A0A060VZY9_ONCMY Loading...

Anti-proliferative protein domain-containing protein

AlphaFold DB , UniProt , Accession A0A060VZY9, Species ONCMY (Oncorhynchus mykiss, Rainbow trout), Gene LOC110494047, Length 166 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
1M34Very low45.7Very low235 Ų235141.8 Ų141.8100%1.15874%0.742SS**  01060-71.781.817400107.7
2N32.6Very low49.3Very low169 Ų169132.8 Ų132.890%0.90471%0.709SS**  trans-88.1115.7179.3-75.2-3000108.8A4N2-A4 PolarHBondContact O-N 3.49Å; N2-A4 VanDerWaalsContact O-N 3.09Å
3Q32.8Very low52.9Low159 Ų159127.5 Ų127.574%0.74369%0.687SS**  trans-60.3110173.8-83.2172.1-13.100109.2Y5Q3-Y5 HydrophobicContact CB-CD2 4.01Å; Q3-Y5 HydrophobicContact CB-CE2 4.45Å; Q3-Y5 PolarHBondContact O-N 3.33Å
4A36.1Very low56.1Low90 Ų90118.9 Ų118.974%0.74464%0.64SS**  trans-64.683.615500000107.9N2 S6N2-A4 PolarHBondContact O-N 3.49Å; N2-A4 VanDerWaalsContact O-N 3.09Å; A4-S6 VanDerWaalsContact C-N 3.34Å; A4-S6 PolarHBondContact O-N 3.29Å
5Y39.7Very low58.9Low198 Ų198111.1 Ų111.178%0.77660%0.598SS**  trans-68.6103.1163.2-105.6-87000106.9Q3 S7Q3-Y5 HydrophobicContact CB-CD2 4.01Å; Q3-Y5 HydrophobicContact CB-CE2 4.45Å; Q3-Y5 PolarHBondContact O-N 3.33Å; Y5-S7 PolarHBondContact O-N 2.89Å
6S37.8Very low61.4Low94 Ų94107.6 Ų107.666%0.65758%0.582SS**  trans-53.8118.7-177.7-69.30000110.7A4 R8A4-S6 VanDerWaalsContact C-N 3.34Å; A4-S6 PolarHBondContact O-N 3.29Å; S6-R8 PolarHBondContact O-N 3.36Å
7S44.5Very low63.6Low114 Ų114102.5 Ų102.580%0.79756%0.557SS**  trans-69.649.6172.861.30000112.1Y5 S9Y5-S7 PolarHBondContact O-N 2.89Å; S7-S9 VanDerWaalsContact C-N 3.31Å
8R44.3Very low65.5Low235 Ų23596.8 Ų96.889%0.88753%0.526SS*.  trans-92.614.6-175.8-127.9-179.8-174.8-160-0.4113.1S6S6-R8 PolarHBondContact O-N 3.36Å
9S50.8Low67.2Low102 Ų10291.7 Ų91.771%0.71350%0.499SS*.SBendtrans-139.527.9-162.7-43.60000115.8S7S7-S9 VanDerWaalsContact C-N 3.31Å
10E69.3Low68.8Low134 Ų13488.1 Ų88.163%0.62648%0.48SS*.SBendtrans-117.9-6.4178-75.1-172.5173.400115.5W56E10-W56 PolarHBondContact O-NE1 3.43Å; E10-W56 VanDerWaalsContact O-NE1 3.09Å
11I80.5Confident70.2Confident30 Ų3084.8 Ų84.815%0.15446%0.461CS..SBendtrans-112.7-9.8-179.5-51-176.4000111.8V15 Y52 W56I11-V15 HydrophobicContact CG2-CB 4.37Å; I11-V15 HydrophobicContact CG2-CG2 3.48Å; I11-V15 VanDerWaalsContact CG2-CG2 3.48Å; I11-V15 WeakPolarHBondContact O-CB 3.43Å; I11-V15 PolarHBondContact O-N 3.36Å; I11-Y52 HydrophobicContact CG2-CD2 4.25Å; I11-W56 HydrophobicContact CB-CD2 4.41Å; I11-W56 HydrophobicContact CB-CZ2 4.43Å; I11-W56 HydrophobicContact CD1-CB 3.78Å; I11-W56 HydrophobicContact CD1-CD2 4.02Å; I11-W56 HydrophobicContact CD1-CE3 4.47Å; I11-W56 HydrophobicContact CD1-CG 3.72Å; I11-W56 HydrophobicContact CG1-CB 4.25Å; I11-W56 HydrophobicContact CG1-CD2 3.73Å; I11-W56 HydrophobicContact CG1-CE3 4.42Å; I11-W56 HydrophobicContact CG1-CG 3.63Å; I11-W56 HydrophobicContact CG1-CZ2 4.48Å; I11-W56 HydrophobicContact CG2-CD2 4.16Å; I11-W56 HydrophobicContact CG2-CE3 4.1Å; I11-W56 HydrophobicContact CG2-CH2 4.14Å; I11-W56 HydrophobicContact CG2-CZ2 4.14Å; I11-W56 HydrophobicContact CG2-CZ3 4.1Å
12G89Confident73.3Confident34 Ų3473.7 Ų73.735%0.35141%0.406SS..Hα-helixtrans-60.7-55.8-163.300000114.7E14 T16G12-E14 PolarHBondContact O-N 3.17Å; G12-T16 VanDerWaalsContact O-CB 3.27Å; G12-T16 WeakPolarHBondContact O-CB 3.33Å; G12-T16 PolarHBondContact O-N 3.2Å; G12-T16 PolarHBondContact O-OG1 3.48Å
13P96.3Very high76.4Confident64 Ų6465.7 Ų65.742%0.41636%0.363SS..Hα-helixtrans-59.5-43.6-175.8-26.235.9000113.8T16 A17 Y125P13-T16 WeakPolarHBondContact O-CB 3.23Å; P13-T16 PolarHBondContact O-N 3.18Å; P13-A17 WeakPolarHBondContact O-CB 3.07Å; P13-A17 PolarHBondContact O-N 2.82Å; P13-Y125 HydrophobicContact CB-CE1 4.42Å; P13-Y125 HydrophobicContact CB-CE2 4.03Å; P13-Y125 WeakPolarHBondContact CB-OH 3.14Å
14E98.1Very high79.4Confident7 Ų764.3 Ų64.33%0.03335%0.352CS..Hα-helixtrans-67.6-47.5-177.4-62.791154.900111.1G12 T16 A17 A18 W56 V106 D107 F109 V111 Y125G12-E14 PolarHBondContact O-N 3.17Å; E14-T16 VanDerWaalsContact C-N 3.31Å; E14-T16 PolarHBondContact O-N 3.48Å; E14-A17 PolarHBondContact O-N 2.99Å; E14-A18 WeakPolarHBondContact O-CB 3.36Å; E14-A18 PolarHBondContact O-N 3.1Å; E14-W56 HydrophobicContact CB-CH2 3.9Å; E14-W56 HydrophobicContact CB-CZ2 4.28Å; E14-W56 HydrophobicContact CG-CH2 4.14Å; E14-W56 HydrophobicContact CG-CZ2 4.17Å; E14-V106 HydrophobicContact CB-CG1 3.94Å; E14-D107 WeakPolarHBondContact CG-O 3.4Å; E14-F109 PolarHBondContact OE1-N 2.68Å; E14-V111 HydrophobicContact CB-CG2 3.7Å; E14-V111 HydrophobicContact CG-CG2 4.16Å; E14-V111 WeakPolarHBondContact O-CG2 3.44Å; E14-Y125 HydrophobicContact CG-CD1 3.87Å; E14-Y125 HydrophobicContact CG-CE1 3.66Å
15V98.1Very high82.3Confident1 Ų161.3 Ų61.31%0.00632%0.323CS..Hα-helixtrans-64.4-37.8175.7164.10000111.5I11 A18 A19 Q45 L48 Y52 V106I11-V15 HydrophobicContact CG2-CB 4.37Å; I11-V15 HydrophobicContact CG2-CG2 3.48Å; I11-V15 VanDerWaalsContact CG2-CG2 3.48Å; I11-V15 WeakPolarHBondContact O-CB 3.43Å; I11-V15 PolarHBondContact O-N 3.36Å; V15-A18 PolarHBondContact O-N 3.32Å; V15-A19 WeakPolarHBondContact O-CB 3.44Å; V15-A19 PolarHBondContact O-N 3Å; V15-Q45 HydrophobicContact CG1-CB 3.99Å; V15-Q45 HydrophobicContact CG1-CG 4.08Å; V15-Q45 WeakPolarHBondContact CG1-O 3.29Å; V15-L48 HydrophobicContact CG1-CB 3.93Å; V15-L48 HydrophobicContact CG1-CD1 4.25Å; V15-L48 HydrophobicContact CG2-CB 4.02Å; V15-Y52 HydrophobicContact CG2-CD2 3.93Å; V15-Y52 HydrophobicContact CG2-CE2 3.89Å; V15-V106 HydrophobicContact CG2-CG1 4.27Å
16T98.3Very high85Confident56 Ų5651.9 Ų51.934%0.34429%0.286SS..Hα-helixtrans-62.2-44.6174.9-59.10000111.2G12 P13 E14 T20 Q45G12-T16 VanDerWaalsContact O-CB 3.27Å; G12-T16 WeakPolarHBondContact O-CB 3.33Å; G12-T16 PolarHBondContact O-N 3.2Å; G12-T16 PolarHBondContact O-OG1 3.48Å; P13-T16 WeakPolarHBondContact O-CB 3.23Å; P13-T16 PolarHBondContact O-N 3.18Å; E14-T16 VanDerWaalsContact C-N 3.31Å; E14-T16 PolarHBondContact O-N 3.48Å; T16-T20 WeakPolarHBondContact O-CB 3.37Å; T16-T20 PolarHBondContact O-N 3.21Å; T16-T20 PolarHBondContact O-OG1 2.94Å; T16-Q45 PolarHBondContact OG1-OE1 2.93Å
17A98.5Very high87.7Confident20 Ų2053.1 Ų53.117%0.16528%0.276CS..Hα-helixtrans-61.7-49.8177.600000110.8P13 E14 T20 F21 V111 L124 Y125P13-A17 WeakPolarHBondContact O-CB 3.07Å; P13-A17 PolarHBondContact O-N 2.82Å; E14-A17 PolarHBondContact O-N 2.99Å; A17-T20 PolarHBondContact O-N 3.46Å; A17-F21 WeakPolarHBondContact O-CB 3.27Å; A17-F21 PolarHBondContact O-N 3.31Å; A17-V111 HydrophobicContact CB-CG2 4.25Å; A17-L124 HydrophobicContact CB-CD2 4.15Å; A17-L124 WeakPolarHBondContact O-CD2 3.31Å; A17-Y125 HydrophobicContact CB-CG 4.31Å
18A98.6Very high90Very high0 Ų053.2 Ų53.20%027%0.272CS..Hα-helixtrans-56.9-52.4177.800000112.4E14 V15 T20 F21 V22 L104 V106 V111E14-A18 WeakPolarHBondContact O-CB 3.36Å; E14-A18 PolarHBondContact O-N 3.1Å; V15-A18 PolarHBondContact O-N 3.32Å; A18-T20 VanDerWaalsContact C-N 3.33Å; A18-T20 PolarHBondContact O-N 3.18Å; A18-F21 PolarHBondContact O-N 2.98Å; A18-V22 PolarHBondContact O-N 3.17Å; A18-V22 VanDerWaalsContact O-N 3.1Å; A18-L104 HydrophobicContact CB-CD2 4Å; A18-V106 HydrophobicContact CB-CG1 4.31Å; A18-V106 HydrophobicContact CB-CG2 3.63Å; A18-V111 HydrophobicContact CB-CG1 4.25Å
19A98.5Very high91.8Very high0 Ų048.4 Ų48.40%025%0.254CS..Hα-helixtrans-64.7-38.1-179.400000112.4V15 F21 V22 S23 R41 L44 Q45V15-A19 WeakPolarHBondContact O-CB 3.44Å; V15-A19 PolarHBondContact O-N 3Å; A19-F21 VanDerWaalsContact C-N 3.34Å; A19-V22 PolarHBondContact O-N 3.21Å; A19-S23 VanDerWaalsContact O-CB 3.28Å; A19-S23 WeakPolarHBondContact O-CB 3.42Å; A19-S23 PolarHBondContact O-N 3.44Å; A19-R41 HydrophobicContact CB-CG 3.86Å; A19-L44 HydrophobicContact CB-CB 4.24Å; A19-L44 HydrophobicContact CB-CD2 3.96Å; A19-L44 HydrophobicContact CB-CG 4.02Å; A19-Q45 HydrophobicContact CB-CG 3.51Å
20T98.3Very high93.3Very high20 Ų2044.3 Ų44.312%0.12323%0.228CC..Hα-helixtrans-62.7-41.3174.7-68.40000111.7T16 A17 A18 S23 R24 R41T16-T20 WeakPolarHBondContact O-CB 3.37Å; T16-T20 PolarHBondContact O-N 3.21Å; T16-T20 PolarHBondContact O-OG1 2.94Å; A17-T20 PolarHBondContact O-N 3.46Å; A18-T20 VanDerWaalsContact C-N 3.33Å; A18-T20 PolarHBondContact O-N 3.18Å; T20-S23 PolarHBondContact O-N 3.21Å; T20-R24 HydrophobicContact CG2-CG 4.49Å; T20-R24 WeakPolarHBondContact O-CB 3.5Å; T20-R24 VanDerWaalsContact O-CG 3.26Å; T20-R24 WeakPolarHBondContact O-CG 3.18Å; T20-R24 PolarHBondContact O-N 3.47Å; T20-R41 PolarHBondContact OG1-NH1 2.98Å
21F98.5Very high94.2Very high19 Ų1948.1 Ų48.18%0.08324%0.243CC..Hα-helixtrans-63.9-47.6178172.1-109000112.1A17 A18 A19 S23 R24 L25 L102 L104 Y113 L124A17-F21 WeakPolarHBondContact O-CB 3.27Å; A17-F21 PolarHBondContact O-N 3.31Å; A18-F21 PolarHBondContact O-N 2.98Å; A19-F21 VanDerWaalsContact C-N 3.34Å; F21-S23 PolarHBondContact O-N 3.18Å; F21-R24 WeakPolarHBondContact O-CB 3.4Å; F21-R24 PolarHBondContact O-N 2.81Å; F21-R24 VanDerWaalsContact O-N 3.17Å; F21-L25 HydrophobicContact CD1-CD1 4.29Å; F21-L25 HydrophobicContact CE1-CD1 3.76Å; F21-L25 HydrophobicContact CE1-CG 4.47Å; F21-L25 HydrophobicContact CE2-CD1 4.49Å; F21-L25 HydrophobicContact CE2-CD2 4.37Å; F21-L25 HydrophobicContact CE2-CG 4.42Å; F21-L25 HydrophobicContact CZ-CD1 3.88Å; F21-L25 HydrophobicContact CZ-CD2 4.32Å; F21-L25 HydrophobicContact CZ-CG 4.28Å; F21-L25 PolarHBondContact O-N 3.27Å; F21-L102 HydrophobicContact CE1-CD1 4.09Å; F21-L102 HydrophobicContact CE1-CD2 4.43Å; F21-L104 HydrophobicContact CD1-CD1 4.36Å; F21-L104 HydrophobicContact CD1-CD2 4.4Å; F21-Y113 HydrophobicContact CE1-CD1 4.38Å; F21-Y113 HydrophobicContact CE1-CD2 4.17Å; F21-Y113 HydrophobicContact CE1-CG 4.01Å; F21-Y113 HydrophobicContact CE2-CD1 4.37Å; F21-Y113 HydrophobicContact CE2-CE1 4.1Å; F21-Y113 HydrophobicContact CE2-CE2 4.26Å; F21-Y113 HydrophobicContact CZ-CD1 4.04Å; F21-Y113 AromaticContact CZ-CD2 3.66Å; F21-Y113 HydrophobicContact CZ-CD2 3.66Å; F21-Y113 HydrophobicContact CZ-CE1 4.12Å; F21-Y113 AromaticContact CZ-CE2 3.75Å; F21-Y113 HydrophobicContact CZ-CE2 3.75Å; F21-Y113 AromaticContact CZ-CG 3.81Å; F21-Y113 HydrophobicContact CZ-CG 3.81Å; F21-Y113 AromaticContact CZ-CZ 3.98Å; F21-L124 HydrophobicContact CB-CD1 4.05Å; F21-L124 HydrophobicContact CB-CD2 3.44Å; F21-L124 VanDerWaalsContact CB-CD2 3.44Å; F21-L124 HydrophobicContact CB-CG 4.4Å; F21-L124 HydrophobicContact CD2-CD1 3.79Å; F21-L124 HydrophobicContact CD2-CD2 4.47Å; F21-L124 HydrophobicContact CG-CD1 4.12Å; F21-L124 HydrophobicContact CG-CD2 3.95Å
