A0A096NT71_PAPAN Loading...

Transmembrane protein 235

AlphaFold DB , UniProt , Accession A0A096NT71, Species PAPAN (Papio anubis, Olive baboon), Gene TMEM235, Length 223 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
1M68.8Low86.3Confident208 Ų20882.2 Ų82.2100%1.02545%0.452SS*.  0-50.50-66.1-154-82.400113.4R3 L4 G5M1-R3 PolarHBondContact O-N 3.07Å; M1-L4 PolarHBondContact O-N 3.08Å; M1-L4 VanDerWaalsContact O-N 3.1Å; M1-G5 PolarHBondContact O-N 3.28Å
2A80.4Confident86.6Confident83 Ų8377.4 Ų77.469%0.68643%0.432SS*.Hα-helixtrans-53.8-42.7-179.200000115L4 G5 V6A2-L4 VanDerWaalsContact C-N 3.35Å; A2-L4 PolarHBondContact O-N 3.25Å; A2-G5 PolarHBondContact O-N 3.33Å; A2-V6 WeakPolarHBondContact O-CG2 3.37Å; A2-V6 PolarHBondContact O-N 3.05Å; A2-V6 VanDerWaalsContact O-N 3.09Å
3R84.5Confident87.1Confident224 Ų22479.5 Ų79.585%0.84544%0.44SS*.Hα-helixtrans-62-38.5177.8-65.8-177.1-177.7173.70.2113.3M1 V6 L7M1-R3 PolarHBondContact O-N 3.07Å; R3-V6 PolarHBondContact O-N 2.77Å; R3-L7 WeakPolarHBondContact O-CG 3.47Å; R3-L7 PolarHBondContact O-N 3.22Å; R3-L7 VanDerWaalsContact O-N 3.13Å
4L84.7Confident87.4Confident35 Ų3574.4 Ų74.418%0.18342%0.415CS..Hα-helixtrans-68-44.1178.8-163.5103.3000110.9M1 A2 V6 L7 L8 A198 T201 L202M1-L4 PolarHBondContact O-N 3.08Å; M1-L4 VanDerWaalsContact O-N 3.1Å; A2-L4 VanDerWaalsContact C-N 3.35Å; A2-L4 PolarHBondContact O-N 3.25Å; L4-V6 VanDerWaalsContact C-N 3.32Å; L4-V6 PolarHBondContact O-N 3.13Å; L4-L7 PolarHBondContact O-N 3.5Å; L4-L8 HydrophobicContact CD2-CD1 3.85Å; L4-L8 HydrophobicContact CG-CD1 4.29Å; L4-L8 WeakPolarHBondContact O-CG 3.48Å; L4-L8 PolarHBondContact O-N 2.89Å; L4-A198 HydrophobicContact CD1-CB 4.5Å; L4-T201 VanDerWaalsContact CD1-OG1 3.23Å; L4-T201 WeakPolarHBondContact CD1-OG1 3.34Å; L4-L202 HydrophobicContact CD1-CB 4.49Å; L4-L202 HydrophobicContact CD1-CD1 3.56Å; L4-L202 HydrophobicContact CD2-CD1 3.58Å; L4-L202 HydrophobicContact CG-CD1 4.22Å
5G86.2Confident87.5Confident39 Ų3969.5 Ų69.540%0.40239%0.388SS..Hα-helixtrans-60.2-40.7176.800000112.6M1 A2 L8 L9M1-G5 PolarHBondContact O-N 3.28Å; A2-G5 PolarHBondContact O-N 3.33Å; G5-L8 PolarHBondContact O-N 3.42Å; G5-L9 VanDerWaalsContact O-CB 3.31Å; G5-L9 WeakPolarHBondContact O-CB 3.36Å; G5-L9 PolarHBondContact O-N 3.09Å
6V90.7Very high87.8Confident99 Ų9969.5 Ų69.560%0.639%0.387SS*.Hα-helixtrans-63.8-43.2175.2173.40000111.6A2 R3 L4 L9 A10A2-V6 WeakPolarHBondContact O-CG2 3.37Å; A2-V6 PolarHBondContact O-N 3.05Å; A2-V6 VanDerWaalsContact O-N 3.09Å; R3-V6 PolarHBondContact O-N 2.77Å; L4-V6 VanDerWaalsContact C-N 3.32Å; L4-V6 PolarHBondContact O-N 3.13Å; V6-L9 PolarHBondContact O-N 3.36Å; V6-A10 VanDerWaalsContact O-CB 3.32Å; V6-A10 WeakPolarHBondContact O-CB 3.23Å; V6-A10 PolarHBondContact O-N 3.21Å
7L90.3Very high88.1Confident43 Ų4371.2 Ų71.223%0.22539%0.394CS..Hα-helixtrans-62.5-44.8177.1-69.9171.3000111.9R3 L4 A11 L194 A198R3-L7 WeakPolarHBondContact O-CG 3.47Å; R3-L7 PolarHBondContact O-N 3.22Å; R3-L7 VanDerWaalsContact O-N 3.13Å; L4-L7 PolarHBondContact O-N 3.5Å; L7-A11 VanDerWaalsContact O-CB 3.31Å; L7-A11 WeakPolarHBondContact O-CB 3.33Å; L7-A11 PolarHBondContact O-N 2.96Å; L7-L194 HydrophobicContact CD2-CD2 3.71Å; L7-A198 HydrophobicContact CB-CB 4.27Å; L7-A198 HydrophobicContact CD1-CB 4.39Å
8L89.7Confident88.3Confident27 Ų2767.2 Ų67.214%0.14137%0.372CS..Hα-helixtrans-66.8-40178.9-67.4174.9000111.9L4 G5 A11 A12 L126 L195 A198L4-L8 HydrophobicContact CD2-CD1 3.85Å; L4-L8 HydrophobicContact CG-CD1 4.29Å; L4-L8 WeakPolarHBondContact O-CG 3.48Å; L4-L8 PolarHBondContact O-N 2.89Å; G5-L8 PolarHBondContact O-N 3.42Å; L8-A11 PolarHBondContact O-N 3.41Å; L8-A12 WeakPolarHBondContact O-CB 3.38Å; L8-A12 PolarHBondContact O-N 3.26Å; L8-L126 HydrophobicContact CD2-CD2 3.66Å; L8-L195 HydrophobicContact CD2-CD2 4.12Å; L8-A198 HydrophobicContact CD2-CB 4.16Å
9L90.9Very high88.4Confident112 Ų11266.9 Ų66.959%0.58637%0.367SS*.Hα-helixtrans-65.8-45.5176.7-176.964.1000111.5G5 V6 A11 A12 L13G5-L9 VanDerWaalsContact O-CB 3.31Å; G5-L9 WeakPolarHBondContact O-CB 3.36Å; G5-L9 PolarHBondContact O-N 3.09Å; V6-L9 PolarHBondContact O-N 3.36Å; L9-A11 VanDerWaalsContact C-N 3.33Å; L9-A11 PolarHBondContact O-N 3.1Å; L9-A12 PolarHBondContact O-N 2.97Å; L9-L13 HydrophobicContact CG-CD1 4.32Å; L9-L13 WeakPolarHBondContact O-CG 3.45Å; L9-L13 PolarHBondContact O-N 3.31Å
10A91.8Very high88.6Confident33 Ų3366.4 Ų66.427%0.27337%0.371SS..Hα-helixtrans-62.8-40.2176.600000111.7V6 L13 G14 L194V6-A10 VanDerWaalsContact O-CB 3.32Å; V6-A10 WeakPolarHBondContact O-CB 3.23Å; V6-A10 PolarHBondContact O-N 3.21Å; A10-L13 PolarHBondContact O-N 3.5Å; A10-G14 PolarHBondContact O-N 3.37Å; A10-L194 HydrophobicContact CB-CD1 3.66Å
11A91.4Very high88.6Confident1 Ų164.9 Ų64.91%0.00836%0.362CS..Hα-helixtrans-64.5-41.4174.500000112.3L7 L8 L9 G14 A15 S191 L194 L195L7-A11 VanDerWaalsContact O-CB 3.31Å; L7-A11 WeakPolarHBondContact O-CB 3.33Å; L7-A11 PolarHBondContact O-N 2.96Å; L8-A11 PolarHBondContact O-N 3.41Å; L9-A11 VanDerWaalsContact C-N 3.33Å; L9-A11 PolarHBondContact O-N 3.1Å; A11-G14 PolarHBondContact O-N 3.18Å; A11-A15 WeakPolarHBondContact O-CB 3.48Å; A11-A15 PolarHBondContact O-N 2.96Å; A11-S191 PolarHBondContact O-OG 2.76Å; A11-L194 HydrophobicContact CB-CB 3.92Å; A11-L194 HydrophobicContact CB-CD1 4.33Å; A11-L195 HydrophobicContact CB-CD2 3.94Å; A11-L195 HydrophobicContact CB-CG 3.85Å
12A90.3Very high89.4Confident25 Ų2555 Ų5521%0.20731%0.314CS..Hα-helixtrans-65-43.2177.500000112L8 L9 A15 L16L8-A12 WeakPolarHBondContact O-CB 3.38Å; L8-A12 PolarHBondContact O-N 3.26Å; L9-A12 PolarHBondContact O-N 2.97Å; A12-A15 PolarHBondContact O-N 2.71Å; A12-L16 WeakPolarHBondContact O-CB 3.34Å; A12-L16 WeakPolarHBondContact O-CG 3.47Å; A12-L16 PolarHBondContact O-N 3.4Å
13L92.4Very high89.8Confident104 Ų10452.5 Ų52.555%0.54529%0.293SS..Hα-helixtrans-64.7-40.8175.6-70.4173.4000111.9L9 A10 L16 L17L9-L13 HydrophobicContact CG-CD1 4.32Å; L9-L13 WeakPolarHBondContact O-CG 3.45Å; L9-L13 PolarHBondContact O-N 3.31Å; A10-L13 PolarHBondContact O-N 3.5Å; L13-L16 PolarHBondContact O-N 3.5Å; L13-L17 WeakPolarHBondContact O-CB 3.46Å; L13-L17 PolarHBondContact O-N 3.02Å
14G91.3Very high89.8Confident8 Ų843.9 Ų43.98%0.08227%0.27CS..Hα-helixtrans-64.5-40.8175.100000112.7A10 A11 L17 S18 S191A10-G14 PolarHBondContact O-N 3.37Å; A11-G14 PolarHBondContact O-N 3.18Å; G14-L17 PolarHBondContact O-N 3.1Å; G14-S18 WeakPolarHBondContact O-CB 3.32Å; G14-S18 PolarHBondContact O-N 3.44Å; G14-S191 WeakPolarHBondContact CA-OG 3.21Å
15A89.9Confident89.7Confident2 Ų242.2 Ų42.22%0.01726%0.261CS..Hα-helixtrans-66.5-42.3176.500000112.2A11 A12 S18 F19 F133 S191A11-A15 WeakPolarHBondContact O-CB 3.48Å; A11-A15 PolarHBondContact O-N 2.96Å; A12-A15 PolarHBondContact O-N 2.71Å; A15-S18 WeakPolarHBondContact O-CB 3.31Å; A15-S18 PolarHBondContact O-N 2.94Å; A15-F19 PolarHBondContact O-N 3.19Å; A15-F133 HydrophobicContact CB-CE1 3.61Å; A15-F133 HydrophobicContact CB-CE2 4.32Å; A15-F133 HydrophobicContact CB-CZ 3.43Å; A15-F133 VanDerWaalsContact CB-CZ 3.43Å; A15-S191 PolarHBondContact N-OG 3.47Å