22V97.9Very high94.8Very high1 Ų148.1 Ų48.11%0.00624%0.243CC..Hα-helixtrans-63.2-43177-176.80000111.3A18 A19 R24 L25 L26 F40 L44 I80 L98 L104A18-V22 PolarHBondContact O-N 3.17Å; A18-V22 VanDerWaalsContact O-N 3.1Å; A19-V22 PolarHBondContact O-N 3.21Å; V22-R24 VanDerWaalsContact C-N 3.27Å; V22-R24 PolarHBondContact O-N 3.41Å; V22-L25 WeakPolarHBondContact O-CB 3.28Å; V22-L25 PolarHBondContact O-N 3.27Å; V22-L25 VanDerWaalsContact O-N 3.1Å; V22-L26 PolarHBondContact O-N 3.15Å; V22-F40 HydrophobicContact CB-CE1 4.21Å; V22-F40 HydrophobicContact CB-CZ 4.41Å; V22-F40 HydrophobicContact CG1-CE1 3.88Å; V22-F40 HydrophobicContact CG1-CZ 3.7Å; V22-L44 HydrophobicContact CB-CD2 4.21Å; V22-L44 HydrophobicContact CG2-CD2 4.43Å; V22-I80 HydrophobicContact CG1-CD1 4.14Å; V22-I80 HydrophobicContact CG2-CD1 4.16Å; V22-L98 HydrophobicContact CG1-CD2 4.17Å; V22-L104 HydrophobicContact CG2-CD2 4.16Å
23S97.9Very high95.2Very high1 Ų149.1 Ų49.11%0.00724%0.244CC..Hα-helixtrans-58-39.6175.2-178.80000111.7A19 T20 F21 L26 R27 L37 R41A19-S23 VanDerWaalsContact O-CB 3.28Å; A19-S23 WeakPolarHBondContact O-CB 3.42Å; A19-S23 PolarHBondContact O-N 3.44Å; T20-S23 PolarHBondContact O-N 3.21Å; F21-S23 PolarHBondContact O-N 3.18Å; S23-L26 PolarHBondContact O-N 3.4Å; S23-R27 PolarHBondContact O-N 3.42Å; S23-L37 PolarHBondContact OG-O 3.48Å; S23-R41 PolarHBondContact OG-NH2 3.29Å; S23-R41 VanDerWaalsContact OG-NH2 3.09Å
24R97.2Very high95.1Very high131 Ų13151.6 Ų51.649%0.49425%0.25SS..Hα-helixtrans-64.2-41.3174.3-75.3171178.8175.22112.3T20 F21 V22 R27 T28T20-R24 HydrophobicContact CG2-CG 4.49Å; T20-R24 WeakPolarHBondContact O-CB 3.5Å; T20-R24 VanDerWaalsContact O-CG 3.26Å; T20-R24 WeakPolarHBondContact O-CG 3.18Å; T20-R24 PolarHBondContact O-N 3.47Å; F21-R24 WeakPolarHBondContact O-CB 3.4Å; F21-R24 PolarHBondContact O-N 2.81Å; F21-R24 VanDerWaalsContact O-N 3.17Å; V22-R24 VanDerWaalsContact C-N 3.27Å; V22-R24 PolarHBondContact O-N 3.41Å; R24-R27 PolarHBondContact O-N 3.27Å; R24-T28 PolarHBondContact O-N 3.4Å; R24-T28 PolarHBondContact O-OG1 2.91Å; R24-T28 VanDerWaalsContact O-OG1 3.1Å
25L96.3Very high95.1Very high27 Ų2757.4 Ų57.414%0.14128%0.277CS..Hα-helixtrans-60.3-46.3175.9-66.4175.5000111.4F21 V22 R27 T28 R29 L98 P99 L102F21-L25 HydrophobicContact CD1-CD1 4.29Å; F21-L25 HydrophobicContact CE1-CD1 3.76Å; F21-L25 HydrophobicContact CE1-CG 4.47Å; F21-L25 HydrophobicContact CE2-CD1 4.49Å; F21-L25 HydrophobicContact CE2-CD2 4.37Å; F21-L25 HydrophobicContact CE2-CG 4.42Å; F21-L25 HydrophobicContact CZ-CD1 3.88Å; F21-L25 HydrophobicContact CZ-CD2 4.32Å; F21-L25 HydrophobicContact CZ-CG 4.28Å; F21-L25 PolarHBondContact O-N 3.27Å; V22-L25 WeakPolarHBondContact O-CB 3.28Å; V22-L25 PolarHBondContact O-N 3.27Å; V22-L25 VanDerWaalsContact O-N 3.1Å; L25-R27 VanDerWaalsContact C-N 3.32Å; L25-R27 PolarHBondContact O-N 2.89Å; L25-T28 PolarHBondContact O-N 3.2Å; L25-R29 PolarHBondContact O-N 3.32Å; L25-L98 HydrophobicContact CB-CD2 3.75Å; L25-L98 HydrophobicContact CD1-CD2 4.36Å; L25-P99 HydrophobicContact CD1-CG 4.18Å; L25-L102 HydrophobicContact CD1-CD2 4.12Å
26L96.1Very high95.1Very high0 Ų060.3 Ų60.30%029%0.291CS..Hα-helixtrans-60.3-41.8175.9-68.4176.8000112V22 S23 R29 G30 L32 L37 F40 L94 L97 L98V22-L26 PolarHBondContact O-N 3.15Å; S23-L26 PolarHBondContact O-N 3.4Å; L26-R29 PolarHBondContact O-N 2.83Å; L26-G30 WeakPolarHBondContact O-CA 3.49Å; L26-G30 PolarHBondContact O-N 2.91Å; L26-L32 HydrophobicContact CB-CD1 3.86Å; L26-L32 HydrophobicContact CD1-CD1 4.42Å; L26-L37 HydrophobicContact CB-CD2 4.12Å; L26-F40 HydrophobicContact CD1-CD1 3.84Å; L26-F40 HydrophobicContact CD1-CD2 4.17Å; L26-F40 HydrophobicContact CD1-CE1 3.63Å; L26-F40 HydrophobicContact CD1-CE2 3.97Å; L26-F40 HydrophobicContact CD1-CG 4.11Å; L26-F40 HydrophobicContact CD1-CZ 3.68Å; L26-L94 HydrophobicContact CD2-CD2 3.86Å; L26-L97 HydrophobicContact CD2-CB 3.89Å; L26-L97 HydrophobicContact CD2-CD1 4.31Å; L26-L98 HydrophobicContact CD2-CD1 4.16Å; L26-L98 HydrophobicContact CD2-CD2 3.62Å; L26-L98 HydrophobicContact CD2-CG 3.76Å; L26-L98 HydrophobicContact CG-CD2 3.92Å
27R95.4Very high95.1Very high119 Ų11957.7 Ų57.745%0.44928%0.275SS..Hα-helixtrans-63.9-41.4177-172.9174.764.8178.34112.6S23 R24 L25 R29 E34 L37S23-R27 PolarHBondContact O-N 3.42Å; R24-R27 PolarHBondContact O-N 3.27Å; L25-R27 VanDerWaalsContact C-N 3.32Å; L25-R27 PolarHBondContact O-N 2.89Å; R27-R29 VanDerWaalsContact C-N 3.26Å; R27-R29 PolarHBondContact O-N 3.24Å; R27-E34 WeakPolarHBondContact CD-OE1 3.43Å; R27-E34 IonicContact NH1-OE1 3.8Å; R27-L37 HydrophobicContact CB-CD1 3.67Å; R27-L37 HydrophobicContact CB-CD2 4.28Å; R27-L37 HydrophobicContact CG-CD1 3.7Å
28T91.8Very high95Very high117 Ų11761.8 Ų61.872%0.71829%0.29SS*.Hα-helixtrans-65.8-29.9-177.1-64.60000112.6R24 L25R24-T28 PolarHBondContact O-N 3.4Å; R24-T28 PolarHBondContact O-OG1 2.91Å; R24-T28 VanDerWaalsContact O-OG1 3.1Å; L25-T28 PolarHBondContact O-N 3.2Å
29R83.4Confident95Very high133 Ų13364.9 Ų64.950%0.50231%0.307SS..Hα-helixtrans-110.5-8.6-174.9-56.6-159.7-173.9167.7-3.9114.6L25 L26 R27 L97 L98L25-R29 PolarHBondContact O-N 3.32Å; L26-R29 PolarHBondContact O-N 2.83Å; R27-R29 VanDerWaalsContact C-N 3.26Å; R27-R29 PolarHBondContact O-N 3.24Å; R29-L97 HydrophobicContact CB-CD2 4.26Å; R29-L97 WeakPolarHBondContact CB-O 3.28Å; R29-L97 VanDerWaalsContact CD-O 3.27Å; R29-L97 WeakPolarHBondContact CD-O 3.45Å; R29-L97 VanDerWaalsContact O-CD2 3.28Å; R29-L97 WeakPolarHBondContact O-CD2 3.3Å; R29-L98 PolarHBondContact NH1-O 3.32Å
30G82.6Confident95Very high16 Ų1664.9 Ų64.917%0.16531%0.307CS..SBendtrans-120.9168.4-170.700000114.7L26 L97L26-G30 WeakPolarHBondContact O-CA 3.49Å; L26-G30 PolarHBondContact O-N 2.91Å; G30-L97 VanDerWaalsContact CA-CD2 3.43Å
31F86.9Confident95Very high215 Ų21566.5 Ų66.594%0.94331%0.311SS*.  trans-10139.1175.8-58.1-79.6000111.6
32L94.1Very high95Very high29 Ų2969.1 Ų69.115%0.15233%0.325CS..  trans-82.4139.1-176.6-62.4175.2000110.8L26 L37 I87 L89L26-L32 HydrophobicContact CB-CD1 3.86Å; L26-L32 HydrophobicContact CD1-CD1 4.42Å; L32-L37 HydrophobicContact CB-CD1 4.46Å; L32-L37 HydrophobicContact CB-CD2 4.01Å; L32-L37 HydrophobicContact CB-CG 3.95Å; L32-L37 HydrophobicContact CD1-CD2 3.75Å; L32-I87 HydrophobicContact CD1-CD1 4.2Å; L32-I87 HydrophobicContact CD2-CD1 4.37Å; L32-L89 HydrophobicContact CD1-CD1 4.07Å; L32-L89 HydrophobicContact CD2-CD1 4.29Å; L32-L89 HydrophobicContact CD2-CD2 4.21Å; L32-L89 HydrophobicContact CD2-CG 4.47Å
33S95.8Very high95Very high55 Ų5569.5 Ų69.539%0.38533%0.328SS..  trans-70.9155.7171.864.90000111.5H35 Q36 L37S33-H35 PolarHBondContact O-N 3.13Å; S33-Q36 PolarHBondContact O-N 3.02Å; S33-Q36 VanDerWaalsContact O-N 3.13Å; S33-Q36 WeakPolarHBondContact OG-CG 3.28Å; S33-Q36 PolarHBondContact OG-N 3.4Å; S33-Q36 PolarHBondContact OG-OE1 2.89Å; S33-L37 WeakPolarHBondContact O-CG 3.41Å; S33-L37 PolarHBondContact O-N 2.87Å
34E95.8Very high95Very high116 Ų11669.5 Ų69.554%0.54233%0.328SS..Hα-helixtrans-59.8-31.9174.9-70.4-64.513600112.2R27 L37 H38R27-E34 WeakPolarHBondContact CD-OE1 3.43Å; R27-E34 IonicContact NH1-OE1 3.8Å; E34-L37 PolarHBondContact O-N 3.38Å; E34-H38 VanDerWaalsContact O-CB 3.3Å; E34-H38 WeakPolarHBondContact O-CB 3.29Å; E34-H38 PolarHBondContact O-N 2.93Å
35H97.4Very high95.1Very high130 Ų13065.2 Ų65.260%0.60231%0.314SS*.Hα-helixtrans-63.4-47.8173.5-172.1-73.1000111.8S33 L37 H38 D39S33-H35 PolarHBondContact O-N 3.13Å; H35-L37 VanDerWaalsContact C-N 3.32Å; H35-L37 PolarHBondContact O-N 3.29Å; H35-H38 WeakPolarHBondContact O-CB 3.25Å; H35-H38 PolarHBondContact O-N 2.91Å; H35-D39 IonicContact CE1-OD1 3.71Å; H35-D39 IonicContact CE1-OD2 2.98Å; H35-D39 PolarHBondContact CE1-OD2 3.35Å; H35-D39 IonicContact ND1-OD1 3.95Å; H35-D39 IonicContact ND1-OD2 2.88Å; H35-D39 PolarHBondContact ND1-OD2 3.28Å; H35-D39 VanDerWaalsContact O-CG 3.3Å; H35-D39 PolarHBondContact O-N 2.93Å
36Q97.8Very high95.1Very high62 Ų6268.9 Ų68.929%0.2933%0.33SS..Hα-helixtrans-61.7-41.4175.3-73.8169.3-65.300111.5S33 H38 D39 F40 I87S33-Q36 PolarHBondContact O-N 3.02Å; S33-Q36 VanDerWaalsContact O-N 3.13Å; S33-Q36 WeakPolarHBondContact OG-CG 3.28Å; S33-Q36 PolarHBondContact OG-N 3.4Å; S33-Q36 PolarHBondContact OG-OE1 2.89Å; Q36-H38 VanDerWaalsContact C-N 3.29Å; Q36-H38 PolarHBondContact O-N 3.44Å; Q36-D39 PolarHBondContact O-N 3.49Å; Q36-F40 VanDerWaalsContact O-CB 3.3Å; Q36-F40 WeakPolarHBondContact O-CB 3.11Å; Q36-F40 PolarHBondContact O-N 3.36Å; Q36-I87 HydrophobicContact CB-CB 4.3Å; Q36-I87 HydrophobicContact CB-CD1 4.27Å; Q36-I87 HydrophobicContact CB-CG2 4.47Å; Q36-I87 HydrophobicContact CG-CB 4.43Å; Q36-I87 PolarHBondContact NE2-O 3.33Å; Q36-I87 WeakPolarHBondContact O-CG2 3.41Å
37L97.9Very high95.2Very high1 Ų170 Ų701%0.00534%0.338CS..Hα-helixtrans-66.1-33.6178.6-70171.7000112.6S23 L26 R27 L32 S33 E34 H35 R41S23-L37 PolarHBondContact OG-O 3.48Å; L26-L37 HydrophobicContact CB-CD2 4.12Å; R27-L37 HydrophobicContact CB-CD1 3.67Å; R27-L37 HydrophobicContact CB-CD2 4.28Å; R27-L37 HydrophobicContact CG-CD1 3.7Å; L32-L37 HydrophobicContact CB-CD1 4.46Å; L32-L37 HydrophobicContact CB-CD2 4.01Å; L32-L37 HydrophobicContact CB-CG 3.95Å; L32-L37 HydrophobicContact CD1-CD2 3.75Å; S33-L37 WeakPolarHBondContact O-CG 3.41Å; S33-L37 PolarHBondContact O-N 2.87Å; E34-L37 PolarHBondContact O-N 3.38Å; H35-L37 VanDerWaalsContact C-N 3.32Å; H35-L37 PolarHBondContact O-N 3.29Å; L37-R41 WeakPolarHBondContact O-CB 3.45Å; L37-R41 PolarHBondContact O-N 3.06Å; L37-R41 VanDerWaalsContact O-N 3.17Å
38H97.9Very high95.4Very high106 Ų10664.3 Ų64.349%0.49132%0.316SS..Hα-helixtrans-66-54.4172.8-177.9-80.7000110.8E34 H35 Q36 F40 R41 D42E34-H38 VanDerWaalsContact O-CB 3.3Å; E34-H38 WeakPolarHBondContact O-CB 3.29Å; E34-H38 PolarHBondContact O-N 2.93Å; H35-H38 WeakPolarHBondContact O-CB 3.25Å; H35-H38 PolarHBondContact O-N 2.91Å; Q36-H38 VanDerWaalsContact C-N 3.29Å; Q36-H38 PolarHBondContact O-N 3.44Å; H38-F40 VanDerWaalsContact C-N 3.29Å; H38-F40 PolarHBondContact O-N 3.25Å; H38-R41 WeakPolarHBondContact O-CB 3.47Å; H38-R41 PolarHBondContact O-N 3.31Å; H38-D42 IonicContact CE1-OD2 2.91Å; H38-D42 PolarHBondContact CE1-OD2 2.78Å; H38-D42 IonicContact ND1-OD2 3.39Å; H38-D42 PolarHBondContact ND1-OD2 2.87Å; H38-D42 IonicContact NE2-OD2 3.77Å; H38-D42 PolarHBondContact O-N 3.3Å
39D98.2Very high95.6Very high64 Ų6461 Ų6134%0.34230%0.298SS..Hα-helixtrans-57.2-42.1179.2-67.6-20.7000112.3H35 Q36 C43 I87H35-D39 IonicContact CE1-OD1 3.71Å; H35-D39 IonicContact CE1-OD2 2.98Å; H35-D39 PolarHBondContact CE1-OD2 3.35Å; H35-D39 IonicContact ND1-OD1 3.95Å; H35-D39 IonicContact ND1-OD2 2.88Å; H35-D39 PolarHBondContact ND1-OD2 3.28Å; H35-D39 VanDerWaalsContact O-CG 3.3Å; H35-D39 PolarHBondContact O-N 2.93Å; Q36-D39 PolarHBondContact O-N 3.49Å; D39-C43 VanDerWaalsContact O-CB 3.28Å; D39-C43 WeakPolarHBondContact O-CB 3.27Å; D39-C43 PolarHBondContact O-N 3.27Å; D39-I87 HydrophobicContact CB-CG2 3.81Å
40F98.4Very high96.3Very high0 Ų060.3 Ų60.30%030%0.3CS..Hα-helixtrans-59.3-47.6174.8169.8-99.3000111.5V22 L26 Q36 H38 C43 L44 A83 A84 I87V22-F40 HydrophobicContact CB-CE1 4.21Å; V22-F40 HydrophobicContact CB-CZ 4.41Å; V22-F40 HydrophobicContact CG1-CE1 3.88Å; V22-F40 HydrophobicContact CG1-CZ 3.7Å; L26-F40 HydrophobicContact CD1-CD1 3.84Å; L26-F40 HydrophobicContact CD1-CD2 4.17Å; L26-F40 HydrophobicContact CD1-CE1 3.63Å; L26-F40 HydrophobicContact CD1-CE2 3.97Å; L26-F40 HydrophobicContact CD1-CG 4.11Å; L26-F40 HydrophobicContact CD1-CZ 3.68Å; Q36-F40 VanDerWaalsContact O-CB 3.3Å; Q36-F40 WeakPolarHBondContact O-CB 3.11Å; Q36-F40 PolarHBondContact O-N 3.36Å; H38-F40 VanDerWaalsContact C-N 3.29Å; H38-F40 PolarHBondContact O-N 3.25Å; F40-C43 PolarHBondContact O-N 3.15Å; F40-L44 HydrophobicContact CE1-CD2 3.88Å; F40-L44 HydrophobicContact CZ-CD2 3.75Å; F40-L44 VanDerWaalsContact O-CB 3.28Å; F40-L44 WeakPolarHBondContact O-CB 3.1Å; F40-L44 PolarHBondContact O-N 3.03Å; F40-A83 HydrophobicContact CD2-CB 4.04Å; F40-A83 HydrophobicContact CE2-CB 3.89Å; F40-A84 HydrophobicContact CD2-CB 4.31Å; F40-A84 HydrophobicContact CE2-CB 4.06Å; F40-I87 HydrophobicContact CB-CD1 3.92Å; F40-I87 HydrophobicContact CB-CG1 4.4Å; F40-I87 HydrophobicContact CB-CG2 4.13Å; F40-I87 HydrophobicContact CD2-CD1 4.47Å; F40-I87 HydrophobicContact CG-CD1 4.45Å
41R98.2Very high97Very high55 Ų5562.5 Ų62.521%0.20831%0.306CS..Hα-helixtrans-65.4-43.6-177-166.3-170.2-50.6-136.2-1.1111.3A19 T20 S23 L37 H38 L44 Q45A19-R41 HydrophobicContact CB-CG 3.86Å; T20-R41 PolarHBondContact OG1-NH1 2.98Å; S23-R41 PolarHBondContact OG-NH2 3.29Å; S23-R41 VanDerWaalsContact OG-NH2 3.09Å; L37-R41 WeakPolarHBondContact O-CB 3.45Å; L37-R41 PolarHBondContact O-N 3.06Å; L37-R41 VanDerWaalsContact O-N 3.17Å; H38-R41 WeakPolarHBondContact O-CB 3.47Å; H38-R41 PolarHBondContact O-N 3.31Å; R41-L44 PolarHBondContact O-N 2.83Å; R41-Q45 WeakPolarHBondContact O-CB 3.35Å; R41-Q45 VanDerWaalsContact O-CG 3.24Å; R41-Q45 WeakPolarHBondContact O-CG 3.44Å; R41-Q45 PolarHBondContact O-N 3.43Å; R41-Q45 PolarHBondContact O-NE2 3.44Å
42D97.9Very high97.5Very high73 Ų7352.3 Ų52.339%0.3926%0.261SS..Hα-helixtrans-63.9-45.9178.2-75-0.6000111.2H38 L44 Q45 Q46H38-D42 IonicContact CE1-OD2 2.91Å; H38-D42 PolarHBondContact CE1-OD2 2.78Å; H38-D42 IonicContact ND1-OD2 3.39Å; H38-D42 PolarHBondContact ND1-OD2 2.87Å; H38-D42 IonicContact NE2-OD2 3.77Å; H38-D42 PolarHBondContact O-N 3.3Å; D42-L44 VanDerWaalsContact C-N 3.31Å; D42-L44 PolarHBondContact O-N 2.88Å; D42-Q45 PolarHBondContact O-N 3.38Å; D42-Q46 WeakPolarHBondContact O-CB 3.33Å; D42-Q46 PolarHBondContact O-N 2.96Å
43C98.3Very high97.5Very high10 Ų1057.4 Ų57.47%0.06828%0.284CS..Hα-helixtrans-61.4-41.3176.7-172.70000111.9D39 F40 S47 A83 R86D39-C43 VanDerWaalsContact O-CB 3.28Å; D39-C43 WeakPolarHBondContact O-CB 3.27Å; D39-C43 PolarHBondContact O-N 3.27Å; F40-C43 PolarHBondContact O-N 3.15Å; C43-S47 WeakPolarHBondContact O-CB 3.4Å; C43-S47 PolarHBondContact O-N 3.23Å; C43-S47 PolarHBondContact O-OG 2.83Å; C43-A83 HydrophobicContact CB-CB 4.22Å; C43-R86 WeakPolarHBondContact SG-CD 3.39Å; C43-R86 PolarHBondContact SG-NE 3.05Å; C43-R86 VanDerWaalsContact SG-NE 3.44Å
44L98.6Very high97.4Very high0 Ų060.9 Ų60.90%030%0.299CS..Hα-helixtrans-67.6-46.5178.5-178.155.8000111.2A19 V22 F40 R41 D42 Q46 S47 L48 I79 I80 A83A19-L44 HydrophobicContact CB-CB 4.24Å; A19-L44 HydrophobicContact CB-CD2 3.96Å; A19-L44 HydrophobicContact CB-CG 4.02Å; V22-L44 HydrophobicContact CB-CD2 4.21Å; V22-L44 HydrophobicContact CG2-CD2 4.43Å; F40-L44 HydrophobicContact CE1-CD2 3.88Å; F40-L44 HydrophobicContact CZ-CD2 3.75Å; F40-L44 VanDerWaalsContact O-CB 3.28Å; F40-L44 WeakPolarHBondContact O-CB 3.1Å; F40-L44 PolarHBondContact O-N 3.03Å; R41-L44 PolarHBondContact O-N 2.83Å; D42-L44 VanDerWaalsContact C-N 3.31Å; D42-L44 PolarHBondContact O-N 2.88Å; L44-Q46 VanDerWaalsContact C-N 3.32Å; L44-Q46 PolarHBondContact O-N 3.44Å; L44-S47 PolarHBondContact O-N 3.13Å; L44-L48 HydrophobicContact CD1-CD1 3.89Å; L44-L48 HydrophobicContact CD1-CD2 4.23Å; L44-L48 HydrophobicContact CD1-CG 3.84Å; L44-L48 HydrophobicContact CG-CD1 3.91Å; L44-L48 HydrophobicContact CG-CG 4.3Å; L44-L48 VanDerWaalsContact O-CG 3.28Å; L44-L48 WeakPolarHBondContact O-CG 3.41Å; L44-L48 PolarHBondContact O-N 2.87Å; L44-I79 HydrophobicContact CD1-CG2 3.8Å; L44-I80 HydrophobicContact CD1-CD1 3.73Å; L44-I80 HydrophobicContact CD2-CD1 3.69Å; L44-I80 HydrophobicContact CG-CD1 4.39Å; L44-A83 HydrophobicContact CB-CB 3.97Å; L44-A83 HydrophobicContact CD1-CB 4.38Å
45Q98.2Very high97.5Very high42 Ų4258.4 Ų58.420%0.19629%0.287CS..Hα-helixtrans-56.7-46.6177.1-75.6178.877.300111.9V15 T16 A19 R41 D42 S49V15-Q45 HydrophobicContact CG1-CB 3.99Å; V15-Q45 HydrophobicContact CG1-CG 4.08Å; V15-Q45 WeakPolarHBondContact CG1-O 3.29Å; T16-Q45 PolarHBondContact OG1-OE1 2.93Å; A19-Q45 HydrophobicContact CB-CG 3.51Å; R41-Q45 WeakPolarHBondContact O-CB 3.35Å; R41-Q45 VanDerWaalsContact O-CG 3.24Å; R41-Q45 WeakPolarHBondContact O-CG 3.44Å; R41-Q45 PolarHBondContact O-N 3.43Å; R41-Q45 PolarHBondContact O-NE2 3.44Å; D42-Q45 PolarHBondContact O-N 3.38Å; Q45-S49 WeakPolarHBondContact O-CB 3.33Å; Q45-S49 PolarHBondContact O-N 3.45Å; Q45-S49 PolarHBondContact O-OG 3.04Å
46Q97.4Very high97.5Very high104 Ų10453.4 Ų53.449%0.48626%0.263SS..Hα-helixtrans-60.6-49.9176.8-179.5176.10.800111.2D42 L44 L48 S49 E50D42-Q46 WeakPolarHBondContact O-CB 3.33Å; D42-Q46 PolarHBondContact O-N 2.96Å; L44-Q46 VanDerWaalsContact C-N 3.32Å; L44-Q46 PolarHBondContact O-N 3.44Å; Q46-L48 VanDerWaalsContact C-N 3.34Å; Q46-L48 PolarHBondContact O-N 3.03Å; Q46-S49 PolarHBondContact O-N 3.41Å; Q46-E50 HydrophobicContact CG-CG 4.49Å; Q46-E50 VanDerWaalsContact CG-OE1 3.27Å; Q46-E50 WeakPolarHBondContact CG-OE1 3.44Å; Q46-E50 PolarHBondContact NE2-OE1 3.34Å; Q46-E50 WeakPolarHBondContact O-CG 3.47Å; Q46-E50 PolarHBondContact O-N 2.97Å
47S98.1Very high97.4Very high23 Ų2353.4 Ų53.416%0.16126%0.262CS..Hα-helixtrans-63.6-38.8-175.9-55.80000112.5C43 L44 H51C43-S47 WeakPolarHBondContact O-CB 3.4Å; C43-S47 PolarHBondContact O-N 3.23Å; C43-S47 PolarHBondContact O-OG 2.83Å; L44-S47 PolarHBondContact O-N 3.13Å; S47-H51 VanDerWaalsContact O-CB 3.26Å; S47-H51 WeakPolarHBondContact O-CB 3.49Å; S47-H51 PolarHBondContact O-N 2.93Å
48L98.3Very high97.2Very high0 Ų054.8 Ų54.80%027%0.271CS..Hα-helixtrans-68.3-44.7175.7-65.6175.9000111.5V15 L44 Q46 E50 H51 Y52 I70 I79V15-L48 HydrophobicContact CG1-CB 3.93Å; V15-L48 HydrophobicContact CG1-CD1 4.25Å; V15-L48 HydrophobicContact CG2-CB 4.02Å; L44-L48 HydrophobicContact CD1-CD1 3.89Å; L44-L48 HydrophobicContact CD1-CD2 4.23Å; L44-L48 HydrophobicContact CD1-CG 3.84Å; L44-L48 HydrophobicContact CG-CD1 3.91Å; L44-L48 HydrophobicContact CG-CG 4.3Å; L44-L48 VanDerWaalsContact O-CG 3.28Å; L44-L48 WeakPolarHBondContact O-CG 3.41Å; L44-L48 PolarHBondContact O-N 2.87Å; Q46-L48 VanDerWaalsContact C-N 3.34Å; Q46-L48 PolarHBondContact O-N 3.03Å; L48-E50 VanDerWaalsContact C-N 3.31Å; L48-E50 PolarHBondContact O-N 3.17Å; L48-H51 PolarHBondContact O-N 2.98Å; L48-H51 VanDerWaalsContact O-N 3.15Å; L48-Y52 HydrophobicContact CB-CE2 4.14Å; L48-Y52 HydrophobicContact CD2-CE1 4.24Å; L48-Y52 WeakPolarHBondContact CD2-OH 3.3Å; L48-Y52 WeakPolarHBondContact O-CB 3.48Å; L48-Y52 WeakPolarHBondContact O-CD1 3.41Å; L48-Y52 PolarHBondContact O-N 3.47Å; L48-I70 HydrophobicContact CD1-CD1 3.96Å; L48-I70 HydrophobicContact CD2-CD1 3.74Å; L48-I70 HydrophobicContact CD2-CG1 4.16Å; L48-I79 HydrophobicContact CD2-CB 4.42Å; L48-I79 HydrophobicContact CD2-CD1 3.97Å; L48-I79 HydrophobicContact CD2-CG2 3.82Å; L48-I79 HydrophobicContact CG-CG2 4.31Å
49S96.9Very high97.1Very high46 Ų4656.6 Ų56.632%0.32229%0.285SS..Hα-helixtrans-58.8-43.8178.3-590000111.7Q45 Q46 Q53Q45-S49 WeakPolarHBondContact O-CB 3.33Å; Q45-S49 PolarHBondContact O-N 3.45Å; Q45-S49 PolarHBondContact O-OG 3.04Å; Q46-S49 PolarHBondContact O-N 3.41Å; S49-Q53 PolarHBondContact O-N 3.27Å
50E96.8Very high96.9Very high119 Ų11961.9 Ų61.956%0.55630%0.3SS*.Hα-helixtrans-64.8-43.5175-71.5172.5-172.300111.6Q46 L48 Y52Q46-E50 HydrophobicContact CG-CG 4.49Å; Q46-E50 VanDerWaalsContact CG-OE1 3.27Å; Q46-E50 WeakPolarHBondContact CG-OE1 3.44Å; Q46-E50 PolarHBondContact NE2-OE1 3.34Å; Q46-E50 WeakPolarHBondContact O-CG 3.47Å; Q46-E50 PolarHBondContact O-N 2.97Å; L48-E50 VanDerWaalsContact C-N 3.31Å; L48-E50 PolarHBondContact O-N 3.17Å; E50-Y52 VanDerWaalsContact C-N 3.34Å; E50-Y52 PolarHBondContact O-N 3.1Å
51H97.8Very high96.8Very high63 Ų6363.5 Ų63.529%0.29231%0.31SS..Hα-helixtrans-65.8-35.4-179-171.763.8000113S47 L48 Y67 I79S47-H51 VanDerWaalsContact O-CB 3.26Å; S47-H51 WeakPolarHBondContact O-CB 3.49Å; S47-H51 PolarHBondContact O-N 2.93Å; L48-H51 PolarHBondContact O-N 2.98Å; L48-H51 VanDerWaalsContact O-N 3.15Å; H51-Y67 AromaticContact CD2-CE1 3.74Å; H51-Y67 AromaticContact CE1-CE1 3.8Å; H51-Y67 AromaticContact CE1-CZ 3.36Å; H51-Y67 PolarHBondContact CE1-OH 2.85Å; H51-Y67 AromaticContact ND1-CZ 3.98Å; H51-Y67 PolarHBondContact ND1-OH 3.28Å; H51-Y67 AromaticContact NE2-CE1 3.41Å; H51-Y67 WeakPolarHBondContact NE2-CE1 3.48Å; H51-Y67 AromaticContact NE2-CZ 3.43Å; H51-Y67 WeakPolarHBondContact O-CE1 3.39Å; H51-Y67 PolarHBondContact O-OH 2.73Å; H51-I79 HydrophobicContact CB-CD1 3.88Å