16L92.1Very high89.4Confident69 Ų6941.4 Ų41.436%0.36125%0.248SC..Hα-helixtrans-60-45.1172.9-85.6163.5000111.9A12 L13 F19 A20 W111A12-L16 WeakPolarHBondContact O-CB 3.34Å; A12-L16 WeakPolarHBondContact O-CG 3.47Å; A12-L16 PolarHBondContact O-N 3.4Å; L13-L16 PolarHBondContact O-N 3.5Å; L16-F19 PolarHBondContact O-N 2.98Å; L16-A20 PolarHBondContact O-N 3.39Å; L16-W111 HydrophobicContact CD2-CH2 3.28Å; L16-W111 HydrophobicContact CD2-CZ2 3.27Å; L16-W111 HydrophobicContact CD2-CZ3 4.02Å; L16-W111 HydrophobicContact CG-CH2 4.37Å; L16-W111 HydrophobicContact CG-CZ2 3.95Å
17L92.8Very high88.7Confident98 Ų9840.2 Ų40.251%0.51325%0.249SC..Hα-helixtrans-63.9-45.4177.6-18062.2000111L13 G14 F19 A20 L21L13-L17 WeakPolarHBondContact O-CB 3.46Å; L13-L17 PolarHBondContact O-N 3.02Å; G14-L17 PolarHBondContact O-N 3.1Å; L17-F19 PolarHBondContact O-N 2.83Å; L17-A20 PolarHBondContact O-N 2.94Å; L17-L21 HydrophobicContact CD1-CD1 4.11Å; L17-L21 HydrophobicContact CD1-CG 4.14Å; L17-L21 HydrophobicContact CG-CD1 3.91Å; L17-L21 HydrophobicContact CG-CG 4.36Å; L17-L21 WeakPolarHBondContact O-CB 3.31Å; L17-L21 WeakPolarHBondContact O-CG 3.29Å; L17-L21 PolarHBondContact O-N 3.47Å
18S91.1Very high87.7Confident0 Ų039.2 Ų39.20%025%0.246CC..Hα-helixtrans-53.4-52.2172156.50000111.4G14 A15 A20 L21 L22 L107 S184 S187 E188G14-S18 WeakPolarHBondContact O-CB 3.32Å; G14-S18 PolarHBondContact O-N 3.44Å; A15-S18 WeakPolarHBondContact O-CB 3.31Å; A15-S18 PolarHBondContact O-N 2.94Å; S18-A20 VanDerWaalsContact C-N 3.32Å; S18-A20 PolarHBondContact O-N 3Å; S18-L21 PolarHBondContact O-N 3.49Å; S18-L21 VanDerWaalsContact O-N 3.14Å; S18-L22 WeakPolarHBondContact O-CB 3.4Å; S18-L22 PolarHBondContact O-N 3.33Å; S18-L107 VanDerWaalsContact OG-CD1 3.23Å; S18-L107 WeakPolarHBondContact OG-CD1 3.34Å; S18-L107 WeakPolarHBondContact OG-CD2 3.44Å; S18-S184 PolarHBondContact O-OG 3.45Å; S18-S184 PolarHBondContact OG-OG 2.92Å; S18-S187 WeakPolarHBondContact CA-OG 3.43Å; S18-S187 WeakPolarHBondContact CB-OG 3.3Å; S18-S187 PolarHBondContact N-OG 2.96Å; S18-E188 WeakPolarHBondContact OG-CG 3.49Å; S18-E188 PolarHBondContact OG-OE1 2.05Å
19F90.5Very high86.3Confident62 Ų6240.5 Ų40.527%0.27225%0.253SS..Hα-helixtrans-55.5-48.4-179.6177-103000111.8A15 L16 L17 L21 L22 A23 L104 L107 V108A15-F19 PolarHBondContact O-N 3.19Å; L16-F19 PolarHBondContact O-N 2.98Å; L17-F19 PolarHBondContact O-N 2.83Å; F19-L21 PolarHBondContact O-N 3.34Å; F19-L22 PolarHBondContact O-N 3.28Å; F19-A23 WeakPolarHBondContact O-CB 3.46Å; F19-A23 PolarHBondContact O-N 3.44Å; F19-L104 HydrophobicContact CE2-CD1 4.44Å; F19-L104 HydrophobicContact CE2-CD2 4.4Å; F19-L104 HydrophobicContact CE2-CG 4.32Å; F19-L107 HydrophobicContact CB-CD2 3.49Å; F19-L107 VanDerWaalsContact CB-CD2 3.49Å; F19-L107 HydrophobicContact CD2-CD2 4Å; F19-L107 HydrophobicContact CG-CD2 4.25Å; F19-V108 HydrophobicContact CD2-CG2 4.04Å; F19-V108 HydrophobicContact CE2-CG2 3.6Å
20A91.6Very high84.6Confident55 Ų5540.8 Ų40.846%0.45525%0.247SC..Hα-helixtrans-62.3-43.1179.100000112L16 L17 S18 A24L16-A20 PolarHBondContact O-N 3.39Å; L17-A20 PolarHBondContact O-N 2.94Å; S18-A20 VanDerWaalsContact C-N 3.32Å; S18-A20 PolarHBondContact O-N 3Å; A20-A24 WeakPolarHBondContact O-CB 3.48Å; A20-A24 PolarHBondContact O-N 3.3Å
21L88.3Confident83.2Confident35 Ų3539.4 Ų39.418%0.18324%0.235CC..Hα-helixtrans-66.4-44179.3-69.8173.8000112L17 S18 F19 A25 L180L17-L21 HydrophobicContact CD1-CD1 4.11Å; L17-L21 HydrophobicContact CD1-CG 4.14Å; L17-L21 HydrophobicContact CG-CD1 3.91Å; L17-L21 HydrophobicContact CG-CG 4.36Å; L17-L21 WeakPolarHBondContact O-CB 3.31Å; L17-L21 WeakPolarHBondContact O-CG 3.29Å; L17-L21 PolarHBondContact O-N 3.47Å; S18-L21 PolarHBondContact O-N 3.49Å; S18-L21 VanDerWaalsContact O-N 3.14Å; F19-L21 PolarHBondContact O-N 3.34Å; L21-A25 VanDerWaalsContact O-CB 3.31Å; L21-A25 WeakPolarHBondContact O-CB 3.32Å; L21-A25 PolarHBondContact O-N 2.97Å; L21-L180 HydrophobicContact CD2-CD2 3.5Å; L21-L180 VanDerWaalsContact CD2-CD2 3.5Å
22L87.1Confident81.3Confident0 Ų041 Ų410%024%0.241CC..Hα-helixtrans-70.5-41.6178.8-169.862.1000111.7S18 F19 A24 A25 V26 L100 L104 T140 S184S18-L22 WeakPolarHBondContact O-CB 3.4Å; S18-L22 PolarHBondContact O-N 3.33Å; F19-L22 PolarHBondContact O-N 3.28Å; L22-A24 VanDerWaalsContact C-N 3.34Å; L22-A25 PolarHBondContact O-N 2.95Å; L22-V26 WeakPolarHBondContact O-CB 3.42Å; L22-V26 VanDerWaalsContact O-CG2 3.3Å; L22-V26 WeakPolarHBondContact O-CG2 3.31Å; L22-V26 PolarHBondContact O-N 3.35Å; L22-L100 HydrophobicContact CD1-CD2 4.29Å; L22-L104 HydrophobicContact CB-CD1 4.43Å; L22-L104 HydrophobicContact CD2-CB 4.13Å; L22-L104 HydrophobicContact CD2-CD1 4.28Å; L22-L104 HydrophobicContact CG-CD1 4.14Å; L22-T140 HydrophobicContact CD1-CG2 3.72Å; L22-T140 HydrophobicContact CD2-CG2 3.79Å; L22-T140 HydrophobicContact CG-CG2 4.43Å; L22-S184 WeakPolarHBondContact CB-OG 3.37Å
23A87.5Confident79.2Confident31 Ų3141.2 Ų41.226%0.25624%0.238SC..Hα-helixtrans-61.7-44.7174.600000110.9F19 A25 V26 A27 L104F19-A23 WeakPolarHBondContact O-CB 3.46Å; F19-A23 PolarHBondContact O-N 3.44Å; A23-A25 VanDerWaalsContact C-N 3.35Å; A23-A25 PolarHBondContact O-N 3.48Å; A23-V26 PolarHBondContact O-N 2.85Å; A23-A27 WeakPolarHBondContact O-CB 3.16Å; A23-A27 PolarHBondContact O-N 2.84Å; A23-L104 HydrophobicContact CB-CD1 4.08Å
24A85.1Confident76.9Confident43 Ų4339.1 Ų39.136%0.35523%0.227SC..Hα-helixtrans-61.9-42.3174.200000111.5A20 L22 A27 S28 L180A20-A24 WeakPolarHBondContact O-CB 3.48Å; A20-A24 PolarHBondContact O-N 3.3Å; L22-A24 VanDerWaalsContact C-N 3.34Å; A24-A27 PolarHBondContact O-N 2.95Å; A24-S28 WeakPolarHBondContact O-CB 3.23Å; A24-S28 PolarHBondContact O-N 2.97Å; A24-S28 PolarHBondContact O-OG 3.42Å; A24-L180 HydrophobicContact CB-CD1 4.02Å
25A82.8Confident74.5Confident0 Ų043.5 Ų43.50%025%0.245CC..Hα-helixtrans-62.8-44.1176.600000112.2L21 L22 A23 S28 W31 L180 A181L21-A25 VanDerWaalsContact O-CB 3.31Å; L21-A25 WeakPolarHBondContact O-CB 3.32Å; L21-A25 PolarHBondContact O-N 2.97Å; L22-A25 PolarHBondContact O-N 2.95Å; A23-A25 VanDerWaalsContact C-N 3.35Å; A23-A25 PolarHBondContact O-N 3.48Å; A25-S28 WeakPolarHBondContact CA-OG 3.37Å; A25-S28 PolarHBondContact O-OG 2.9Å; A25-W31 PolarHBondContact O-NE1 2.95Å; A25-L180 HydrophobicContact CB-CB 4.12Å; A25-A181 HydrophobicContact CB-CB 4.4Å
26V80.1Confident72.2Confident22 Ų2247.2 Ų47.213%0.13327%0.268CS..Hα-helixtrans-68.9-38.1178.5173.20000112L22 A23 W59 L100L22-V26 WeakPolarHBondContact O-CB 3.42Å; L22-V26 VanDerWaalsContact O-CG2 3.3Å; L22-V26 WeakPolarHBondContact O-CG2 3.31Å; L22-V26 PolarHBondContact O-N 3.35Å; A23-V26 PolarHBondContact O-N 2.85Å; V26-W59 PolarHBondContact O-NE1 3.16Å; V26-L100 HydrophobicContact CG2-CB 4.32Å; V26-L100 HydrophobicContact CG2-CD2 3.72Å