52Y97.9Very high96.7Very high1 Ų167.4 Ų67.40%0.00433%0.331CS..Hα-helixtrans-87.9-11.4-174.5-62-8.3000114.2I11 V15 L48 E50 N54 H55 W56 R68 V106I11-Y52 HydrophobicContact CG2-CD2 4.25Å; V15-Y52 HydrophobicContact CG2-CD2 3.93Å; V15-Y52 HydrophobicContact CG2-CE2 3.89Å; L48-Y52 HydrophobicContact CB-CE2 4.14Å; L48-Y52 HydrophobicContact CD2-CE1 4.24Å; L48-Y52 WeakPolarHBondContact CD2-OH 3.3Å; L48-Y52 WeakPolarHBondContact O-CB 3.48Å; L48-Y52 WeakPolarHBondContact O-CD1 3.41Å; L48-Y52 PolarHBondContact O-N 3.47Å; E50-Y52 VanDerWaalsContact C-N 3.34Å; E50-Y52 PolarHBondContact O-N 3.1Å; Y52-N54 VanDerWaalsContact C-N 3.25Å; Y52-N54 PolarHBondContact O-N 3.44Å; Y52-H55 CarbonylContact O-C 3.52Å; Y52-H55 WeakPolarHBondContact O-CA 3.35Å; Y52-H55 PolarHBondContact O-N 2.89Å; Y52-W56 HydrophobicContact CD2-CE3 4.12Å; Y52-W56 AromaticContact CD2-CZ3 3.9Å; Y52-W56 HydrophobicContact CD2-CZ3 3.9Å; Y52-W56 HydrophobicContact CE2-CZ3 4.41Å; Y52-W56 PolarHBondContact O-N 2.95Å; Y52-R68 HydrophobicContact CD1-CB 3.97Å; Y52-R68 HydrophobicContact CD1-CG 3.61Å; Y52-R68 HydrophobicContact CD2-CG 4.38Å; Y52-R68 HydrophobicContact CE1-CB 3.6Å; Y52-R68 HydrophobicContact CE1-CG 3.82Å; Y52-R68 HydrophobicContact CE2-CB 4.29Å; Y52-R68 HydrophobicContact CG-CB 4.47Å; Y52-R68 HydrophobicContact CG-CG 3.93Å; Y52-R68 PolarHBondContact OH-O 2.8Å; Y52-V106 HydrophobicContact CE2-CB 3.81Å; Y52-V106 HydrophobicContact CE2-CG1 3.79Å; Y52-V106 HydrophobicContact CE2-CG2 4.49Å
53Q93Very high96.7Very high136 Ų13668.8 Ų68.864%0.63633%0.333SS*.THydrogen-bonded Turntrans-48.4-41.5-169.4-173178.630.800114.6S49S49-Q53 PolarHBondContact O-N 3.27Å
54N95.1Very high96.6Very high128 Ų12869.5 Ų69.568%0.68434%0.342SS*.THydrogen-bonded Turntrans-99.75.4-178.9-61.3-43.1000113.7Y52Y52-N54 VanDerWaalsContact C-N 3.25Å; Y52-N54 PolarHBondContact O-N 3.44Å
55H97.4Very high96.6Very high64 Ų6470 Ų7030%0.29635%0.346SS..SBendtrans-128.626.5-176.7-62.491.3000111.1Y52 Y67 R68Y52-H55 CarbonylContact O-C 3.52Å; Y52-H55 WeakPolarHBondContact O-CA 3.35Å; Y52-H55 PolarHBondContact O-N 2.89Å; H55-Y67 HydrophobicContact CB-CD1 3.61Å; H55-Y67 HydrophobicContact CB-CE1 3.78Å; H55-Y67 HydrophobicContact CB-CG 4.45Å; H55-Y67 AromaticContact CD2-CD1 3.94Å; H55-Y67 AromaticContact CE1-CE1 3.83Å; H55-Y67 AromaticContact CE1-CE2 3.76Å; H55-Y67 AromaticContact CE1-CZ 3.49Å; H55-Y67 VanDerWaalsContact CE1-CZ 3.49Å; H55-Y67 AromaticContact CG-CD1 3.51Å; H55-Y67 AromaticContact CG-CE1 3.46Å; H55-Y67 VanDerWaalsContact CG-CE1 3.46Å; H55-Y67 AromaticContact CG-CZ 3.94Å; H55-Y67 AromaticContact ND1-CD1 3.82Å; H55-Y67 AromaticContact ND1-CE1 3.25Å; H55-Y67 WeakPolarHBondContact ND1-CE1 3.47Å; H55-Y67 AromaticContact ND1-CZ 3.37Å; H55-R68 WeakPolarHBondContact O-CD 3.18Å; H55-R68 PolarHBondContact O-NH1 3.1Å
56W97.4Very high96.6Very high24 Ų2471.1 Ų71.19%0.09137%0.369CS..  trans-110.4120176.3-161.3-104.5000109.8E10 I11 E14 Y52 R68 V106 D107 P108E10-W56 PolarHBondContact O-NE1 3.43Å; E10-W56 VanDerWaalsContact O-NE1 3.09Å; I11-W56 HydrophobicContact CB-CD2 4.41Å; I11-W56 HydrophobicContact CB-CZ2 4.43Å; I11-W56 HydrophobicContact CD1-CB 3.78Å; I11-W56 HydrophobicContact CD1-CD2 4.02Å; I11-W56 HydrophobicContact CD1-CE3 4.47Å; I11-W56 HydrophobicContact CD1-CG 3.72Å; I11-W56 HydrophobicContact CG1-CB 4.25Å; I11-W56 HydrophobicContact CG1-CD2 3.73Å; I11-W56 HydrophobicContact CG1-CE3 4.42Å; I11-W56 HydrophobicContact CG1-CG 3.63Å; I11-W56 HydrophobicContact CG1-CZ2 4.48Å; I11-W56 HydrophobicContact CG2-CD2 4.16Å; I11-W56 HydrophobicContact CG2-CE3 4.1Å; I11-W56 HydrophobicContact CG2-CH2 4.14Å; I11-W56 HydrophobicContact CG2-CZ2 4.14Å; I11-W56 HydrophobicContact CG2-CZ3 4.1Å; E14-W56 HydrophobicContact CB-CH2 3.9Å; E14-W56 HydrophobicContact CB-CZ2 4.28Å; E14-W56 HydrophobicContact CG-CH2 4.14Å; E14-W56 HydrophobicContact CG-CZ2 4.17Å; Y52-W56 HydrophobicContact CD2-CE3 4.12Å; Y52-W56 AromaticContact CD2-CZ3 3.9Å; Y52-W56 HydrophobicContact CD2-CZ3 3.9Å; Y52-W56 HydrophobicContact CE2-CZ3 4.41Å; Y52-W56 PolarHBondContact O-N 2.95Å; W56-R68 VanDerWaalsContact CE3-CD 3.44Å; W56-V106 HydrophobicContact CH2-CG1 4.37Å; W56-V106 HydrophobicContact CZ3-CG1 4.44Å; W56-V106 WeakPolarHBondContact CZ3-O 3.46Å; W56-D107 VanDerWaalsContact CH2-C 3.45Å; W56-P108 HydrophobicContact CD2-CG 3.87Å; W56-P108 HydrophobicContact CE3-CG 4.38Å; W56-P108 HydrophobicContact CG-CG 4.31Å; W56-P108 HydrophobicContact CH2-CG 4.31Å; W56-P108 VanDerWaalsContact CZ2-CA 3.44Å; W56-P108 HydrophobicContact CZ2-CB 3.99Å; W56-P108 HydrophobicContact CZ2-CG 3.84Å
57F95.7Very high96.7Very high62 Ų6270.9 Ų70.927%0.27236%0.364SS..  trans-133.384.6-175.2-53.3-80.4000110.4D59 R60 K63F57-D59 VanDerWaalsContact C-N 3.27Å; F57-D59 PolarHBondContact O-N 2.84Å; F57-R60 CarbonylContact O-C 3.6Å; F57-R60 WeakPolarHBondContact O-CA 3.41Å; F57-R60 PolarHBondContact O-N 2.89Å; F57-R60 VanDerWaalsContact O-O 3.11Å; F57-K63 HydrophobicContact CB-CB 4.39Å; F57-K63 HydrophobicContact CB-CD 4.48Å; F57-K63 HydrophobicContact CD1-CD 4.15Å; F57-K63 HydrophobicContact CD2-CB 3.91Å; F57-K63 HydrophobicContact CD2-CD 3.71Å; F57-K63 HydrophobicContact CD2-CG 3.75Å; F57-K63 WeakPolarHBondContact CD2-O 3.5Å; F57-K63 HydrophobicContact CE1-CD 4.32Å; F57-K63 HydrophobicContact CE2-CD 3.88Å; F57-K63 HydrophobicContact CE2-CG 3.96Å; F57-K63 HydrophobicContact CG-CB 4.35Å; F57-K63 HydrophobicContact CG-CD 3.85Å; F57-K63 HydrophobicContact CG-CG 4.32Å; F57-K63 HydrophobicContact CZ-CD 4.2Å
58P94.5Very high96.7Very high31 Ų3169.9 Ų69.920%0.20136%0.357CS..THydrogen-bonded Turntrans-55.4-37.6-179.4-27.836.4000114R60 P61 P108 F109P58-R60 PolarHBondContact O-N 3.15Å; P58-P61 VanDerWaalsContact O-CD 3.31Å; P58-P61 WeakPolarHBondContact O-CD 3.45Å; P58-P61 WeakPolarHBondContact O-CG 3.42Å; P58-P108 HydrophobicContact CB-CB 4.37Å; P58-F109 HydrophobicContact CB-CE2 4.06Å; P58-F109 HydrophobicContact CB-CZ 3.95Å; P58-F109 WeakPolarHBondContact O-CE2 3.44Å
59D93.9Very high96.7Very high144 Ų14471.1 Ų71.177%0.7737%0.365SS*.THydrogen-bonded Turntrans-67.9-17.9177.1-59.4-36000113.7F57F57-D59 VanDerWaalsContact C-N 3.27Å; F57-D59 PolarHBondContact O-N 2.84Å
60R95.3Very high96.8Very high175 Ų17569.1 Ų69.166%0.6635%0.351SS*.SBendtrans-142.471.7178.8-61.1-176.4-171.5168.74.4109.3F57 P58 Q62 K63F57-R60 CarbonylContact O-C 3.6Å; F57-R60 WeakPolarHBondContact O-CA 3.41Å; F57-R60 PolarHBondContact O-N 2.89Å; F57-R60 VanDerWaalsContact O-O 3.11Å; P58-R60 PolarHBondContact O-N 3.15Å; R60-Q62 PolarHBondContact O-N 3Å; R60-K63 HydrophobicContact CB-CB 4.01Å; R60-K63 VanDerWaalsContact O-CB 3.24Å; R60-K63 WeakPolarHBondContact O-CB 3.25Å; R60-K63 PolarHBondContact O-N 3.38Å
61P95.9Very high96.8Very high34 Ų3470.1 Ų70.122%0.22135%0.35CS..THydrogen-bonded Turntrans-54-37.5-168.8-29.336.7000113.8P58 K63 R68 P108 F109P58-P61 VanDerWaalsContact O-CD 3.31Å; P58-P61 WeakPolarHBondContact O-CD 3.45Å; P58-P61 WeakPolarHBondContact O-CG 3.42Å; P61-K63 VanDerWaalsContact C-N 3.26Å; P61-K63 PolarHBondContact O-N 3.26Å; P61-R68 PolarHBondContact O-NH2 2.87Å; P61-P108 HydrophobicContact CB-CB 4.11Å; P61-P108 HydrophobicContact CB-CG 4.24Å; P61-P108 HydrophobicContact CG-CB 4.29Å; P61-F109 HydrophobicContact CG-CD2 4.07Å; P61-F109 HydrophobicContact CG-CE2 4.39Å
62Q95.6Very high96.6Very high136 Ų13667.3 Ų67.364%0.63634%0.337SS*.THydrogen-bonded Turntrans-68.4-20.5179.8-59.4-57.8-35.100113.9R60 G64 S65R60-Q62 PolarHBondContact O-N 3Å; Q62-G64 PolarHBondContact O-N 3.01Å; Q62-S65 WeakPolarHBondContact O-CB 3.38Å; Q62-S65 PolarHBondContact O-N 3.39Å
63K97.6Very high96.2Very high102 Ų10269.6 Ų69.644%0.44335%0.349SS..THydrogen-bonded Turntrans-67120.6177.3-173.6-175.9175-161.90108.9F57 R60 P61 S65 R68F57-K63 HydrophobicContact CB-CB 4.39Å; F57-K63 HydrophobicContact CB-CD 4.48Å; F57-K63 HydrophobicContact CD1-CD 4.15Å; F57-K63 HydrophobicContact CD2-CB 3.91Å; F57-K63 HydrophobicContact CD2-CD 3.71Å; F57-K63 HydrophobicContact CD2-CG 3.75Å; F57-K63 WeakPolarHBondContact CD2-O 3.5Å; F57-K63 HydrophobicContact CE1-CD 4.32Å; F57-K63 HydrophobicContact CE2-CD 3.88Å; F57-K63 HydrophobicContact CE2-CG 3.96Å; F57-K63 HydrophobicContact CG-CB 4.35Å; F57-K63 HydrophobicContact CG-CD 3.85Å; F57-K63 HydrophobicContact CG-CG 4.32Å; F57-K63 HydrophobicContact CZ-CD 4.2Å; R60-K63 HydrophobicContact CB-CB 4.01Å; R60-K63 VanDerWaalsContact O-CB 3.24Å; R60-K63 WeakPolarHBondContact O-CB 3.25Å; R60-K63 PolarHBondContact O-N 3.38Å; P61-K63 VanDerWaalsContact C-N 3.26Å; P61-K63 PolarHBondContact O-N 3.26Å; K63-S65 VanDerWaalsContact C-N 3.32Å; K63-R68 PolarHBondContact O-NH1 3.21Å
64G98Very high95.9Very high25 Ų2570 Ų7026%0.25835%0.35SS..THydrogen-bonded Turntrans80.64.8-179.200000115Q62 G66 Y67 R68Q62-G64 PolarHBondContact O-N 3.01Å; G64-G66 VanDerWaalsContact C-N 3.29Å; G64-G66 PolarHBondContact O-N 3.21Å; G64-Y67 WeakPolarHBondContact O-CB 3.48Å; G64-Y67 PolarHBondContact O-N 3.03Å; G64-R68 PolarHBondContact O-N 2.76Å
65S98.3Very high95.9Very high11 Ų1170.9 Ų70.98%0.07735%0.35CS..Hα-helixtrans-54.8-43.7178.6176.80000112.2Q62 K63 Y67 R68 C69 D107Q62-S65 WeakPolarHBondContact O-CB 3.38Å; Q62-S65 PolarHBondContact O-N 3.39Å; K63-S65 VanDerWaalsContact C-N 3.32Å; S65-Y67 VanDerWaalsContact C-N 3.3Å; S65-Y67 PolarHBondContact O-N 2.97Å; S65-R68 CarbonylContact O-C 3.33Å; S65-R68 PolarHBondContact O-N 2.65Å; S65-R68 VanDerWaalsContact O-N 3.15Å; S65-C69 WeakPolarHBondContact O-CB 3.4Å; S65-C69 PolarHBondContact O-N 2.99Å; S65-D107 WeakPolarHBondContact CA-OD1 3.39Å; S65-D107 VanDerWaalsContact CB-OD1 3.27Å; S65-D107 WeakPolarHBondContact CB-OD1 3.27Å; S65-D107 VanDerWaalsContact CB-OD2 3.3Å; S65-D107 WeakPolarHBondContact CB-OD2 3.45Å; S65-D107 VanDerWaalsContact OG-CG 3.28Å; S65-D107 PolarHBondContact OG-OD1 2.92Å; S65-D107 VanDerWaalsContact OG-OD1 3.06Å; S65-D107 PolarHBondContact OG-OD2 3.42Å
66G98.3Very high95.8Very high66 Ų6669.2 Ų69.268%0.6834%0.343SS*.Hα-helixtrans-62.4-31175.200000114.8G64 C69G64-G66 VanDerWaalsContact C-N 3.29Å; G64-G66 PolarHBondContact O-N 3.21Å; G66-C69 WeakPolarHBondContact O-CB 3.45Å
67Y98.5Very high95.8Very high99 Ų9968.9 Ų68.939%0.38834%0.343SS..Hα-helixtrans-73.3-38174.9171.5-84.1000111.3H51 H55 G64 S65 C69H51-Y67 AromaticContact CD2-CE1 3.74Å; H51-Y67 AromaticContact CE1-CE1 3.8Å; H51-Y67 AromaticContact CE1-CZ 3.36Å; H51-Y67 PolarHBondContact CE1-OH 2.85Å; H51-Y67 AromaticContact ND1-CZ 3.98Å; H51-Y67 PolarHBondContact ND1-OH 3.28Å; H51-Y67 AromaticContact NE2-CE1 3.41Å; H51-Y67 WeakPolarHBondContact NE2-CE1 3.48Å; H51-Y67 AromaticContact NE2-CZ 3.43Å; H51-Y67 WeakPolarHBondContact O-CE1 3.39Å; H51-Y67 PolarHBondContact O-OH 2.73Å; H55-Y67 HydrophobicContact CB-CD1 3.61Å; H55-Y67 HydrophobicContact CB-CE1 3.78Å; H55-Y67 HydrophobicContact CB-CG 4.45Å; H55-Y67 AromaticContact CD2-CD1 3.94Å; H55-Y67 AromaticContact CE1-CE1 3.83Å; H55-Y67 AromaticContact CE1-CE2 3.76Å; H55-Y67 AromaticContact CE1-CZ 3.49Å; H55-Y67 VanDerWaalsContact CE1-CZ 3.49Å; H55-Y67 AromaticContact CG-CD1 3.51Å; H55-Y67 AromaticContact CG-CE1 3.46Å; H55-Y67 VanDerWaalsContact CG-CE1 3.46Å; H55-Y67 AromaticContact CG-CZ 3.94Å; H55-Y67 AromaticContact ND1-CD1 3.82Å; H55-Y67 AromaticContact ND1-CE1 3.25Å; H55-Y67 WeakPolarHBondContact ND1-CE1 3.47Å; H55-Y67 AromaticContact ND1-CZ 3.37Å; G64-Y67 WeakPolarHBondContact O-CB 3.48Å; G64-Y67 PolarHBondContact O-N 3.03Å; S65-Y67 VanDerWaalsContact C-N 3.3Å; S65-Y67 PolarHBondContact O-N 2.97Å; Y67-C69 VanDerWaalsContact C-N 3.3Å
68R98.6Very high95.8Very high1 Ų170.2 Ų70.20%0.00436%0.358CS..Hα-helixtrans-81-11.1178-59.5-170.6-58-90.1-3.5113.3Y52 H55 W56 P61 K63 G64 S65 I70 V106 D107Y52-R68 HydrophobicContact CD1-CB 3.97Å; Y52-R68 HydrophobicContact CD1-CG 3.61Å; Y52-R68 HydrophobicContact CD2-CG 4.38Å; Y52-R68 HydrophobicContact CE1-CB 3.6Å; Y52-R68 HydrophobicContact CE1-CG 3.82Å; Y52-R68 HydrophobicContact CE2-CB 4.29Å; Y52-R68 HydrophobicContact CG-CB 4.47Å; Y52-R68 HydrophobicContact CG-CG 3.93Å; Y52-R68 PolarHBondContact OH-O 2.8Å; H55-R68 WeakPolarHBondContact O-CD 3.18Å; H55-R68 PolarHBondContact O-NH1 3.1Å; W56-R68 VanDerWaalsContact CE3-CD 3.44Å; P61-R68 PolarHBondContact O-NH2 2.87Å; K63-R68 PolarHBondContact O-NH1 3.21Å; G64-R68 PolarHBondContact O-N 2.76Å; S65-R68 CarbonylContact O-C 3.33Å; S65-R68 PolarHBondContact O-N 2.65Å; S65-R68 VanDerWaalsContact O-N 3.15Å; R68-I70 PolarHBondContact O-N 3.2Å; R68-V106 PolarHBondContact NE-O 3.18Å; R68-D107 IonicContact CZ-OD1 3.47Å; R68-D107 IonicContact NE-OD1 3.53Å; R68-D107 VanDerWaalsContact NH2-CG 3.34Å; R68-D107 IonicContact NH2-OD1 2.65Å; R68-D107 PolarHBondContact NH2-OD1 3.39Å
69C98.3Very high96Very high27 Ų2769.1 Ų69.118%0.18235%0.35CS..  trans-62.1124.3-178.61800000110.6S65 G66 Y67 T103 L104S65-C69 WeakPolarHBondContact O-CB 3.4Å; S65-C69 PolarHBondContact O-N 2.99Å; G66-C69 WeakPolarHBondContact O-CB 3.45Å; Y67-C69 VanDerWaalsContact C-N 3.3Å; C69-T103 WeakPolarHBondContact SG-CG2 3.43Å; C69-L104 WeakPolarHBondContact CA-O 3.26Å
70I98.3Very high96.2Very high3 Ų362.2 Ų62.22%0.01531%0.314CS..EExtended strand (participates in β ladder)trans-88.4120.1169.3-62.8160.5000106.9L48 R68 D77 I80 L104 V106L48-I70 HydrophobicContact CD1-CD1 3.96Å; L48-I70 HydrophobicContact CD2-CD1 3.74Å; L48-I70 HydrophobicContact CD2-CG1 4.16Å; R68-I70 PolarHBondContact O-N 3.2Å; I70-D77 HydrophobicContact CG2-CB 4.06Å; I70-I80 HydrophobicContact CG2-CD1 4.13Å; I70-I80 HydrophobicContact CG2-CG1 3.76Å; I70-L104 HydrophobicContact CB-CB 4.22Å; I70-L104 HydrophobicContact CD1-CD2 3.96Å; I70-L104 PolarHBondContact N-O 3.39Å; I70-L104 PolarHBondContact O-N 3.37Å; I70-V106 HydrophobicContact CD1-CG2 4.25Å
71R96.8Very high96.3Very high141 Ų14154.9 Ų54.953%0.53229%0.292SS..EExtended strand (participates in β ladder)trans-128.4125.7-177.9-171.5176179.1-176.6-0.8110.5L102R71-L102 WeakPolarHBondContact CA-O 3.38Å
72M94.3Very high96.4Very high4 Ų460.9 Ų60.92%0.0231%0.31CS..EExtended strand (participates in β ladder)trans-119.7128.9169.4-61.8-178.9-56.100108.6M76 D77 I80 L98 E101 L102M72-M76 HydrophobicContact CG-SD 4.28Å; M72-M76 HydrophobicContact SD-CE 4.23Å; M72-M76 HydrophobicContact SD-SD 3.72Å; M72-D77 HydrophobicContact CG-CB 4.02Å; M72-I80 HydrophobicContact SD-CG2 4.14Å; M72-L98 HydrophobicContact CE-CB 3.95Å; M72-L98 HydrophobicContact CE-CD1 3.72Å; M72-L98 HydrophobicContact CE-CG 4.31Å; M72-L98 HydrophobicContact SD-CD1 3.58Å; M72-L98 VanDerWaalsContact SD-CD1 3.58Å; M72-E101 WeakPolarHBondContact O-CA 3.37Å; M72-L102 HydrophobicContact CB-CB 4.48Å; M72-L102 HydrophobicContact CE-CB 3.69Å; M72-L102 HydrophobicContact CE-CD2 3.39Å; M72-L102 HydrophobicContact CE-CG 4.09Å; M72-L102 PolarHBondContact N-O 2.74Å; M72-L102 PolarHBondContact O-N 2.87Å
73N89.8Confident96.5Very high48 Ų4854.4 Ų54.426%0.25728%0.28SS..SBendtrans-139.1-122.2173.8604.2000108.3E75 F95 R100N73-E75 PolarHBondContact N-O 2.9Å; N73-E75 PolarHBondContact O-N 3.4Å; N73-E75 PolarHBondContact OD1-N 3.36Å; N73-F95 WeakPolarHBondContact O-CE1 3.38Å; N73-R100 CarbonylContact C-O 3.53Å; N73-R100 VanDerWaalsContact CA-O 3.23Å; N73-R100 WeakPolarHBondContact CA-O 3.48Å
74H87.3Confident96.4Very high144 Ų14449.5 Ų49.567%0.66726%0.259SS*.SBendtrans-68.9-12165.6-55.897.3000113
75E93.4Very high96.4Very high147 Ų14750.4 Ų50.469%0.68727%0.268SS*.SBendtrans-117.2143.6177-62.2-175165.400110.9N73N73-E75 PolarHBondContact N-O 2.9Å; N73-E75 PolarHBondContact O-N 3.4Å; N73-E75 PolarHBondContact OD1-N 3.36Å
76M95.6Very high96.3Very high30 Ų3059 Ų5915%0.14830%0.299CS..  trans-83.1132.6177-178.555.552.400109.1M72 I80 L94 F95M72-M76 HydrophobicContact CG-SD 4.28Å; M72-M76 HydrophobicContact SD-CE 4.23Å; M72-M76 HydrophobicContact SD-SD 3.72Å; M76-I80 HydrophobicContact SD-CB 4.31Å; M76-I80 HydrophobicContact SD-CG2 3.95Å; M76-L94 HydrophobicContact CE-CB 3.38Å; M76-L94 HydrophobicContact CE-CD1 4.1Å; M76-L94 HydrophobicContact CE-CG 4.39Å; M76-L94 HydrophobicContact CG-CD1 4.29Å; M76-L94 HydrophobicContact SD-CB 4.17Å; M76-L94 HydrophobicContact SD-CD1 3.86Å; M76-F95 HydrophobicContact CB-CE2 4.37Å; M76-F95 HydrophobicContact CB-CZ 3.97Å; M76-F95 HydrophobicContact CE-CD1 3.89Å; M76-F95 HydrophobicContact CE-CD2 4.37Å; M76-F95 HydrophobicContact CE-CE1 3.84Å; M76-F95 HydrophobicContact CE-CE2 4.33Å; M76-F95 HydrophobicContact CE-CG 4.16Å; M76-F95 HydrophobicContact CE-CZ 4.08Å
77D97.4Very high96.2Very high16 Ų1656.6 Ų56.69%0.08627%0.27CS..  trans-59.1128.5172.1176.5-83.6000109.7I70 M72 I79 I80 G81I70-D77 HydrophobicContact CG2-CB 4.06Å; M72-D77 HydrophobicContact CG-CB 4.02Å; D77-I79 VanDerWaalsContact C-N 3.26Å; D77-I79 PolarHBondContact O-N 3Å; D77-I79 WeakPolarHBondContact OD1-CA 3.28Å; D77-I79 VanDerWaalsContact OD1-CB 3.29Å; D77-I79 WeakPolarHBondContact OD1-CB 3.43Å; D77-I79 PolarHBondContact OD1-N 3.46Å; D77-I80 HydrophobicContact CB-CB 4.04Å; D77-I80 HydrophobicContact CB-CG1 3.79Å; D77-I80 PolarHBondContact O-N 3.29Å; D77-I80 PolarHBondContact OD1-N 2.92Å; D77-G81 PolarHBondContact O-N 2.95Å
78P97.1Very high96.1Very high90 Ų9054.6 Ų54.658%0.58428%0.28SS*.Hα-helixtrans-68.3-23.4-173.126.1-34.9000113.5R82P78-R82 WeakPolarHBondContact O-CB 3.35Å; P78-R82 VanDerWaalsContact O-CG 3.28Å; P78-R82 WeakPolarHBondContact O-CG 3.48Å; P78-R82 PolarHBondContact O-N 3.45Å; P78-R82 PolarHBondContact O-NE 3.12Å
79I98.1Very high96Very high8 Ų855.5 Ų55.54%0.04129%0.285CS..Hα-helixtrans-77.3-45.7175.6-56.1179.3000109.4L44 L48 H51 D77 R82 A83L44-I79 HydrophobicContact CD1-CG2 3.8Å; L48-I79 HydrophobicContact CD2-CB 4.42Å; L48-I79 HydrophobicContact CD2-CD1 3.97Å; L48-I79 HydrophobicContact CD2-CG2 3.82Å; L48-I79 HydrophobicContact CG-CG2 4.31Å; H51-I79 HydrophobicContact CB-CD1 3.88Å; D77-I79 VanDerWaalsContact C-N 3.26Å; D77-I79 PolarHBondContact O-N 3Å; D77-I79 WeakPolarHBondContact OD1-CA 3.28Å; D77-I79 VanDerWaalsContact OD1-CB 3.29Å; D77-I79 WeakPolarHBondContact OD1-CB 3.43Å; D77-I79 PolarHBondContact OD1-N 3.46Å; I79-R82 PolarHBondContact O-N 2.98Å; I79-A83 PolarHBondContact O-N 2.95Å
80I97.9Very high95.9Very high0 Ų057.7 Ų57.70%030%0.298CS..Hα-helixtrans-59.4-49174.5-59.5-66.4000110.7V22 L44 I70 M72 M76 D77 R82 A83 A84 L98V22-I80 HydrophobicContact CG1-CD1 4.14Å; V22-I80 HydrophobicContact CG2-CD1 4.16Å; L44-I80 HydrophobicContact CD1-CD1 3.73Å; L44-I80 HydrophobicContact CD2-CD1 3.69Å; L44-I80 HydrophobicContact CG-CD1 4.39Å; I70-I80 HydrophobicContact CG2-CD1 4.13Å; I70-I80 HydrophobicContact CG2-CG1 3.76Å; M72-I80 HydrophobicContact SD-CG2 4.14Å; M76-I80 HydrophobicContact SD-CB 4.31Å; M76-I80 HydrophobicContact SD-CG2 3.95Å; D77-I80 HydrophobicContact CB-CB 4.04Å; D77-I80 HydrophobicContact CB-CG1 3.79Å; D77-I80 PolarHBondContact O-N 3.29Å; D77-I80 PolarHBondContact OD1-N 2.92Å; I80-R82 PolarHBondContact O-N 2.69Å; I80-A83 PolarHBondContact O-N 3.42Å; I80-A84 VanDerWaalsContact O-CB 3.25Å; I80-A84 WeakPolarHBondContact O-CB 3.28Å; I80-A84 PolarHBondContact O-N 2.93Å; I80-L98 HydrophobicContact CG2-CD1 4.16Å
81G97.3Very high95.6Very high20 Ų2060.4 Ų60.421%0.20632%0.317CS..Hα-helixtrans-59.1-42.9179.600000112.8D77 G85D77-G81 PolarHBondContact O-N 2.95Å; G81-G85 PolarHBondContact O-N 2.88Å
82R97.4Very high95.4Very high160 Ų16059.9 Ų59.960%0.60433%0.325SS*.Hα-helixtrans-65.9-42.6175.9-78.1-175.6-61.7-174.66.2112.8P78 I79 I80 G85 R86P78-R82 WeakPolarHBondContact O-CB 3.35Å; P78-R82 VanDerWaalsContact O-CG 3.28Å; P78-R82 WeakPolarHBondContact O-CG 3.48Å; P78-R82 PolarHBondContact O-N 3.45Å; P78-R82 PolarHBondContact O-NE 3.12Å; I79-R82 PolarHBondContact O-N 2.98Å; I80-R82 PolarHBondContact O-N 2.69Å; R82-G85 PolarHBondContact O-N 3.06Å; R82-R86 PolarHBondContact O-N 2.95Å
83A97.9Very high95.5Very high0 Ų064 Ų640%034%0.344CS..Hα-helixtrans-65.4-42.9178.500000111.6F40 C43 L44 I79 I80 R86F40-A83 HydrophobicContact CD2-CB 4.04Å; F40-A83 HydrophobicContact CE2-CB 3.89Å; C43-A83 HydrophobicContact CB-CB 4.22Å; L44-A83 HydrophobicContact CB-CB 3.97Å; L44-A83 HydrophobicContact CD1-CB 4.38Å; I79-A83 PolarHBondContact O-N 2.95Å; I80-A83 PolarHBondContact O-N 3.42Å; A83-R86 WeakPolarHBondContact O-CB 3.28Å; A83-R86 PolarHBondContact O-N 3.44Å
84A97.1Very high95.7Very high0 Ų061.7 Ų61.70%033%0.332CS..Hα-helixtrans-65.3-37.6176.100000113F40 I80 R86 I87 G88 L89 L94F40-A84 HydrophobicContact CD2-CB 4.31Å; F40-A84 HydrophobicContact CE2-CB 4.06Å; I80-A84 VanDerWaalsContact O-CB 3.25Å; I80-A84 WeakPolarHBondContact O-CB 3.28Å; I80-A84 PolarHBondContact O-N 2.93Å; A84-R86 PolarHBondContact O-N 2.94Å; A84-I87 WeakPolarHBondContact O-CG1 3.24Å; A84-I87 PolarHBondContact O-N 2.94Å; A84-G88 PolarHBondContact O-N 3.19Å; A84-L89 HydrophobicContact CB-CB 4.1Å; A84-L89 PolarHBondContact O-N 2.96Å; A84-L89 VanDerWaalsContact O-N 3.13Å; A84-L94 HydrophobicContact CB-CD1 3.37Å; A84-L94 HydrophobicContact CB-CD2 3.58Å; A84-L94 HydrophobicContact CB-CG 3.91Å
85G97.4Very high96Very high44 Ų4458 Ų5845%0.45431%0.314SS..Hα-helixtrans-57.5-31.3175.100000113G81 R82 I87 G88G81-G85 PolarHBondContact O-N 2.88Å; R82-G85 PolarHBondContact O-N 3.06Å; G85-I87 PolarHBondContact O-N 3.1Å; G85-G88 PolarHBondContact O-N 3.41Å; G85-G88 VanDerWaalsContact O-N 3.15Å