27A74.9Confident69.7Low75 Ų7546.5 Ų46.562%0.6227%0.272SS*.Hα-helixtrans-79.5-24.1-179.400000113.2A23 A24A23-A27 WeakPolarHBondContact O-CB 3.16Å; A23-A27 PolarHBondContact O-N 2.84Å; A24-A27 PolarHBondContact O-N 2.95Å
28S69.2Low67.2Low22 Ų2247.3 Ų47.315%0.15428%0.276CS..  trans-75.1135.5-178.859.40000112A24 A25 Y30 S177A24-S28 WeakPolarHBondContact O-CB 3.23Å; A24-S28 PolarHBondContact O-N 2.97Å; A24-S28 PolarHBondContact O-OG 3.42Å; A25-S28 WeakPolarHBondContact CA-OG 3.37Å; A25-S28 PolarHBondContact O-OG 2.9Å; S28-Y30 PolarHBondContact O-N 3.04Å; S28-S177 WeakPolarHBondContact CB-OG 3.49Å; S28-S177 VanDerWaalsContact OG-CB 3.3Å; S28-S177 WeakPolarHBondContact OG-CB 3.17Å; S28-S177 PolarHBondContact OG-OG 2.91Å
29D60.3Low64.5Low53 Ų5351.2 Ų51.228%0.28331%0.309SS..SBendtrans-8420.8175.5-60.6-56.1000113.6S56 G57 H60D29-S56 CarbonylContact O-C 2.99Å; D29-G57 VanDerWaalsContact C-CA 3.41Å; D29-G57 WeakPolarHBondContact O-CA 3.31Å; D29-G57 PolarHBondContact O-N 2.93Å; D29-H60 IonicContact OD1-CD2 3.93Å
30Y56.9Low62.1Low118 Ų11851.8 Ų51.846%0.46333%0.332SS..  trans-112.849.9-175.1-61.4-84.6000110.9S28 H55 S175 S177S28-Y30 PolarHBondContact O-N 3.04Å; Y30-H55 HydrophobicContact CD1-CB 4.12Å; Y30-H55 AromaticContact CD1-CG 3.82Å; Y30-H55 AromaticContact CD1-ND1 3.57Å; Y30-H55 HydrophobicContact CE1-CB 4.11Å; Y30-H55 AromaticContact CE1-CD2 3.92Å; Y30-H55 AromaticContact CE1-CE1 3.96Å; Y30-H55 AromaticContact CE1-CG 3.64Å; Y30-H55 AromaticContact CE1-ND1 3.69Å; Y30-S175 WeakPolarHBondContact O-CB 3.19Å; Y30-S177 VanDerWaalsContact C-OG 3.29Å; Y30-S177 VanDerWaalsContact O-CB 3.27Å; Y30-S177 WeakPolarHBondContact O-CB 3.21Å; Y30-S177 PolarHBondContact O-OG 3.39Å
31W60.8Low59.4Low5 Ų556.6 Ų56.62%0.01935%0.35CS..SBendtrans-78.9-31.7170.7-80.673.9000110.6A25 S56 L100 Y147 S175A25-W31 PolarHBondContact O-NE1 2.95Å; W31-S56 PolarHBondContact N-O 3.49Å; W31-L100 HydrophobicContact CH2-CD1 3.8Å; W31-L100 HydrophobicContact CH2-CD2 3.53Å; W31-L100 HydrophobicContact CH2-CG 4.31Å; W31-L100 HydrophobicContact CZ2-CD1 4.36Å; W31-L100 HydrophobicContact CZ2-CD2 3.56Å; W31-L100 HydrophobicContact CZ3-CD1 4.45Å; W31-Y147 HydrophobicContact CB-CE1 4.47Å; W31-Y147 HydrophobicContact CB-CE2 4.07Å; W31-Y147 WeakPolarHBondContact CB-OH 3.27Å; W31-Y147 HydrophobicContact CD2-CE2 4.35Å; W31-Y147 AromaticContact CE3-CD1 3.68Å; W31-Y147 HydrophobicContact CE3-CD1 3.68Å; W31-Y147 AromaticContact CE3-CD2 3.66Å; W31-Y147 HydrophobicContact CE3-CD2 3.66Å; W31-Y147 AromaticContact CE3-CE1 3.72Å; W31-Y147 HydrophobicContact CE3-CE1 3.72Å; W31-Y147 AromaticContact CE3-CE2 3.69Å; W31-Y147 HydrophobicContact CE3-CE2 3.69Å; W31-Y147 AromaticContact CE3-CG 3.68Å; W31-Y147 HydrophobicContact CE3-CG 3.68Å; W31-Y147 AromaticContact CE3-CZ 3.75Å; W31-Y147 AromaticContact CZ3-CD1 3.96Å; W31-Y147 HydrophobicContact CZ3-CD1 3.96Å; W31-Y147 HydrophobicContact CZ3-CD2 4.08Å; W31-Y147 HydrophobicContact CZ3-CE1 4.45Å; W31-Y147 AromaticContact CZ3-CG 3.79Å; W31-Y147 HydrophobicContact CZ3-CG 3.79Å; W31-Y147 PolarHBondContact O-OH 3.4Å; W31-Y147 VanDerWaalsContact O-OH 3.05Å; W31-S175 WeakPolarHBondContact O-CB 3.36Å; W31-S175 PolarHBondContact O-OG 3.03Å
32Y52.4Low57.3Low35 Ų3558.4 Ų58.414%0.13738%0.377CS..EExtended strand (participates in β ladder)trans-124.8134.7-179.4-152.4-66.5000111.7L34 S56 S175Y32-L34 HydrophobicContact CD1-CB 4.31Å; Y32-L34 HydrophobicContact CD1-CD1 3.35Å; Y32-L34 HydrophobicContact CD1-CG 3.96Å; Y32-L34 HydrophobicContact CE1-CB 3.93Å; Y32-L34 HydrophobicContact CE1-CD1 2.94Å; Y32-L34 HydrophobicContact CE1-CG 3.23Å; Y32-L34 HydrophobicContact CE2-CD1 4.42Å; Y32-L34 HydrophobicContact CG-CD1 4.32Å; Y32-L34 VanDerWaalsContact CZ-CD1 3.48Å; Y32-S56 PolarHBondContact N-O 3.39Å; Y32-S56 PolarHBondContact O-N 3.17Å; Y32-S175 PolarHBondContact N-OG 3.46Å
33I45.7Very low55Low28 Ų2864.3 Ų64.314%0.14442%0.418CS..EExtended strand (participates in β ladder)trans-123.7104.7164.6-63.2168000107.4E35 S173I33-E35 HydrophobicContact CG2-CG 3.92Å; I33-E35 PolarHBondContact O-N 2.93Å; I33-S173 WeakPolarHBondContact CG2-OG 3.34Å
34L45.1Very low52.7Low60 Ų6065.7 Ų65.731%0.31443%0.43SS..EExtended strand (participates in β ladder)trans-86.596.9167-95.6110.9000107Y32 V36Y32-L34 HydrophobicContact CD1-CB 4.31Å; Y32-L34 HydrophobicContact CD1-CD1 3.35Å; Y32-L34 HydrophobicContact CD1-CG 3.96Å; Y32-L34 HydrophobicContact CE1-CB 3.93Å; Y32-L34 HydrophobicContact CE1-CD1 2.94Å; Y32-L34 HydrophobicContact CE1-CG 3.23Å; Y32-L34 HydrophobicContact CE2-CD1 4.42Å; Y32-L34 HydrophobicContact CG-CD1 4.32Å; Y32-L34 VanDerWaalsContact CZ-CD1 3.48Å; L34-V36 PolarHBondContact O-N 3.49Å
35E40.6Very low50.5Low101 Ų10165.9 Ų65.947%0.47244%0.436SS..EExtended strand (participates in β ladder)trans-82.9103.8164.6-80.9179.3-179.800108.7I33 A37 V170I33-E35 HydrophobicContact CG2-CG 3.92Å; I33-E35 PolarHBondContact O-N 2.93Å; E35-A37 PolarHBondContact O-N 3.5Å; E35-V170 WeakPolarHBondContact O-CA 3.47Å
36V42Very low48.5Very low80 Ų8071.8 Ų71.849%0.48547%0.474SS..EExtended strand (participates in β ladder)trans-74.2105.1167.4-176.50000107.2L34 D38L34-V36 PolarHBondContact O-N 3.49Å; V36-D38 PolarHBondContact O-N 3.33Å
37A38.2Very low46.5Very low54 Ų5473 Ų7345%0.44649%0.491SS..  trans-69.8130.917000000109.6E35 A39 G169E35-A37 PolarHBondContact O-N 3.5Å; A37-A39 PolarHBondContact O-N 2.93Å; A37-A39 VanDerWaalsContact O-N 3.12Å; A37-G169 WeakPolarHBondContact CA-O 3.36Å; A37-G169 WeakPolarHBondContact CB-O 3.47Å; A37-G169 PolarHBondContact N-O 2.95Å; A37-G169 VanDerWaalsContact N-O 3.11Å
38D40.2Very low44.8Very low114 Ų11477.4 Ų77.461%0.6149%0.492SS*.  trans-44.1115.7176.3-76.7-49.9000111.3V36 G40V36-D38 PolarHBondContact O-N 3.33Å; D38-G40 PolarHBondContact O-N 3.27Å
39A35.4Very low43.3Very low82 Ų8279.3 Ų79.368%0.67851%0.509SS*.  trans-63.7105.5159.100000106.5A37 N41A37-A39 PolarHBondContact O-N 2.93Å; A37-A39 VanDerWaalsContact O-N 3.12Å; A39-N41 PolarHBondContact O-N 2.89Å
40G40Very low42.4Very low74 Ų7484.6 Ų84.676%0.76353%0.532SS*.SBendtrans-50.2122.6-166.800000114D38D38-G40 PolarHBondContact O-N 3.27Å
41N34.5Very low41.4Very low157 Ų15783.4 Ų83.484%0.8453%0.531SS*.  trans-147.8116.3136.5-149.24.3000109A39 S43A39-N41 PolarHBondContact O-N 2.89Å; N41-S43 PolarHBondContact O-N 3.43Å
42G44.2Very low40.6Very low72 Ų7288.2 Ų88.274%0.74256%0.556SS**SBendtrans-57.6125-167.400000113.7
43S38.5Very low40.2Very low124 Ų12487.9 Ų87.987%0.86756%0.559SS**  trans165.7-4.2152.144.30000115N41N41-S43 PolarHBondContact O-N 3.43Å
44A39.9Very low40.5Very low61 Ų6187.9 Ų87.950%0.50456%0.561SS.*  trans-90.1118.9-179.200000112R48A44-R48 HydrophobicContact CB-CB 4.29Å
45G38Very low41.1Very low47 Ų4787.3 Ų87.349%0.48556%0.557SS.*  trans-65.817217900000114.5G47 R48G45-G47 PolarHBondContact O-N 2.97Å; G45-R48 PolarHBondContact O-N 3.41Å