86R95.9Very high96Very high190 Ų19054.7 Ų54.772%0.71731%0.311SS*.THydrogen-bonded Turntrans-65-26.6176.2-67.1-144.9-177.5-172.63.9114C43 R82 A83 A84C43-R86 WeakPolarHBondContact SG-CD 3.39Å; C43-R86 PolarHBondContact SG-NE 3.05Å; C43-R86 VanDerWaalsContact SG-NE 3.44Å; R82-R86 PolarHBondContact O-N 2.95Å; A83-R86 WeakPolarHBondContact O-CB 3.28Å; A83-R86 PolarHBondContact O-N 3.44Å; A84-R86 PolarHBondContact O-N 2.94Å
87I96.6Very high96Very high16 Ų1654.5 Ų54.58%0.08231%0.311CS..THydrogen-bonded Turntrans-100.412.5178.265.1155.9000112.4L32 Q36 D39 F40 A84 G85 L89L32-I87 HydrophobicContact CD1-CD1 4.2Å; L32-I87 HydrophobicContact CD2-CD1 4.37Å; Q36-I87 HydrophobicContact CB-CB 4.3Å; Q36-I87 HydrophobicContact CB-CD1 4.27Å; Q36-I87 HydrophobicContact CB-CG2 4.47Å; Q36-I87 HydrophobicContact CG-CB 4.43Å; Q36-I87 PolarHBondContact NE2-O 3.33Å; Q36-I87 WeakPolarHBondContact O-CG2 3.41Å; D39-I87 HydrophobicContact CB-CG2 3.81Å; F40-I87 HydrophobicContact CB-CD1 3.92Å; F40-I87 HydrophobicContact CB-CG1 4.4Å; F40-I87 HydrophobicContact CB-CG2 4.13Å; F40-I87 HydrophobicContact CD2-CD1 4.47Å; F40-I87 HydrophobicContact CG-CD1 4.45Å; A84-I87 WeakPolarHBondContact O-CG1 3.24Å; A84-I87 PolarHBondContact O-N 2.94Å; G85-I87 PolarHBondContact O-N 3.1Å; I87-L89 HydrophobicContact CD1-CD1 3.71Å; I87-L89 HydrophobicContact CD1-CG 4.05Å; I87-L89 HydrophobicContact CG1-CD1 4.22Å; I87-L89 HydrophobicContact CG1-CG 4.13Å
88G96.2Very high95.9Very high58 Ų5853.9 Ų53.960%0.59831%0.307SS*.THydrogen-bonded Turntrans82.815.5175.400000115A84 G85A84-G88 PolarHBondContact O-N 3.19Å; G85-G88 PolarHBondContact O-N 3.41Å; G85-G88 VanDerWaalsContact O-N 3.15Å
89L96.6Very high95.7Very high19 Ų1949.9 Ų49.910%0.09928%0.282CS..  trans-89133.5177.3-69.1-179.2000112.2L32 A84 I87 Q93 L94 L97L32-L89 HydrophobicContact CD1-CD1 4.07Å; L32-L89 HydrophobicContact CD2-CD1 4.29Å; L32-L89 HydrophobicContact CD2-CD2 4.21Å; L32-L89 HydrophobicContact CD2-CG 4.47Å; A84-L89 HydrophobicContact CB-CB 4.1Å; A84-L89 PolarHBondContact O-N 2.96Å; A84-L89 VanDerWaalsContact O-N 3.13Å; I87-L89 HydrophobicContact CD1-CD1 3.71Å; I87-L89 HydrophobicContact CD1-CG 4.05Å; I87-L89 HydrophobicContact CG1-CD1 4.22Å; I87-L89 HydrophobicContact CG1-CG 4.13Å; L89-Q93 HydrophobicContact CD2-CB 4.23Å; L89-L94 HydrophobicContact CB-CD2 4.4Å; L89-L94 HydrophobicContact CB-CG 4.4Å; L89-L94 HydrophobicContact CD1-CD2 3.93Å; L89-L97 HydrophobicContact CD1-CD1 4.21Å; L89-L97 HydrophobicContact CD2-CD1 4.26Å
90T94.9Very high95.4Very high74 Ų7458.4 Ų58.445%0.45431%0.313SS..  trans-84.8162170.971.50000111.7D92 Q93 L94T90-D92 VanDerWaalsContact C-N 3.26Å; T90-D92 PolarHBondContact O-N 2.88Å; T90-Q93 PolarHBondContact O-N 3.49Å; T90-Q93 WeakPolarHBondContact OG1-CG 3.27Å; T90-Q93 PolarHBondContact OG1-N 3.17Å; T90-Q93 PolarHBondContact OG1-OE1 3.26Å; T90-L94 WeakPolarHBondContact O-CG 3.3Å; T90-L94 PolarHBondContact O-N 3.02Å
91S92.3Very high95.3Very high60 Ų6061.1 Ų61.142%0.4233%0.326SS..Hα-helixtrans-56.4-40.3174.4-51.10000112.5Q93 L94 F95S91-Q93 PolarHBondContact O-N 2.88Å; S91-L94 WeakPolarHBondContact O-CB 3.38Å; S91-L94 PolarHBondContact O-N 2.91Å; S91-F95 WeakPolarHBondContact O-CD2 3.36Å; S91-F95 PolarHBondContact O-N 2.64Å
92D93.6Very high95.3Very high130 Ų13060.2 Ų60.270%0.69532%0.316SS*.Hα-helixtrans-64.4-41178.8-64-22.2000112T90 L94 F95 A96T90-D92 VanDerWaalsContact C-N 3.26Å; T90-D92 PolarHBondContact O-N 2.88Å; D92-L94 VanDerWaalsContact C-N 3.33Å; D92-F95 PolarHBondContact O-N 3.36Å; D92-A96 PolarHBondContact O-N 3.26Å; D92-A96 VanDerWaalsContact O-N 3.17Å
93Q94.9Very high95.3Very high89 Ų8953.2 Ų53.242%0.41629%0.291SS..Hα-helixtrans-64-41174-71.2172.5-39.200110.9L89 T90 S91 F95 A96 L97L89-Q93 HydrophobicContact CD2-CB 4.23Å; T90-Q93 PolarHBondContact O-N 3.49Å; T90-Q93 WeakPolarHBondContact OG1-CG 3.27Å; T90-Q93 PolarHBondContact OG1-N 3.17Å; T90-Q93 PolarHBondContact OG1-OE1 3.26Å; S91-Q93 PolarHBondContact O-N 2.88Å; Q93-F95 PolarHBondContact O-N 2.82Å; Q93-A96 WeakPolarHBondContact O-CB 3.37Å; Q93-A96 PolarHBondContact O-N 3.13Å; Q93-L97 WeakPolarHBondContact O-CB 3.45Å; Q93-L97 WeakPolarHBondContact O-CG 3.46Å; Q93-L97 PolarHBondContact O-N 2.75Å
94L94.8Very high95.3Very high1 Ų153.2 Ų53.21%0.00529%0.291CS..Hα-helixtrans-62.4-41.3175.9-69.3168.2000112.3L26 M76 A84 L89 T90 S91 D92 A96 L97 L98L26-L94 HydrophobicContact CD2-CD2 3.86Å; M76-L94 HydrophobicContact CE-CB 3.38Å; M76-L94 HydrophobicContact CE-CD1 4.1Å; M76-L94 HydrophobicContact CE-CG 4.39Å; M76-L94 HydrophobicContact CG-CD1 4.29Å; M76-L94 HydrophobicContact SD-CB 4.17Å; M76-L94 HydrophobicContact SD-CD1 3.86Å; A84-L94 HydrophobicContact CB-CD1 3.37Å; A84-L94 HydrophobicContact CB-CD2 3.58Å; A84-L94 HydrophobicContact CB-CG 3.91Å; L89-L94 HydrophobicContact CB-CD2 4.4Å; L89-L94 HydrophobicContact CB-CG 4.4Å; L89-L94 HydrophobicContact CD1-CD2 3.93Å; T90-L94 WeakPolarHBondContact O-CG 3.3Å; T90-L94 PolarHBondContact O-N 3.02Å; S91-L94 WeakPolarHBondContact O-CB 3.38Å; S91-L94 PolarHBondContact O-N 2.91Å; D92-L94 VanDerWaalsContact C-N 3.33Å; L94-A96 PolarHBondContact O-N 3.09Å; L94-L97 PolarHBondContact O-N 3.03Å; L94-L97 VanDerWaalsContact O-N 3.1Å; L94-L98 HydrophobicContact CB-CD1 4.36Å; L94-L98 HydrophobicContact CD2-CD1 4.1Å; L94-L98 WeakPolarHBondContact O-CB 3.46Å; L94-L98 PolarHBondContact O-N 3.17Å
95F93.9Very high95.4Very high67 Ų6755.5 Ų55.529%0.29430%0.3SS..Hα-helixtrans-63.3-29175.3-75-56.9000113.3N73 M76 S91 D92 Q93N73-F95 WeakPolarHBondContact O-CE1 3.38Å; M76-F95 HydrophobicContact CB-CE2 4.37Å; M76-F95 HydrophobicContact CB-CZ 3.97Å; M76-F95 HydrophobicContact CE-CD1 3.89Å; M76-F95 HydrophobicContact CE-CD2 4.37Å; M76-F95 HydrophobicContact CE-CE1 3.84Å; M76-F95 HydrophobicContact CE-CE2 4.33Å; M76-F95 HydrophobicContact CE-CG 4.16Å; M76-F95 HydrophobicContact CE-CZ 4.08Å; S91-F95 WeakPolarHBondContact O-CD2 3.36Å; S91-F95 PolarHBondContact O-N 2.64Å; D92-F95 PolarHBondContact O-N 3.36Å; Q93-F95 PolarHBondContact O-N 2.82Å
96A93.5Very high95.5Very high77 Ų7753.4 Ų53.464%0.63628%0.278SS*.Hα-helixtrans-76.6-32.6172.600000112.7D92 Q93 L94D92-A96 PolarHBondContact O-N 3.26Å; D92-A96 VanDerWaalsContact O-N 3.17Å; Q93-A96 WeakPolarHBondContact O-CB 3.37Å; Q93-A96 PolarHBondContact O-N 3.13Å; L94-A96 PolarHBondContact O-N 3.09Å
97L94.9Very high95.6Very high25 Ų2544.6 Ų44.613%0.13125%0.245CC..Hα-helixtrans-91.5-24-173.6-67.2173.3000114.3L26 R29 G30 L89 Q93 L94L26-L97 HydrophobicContact CD2-CB 3.89Å; L26-L97 HydrophobicContact CD2-CD1 4.31Å; R29-L97 HydrophobicContact CB-CD2 4.26Å; R29-L97 WeakPolarHBondContact CB-O 3.28Å; R29-L97 VanDerWaalsContact CD-O 3.27Å; R29-L97 WeakPolarHBondContact CD-O 3.45Å; R29-L97 VanDerWaalsContact O-CD2 3.28Å; R29-L97 WeakPolarHBondContact O-CD2 3.3Å; G30-L97 VanDerWaalsContact CA-CD2 3.43Å; L89-L97 HydrophobicContact CD1-CD1 4.21Å; L89-L97 HydrophobicContact CD2-CD1 4.26Å; Q93-L97 WeakPolarHBondContact O-CB 3.45Å; Q93-L97 WeakPolarHBondContact O-CG 3.46Å; Q93-L97 PolarHBondContact O-N 2.75Å; L94-L97 PolarHBondContact O-N 3.03Å; L94-L97 VanDerWaalsContact O-N 3.1Å
98L95.3Very high95.6Very high3 Ų344 Ų442%0.01624%0.242CC..SBendtrans-106.1161.7-177.8-65.1173000111.2V22 L25 L26 R29 M72 I80 L94 R100V22-L98 HydrophobicContact CG1-CD2 4.17Å; L25-L98 HydrophobicContact CB-CD2 3.75Å; L25-L98 HydrophobicContact CD1-CD2 4.36Å; L26-L98 HydrophobicContact CD2-CD1 4.16Å; L26-L98 HydrophobicContact CD2-CD2 3.62Å; L26-L98 HydrophobicContact CD2-CG 3.76Å; L26-L98 HydrophobicContact CG-CD2 3.92Å; R29-L98 PolarHBondContact NH1-O 3.32Å; M72-L98 HydrophobicContact CE-CB 3.95Å; M72-L98 HydrophobicContact CE-CD1 3.72Å; M72-L98 HydrophobicContact CE-CG 4.31Å; M72-L98 HydrophobicContact SD-CD1 3.58Å; M72-L98 VanDerWaalsContact SD-CD1 3.58Å; I80-L98 HydrophobicContact CG2-CD1 4.16Å; L94-L98 HydrophobicContact CB-CD1 4.36Å; L94-L98 HydrophobicContact CD2-CD1 4.1Å; L94-L98 WeakPolarHBondContact O-CB 3.46Å; L94-L98 PolarHBondContact O-N 3.17Å; L98-R100 PolarHBondContact O-N 3.06Å
99P93.9Very high95.6Very high7 Ų743.6 Ų43.65%0.04522%0.224CC..  trans-57.2135.7167.7-20.132000110.4L25 E101 I115L25-P99 HydrophobicContact CD1-CG 4.18Å; P99-E101 PolarHBondContact O-N 3.25Å; P99-I115 HydrophobicContact CB-CG1 4.4Å; P99-I115 HydrophobicContact CB-CG2 3.81Å; P99-I115 HydrophobicContact CG-CD1 4.04Å; P99-I115 HydrophobicContact CG-CG1 4.23Å; P99-I115 HydrophobicContact CG-CG2 4.31Å
100R90.6Very high95.7Very high187 Ų18745.6 Ų45.671%0.70623%0.233SC*.SBendtrans-59.8-29.7178.6-65.9-170.883.5-158.34.9112.3N73 L98N73-R100 CarbonylContact C-O 3.53Å; N73-R100 VanDerWaalsContact CA-O 3.23Å; N73-R100 WeakPolarHBondContact CA-O 3.48Å; L98-R100 PolarHBondContact O-N 3.06Å
101E95.7Very high95.9Very high57 Ų5742.1 Ų42.127%0.26621%0.212SC..SBendtrans-128.9105.1178.1-65.7178.2148.500108.4M72 P99 I115 G116 E117M72-E101 WeakPolarHBondContact O-CA 3.37Å; P99-E101 PolarHBondContact O-N 3.25Å; E101-I115 CarbonylContact O-C 3.47Å; E101-I115 WeakPolarHBondContact O-CA 3.32Å; E101-G116 PolarHBondContact O-N 2.94Å; E101-G116 WeakPolarHBondContact OE2-CA 3.24Å; E101-E117 WeakPolarHBondContact OE1-CG 3.47Å; E101-E117 VanDerWaalsContact OE2-CG 3.27Å; E101-E117 WeakPolarHBondContact OE2-CG 3.27Å; E101-E117 PolarHBondContact OE2-N 3.2Å
102L97.1Very high96.2Very high1 Ų139.6 Ų39.61%0.00519%0.194CC..EExtended strand (participates in β ladder)trans-127131.3174.1178.565.4000108.5F21 L25 R71 M72 Y113 I115F21-L102 HydrophobicContact CE1-CD1 4.09Å; F21-L102 HydrophobicContact CE1-CD2 4.43Å; L25-L102 HydrophobicContact CD1-CD2 4.12Å; R71-L102 WeakPolarHBondContact CA-O 3.38Å; M72-L102 HydrophobicContact CB-CB 4.48Å; M72-L102 HydrophobicContact CE-CB 3.69Å; M72-L102 HydrophobicContact CE-CD2 3.39Å; M72-L102 HydrophobicContact CE-CG 4.09Å; M72-L102 PolarHBondContact N-O 2.74Å; M72-L102 PolarHBondContact O-N 2.87Å; L102-Y113 HydrophobicContact CD1-CD2 4.41Å; L102-I115 HydrophobicContact CD1-CG1 3.77Å
103T98.3Very high96.4Very high13 Ų1335.9 Ų35.98%0.0817%0.171CC..EExtended strand (participates in β ladder)trans-122.4127.6165.2-47.80000107.6C69 W105 Y113 R114C69-T103 WeakPolarHBondContact SG-CG2 3.43Å; T103-W105 HydrophobicContact CG2-CD2 4.21Å; T103-W105 HydrophobicContact CG2-CE3 4.38Å; T103-W105 HydrophobicContact CG2-CH2 3.53Å; T103-W105 HydrophobicContact CG2-CZ2 3.32Å; T103-W105 HydrophobicContact CG2-CZ3 4.06Å; T103-Y113 CarbonylContact O-C 2.96Å; T103-Y113 WeakPolarHBondContact O-CA 3.48Å; T103-Y113 WeakPolarHBondContact O-CB 3.46Å; T103-R114 PolarHBondContact N-O 2.9Å; T103-R114 PolarHBondContact O-N 2.87Å; T103-R114 PolarHBondContact OG1-NH2 3.09Å
104L98.6Very high96.6Very high0 Ų034.6 Ų34.60%016%0.162CC..EExtended strand (participates in β ladder)trans-131117.3-178.2174.167.8000108.4A18 F21 V22 C69 I70 V106 V111 S112A18-L104 HydrophobicContact CB-CD2 4Å; F21-L104 HydrophobicContact CD1-CD1 4.36Å; F21-L104 HydrophobicContact CD1-CD2 4.4Å; V22-L104 HydrophobicContact CG2-CD2 4.16Å; C69-L104 WeakPolarHBondContact CA-O 3.26Å; I70-L104 HydrophobicContact CB-CB 4.22Å; I70-L104 HydrophobicContact CD1-CD2 3.96Å; I70-L104 PolarHBondContact N-O 3.39Å; I70-L104 PolarHBondContact O-N 3.37Å; L104-V106 HydrophobicContact CG-CG2 4.15Å; L104-V111 HydrophobicContact CD1-CG1 3.64Å; L104-S112 WeakPolarHBondContact CD1-O 3.46Å
105W98.7Very high96.7Very high47 Ų4738 Ų3818%0.17818%0.179CC..EExtended strand (participates in β ladder)trans-95.5128.2175.3-62.3-87000108.9T103 V111 S112 R114 I121T103-W105 HydrophobicContact CG2-CD2 4.21Å; T103-W105 HydrophobicContact CG2-CE3 4.38Å; T103-W105 HydrophobicContact CG2-CH2 3.53Å; T103-W105 HydrophobicContact CG2-CZ2 3.32Å; T103-W105 HydrophobicContact CG2-CZ3 4.06Å; W105-V111 WeakPolarHBondContact O-CA 3.26Å; W105-V111 WeakPolarHBondContact O-CG1 3.48Å; W105-S112 PolarHBondContact N-O 2.91Å; W105-S112 PolarHBondContact O-N 3.21Å; W105-S112 VanDerWaalsContact O-N 3.12Å; W105-R114 HydrophobicContact CH2-CB 4.19Å; W105-R114 HydrophobicContact CZ3-CB 4.01Å; W105-I121 HydrophobicContact CZ3-CG1 4.44Å
106V98.6Very high96.8Very high0 Ų035.8 Ų35.80%018%0.176CC..EExtended strand (participates in β ladder)trans-121.793.1178.8-1690000106.6E14 V15 A18 Y52 W56 R68 I70 L104 V111E14-V106 HydrophobicContact CB-CG1 3.94Å; V15-V106 HydrophobicContact CG2-CG1 4.27Å; A18-V106 HydrophobicContact CB-CG1 4.31Å; A18-V106 HydrophobicContact CB-CG2 3.63Å; Y52-V106 HydrophobicContact CE2-CB 3.81Å; Y52-V106 HydrophobicContact CE2-CG1 3.79Å; Y52-V106 HydrophobicContact CE2-CG2 4.49Å; W56-V106 HydrophobicContact CH2-CG1 4.37Å; W56-V106 HydrophobicContact CZ3-CG1 4.44Å; W56-V106 WeakPolarHBondContact CZ3-O 3.46Å; R68-V106 PolarHBondContact NE-O 3.18Å; I70-V106 HydrophobicContact CD1-CG2 4.25Å; L104-V106 HydrophobicContact CG-CG2 4.15Å; V106-V111 HydrophobicContact CG1-CG2 4.21Å; V106-V111 HydrophobicContact CG2-CG1 4.43Å
107D98.2Very high96.6Very high5 Ų538.7 Ų38.73%0.02718%0.177CC..EExtended strand (participates in β ladder)trans-118.4154.1-172.7-63.9-23.2000109.6E14 W56 S65 R68 F109 E110E14-D107 WeakPolarHBondContact CG-O 3.4Å; W56-D107 VanDerWaalsContact CH2-C 3.45Å; S65-D107 WeakPolarHBondContact CA-OD1 3.39Å; S65-D107 VanDerWaalsContact CB-OD1 3.27Å; S65-D107 WeakPolarHBondContact CB-OD1 3.27Å; S65-D107 VanDerWaalsContact CB-OD2 3.3Å; S65-D107 WeakPolarHBondContact CB-OD2 3.45Å; S65-D107 VanDerWaalsContact OG-CG 3.28Å; S65-D107 PolarHBondContact OG-OD1 2.92Å; S65-D107 VanDerWaalsContact OG-OD1 3.06Å; S65-D107 PolarHBondContact OG-OD2 3.42Å; R68-D107 IonicContact CZ-OD1 3.47Å; R68-D107 IonicContact NE-OD1 3.53Å; R68-D107 VanDerWaalsContact NH2-CG 3.34Å; R68-D107 IonicContact NH2-OD1 2.65Å; R68-D107 PolarHBondContact NH2-OD1 3.39Å; D107-F109 PolarHBondContact O-N 3.26Å; D107-E110 CarbonylContact C-O 3.6Å; D107-E110 PolarHBondContact N-O 3.05Å; D107-E110 CarbonylContact O-C 3.54Å; D107-E110 PolarHBondContact O-N 3.43Å
108P97.5Very high96.6Very high3 Ų345.6 Ų45.62%0.01921%0.214CC..THydrogen-bonded Turntrans-50.9128.3173.6-23.729.4000111W56 P58 P61 E110W56-P108 HydrophobicContact CD2-CG 3.87Å; W56-P108 HydrophobicContact CE3-CG 4.38Å; W56-P108 HydrophobicContact CG-CG 4.31Å; W56-P108 HydrophobicContact CH2-CG 4.31Å; W56-P108 VanDerWaalsContact CZ2-CA 3.44Å; W56-P108 HydrophobicContact CZ2-CB 3.99Å; W56-P108 HydrophobicContact CZ2-CG 3.84Å; P58-P108 HydrophobicContact CB-CB 4.37Å; P61-P108 HydrophobicContact CB-CB 4.11Å; P61-P108 HydrophobicContact CB-CG 4.24Å; P61-P108 HydrophobicContact CG-CB 4.29Å; P108-E110 PolarHBondContact O-N 2.88Å
109F96.6Very high96.6Very high50 Ų5046.7 Ų46.722%0.21923%0.226CC..THydrogen-bonded Turntrans69-3.1-179.6-39.5-67.6000116.6E14 P58 P61 D107 E126 A127E14-F109 PolarHBondContact OE1-N 2.68Å; P58-F109 HydrophobicContact CB-CE2 4.06Å; P58-F109 HydrophobicContact CB-CZ 3.95Å; P58-F109 WeakPolarHBondContact O-CE2 3.44Å; P61-F109 HydrophobicContact CG-CD2 4.07Å; P61-F109 HydrophobicContact CG-CE2 4.39Å; D107-F109 PolarHBondContact O-N 3.26Å; F109-E126 CarbonylContact O-C 3.48Å; F109-E126 VanDerWaalsContact O-CA 3.29Å; F109-E126 WeakPolarHBondContact O-CA 3.4Å; F109-A127 HydrophobicContact CB-CB 4.33Å; F109-A127 HydrophobicContact CD1-CB 4.42Å; F109-A127 PolarHBondContact O-N 3.41Å
110E97.8Very high96.8Very high62 Ų6251.1 Ų51.129%0.2926%0.257SS..EExtended strand (participates in β ladder)trans-145.8132.6179.5-165.9-169.5116.800112.3D107 P108 S112 V123 Y125D107-E110 CarbonylContact C-O 3.6Å; D107-E110 PolarHBondContact N-O 3.05Å; D107-E110 CarbonylContact O-C 3.54Å; D107-E110 PolarHBondContact O-N 3.43Å; P108-E110 PolarHBondContact O-N 2.88Å; E110-S112 WeakPolarHBondContact OE1-CB 3.34Å; E110-S112 PolarHBondContact OE1-OG 3.24Å; E110-V123 HydrophobicContact CG-CG1 4.33Å; E110-Y125 CarbonylContact C-O 3.48Å; E110-Y125 WeakPolarHBondContact CA-O 3.4Å
111V98.7Very high97.1Very high0 Ų047.3 Ų47.30%025%0.249CC..EExtended strand (participates in β ladder)trans-120121.7163.6-173.90000108E14 A17 A18 L104 W105 V106 L124 Y125E14-V111 HydrophobicContact CB-CG2 3.7Å; E14-V111 HydrophobicContact CG-CG2 4.16Å; E14-V111 WeakPolarHBondContact O-CG2 3.44Å; A17-V111 HydrophobicContact CB-CG2 4.25Å; A18-V111 HydrophobicContact CB-CG1 4.25Å; L104-V111 HydrophobicContact CD1-CG1 3.64Å; W105-V111 WeakPolarHBondContact O-CA 3.26Å; W105-V111 WeakPolarHBondContact O-CG1 3.48Å; V106-V111 HydrophobicContact CG1-CG2 4.21Å; V106-V111 HydrophobicContact CG2-CG1 4.43Å; V111-L124 HydrophobicContact CB-CB 4.37Å; V111-L124 HydrophobicContact CB-CD2 4.43Å; V111-L124 HydrophobicContact CG1-CB 4.3Å; V111-L124 HydrophobicContact CG1-CD2 3.84Å; V111-L124 WeakPolarHBondContact O-CA 3.24Å; V111-L124 WeakPolarHBondContact O-CB 3.49Å; V111-L124 PolarHBondContact O-N 2.79Å; V111-Y125 HydrophobicContact CG2-CD1 4.21Å; V111-Y125 HydrophobicContact CG2-CG 4.46Å; V111-Y125 PolarHBondContact N-O 2.84Å; V111-Y125 PolarHBondContact O-N 3.36Å; V111-Y125 VanDerWaalsContact O-N 3.13Å
112S98.7Very high97.2Very high7 Ų747 Ų475%0.04925%0.253CS..EExtended strand (participates in β ladder)trans-134.4155.218055.10000110.8L104 W105 E110 C122L104-S112 WeakPolarHBondContact CD1-O 3.46Å; W105-S112 PolarHBondContact N-O 2.91Å; W105-S112 PolarHBondContact O-N 3.21Å; W105-S112 VanDerWaalsContact O-N 3.12Å; E110-S112 WeakPolarHBondContact OE1-CB 3.34Å; E110-S112 PolarHBondContact OE1-OG 3.24Å; S112-C122 CarbonylContact C-O 3.52Å; S112-C122 VanDerWaalsContact CA-O 3.24Å; S112-C122 WeakPolarHBondContact CA-O 3.49Å; S112-C122 WeakPolarHBondContact CB-O 3.42Å
113Y98.7Very high97.3Very high52 Ų5250.7 Ų50.720%0.20428%0.275CS..EExtended strand (participates in β ladder)trans-143.3160.7-175.973.7-84.7000112.3F21 L102 T103 I115 I121 C122 L124F21-Y113 HydrophobicContact CE1-CD1 4.38Å; F21-Y113 HydrophobicContact CE1-CD2 4.17Å; F21-Y113 HydrophobicContact CE1-CG 4.01Å; F21-Y113 HydrophobicContact CE2-CD1 4.37Å; F21-Y113 HydrophobicContact CE2-CE1 4.1Å; F21-Y113 HydrophobicContact CE2-CE2 4.26Å; F21-Y113 HydrophobicContact CZ-CD1 4.04Å; F21-Y113 AromaticContact CZ-CD2 3.66Å; F21-Y113 HydrophobicContact CZ-CD2 3.66Å; F21-Y113 HydrophobicContact CZ-CE1 4.12Å; F21-Y113 AromaticContact CZ-CE2 3.75Å; F21-Y113 HydrophobicContact CZ-CE2 3.75Å; F21-Y113 AromaticContact CZ-CG 3.81Å; F21-Y113 HydrophobicContact CZ-CG 3.81Å; F21-Y113 AromaticContact CZ-CZ 3.98Å; L102-Y113 HydrophobicContact CD1-CD2 4.41Å; T103-Y113 CarbonylContact O-C 2.96Å; T103-Y113 WeakPolarHBondContact O-CA 3.48Å; T103-Y113 WeakPolarHBondContact O-CB 3.46Å; Y113-I115 HydrophobicContact CD2-CD1 4.19Å; Y113-I115 HydrophobicContact CD2-CG1 3.99Å; Y113-I115 HydrophobicContact CE2-CD1 3.86Å; Y113-I115 HydrophobicContact CE2-CG1 4.09Å; Y113-I121 WeakPolarHBondContact O-CA 3.46Å; Y113-C122 HydrophobicContact CD1-CB 4.03Å; Y113-C122 WeakPolarHBondContact CD1-O 3.41Å; Y113-C122 HydrophobicContact CE1-CB 3.45Å; Y113-C122 VanDerWaalsContact CE1-CB 3.45Å; Y113-C122 HydrophobicContact CE2-CB 4.15Å; Y113-C122 PolarHBondContact N-O 2.9Å; Y113-C122 PolarHBondContact O-N 3.42Å; Y113-L124 HydrophobicContact CD1-CB 4.28Å
114R98.3Very high97.3Very high62 Ų6252.7 Ų52.723%0.23429%0.285CS..EExtended strand (participates in β ladder)trans-134.7134.8170.3-177.6179.962.6-127.9-9.3109.5T103 W105 G116 G119T103-R114 PolarHBondContact N-O 2.9Å; T103-R114 PolarHBondContact O-N 2.87Å; T103-R114 PolarHBondContact OG1-NH2 3.09Å; W105-R114 HydrophobicContact CH2-CB 4.19Å; W105-R114 HydrophobicContact CZ3-CB 4.01Å; R114-G116 WeakPolarHBondContact CD-O 3.5Å; R114-G116 WeakPolarHBondContact CG-O 3.13Å; R114-G116 PolarHBondContact NE-O 3.21Å; R114-G119 WeakPolarHBondContact CD-O 3.37Å; R114-G119 VanDerWaalsContact CG-O 3.29Å; R114-G119 WeakPolarHBondContact CG-O 3.37Å
115I96.7Very high97.2Very high72 Ų7255.8 Ų55.837%0.36930%0.297SS..EExtended strand (participates in β ladder)trans-112.2124.9171.8-66.7170.4000108.8P99 E101 L102 Y113 G119P99-I115 HydrophobicContact CB-CG1 4.4Å; P99-I115 HydrophobicContact CB-CG2 3.81Å; P99-I115 HydrophobicContact CG-CD1 4.04Å; P99-I115 HydrophobicContact CG-CG1 4.23Å; P99-I115 HydrophobicContact CG-CG2 4.31Å; E101-I115 CarbonylContact O-C 3.47Å; E101-I115 WeakPolarHBondContact O-CA 3.32Å; L102-I115 HydrophobicContact CD1-CG1 3.77Å; Y113-I115 HydrophobicContact CD2-CD1 4.19Å; Y113-I115 HydrophobicContact CD2-CG1 3.99Å; Y113-I115 HydrophobicContact CE2-CD1 3.86Å; Y113-I115 HydrophobicContact CE2-CG1 4.09Å; I115-G119 WeakPolarHBondContact O-CA 3.41Å
116G95.7Very high97.1Very high22 Ų2260.4 Ų60.423%0.22732%0.321CS..SBendtrans84.5153.9-171.500000113.3E101 R114 D118 G119E101-G116 PolarHBondContact O-N 2.94Å; E101-G116 WeakPolarHBondContact OE2-CA 3.24Å; R114-G116 WeakPolarHBondContact CD-O 3.5Å; R114-G116 WeakPolarHBondContact CG-O 3.13Å; R114-G116 PolarHBondContact NE-O 3.21Å; G116-D118 VanDerWaalsContact C-N 3.32Å; G116-D118 PolarHBondContact O-N 2.84Å; G116-G119 PolarHBondContact O-N 3.26Å
117E91Very high96.9Very high138 Ų13862.1 Ų62.165%0.64534%0.335SS*.THydrogen-bonded Turntrans-58.9-43.8175.6-51.3-162.2129.200112E101E101-E117 WeakPolarHBondContact OE1-CG 3.47Å; E101-E117 VanDerWaalsContact OE2-CG 3.27Å; E101-E117 WeakPolarHBondContact OE2-CG 3.27Å; E101-E117 PolarHBondContact OE2-N 3.2Å