46P41.6Very low41.8Very low124 Ų12483.7 Ų83.781%0.80554%0.542SS*.THydrogen-bonded Turntrans-58.5-14.1-170.921.4-32.7000115.6
47G37.8Very low42.7Very low47 Ų4780.1 Ų80.149%0.48552%0.522SS..THydrogen-bonded Turntrans-80.2-6.1178.800000115.9G45G45-G47 PolarHBondContact O-N 2.97Å
48R39.5Very low43.7Very low168 Ų16877.7 Ų77.763%0.63450%0.502SS*.THydrogen-bonded Turntrans-97.4-22.2-177.6-134.7178.1167.8138.9-1.8114.2A44 G45 Q51A44-R48 HydrophobicContact CB-CB 4.29Å; G45-R48 PolarHBondContact O-N 3.41Å; R48-Q51 HydrophobicContact CG-CB 4.49Å; R48-Q51 VanDerWaalsContact O-CB 3.29Å; R48-Q51 WeakPolarHBondContact O-CB 3.5Å; R48-Q51 PolarHBondContact O-N 2.84Å; R48-Q51 VanDerWaalsContact O-N 3.14Å
49A38.9Very low44.8Very low62 Ų6277 Ų7751%0.51249%0.491SS..THydrogen-bonded Turntrans-68-36.2171.200000111.7Q51A49-Q51 PolarHBondContact O-N 3.15Å
50E40.8Very low45.8Very low163 Ų16377 Ų7776%0.76248%0.477SS*.G310 helixtrans-66.3-19.1170.4-69.3-169.4115.500112.8
51Q36.4Very low46.8Very low94 Ų9475.4 Ų75.444%0.43945%0.451SS..G310 helixtrans-86.4-10.3-174.5-132.2155.81300113.6R48 A49R48-Q51 HydrophobicContact CG-CB 4.49Å; R48-Q51 VanDerWaalsContact O-CB 3.29Å; R48-Q51 WeakPolarHBondContact O-CB 3.5Å; R48-Q51 PolarHBondContact O-N 2.84Å; R48-Q51 VanDerWaalsContact O-N 3.14Å; A49-Q51 PolarHBondContact O-N 3.15Å
52L42.3Very low47.8Very low106 Ų10669 Ų6956%0.55542%0.419SS*.G310 helixtrans-116.37.5175.5-68.1168.5000112.7S54L52-S54 PolarHBondContact O-N 3.3Å
53S45.8Very low48.3Very low28 Ų2871.6 Ų71.620%0.19641%0.412CS..  trans-73.998.9176.5-168.70000109.8H55S53-H55 PolarHBondContact OG-CE1 2.68Å; S53-H55 PolarHBondContact OG-NE2 2.9Å
54S50.7Low49.1Very low27 Ų2767.3 Ų67.319%0.18939%0.387CS..EExtended strand (participates in β ladder)trans-85.2118.5170.3-700000109.2L52L52-S54 PolarHBondContact O-N 3.3Å
55H57.2Low49.4Very low49 Ų4971.6 Ų71.623%0.22740%0.397CS..EExtended strand (participates in β ladder)trans-106.9120.6175.9-64.2-65.2000108.6Y30 S53 C62Y30-H55 HydrophobicContact CD1-CB 4.12Å; Y30-H55 AromaticContact CD1-CG 3.82Å; Y30-H55 AromaticContact CD1-ND1 3.57Å; Y30-H55 HydrophobicContact CE1-CB 4.11Å; Y30-H55 AromaticContact CE1-CD2 3.92Å; Y30-H55 AromaticContact CE1-CE1 3.96Å; Y30-H55 AromaticContact CE1-CG 3.64Å; Y30-H55 AromaticContact CE1-ND1 3.69Å; S53-H55 PolarHBondContact OG-CE1 2.68Å; S53-H55 PolarHBondContact OG-NE2 2.9Å; H55-C62 PolarHBondContact N-O 3.49Å; H55-C62 PolarHBondContact O-N 3.05Å
56S56.4Low49.9Very low24 Ų2476.5 Ų76.517%0.16841%0.412CS..EExtended strand (participates in β ladder)trans-111.5120178.6-53.10000109.9D29 W31 Y32D29-S56 CarbonylContact O-C 2.99Å; W31-S56 PolarHBondContact N-O 3.49Å; Y32-S56 PolarHBondContact N-O 3.39Å; Y32-S56 PolarHBondContact O-N 3.17Å
57G60Low50.3Low6 Ų674 Ų746%0.06240%0.397CS..  trans-79.4178.516800000112.3D29 W59 H60D29-G57 VanDerWaalsContact C-CA 3.41Å; D29-G57 WeakPolarHBondContact O-CA 3.31Å; D29-G57 PolarHBondContact O-N 2.93Å; G57-W59 VanDerWaalsContact C-N 3.25Å; G57-H60 WeakPolarHBondContact CA-O 3.34Å; G57-H60 PolarHBondContact N-O 3.01Å
58L59.9Low51.2Low3 Ų375.2 Ų75.22%0.01640%0.398CS..SBendtrans-69.8-28172.1-17462.7000111.4V96 M97L58-V96 HydrophobicContact CD1-CB 4.42Å; L58-V96 HydrophobicContact CD1-CG1 3.58Å; L58-M97 HydrophobicContact CD1-CG 4.41Å; L58-M97 HydrophobicContact CD1-SD 3.98Å; L58-M97 HydrophobicContact CD2-SD 4Å; L58-M97 HydrophobicContact CG-SD 3.55Å; L58-M97 VanDerWaalsContact CG-SD 3.55Å; L58-M97 WeakPolarHBondContact O-CE 3.32Å
59W62.7Low51.9Low100 Ų10071.9 Ų71.938%0.37939%0.391SS..SBendtrans-116.7-22.6-172.2-46.690.7000114V26 G57 L71 M97 P101V26-W59 PolarHBondContact O-NE1 3.16Å; G57-W59 VanDerWaalsContact C-N 3.25Å; W59-L71 PolarHBondContact O-N 3.49Å; W59-M97 HydrophobicContact CD2-CE 3.79Å; W59-M97 HydrophobicContact CD2-SD 3.86Å; W59-M97 HydrophobicContact CE3-CE 3.3Å; W59-M97 HydrophobicContact CE3-SD 3.62Å; W59-M97 HydrophobicContact CG-CE 4.42Å; W59-M97 HydrophobicContact CH2-CE 4.33Å; W59-M97 HydrophobicContact CH2-SD 3.56Å; W59-M97 VanDerWaalsContact CH2-SD 3.56Å; W59-M97 HydrophobicContact CZ2-SD 3.83Å; W59-M97 HydrophobicContact CZ3-CE 3.61Å; W59-M97 HydrophobicContact CZ3-SD 3.46Å; W59-M97 WeakPolarHBondContact CZ3-SD 3.46Å; W59-P101 HydrophobicContact CH2-CG 4.28Å; W59-P101 HydrophobicContact CZ2-CG 4.2Å
60H57.6Low52.6Low82 Ų8273.4 Ų73.438%0.3840%0.396SS..EExtended strand (participates in β ladder)trans-134.4141.7-175.7-61.6-69.3000110.6D29 G57D29-H60 IonicContact OD1-CD2 3.93Å; G57-H60 WeakPolarHBondContact CA-O 3.34Å; G57-H60 PolarHBondContact N-O 3.01Å
61V60.5Low53.3Low39 Ų3968.3 Ų68.324%0.23637%0.374CS..EExtended strand (participates in β ladder)trans-107.2122.5165.2171.20000107.4C68 I69 L71V61-C68 WeakPolarHBondContact O-CA 3.48Å; V61-I69 PolarHBondContact N-O 2.85Å; V61-I69 VanDerWaalsContact N-O 3.07Å; V61-I69 PolarHBondContact O-N 3.29Å; V61-I69 VanDerWaalsContact O-O 3.1Å; V61-L71 HydrophobicContact CG2-CB 4.13Å; V61-L71 HydrophobicContact CG2-CD1 3.47Å; V61-L71 VanDerWaalsContact CG2-CD1 3.47Å; V61-L71 HydrophobicContact CG2-CD2 4.42Å; V61-L71 HydrophobicContact CG2-CG 4.19Å
62C55.5Low53.9Low24 Ų2469.3 Ų69.316%0.16239%0.386CS..EExtended strand (participates in β ladder)trans-107.6112174-61.70000108.8H55 C68H55-C62 PolarHBondContact N-O 3.49Å; H55-C62 PolarHBondContact O-N 3.05Å; C62-C68 HydrophobicContact CB-CB 4.18Å; C62-C68 WeakPolarHBondContact CB-SG 3.25Å; C62-C68 WeakPolarHBondContact SG-CB 3.38Å; C62-C68 CovalentContact SG-SG 2.05Å; C62-C68 PolarHBondContact SG-SG 3.27Å
63E54.8Low54.2Low126 Ų12668.2 Ų68.259%0.58938%0.381SS*.EExtended strand (participates in β ladder)trans-101.3116175.9-166.5173-176.900108.8S67E63-S67 PolarHBondContact N-O 2.94Å; E63-S67 VanDerWaalsContact N-O 3.15Å
64G55.5Low54.4Low34 Ų3468.2 Ų68.235%0.35138%0.38SS..THydrogen-bonded Turntrans64.7-156.417500000115.9N66G64-N66 PolarHBondContact O-N 3.07Å
65Q44.8Very low54.3Low151 Ų15172.5 Ų72.571%0.70640%0.395SS*.THydrogen-bonded Turntrans-78.158.5-165.9-161.4151.438.800113.8
66N49.5Very low53.8Low150 Ų15074.5 Ų74.580%0.80241%0.411SS*.THydrogen-bonded Turntrans108.319167.9-47.6-40.4000117.6G64 C68G64-N66 PolarHBondContact O-N 3.07Å; N66-C68 PolarHBondContact O-N 3.38Å
67S49.1Very low53.3Low70 Ų7078.7 Ų78.749%0.4944%0.441SS..EExtended strand (participates in β ladder)trans-9983.4171.4-167.70000110.7E63E63-S67 PolarHBondContact N-O 2.94Å; E63-S67 VanDerWaalsContact N-O 3.15Å
68C57Low52.5Low74 Ų7486 Ų8650%0.547%0.473SS..EExtended strand (participates in β ladder)trans-85.9113.8171.2-63.40000109.5V61 C62 N66V61-C68 WeakPolarHBondContact O-CA 3.48Å; C62-C68 HydrophobicContact CB-CB 4.18Å; C62-C68 WeakPolarHBondContact CB-SG 3.25Å; C62-C68 WeakPolarHBondContact SG-CB 3.38Å; C62-C68 CovalentContact SG-SG 2.05Å; C62-C68 PolarHBondContact SG-SG 3.27Å; N66-C68 PolarHBondContact O-N 3.38Å
69I55.3Low51.8Low97 Ų9791.4 Ų91.450%0.49751%0.511SS..EExtended strand (participates in β ladder)trans-101.6131175.6-48.7176000106.3V61 L71V61-I69 PolarHBondContact N-O 2.85Å; V61-I69 VanDerWaalsContact N-O 3.07Å; V61-I69 PolarHBondContact O-N 3.29Å; V61-I69 VanDerWaalsContact O-O 3.1Å; I69-L71 PolarHBondContact O-N 3.5Å; I69-L71 VanDerWaalsContact O-N 3.17Å
70P52.7Low51.1Low94 Ų9492.3 Ų92.361%0.6152%0.523SS*.EExtended strand (participates in β ladder)trans-55.5126.5172.123.3-31.6000108.6V72P70-V72 PolarHBondContact O-N 3.45Å
71L54.9Low50.6Low57 Ų5797.2 Ų97.230%0.29855%0.552SS.*PPolyproline II helixtrans-62.8123.8178.3-178.563.8000106.9W59 V61 I69 D73W59-L71 PolarHBondContact O-N 3.49Å; V61-L71 HydrophobicContact CG2-CB 4.13Å; V61-L71 HydrophobicContact CG2-CD1 3.47Å; V61-L71 VanDerWaalsContact CG2-CD1 3.47Å; V61-L71 HydrophobicContact CG2-CD2 4.42Å; V61-L71 HydrophobicContact CG2-CG 4.19Å; I69-L71 PolarHBondContact O-N 3.5Å; I69-L71 VanDerWaalsContact O-N 3.17Å; L71-D73 PolarHBondContact O-N 3.22Å
72V49.1Very low50.5Low115 Ų11599.1 Ų99.170%0.69756%0.564SS**  trans-29.4123.9-175.8161.50000111.9P70 P74P70-V72 PolarHBondContact O-N 3.45Å; V72-P74 WeakPolarHBondContact O-CD 3.27Å
73D49Very low50.9Low82 Ų82101 Ų10144%0.43958%0.577SS.*  trans-58.2111.1177.8-177.8-58.7000109.1L71 F75 T76L71-D73 PolarHBondContact O-N 3.22Å; D73-F75 PolarHBondContact O-N 2.96Å; D73-F75 VanDerWaalsContact OD1-C 3.28Å; D73-F75 WeakPolarHBondContact OD1-CA 3.25Å; D73-F75 WeakPolarHBondContact OD1-CB 3.16Å; D73-F75 PolarHBondContact OD1-N 3.28Å; D73-T76 HydrophobicContact CB-CG2 3.87Å; D73-T76 PolarHBondContact O-N 3.11Å; D73-T76 VanDerWaalsContact O-N 3.09Å; D73-T76 PolarHBondContact O-OG1 2.69Å; D73-T76 PolarHBondContact OD1-N 3.3Å
74P49.3Very low51.5Low29 Ų29100.8 Ų100.819%0.18858%0.584CS.*THydrogen-bonded Turntrans-72.1-0.4-175.628.2-32000112.9V72 V90V72-P74 WeakPolarHBondContact O-CD 3.27Å; P74-V90 HydrophobicContact CB-CG1 4.24Å
75F49.1Very low51.9Low116 Ų116101.5 Ų101.551%0.50958%0.584SS.*THydrogen-bonded Turntrans-104.3-12.2175.6-49.1-94.7000112.5D73 S77 R94D73-F75 PolarHBondContact O-N 2.96Å; D73-F75 VanDerWaalsContact OD1-C 3.28Å; D73-F75 WeakPolarHBondContact OD1-CA 3.25Å; D73-F75 WeakPolarHBondContact OD1-CB 3.16Å; D73-F75 PolarHBondContact OD1-N 3.28Å; F75-S77 PolarHBondContact O-N 3.4Å; F75-R94 VanDerWaalsContact CD1-NH2 3.31Å; F75-R94 HydrophobicContact CE1-CG 4.21Å; F75-R94 VanDerWaalsContact CE1-NH2 3.3Å; F75-R94 HydrophobicContact CZ-CG 4.19Å
76T46.8Very low52.9Low91 Ų9197 Ų9756%0.55857%0.566SS**  trans-7299.9169.149.90000109.7D73 E78D73-T76 HydrophobicContact CB-CG2 3.87Å; D73-T76 PolarHBondContact O-N 3.11Å; D73-T76 VanDerWaalsContact O-N 3.09Å; D73-T76 PolarHBondContact O-OG1 2.69Å; D73-T76 PolarHBondContact OD1-N 3.3Å; T76-E78 VanDerWaalsContact C-N 3.32Å; T76-E78 PolarHBondContact O-N 2.91Å
77S45.2Very low53.9Low112 Ų11295.6 Ų95.678%0.78356%0.555SS**  trans-7281.8176.656.90000110.5F75 S79F75-S77 PolarHBondContact O-N 3.4Å; S77-S79 PolarHBondContact O-N 3.47Å
78E44.2Very low55.1Low160 Ų16097.4 Ų97.475%0.74856%0.556SS**  trans-8693.2154-71.7-151.694.700107.8T76 L80T76-E78 VanDerWaalsContact C-N 3.32Å; T76-E78 PolarHBondContact O-N 2.91Å; E78-L80 PolarHBondContact O-N 3.3Å
79S45.6Very low55.7Low117 Ų11795.4 Ų95.482%0.81854%0.54SS*.  trans-63.476.7165.254.60000109.2S77S77-S79 PolarHBondContact O-N 3.47Å
80L47.2Very low56.5Low119 Ų11994 Ų9462%0.62354%0.535SS*.  trans-107145.2162.9-65.7171.5000106.4E78 V82E78-L80 PolarHBondContact O-N 3.3Å; L80-V82 VanDerWaalsContact O-CG2 3.3Å; L80-V82 WeakPolarHBondContact O-CG2 3.33Å; L80-V82 PolarHBondContact O-N 3.34Å
81D47.3Very low57.6Low185 Ų18594.2 Ų94.299%0.98953%0.531SS*.  trans-5677.5-179.5-81-51000112.2
82V57.8Low58.7Low79 Ų7992.8 Ų92.848%0.47952%0.524SS..  trans-96.4138.3-175.7168.90000108.7L80 V86L80-V82 VanDerWaalsContact O-CG2 3.3Å; L80-V82 WeakPolarHBondContact O-CG2 3.33Å; L80-V82 PolarHBondContact O-N 3.34Å; V82-V86 HydrophobicContact CG1-CB 3.36Å; V82-V86 HydrophobicContact CG1-CG1 3.39Å; V82-V86 HydrophobicContact CG1-CG2 4.14Å
83S64.3Low59.9Low63 Ų6388.1 Ų88.144%0.44149%0.494SS..  trans-59.2151.2-177.378.40000111.9S85 V86 Q87S83-S85 PolarHBondContact O-N 3.04Å; S83-S85 PolarHBondContact OG-OG 2.89Å; S83-V86 PolarHBondContact O-N 2.82Å; S83-V86 VanDerWaalsContact O-N 3.09Å; S83-Q87 PolarHBondContact O-N 2.97Å
84T67.8Low61.4Low122 Ų12289.7 Ų89.775%0.74849%0.494SS*.Hα-helixtrans-56.3-25.317952.10000113.6H88T84-H88 PolarHBondContact O-N 3.24Å
85S64.7Low62.9Low48 Ų4889.9 Ų89.934%0.33650%0.498SS..Hα-helixtrans-69.9-42.717758.60000112.4S83 H88 L89 E157S83-S85 PolarHBondContact O-N 3.04Å; S83-S85 PolarHBondContact OG-OG 2.89Å; S85-H88 PolarHBondContact O-N 3.46Å; S85-L89 PolarHBondContact O-N 3.5Å; S85-L89 VanDerWaalsContact O-N 3.16Å; S85-E157 PolarHBondContact OG-OE2 3.01Å
86V65.2Low64.5Low56 Ų5684.4 Ų84.434%0.33947%0.474SS..Hα-helixtrans-70.7-36.2179.7176.80000110.9V82 S83 H88 L89 V90V82-V86 HydrophobicContact CG1-CB 3.36Å; V82-V86 HydrophobicContact CG1-CG1 3.39Å; V82-V86 HydrophobicContact CG1-CG2 4.14Å; S83-V86 PolarHBondContact O-N 2.82Å; S83-V86 VanDerWaalsContact O-N 3.09Å; V86-H88 VanDerWaalsContact C-N 3.32Å; V86-H88 PolarHBondContact O-N 3.35Å; V86-L89 VanDerWaalsContact O-CB 3.29Å; V86-L89 WeakPolarHBondContact O-CB 3.32Å; V86-L89 PolarHBondContact O-N 2.99Å; V86-L89 VanDerWaalsContact O-N 3.15Å; V86-V90 WeakPolarHBondContact O-CG2 3.15Å; V86-V90 PolarHBondContact O-N 3.23Å
87Q70.4Confident66.1Low122 Ų12281.2 Ų81.257%0.5745%0.453SS*.Hα-helixtrans-61.6-40.1174.2-169.5175.27.600112.1S83 L89 V90 L91S83-Q87 PolarHBondContact O-N 2.97Å; Q87-L89 VanDerWaalsContact C-N 3.31Å; Q87-L89 PolarHBondContact O-N 3.12Å; Q87-V90 PolarHBondContact O-N 3.37Å; Q87-L91 WeakPolarHBondContact O-CG 3.46Å; Q87-L91 PolarHBondContact O-N 2.93Å; Q87-L91 VanDerWaalsContact O-N 3.11Å
88H73.3Confident67.9Low108 Ų10879.7 Ų79.750%0.544%0.439SS..Hα-helixtrans-64.1-38.5175-164.165.2000111.8T84 S85 V86 L91 L92T84-H88 PolarHBondContact O-N 3.24Å; S85-H88 PolarHBondContact O-N 3.46Å; V86-H88 VanDerWaalsContact C-N 3.32Å; V86-H88 PolarHBondContact O-N 3.35Å; H88-L91 PolarHBondContact O-N 3.31Å; H88-L92 WeakPolarHBondContact O-CB 3.41Å; H88-L92 PolarHBondContact O-N 3.39Å
89L71.2Confident69.9Low32 Ų3273.2 Ų73.217%0.16841%0.41CS..Hα-helixtrans-62.4-44.5176.9-136.575.1000112.3S85 V86 Q87 L92 H93 Y150 L153 A154S85-L89 PolarHBondContact O-N 3.5Å; S85-L89 VanDerWaalsContact O-N 3.16Å; V86-L89 VanDerWaalsContact O-CB 3.29Å; V86-L89 WeakPolarHBondContact O-CB 3.32Å; V86-L89 PolarHBondContact O-N 2.99Å; V86-L89 VanDerWaalsContact O-N 3.15Å; Q87-L89 VanDerWaalsContact C-N 3.31Å; Q87-L89 PolarHBondContact O-N 3.12Å; L89-L92 PolarHBondContact O-N 2.87Å; L89-H93 PolarHBondContact O-N 3.39Å; L89-Y150 HydrophobicContact CB-CE2 4.33Å; L89-Y150 HydrophobicContact CD1-CD2 4.19Å; L89-Y150 HydrophobicContact CD1-CE2 4.42Å; L89-Y150 HydrophobicContact CD2-CE2 3.96Å; L89-Y150 HydrophobicContact CG-CD2 3.72Å; L89-Y150 HydrophobicContact CG-CE2 3.52Å; L89-Y150 WeakPolarHBondContact O-CD2 3.41Å; L89-Y150 WeakPolarHBondContact O-CE2 3.49Å; L89-L153 HydrophobicContact CD1-CB 3.34Å; L89-L153 HydrophobicContact CD1-CD1 4.31Å; L89-L153 HydrophobicContact CD1-CG 4.44Å; L89-A154 HydrophobicContact CD2-CB 4.08Å