118D93.6Very high96.4Very high170 Ų17070.2 Ų70.291%0.90937%0.372SS*.THydrogen-bonded Turntrans-94.413.9-179.5-62.6-44.3000113.5G116G116-D118 VanDerWaalsContact C-N 3.32Å; G116-D118 PolarHBondContact O-N 2.84Å
119G95.9Very high95.4Very high26 Ų2672.7 Ų72.727%0.26839%0.39SS..PPolyproline II helixtrans-67.7149.6-179.400000113.3R114 I115 G116R114-G119 WeakPolarHBondContact CD-O 3.37Å; R114-G119 VanDerWaalsContact CG-O 3.29Å; R114-G119 WeakPolarHBondContact CG-O 3.37Å; I115-G119 WeakPolarHBondContact O-CA 3.41Å; G116-G119 PolarHBondContact O-N 3.26Å
120S97.4Very high94.1Very high100 Ų10078.1 Ų78.170%0.69942%0.421SS*.PPolyproline II helixtrans-66.4148.4166.5-59.40000111
121I97.9Very high92.3Very high106 Ų10677.3 Ų77.354%0.54442%0.424SS..EExtended strand (participates in β ladder)trans-80.2129.7169-60.5176.8000108.4W105 Y113W105-I121 HydrophobicContact CZ3-CG1 4.44Å; Y113-I121 WeakPolarHBondContact O-CA 3.46Å
122C97.9Very high89.8Confident50 Ų5083.2 Ų83.234%0.33846%0.463SS..EExtended strand (participates in β ladder)trans-119.5134.9177.3-68.60000109.8S112 Y113S112-C122 CarbonylContact C-O 3.52Å; S112-C122 VanDerWaalsContact CA-O 3.24Å; S112-C122 WeakPolarHBondContact CA-O 3.49Å; S112-C122 WeakPolarHBondContact CB-O 3.42Å; Y113-C122 HydrophobicContact CD1-CB 4.03Å; Y113-C122 WeakPolarHBondContact CD1-O 3.41Å; Y113-C122 HydrophobicContact CE1-CB 3.45Å; Y113-C122 VanDerWaalsContact CE1-CB 3.45Å; Y113-C122 HydrophobicContact CE2-CB 4.15Å; Y113-C122 PolarHBondContact N-O 2.9Å; Y113-C122 PolarHBondContact O-N 3.42Å
123V98.3Very high87.5Confident79 Ų7987.4 Ų87.448%0.47950%0.498SS..EExtended strand (participates in β ladder)trans-84.8127.5173.9-178.50000109.2E110 Y125 E126E110-V123 HydrophobicContact CG-CG1 4.33Å; V123-Y125 WeakPolarHBondContact CG1-O 3.33Å; V123-E126 HydrophobicContact CG1-CB 4Å
124L97.8Very high85.4Confident56 Ų5689.6 Ų89.629%0.29353%0.526SS..EExtended strand (participates in β ladder)trans-98-37178-179.377.2000111.6A17 F21 V111 Y113A17-L124 HydrophobicContact CB-CD2 4.15Å; A17-L124 WeakPolarHBondContact O-CD2 3.31Å; F21-L124 HydrophobicContact CB-CD1 4.05Å; F21-L124 HydrophobicContact CB-CD2 3.44Å; F21-L124 VanDerWaalsContact CB-CD2 3.44Å; F21-L124 HydrophobicContact CB-CG 4.4Å; F21-L124 HydrophobicContact CD2-CD1 3.79Å; F21-L124 HydrophobicContact CD2-CD2 4.47Å; F21-L124 HydrophobicContact CG-CD1 4.12Å; F21-L124 HydrophobicContact CG-CD2 3.95Å; V111-L124 HydrophobicContact CB-CB 4.37Å; V111-L124 HydrophobicContact CB-CD2 4.43Å; V111-L124 HydrophobicContact CG1-CB 4.3Å; V111-L124 HydrophobicContact CG1-CD2 3.84Å; V111-L124 WeakPolarHBondContact O-CA 3.24Å; V111-L124 WeakPolarHBondContact O-CB 3.49Å; V111-L124 PolarHBondContact O-N 2.79Å; Y113-L124 HydrophobicContact CD1-CB 4.28Å
125Y98Very high83Confident64 Ų6490.8 Ų90.825%0.25155%0.549SS..EExtended strand (participates in β ladder)trans-144140179.3172-93.9000108.8P13 E14 A17 E110 V111 V123 A127P13-Y125 HydrophobicContact CB-CE1 4.42Å; P13-Y125 HydrophobicContact CB-CE2 4.03Å; P13-Y125 WeakPolarHBondContact CB-OH 3.14Å; E14-Y125 HydrophobicContact CG-CD1 3.87Å; E14-Y125 HydrophobicContact CG-CE1 3.66Å; A17-Y125 HydrophobicContact CB-CG 4.31Å; E110-Y125 CarbonylContact C-O 3.48Å; E110-Y125 WeakPolarHBondContact CA-O 3.4Å; V111-Y125 HydrophobicContact CG2-CD1 4.21Å; V111-Y125 HydrophobicContact CG2-CG 4.46Å; V111-Y125 PolarHBondContact N-O 2.84Å; V111-Y125 PolarHBondContact O-N 3.36Å; V111-Y125 VanDerWaalsContact O-N 3.13Å; V123-Y125 WeakPolarHBondContact CG1-O 3.33Å; Y125-A127 HydrophobicContact CE1-CB 3.95Å; Y125-A127 WeakPolarHBondContact OH-CB 3.41Å
126E96.5Very high80.4Confident145 Ų14593.2 Ų93.268%0.67857%0.57SS**EExtended strand (participates in β ladder)trans-144.8139.5175.2-170.4173.8-161.900108.5F109 V123F109-E126 CarbonylContact O-C 3.48Å; F109-E126 VanDerWaalsContact O-CA 3.29Å; F109-E126 WeakPolarHBondContact O-CA 3.4Å; V123-E126 HydrophobicContact CG1-CB 4Å
127A93.6Very high78.2Confident35 Ų3597.2 Ų97.229%0.28959%0.594SS.*  trans-137.1159.6173.600000110.5F109 Y125 S129F109-A127 HydrophobicContact CB-CB 4.33Å; F109-A127 HydrophobicContact CD1-CB 4.42Å; F109-A127 PolarHBondContact O-N 3.41Å; Y125-A127 HydrophobicContact CE1-CB 3.95Å; Y125-A127 WeakPolarHBondContact OH-CB 3.41Å; A127-S129 PolarHBondContact O-N 3.26Å
128E87Confident75.9Confident175 Ų17596.8 Ų96.882%0.81860%0.604SS**  trans-72.6126176.1-67.5179-176.600110.3L130E128-L130 PolarHBondContact O-N 3.11Å
129S77.4Confident73.2Confident56 Ų5695.8 Ų95.839%0.39260%0.598SS.*  trans-73.2123.9167.6176.50000109.2A127 A131A127-S129 PolarHBondContact O-N 3.26Å; S129-A131 PolarHBondContact O-N 3.08Å; S129-A131 WeakPolarHBondContact OG-CB 3.29Å; S129-A131 PolarHBondContact OG-N 2.82Å
130L68.3Low70.9Confident164 Ų16499.8 Ų99.886%0.85962%0.62SS**  trans-75.23173.7-64.6173000112.8E128E128-L130 PolarHBondContact O-N 3.11Å
131A60.6Low68Low44 Ų44101.5 Ų101.536%0.36463%0.626SS.*SBendtrans-63.3134.8173.200000109.3S129 A133S129-A131 PolarHBondContact O-N 3.08Å; S129-A131 WeakPolarHBondContact OG-CB 3.29Å; S129-A131 PolarHBondContact OG-N 2.82Å; A131-A133 PolarHBondContact O-N 3.23Å; A131-A133 VanDerWaalsContact O-N 3.08Å
132P47.3Very low65.6Low125 Ų125104.6 Ų104.681%0.81264%0.638SS**  trans-56.5124.117621.8-29.9000108.3A134P132-A134 PolarHBondContact O-N 3.47Å; P132-A134 VanDerWaalsContact O-N 3.11Å
133A50.6Low62.8Low95 Ų95109.4 Ų109.479%0.78566%0.66SS**  trans-39.1121.217800000109.5A131 A135A131-A133 PolarHBondContact O-N 3.23Å; A131-A133 VanDerWaalsContact O-N 3.08Å; A133-A135 PolarHBondContact O-N 3.07Å
134A53.1Low60.1Low97 Ų97110.1 Ų110.180%0.80267%0.668SS**  trans-48.3135.3162.800000107.5P132P132-A134 PolarHBondContact O-N 3.47Å; P132-A134 VanDerWaalsContact O-N 3.11Å
135A48.3Very low57Low87 Ų87117.5 Ų117.572%0.71970%0.698SS**SBendtrans-36.1146.2-171.900000114.3A133 S137A133-A135 PolarHBondContact O-N 3.07Å; A135-S137 PolarHBondContact O-N 3.27Å; A135-S137 VanDerWaalsContact O-N 3.07Å
136P41.4Very low54.1Low124 Ų124122.7 Ų122.781%0.80573%0.729SS**PPolyproline II helixtrans-54.6119.7-175.322.8-33.1000110.6
137S50.2Low51.2Low105 Ų105123.2 Ų123.273%0.73473%0.732SS**PPolyproline II helixtrans-54.8135160.438.10000109A135 D139A135-S137 PolarHBondContact O-N 3.27Å; A135-S137 VanDerWaalsContact O-N 3.07Å; S137-D139 PolarHBondContact O-N 3.45Å
138P42.7Very low48.3Very low129 Ų129129.7 Ų129.784%0.83875%0.754SS**PPolyproline II helixtrans-65.2135.9178.326.1-30.9000110.4
139D36.1Very low46.2Very low149 Ų149129 Ų12980%0.79776%0.755SS**PPolyproline II helixtrans-46.9151.3-172.5-103.3-45.5000116.2S137 T141S137-D139 PolarHBondContact O-N 3.45Å; D139-T141 PolarHBondContact O-N 3.09Å
140P49.3Very low44.4Very low111 Ų111134.6 Ų134.672%0.72178%0.779SS**  trans-8998.3171.735.1-25.5000109.9
141T36.3Very low42.9Very low136 Ų136130.6 Ų130.683%0.83478%0.777SS**  trans-99.5101.5157.439.70000109.8D139D139-T141 PolarHBondContact O-N 3.09Å
142H46.5Very low41.7Very low171 Ų171131.9 Ų131.979%0.79280%0.795SS**  trans-28.5131.3149.9-89.7-131.2000112.3
143N38.6Very low41.7Very low151 Ų151138.1 Ų138.181%0.80780%0.802SS**  -165.6141.498.4-154.8-1.2000112.6
144C42.5Very low41.3Very low94 Ų94140.1 Ų140.164%0.63581%0.805SS**  trans-72.7129.3-176.8-460000111
145K32.7Very low41.1Very low211 Ų211140.8 Ų140.892%0.91780%0.804SS**  trans-128.479150.9-87.4-177.8176.2171.90108.5
146N36.4Very low41.4Very low172 Ų172142.2 Ų142.292%0.9281%0.806SS**  trans-80.2111.9159-86.8-7.7000108.1
147Q35.8Very low41.5Very low157 Ų157142.5 Ų142.573%0.73481%0.807SS**  trans-107.6134.7154.1-149.7179.2-0.500108.1
148F32.9Very low41.5Very low170 Ų170147 Ų14775%0.74681%0.814SS**  trans85.3100.4167.5-62.2-72.7000118.9
149L44.2Very low41.8Very low160 Ų160148.6 Ų148.684%0.83882%0.815SS**  trans-8.9148.2133.2-63.3157.8000116.7
150I38.7Very low42.2Very low174 Ų174151.9 Ų151.989%0.89282%0.818SS**  trans105.1101.8160.6-52.9174.7000115.2
151G37.6Very low42.3Very low81 Ų81154 Ų15484%0.83582%0.822SS**  trans82.8131134.900000119.1
152G33.5Very low42.9Very low71 Ų71154.9 Ų154.973%0.73282%0.819SS**  trans119.9118.215000000116
153R49.2Very low43.5Very low255 Ų255152.4 Ų152.496%0.96282%0.816SS**  trans-55134.2170.3-56.3162.590.2176.95.5109.7
154T40.6Very low43.7Very low138 Ų138151.6 Ų151.685%0.84782%0.816SS**  trans-125.8127.6172.457.90000111.5
155S49.7Very low43.7Very low110 Ų110152.9 Ų152.977%0.76983%0.826SS**PPolyproline II helixtrans-71.7164.5178.4-53.80000112.6
156P53.5Low44.7Very low118 Ų118152.2 Ų152.277%0.76685%0.848SS**PPolyproline II helixtrans-68.2158.6174.8-1430.1000112.6
157P44.9Very low45.1Very low129 Ų129151.2 Ų151.284%0.83884%0.844SS**PPolyproline II helixtrans-73.4144.4-166.728.1-32000113.6N159P157-N159 PolarHBondContact O-N 2.92Å
158K50.3Low45.6Very low199 Ų199150.9 Ų150.987%0.86585%0.85SS**SBendtrans-73.2111.1173.5-66.3177.7177.3176.90109.6
159N48.5Very low46.3Very low163 Ų163149.8 Ų149.887%0.87286%0.856SS**  trans-171.348.5146.8-90.3-16000111.6P157P157-N159 PolarHBondContact O-N 2.92Å
160Y44.2Very low46.4Very low219 Ų219149.2 Ų149.286%0.85986%0.857SS**  trans-95.695.1160.8-108.8-95000107.8M162Y160-M162 HydrophobicContact CD1-CG 4.38Å; Y160-M162 HydrophobicContact CD1-SD 4.31Å; Y160-M162 HydrophobicContact CE1-SD 4.49Å
161L50.7Low46.9Very low155 Ų155147.7 Ų147.781%0.81286%0.855SS**  trans-103.4102.3168.2-156.689.4000107.5T163L161-T163 HydrophobicContact CD2-CG2 4.32Å
162M50.8Low47.5Very low154 Ų154152.1 Ų152.176%0.75986%0.856SS**  trans-88.6105.5169.9-63.4-68-98.900107.4Y160 V164Y160-M162 HydrophobicContact CD1-CG 4.38Å; Y160-M162 HydrophobicContact CD1-SD 4.31Å; Y160-M162 HydrophobicContact CE1-SD 4.49Å; M162-V164 PolarHBondContact O-N 3.02Å
163T57.4Low48.5Very low119 Ų119157.9 Ų157.973%0.7387%0.865SS**  trans-79.1111.1168.3400000109.1L161L161-T163 HydrophobicContact CD2-CG2 4.32Å
164V44.1Very low48.5Very low135 Ų135150.5 Ų150.582%0.81886%0.858SS**  trans-93.9119.2163-74.40000108.1M162M162-V164 PolarHBondContact O-N 3.02Å
165S42.9Very low49.2Very low120 Ų120151.5 Ų151.584%0.83986%0.859SS**  trans-87135.5169.8-61.80000109.1
166S52.8Low49.1Very low197 Ų197155.3 Ų155.3100%1.37887%0.867SS**  trans-75.80171.5-53.70000112.3

Retrieved 166 of 166 residues in 385.9 ms (Link to these results)

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