90V71.6Confident71.8Confident66 Ų6667.7 Ų67.740%0.437%0.371SS..Hα-helixtrans-64.7-42.6177.6173.50000111.4P74 V86 Q87 L92 H93 R94P74-V90 HydrophobicContact CB-CG1 4.24Å; V86-V90 WeakPolarHBondContact O-CG2 3.15Å; V86-V90 PolarHBondContact O-N 3.23Å; Q87-V90 PolarHBondContact O-N 3.37Å; V90-L92 VanDerWaalsContact C-N 3.31Å; V90-L92 PolarHBondContact O-N 2.94Å; V90-H93 PolarHBondContact O-N 3.34Å; V90-R94 WeakPolarHBondContact O-CB 3.38Å; V90-R94 PolarHBondContact O-N 2.99Å
91L76.6Confident73.6Confident99 Ų9963.9 Ų63.952%0.51835%0.354SS..Hα-helixtrans-61.2-41.5176.1-74.7169.9000112Q87 H88 R94 A95Q87-L91 WeakPolarHBondContact O-CG 3.46Å; Q87-L91 PolarHBondContact O-N 2.93Å; Q87-L91 VanDerWaalsContact O-N 3.11Å; H88-L91 PolarHBondContact O-N 3.31Å; L91-R94 PolarHBondContact O-N 3.31Å; L91-A95 PolarHBondContact O-N 3.36Å
92L77.4Confident75.5Confident28 Ų2859.1 Ų59.115%0.14733%0.328CS..Hα-helixtrans-67.5-43.7-179.8-153.367.2000111H88 L89 V90 A95 V96 I146 Y150 L153H88-L92 WeakPolarHBondContact O-CB 3.41Å; H88-L92 PolarHBondContact O-N 3.39Å; L89-L92 PolarHBondContact O-N 2.87Å; V90-L92 VanDerWaalsContact C-N 3.31Å; V90-L92 PolarHBondContact O-N 2.94Å; L92-A95 WeakPolarHBondContact O-CB 3.4Å; L92-A95 PolarHBondContact O-N 3.35Å; L92-V96 WeakPolarHBondContact O-CG2 3.45Å; L92-V96 PolarHBondContact O-N 3.48Å; L92-V96 VanDerWaalsContact O-N 3.12Å; L92-I146 HydrophobicContact CD1-CB 4.41Å; L92-I146 HydrophobicContact CD1-CG2 3.53Å; L92-I146 HydrophobicContact CG-CG2 3.57Å; L92-I146 WeakPolarHBondContact O-CG2 3.4Å; L92-Y150 HydrophobicContact CB-CD2 4.39Å; L92-Y150 VanDerWaalsContact CD2-CA 3.45Å; L92-Y150 VanDerWaalsContact CD2-N 3.3Å; L92-L153 HydrophobicContact CD2-CD1 4.27Å
93H74.8Confident77.1Confident17 Ų1755.3 Ų55.38%0.07931%0.305CS..Hα-helixtrans-60.9-44.9173.6-177.879.8000112.2L89 V90 A95 V96 M97 Y150L89-H93 PolarHBondContact O-N 3.39Å; V90-H93 PolarHBondContact O-N 3.34Å; H93-A95 VanDerWaalsContact C-N 3.28Å; H93-A95 PolarHBondContact O-N 3Å; H93-V96 WeakPolarHBondContact O-CB 3.22Å; H93-V96 PolarHBondContact O-N 2.91Å; H93-V96 VanDerWaalsContact O-N 3.15Å; H93-M97 WeakPolarHBondContact O-CG 3.19Å; H93-M97 PolarHBondContact O-N 2.94Å; H93-Y150 HydrophobicContact CB-CD2 4.22Å; H93-Y150 HydrophobicContact CB-CE2 3.87Å
94R79.4Confident78.2Confident114 Ų11454.3 Ų54.343%0.4329%0.294SS..Hα-helixtrans-60.6-37.7175.9-167.9179-172.9-159.60.8112F75 V90 L91 M97 V98F75-R94 VanDerWaalsContact CD1-NH2 3.31Å; F75-R94 HydrophobicContact CE1-CG 4.21Å; F75-R94 VanDerWaalsContact CE1-NH2 3.3Å; F75-R94 HydrophobicContact CZ-CG 4.19Å; V90-R94 WeakPolarHBondContact O-CB 3.38Å; V90-R94 PolarHBondContact O-N 2.99Å; L91-R94 PolarHBondContact O-N 3.31Å; R94-M97 PolarHBondContact O-N 3Å; R94-V98 WeakPolarHBondContact O-CG2 3.21Å; R94-V98 PolarHBondContact O-N 2.82Å
95A81.8Confident79.4Confident34 Ų3452.4 Ų52.428%0.28128%0.282SS..Hα-helixtrans-63.3-44175.100000111.6L91 L92 H93 M97 V98 V99 I146L91-A95 PolarHBondContact O-N 3.36Å; L92-A95 WeakPolarHBondContact O-CB 3.4Å; L92-A95 PolarHBondContact O-N 3.35Å; H93-A95 VanDerWaalsContact C-N 3.28Å; H93-A95 PolarHBondContact O-N 3Å; A95-M97 PolarHBondContact O-N 2.62Å; A95-V98 PolarHBondContact O-N 2.97Å; A95-V99 VanDerWaalsContact O-CB 3.3Å; A95-V99 WeakPolarHBondContact O-CB 3.46Å; A95-V99 WeakPolarHBondContact O-CG2 3.41Å; A95-V99 PolarHBondContact O-N 3.25Å; A95-I146 HydrophobicContact CB-CD1 4.35Å; A95-I146 HydrophobicContact CB-CG2 4.28Å
96V81.3Confident80.5Confident1 Ų151.7 Ų51.71%0.00628%0.275CS..Hα-helixtrans-59.9-47176179.10000111L58 L92 H93 V98 V99 L100 I146 Y147L58-V96 HydrophobicContact CD1-CB 4.42Å; L58-V96 HydrophobicContact CD1-CG1 3.58Å; L92-V96 WeakPolarHBondContact O-CG2 3.45Å; L92-V96 PolarHBondContact O-N 3.48Å; L92-V96 VanDerWaalsContact O-N 3.12Å; H93-V96 WeakPolarHBondContact O-CB 3.22Å; H93-V96 PolarHBondContact O-N 2.91Å; H93-V96 VanDerWaalsContact O-N 3.15Å; V96-V98 PolarHBondContact O-N 3.47Å; V96-V99 PolarHBondContact O-N 2.99Å; V96-L100 HydrophobicContact CB-CD1 4.43Å; V96-L100 HydrophobicContact CG1-CD1 3.3Å; V96-L100 PolarHBondContact O-N 2.84Å; V96-L100 VanDerWaalsContact O-N 3.08Å; V96-I146 HydrophobicContact CG2-CB 4.12Å; V96-I146 HydrophobicContact CG2-CG2 3.42Å; V96-I146 VanDerWaalsContact CG2-CG2 3.42Å; V96-Y147 HydrophobicContact CG1-CD2 4.35Å
97M80.1Confident81.7Confident24 Ų2449.1 Ų49.112%0.11826%0.259CS..Hα-helixtrans-58.8-26.5177.9-75.9-69.4-134.200114L58 W59 H93 R94 A95 P101L58-M97 HydrophobicContact CD1-CG 4.41Å; L58-M97 HydrophobicContact CD1-SD 3.98Å; L58-M97 HydrophobicContact CD2-SD 4Å; L58-M97 HydrophobicContact CG-SD 3.55Å; L58-M97 VanDerWaalsContact CG-SD 3.55Å; L58-M97 WeakPolarHBondContact O-CE 3.32Å; W59-M97 HydrophobicContact CD2-CE 3.79Å; W59-M97 HydrophobicContact CD2-SD 3.86Å; W59-M97 HydrophobicContact CE3-CE 3.3Å; W59-M97 HydrophobicContact CE3-SD 3.62Å; W59-M97 HydrophobicContact CG-CE 4.42Å; W59-M97 HydrophobicContact CH2-CE 4.33Å; W59-M97 HydrophobicContact CH2-SD 3.56Å; W59-M97 VanDerWaalsContact CH2-SD 3.56Å; W59-M97 HydrophobicContact CZ2-SD 3.83Å; W59-M97 HydrophobicContact CZ3-CE 3.61Å; W59-M97 HydrophobicContact CZ3-SD 3.46Å; W59-M97 WeakPolarHBondContact CZ3-SD 3.46Å; H93-M97 WeakPolarHBondContact O-CG 3.19Å; H93-M97 PolarHBondContact O-N 2.94Å; R94-M97 PolarHBondContact O-N 3Å; A95-M97 PolarHBondContact O-N 2.62Å; M97-P101 WeakPolarHBondContact O-CD 3.49Å; M97-P101 WeakPolarHBondContact O-CG 3.47Å
98V84.9Confident82.7Confident80 Ų8045.8 Ų45.849%0.48525%0.247SC..Hα-helixtrans-93.2-44.2177.8174.70000111.2R94 A95 V96 L102R94-V98 WeakPolarHBondContact O-CG2 3.21Å; R94-V98 PolarHBondContact O-N 2.82Å; A95-V98 PolarHBondContact O-N 2.97Å; V96-V98 PolarHBondContact O-N 3.47Å; V98-L102 WeakPolarHBondContact O-CB 3.45Å; V98-L102 PolarHBondContact O-N 3.49Å; V98-L102 VanDerWaalsContact O-N 3.09Å
99V86.2Confident83.5Confident23 Ų2343.1 Ų43.114%0.13924%0.24CC..Hα-helixtrans-69.1-40.1-172.7171.50000112A95 V96 L102 S103 L139A95-V99 VanDerWaalsContact O-CB 3.3Å; A95-V99 WeakPolarHBondContact O-CB 3.46Å; A95-V99 WeakPolarHBondContact O-CG2 3.41Å; A95-V99 PolarHBondContact O-N 3.25Å; V96-V99 PolarHBondContact O-N 2.99Å; V99-L102 PolarHBondContact O-N 2.83Å; V99-S103 WeakPolarHBondContact O-CB 3.45Å; V99-S103 PolarHBondContact O-N 3.09Å; V99-L139 HydrophobicContact CG1-CB 4.25Å; V99-L139 HydrophobicContact CG1-CD2 4.16Å; V99-L139 WeakPolarHBondContact CG1-O 3.13Å
100L84.1Confident84.4Confident1 Ų141.6 Ų41.61%0.00523%0.232CC..Hα-helixtrans-66.6-51.4180-95117.4000113L22 V26 W31 V96 L102 S103 L104L22-L100 HydrophobicContact CD1-CD2 4.29Å; V26-L100 HydrophobicContact CG2-CB 4.32Å; V26-L100 HydrophobicContact CG2-CD2 3.72Å; W31-L100 HydrophobicContact CH2-CD1 3.8Å; W31-L100 HydrophobicContact CH2-CD2 3.53Å; W31-L100 HydrophobicContact CH2-CG 4.31Å; W31-L100 HydrophobicContact CZ2-CD1 4.36Å; W31-L100 HydrophobicContact CZ2-CD2 3.56Å; W31-L100 HydrophobicContact CZ3-CD1 4.45Å; V96-L100 HydrophobicContact CB-CD1 4.43Å; V96-L100 HydrophobicContact CG1-CD1 3.3Å; V96-L100 PolarHBondContact O-N 2.84Å; V96-L100 VanDerWaalsContact O-N 3.08Å; L100-L102 VanDerWaalsContact C-N 3.29Å; L100-L102 PolarHBondContact O-N 3.33Å; L100-S103 PolarHBondContact O-N 3.06Å; L100-S103 PolarHBondContact O-OG 2.83Å; L100-L104 PolarHBondContact O-N 3.47Å; L100-L104 VanDerWaalsContact O-N 3.11Å
101P85.9Confident85.2Confident40 Ų4042 Ų4226%0.2623%0.227SC..Hα-helixtrans-60.5-38.2173.6-27.138000112.8W59 M97 S103 L104 V105W59-P101 HydrophobicContact CH2-CG 4.28Å; W59-P101 HydrophobicContact CZ2-CG 4.2Å; M97-P101 WeakPolarHBondContact O-CD 3.49Å; M97-P101 WeakPolarHBondContact O-CG 3.47Å; P101-S103 VanDerWaalsContact C-N 3.31Å; P101-S103 PolarHBondContact O-N 3.26Å; P101-L104 WeakPolarHBondContact O-CB 3.24Å; P101-L104 PolarHBondContact O-N 2.9Å; P101-V105 WeakPolarHBondContact O-CG2 3.42Å; P101-V105 PolarHBondContact O-N 3.4Å
102L87.4Confident85.9Confident84 Ų8441.6 Ų41.644%0.4422%0.224SC..Hα-helixtrans-60.5-41.6175.9-175.567.2000111.7V98 V99 L100 L104 V105 L106V98-L102 WeakPolarHBondContact O-CB 3.45Å; V98-L102 PolarHBondContact O-N 3.49Å; V98-L102 VanDerWaalsContact O-N 3.09Å; V99-L102 PolarHBondContact O-N 2.83Å; L100-L102 VanDerWaalsContact C-N 3.29Å; L100-L102 PolarHBondContact O-N 3.33Å; L102-L104 VanDerWaalsContact C-N 3.35Å; L102-V105 PolarHBondContact O-N 3.11Å; L102-L106 WeakPolarHBondContact O-CG 3.39Å; L102-L106 PolarHBondContact O-N 2.97Å
103S90.2Very high86.4Confident0 Ų042.1 Ų42.10%023%0.229CC..Hα-helixtrans-64.2-38.5175.971.90000112.6V99 L100 P101 L106 L107 T140V99-S103 WeakPolarHBondContact O-CB 3.45Å; V99-S103 PolarHBondContact O-N 3.09Å; L100-S103 PolarHBondContact O-N 3.06Å; L100-S103 PolarHBondContact O-OG 2.83Å; P101-S103 VanDerWaalsContact C-N 3.31Å; P101-S103 PolarHBondContact O-N 3.26Å; S103-L106 PolarHBondContact O-N 3.19Å; S103-L107 WeakPolarHBondContact O-CB 3.23Å; S103-L107 PolarHBondContact O-N 2.89Å; S103-T140 VanDerWaalsContact OG-CG2 3.29Å; S103-T140 WeakPolarHBondContact OG-CG2 3.29Å
104L88.9Confident87Confident41 Ų4141.8 Ų41.822%0.21523%0.229CC..Hα-helixtrans-65.2-40.7175.3-169.7121.9000111.7F19 L22 A23 L100 P101 L102 L107 V108F19-L104 HydrophobicContact CE2-CD1 4.44Å; F19-L104 HydrophobicContact CE2-CD2 4.4Å; F19-L104 HydrophobicContact CE2-CG 4.32Å; L22-L104 HydrophobicContact CB-CD1 4.43Å; L22-L104 HydrophobicContact CD2-CB 4.13Å; L22-L104 HydrophobicContact CD2-CD1 4.28Å; L22-L104 HydrophobicContact CG-CD1 4.14Å; A23-L104 HydrophobicContact CB-CD1 4.08Å; L100-L104 PolarHBondContact O-N 3.47Å; L100-L104 VanDerWaalsContact O-N 3.11Å; P101-L104 WeakPolarHBondContact O-CB 3.24Å; P101-L104 PolarHBondContact O-N 2.9Å; L102-L104 VanDerWaalsContact C-N 3.35Å; L104-L107 VanDerWaalsContact O-CB 3.32Å; L104-L107 WeakPolarHBondContact O-CB 3.28Å; L104-L107 PolarHBondContact O-N 3.03Å; L104-V108 WeakPolarHBondContact O-CG2 3.06Å; L104-V108 PolarHBondContact O-N 2.98Å
105V91.5Very high87.4Confident82 Ų8241.1 Ų41.150%0.49723%0.233SC..Hα-helixtrans-62.4-45.6174.6171.80000111.1P101 L102 L107 V108 C109P101-V105 WeakPolarHBondContact O-CG2 3.42Å; P101-V105 PolarHBondContact O-N 3.4Å; L102-V105 PolarHBondContact O-N 3.11Å; V105-L107 PolarHBondContact O-N 3.44Å; V105-V108 PolarHBondContact O-N 3.47Å; V105-C109 WeakPolarHBondContact O-CB 3.33Å; V105-C109 PolarHBondContact O-N 3.14Å; V105-C109 PolarHBondContact O-SG 3.2Å; V105-C109 VanDerWaalsContact O-SG 3.34Å
106L88.9Confident87.7Confident34 Ų3444.3 Ų44.318%0.17825%0.245CC..Hα-helixtrans-60.9-35.2175.6-72174000112.1L102 S103 G110 Y132 L139L102-L106 WeakPolarHBondContact O-CG 3.39Å; L102-L106 PolarHBondContact O-N 2.97Å; S103-L106 PolarHBondContact O-N 3.19Å; L106-G110 PolarHBondContact O-N 3.41Å; L106-Y132 HydrophobicContact CD2-CD1 4Å; L106-Y132 HydrophobicContact CD2-CE1 4.06Å; L106-L139 HydrophobicContact CD1-CD1 3.21Å
107L89.9Confident88Confident2 Ų244.2 Ų44.21%0.0125%0.245CC..Hα-helixtrans-66.1-44.4176.7-151103.5000112.2S18 F19 S103 L104 V105 G110 W111 F133 E188S18-L107 VanDerWaalsContact OG-CD1 3.23Å; S18-L107 WeakPolarHBondContact OG-CD1 3.34Å; S18-L107 WeakPolarHBondContact OG-CD2 3.44Å; F19-L107 HydrophobicContact CB-CD2 3.49Å; F19-L107 VanDerWaalsContact CB-CD2 3.49Å; F19-L107 HydrophobicContact CD2-CD2 4Å; F19-L107 HydrophobicContact CG-CD2 4.25Å; S103-L107 WeakPolarHBondContact O-CB 3.23Å; S103-L107 PolarHBondContact O-N 2.89Å; L104-L107 VanDerWaalsContact O-CB 3.32Å; L104-L107 WeakPolarHBondContact O-CB 3.28Å; L104-L107 PolarHBondContact O-N 3.03Å; V105-L107 PolarHBondContact O-N 3.44Å; L107-G110 PolarHBondContact O-N 3.21Å; L107-W111 WeakPolarHBondContact O-CB 3.03Å; L107-W111 PolarHBondContact O-N 2.87Å; L107-F133 HydrophobicContact CD1-CD1 4.04Å; L107-F133 HydrophobicContact CD1-CE1 4.2Å; L107-F133 HydrophobicContact CG-CD1 4.31Å; L107-F133 HydrophobicContact CG-CE1 3.99Å; L107-E188 VanDerWaalsContact CD1-CD 3.4Å; L107-E188 HydrophobicContact CD1-CG 3.5Å; L107-E188 WeakPolarHBondContact CD1-OE1 3.49Å
108V92.3Very high88.2Confident51 Ų5146 Ų4631%0.30926%0.26SS..Hα-helixtrans-63.1-45.9175.6173.30000110.6F19 L104 V105 G110 W111 I112F19-V108 HydrophobicContact CD2-CG2 4.04Å; F19-V108 HydrophobicContact CE2-CG2 3.6Å; L104-V108 WeakPolarHBondContact O-CG2 3.06Å; L104-V108 PolarHBondContact O-N 2.98Å; V105-V108 PolarHBondContact O-N 3.47Å; V108-G110 VanDerWaalsContact C-N 3.34Å; V108-G110 PolarHBondContact O-N 3.3Å; V108-W111 PolarHBondContact O-N 3.04Å; V108-I112 HydrophobicContact CG1-CD1 4.01Å; V108-I112 WeakPolarHBondContact O-CG1 3.42Å; V108-I112 PolarHBondContact O-N 3.46Å
109C90Very high88.2Confident53 Ų5349.8 Ų49.836%0.35828%0.276SS..Hα-helixtrans-59.3-45.4174.4-70.40000111.5V105 W111 I112 C113V105-C109 WeakPolarHBondContact O-CB 3.33Å; V105-C109 PolarHBondContact O-N 3.14Å; V105-C109 PolarHBondContact O-SG 3.2Å; V105-C109 VanDerWaalsContact O-SG 3.34Å; C109-W111 PolarHBondContact O-N 2.89Å; C109-I112 PolarHBondContact O-N 2.85Å; C109-C113 WeakPolarHBondContact O-CB 3.32Å; C109-C113 PolarHBondContact O-N 2.98Å; C109-C113 PolarHBondContact O-SG 3.35Å
110G89.4Confident88.1Confident0 Ų051.6 Ų51.60%029%0.294CS..Hα-helixtrans-59.3-43.7175.300000112.1L106 L107 V108 I112 C113 S114 T129L106-G110 PolarHBondContact O-N 3.41Å; L107-G110 PolarHBondContact O-N 3.21Å; V108-G110 VanDerWaalsContact C-N 3.34Å; V108-G110 PolarHBondContact O-N 3.3Å; G110-I112 PolarHBondContact O-N 3.44Å; G110-C113 PolarHBondContact O-N 2.98Å; G110-S114 WeakPolarHBondContact O-CB 3.32Å; G110-S114 PolarHBondContact O-N 3.28Å; G110-T129 VanDerWaalsContact O-CG2 3.32Å; G110-T129 WeakPolarHBondContact O-CG2 3.19Å
111W87.9Confident88Confident75 Ų7558 Ų5828%0.28432%0.323SS..Hα-helixtrans-62.9-45.1177.6-175.916000112.1L16 L107 V108 C109 S114 L115L16-W111 HydrophobicContact CD2-CH2 3.28Å; L16-W111 HydrophobicContact CD2-CZ2 3.27Å; L16-W111 HydrophobicContact CD2-CZ3 4.02Å; L16-W111 HydrophobicContact CG-CH2 4.37Å; L16-W111 HydrophobicContact CG-CZ2 3.95Å; L107-W111 WeakPolarHBondContact O-CB 3.03Å; L107-W111 PolarHBondContact O-N 2.87Å; V108-W111 PolarHBondContact O-N 3.04Å; C109-W111 PolarHBondContact O-N 2.89Å; W111-S114 WeakPolarHBondContact O-CB 3.42Å; W111-S114 PolarHBondContact O-N 2.94Å; W111-L115 WeakPolarHBondContact O-CG 3.42Å; W111-L115 PolarHBondContact O-N 2.89Å
112I91.2Very high87.9Confident90 Ų9057.4 Ų57.446%0.46232%0.32SS..Hα-helixtrans-59.8-50.2175.2-64.8164.3000109.9V108 C109 G110 S114 L115 L116V108-I112 HydrophobicContact CG1-CD1 4.01Å; V108-I112 WeakPolarHBondContact O-CG1 3.42Å; V108-I112 PolarHBondContact O-N 3.46Å; C109-I112 PolarHBondContact O-N 2.85Å; G110-I112 PolarHBondContact O-N 3.44Å; I112-S114 PolarHBondContact O-N 3.43Å; I112-L115 PolarHBondContact O-N 3.24Å; I112-L115 VanDerWaalsContact O-N 3.09Å; I112-L116 HydrophobicContact CG2-CD1 3.49Å; I112-L116 VanDerWaalsContact CG2-CD1 3.49Å; I112-L116 WeakPolarHBondContact O-CD1 3.32Å; I112-L116 PolarHBondContact O-N 3.45Å
113C88.2Confident87.8Confident38 Ų3854.1 Ų54.126%0.25731%0.305SS..Hα-helixtrans-57.1-37.3176.5-69.70000112.5C109 G110 L116 S117 T129C109-C113 WeakPolarHBondContact O-CB 3.32Å; C109-C113 PolarHBondContact O-N 2.98Å; C109-C113 PolarHBondContact O-SG 3.35Å; G110-C113 PolarHBondContact O-N 2.98Å; C113-L116 PolarHBondContact O-N 3.19Å; C113-S117 WeakPolarHBondContact O-CB 2.97Å; C113-S117 PolarHBondContact O-N 3.42Å; C113-T129 WeakPolarHBondContact CB-OG1 3.48Å
114S88.3Confident87.6Confident10 Ų1058.5 Ų58.57%0.0733%0.334CS..Hα-helixtrans-63.4-42.4176.3-164.90000112.3G110 W111 I112 S117 S118 T129G110-S114 WeakPolarHBondContact O-CB 3.32Å; G110-S114 PolarHBondContact O-N 3.28Å; W111-S114 WeakPolarHBondContact O-CB 3.42Å; W111-S114 PolarHBondContact O-N 2.94Å; I112-S114 PolarHBondContact O-N 3.43Å; S114-S117 PolarHBondContact O-N 3.09Å; S114-S118 WeakPolarHBondContact O-CB 3.46Å; S114-S118 PolarHBondContact O-N 3.24Å; S114-T129 VanDerWaalsContact CB-CG2 3.49Å
115L87.8Confident87.5Confident100 Ų10059.8 Ų59.852%0.52434%0.34SS..Hα-helixtrans-65.8-47.1178-68.3172.1000110.9W111 I112 S117 S118 L119W111-L115 WeakPolarHBondContact O-CG 3.42Å; W111-L115 PolarHBondContact O-N 2.89Å; I112-L115 PolarHBondContact O-N 3.24Å; I112-L115 VanDerWaalsContact O-N 3.09Å; L115-S117 VanDerWaalsContact C-N 3.28Å; L115-S117 PolarHBondContact O-N 2.85Å; L115-S118 PolarHBondContact O-N 2.84Å; L115-L119 PolarHBondContact O-N 3.14Å
116L88.3Confident87.3Confident101 Ų10156 Ų5653%0.52932%0.318SS..Hα-helixtrans-60-41.3174.7-8296.1000111.4I112 C113 S118 L119 A120I112-L116 HydrophobicContact CG2-CD1 3.49Å; I112-L116 VanDerWaalsContact CG2-CD1 3.49Å; I112-L116 WeakPolarHBondContact O-CD1 3.32Å; I112-L116 PolarHBondContact O-N 3.45Å; C113-L116 PolarHBondContact O-N 3.19Å; L116-S118 VanDerWaalsContact C-N 3.35Å; L116-S118 PolarHBondContact O-N 3.48Å; L116-L119 PolarHBondContact O-N 3.32Å; L116-A120 VanDerWaalsContact O-CB 3.25Å; L116-A120 WeakPolarHBondContact O-CB 3.3Å; L116-A120 PolarHBondContact O-N 2.85Å
117S86.4Confident87.2Confident0 Ų057.5 Ų57.50%033%0.325CS..Hα-helixtrans-65.7-37.3179.2-168.40000112.9C113 S114 L115 L119 Q121 S122 L125 L126C113-S117 WeakPolarHBondContact O-CB 2.97Å; C113-S117 PolarHBondContact O-N 3.42Å; S114-S117 PolarHBondContact O-N 3.09Å; L115-S117 VanDerWaalsContact C-N 3.28Å; L115-S117 PolarHBondContact O-N 2.85Å; S117-L119 VanDerWaalsContact C-N 3.35Å; S117-Q121 WeakPolarHBondContact O-CA 3.08Å; S117-Q121 PolarHBondContact O-N 3Å; S117-S122 PolarHBondContact OG-O 3.46Å; S117-L125 VanDerWaalsContact OG-C 3.3Å; S117-L125 VanDerWaalsContact OG-CB 3.25Å; S117-L125 WeakPolarHBondContact OG-CB 3.42Å; S117-L126 WeakPolarHBondContact OG-CA 3.47Å; S117-L126 VanDerWaalsContact OG-CD2 3.32Å; S117-L126 WeakPolarHBondContact OG-CD2 3.49Å; S117-L126 WeakPolarHBondContact OG-CG 3.42Å; S117-L126 PolarHBondContact OG-N 3.32Å
118S84.3Confident87.2Confident62 Ų6262.2 Ų62.243%0.43435%0.346SS..Hα-helixtrans-67.6-37.5175.6-174.20000111.4S114 L115 L116S114-S118 WeakPolarHBondContact O-CB 3.46Å; S114-S118 PolarHBondContact O-N 3.24Å; L115-S118 PolarHBondContact O-N 2.84Å; L116-S118 VanDerWaalsContact C-N 3.35Å; L116-S118 PolarHBondContact O-N 3.48Å
119L85.2Confident87.1Confident158 Ų15859.8 Ų59.883%0.82733%0.331SS*.Hα-helixtrans-74.1-41.1178.9-17163.7000112L115 L116 S117 Q121L115-L119 PolarHBondContact O-N 3.14Å; L116-L119 PolarHBondContact O-N 3.32Å; S117-L119 VanDerWaalsContact C-N 3.35Å; L119-Q121 VanDerWaalsContact C-N 3.29Å; L119-Q121 PolarHBondContact O-N 3.25Å
120A84.2Confident87.1Confident62 Ų6257.3 Ų57.351%0.51231%0.314SS..Hα-helixtrans-80.5-8.4179.800000113.7L116 S122 L125L116-A120 VanDerWaalsContact O-CB 3.25Å; L116-A120 WeakPolarHBondContact O-CB 3.3Å; L116-A120 PolarHBondContact O-N 2.85Å; A120-S122 PolarHBondContact O-N 3.34Å; A120-S122 VanDerWaalsContact O-N 3.16Å; A120-L125 HydrophobicContact CB-CD1 4.3Å
121Q82.4Confident87.1Confident134 Ų13460.3 Ų60.363%0.62634%0.335SS*.THydrogen-bonded Turntrans45.845.7-178.1-153.8-178.7-57.100112.7S117 L119 L202S117-Q121 WeakPolarHBondContact O-CA 3.08Å; S117-Q121 PolarHBondContact O-N 3Å; L119-Q121 VanDerWaalsContact C-N 3.29Å; L119-Q121 PolarHBondContact O-N 3.25Å; Q121-L202 HydrophobicContact CG-CD1 4.11Å; Q121-L202 VanDerWaalsContact O-CD2 3.23Å; Q121-L202 WeakPolarHBondContact O-CD2 3.17Å
122S83.9Confident87.2Confident28 Ų2859.7 Ų59.720%0.19633%0.333CS..  trans-113.7125.3-172.7650000112.3S117 A120 L125 L126S117-S122 PolarHBondContact OG-O 3.46Å; A120-S122 PolarHBondContact O-N 3.34Å; A120-S122 VanDerWaalsContact O-N 3.16Å; S122-L125 PolarHBondContact O-N 2.93Å; S122-L125 WeakPolarHBondContact OG-CB 3.48Å; S122-L125 WeakPolarHBondContact OG-CD1 3.38Å; S122-L125 WeakPolarHBondContact OG-CG 3.13Å; S122-L126 PolarHBondContact O-N 2.83Å
123A84.6Confident87.1Confident15 Ų1555.5 Ų55.512%0.12431%0.311CS..Hα-helixtrans-59.5-42177.600000114.9L125 L126 L127 L202 S203A123-L125 VanDerWaalsContact C-N 3.33Å; A123-L125 PolarHBondContact O-N 3.47Å; A123-L126 PolarHBondContact O-N 3.2Å; A123-L127 WeakPolarHBondContact O-CG 3.32Å; A123-L127 PolarHBondContact O-N 3.3Å; A123-L127 VanDerWaalsContact O-N 3.11Å; A123-L202 HydrophobicContact CB-CB 4.42Å; A123-L202 HydrophobicContact CB-CD2 4.08Å; A123-S203 WeakPolarHBondContact CB-OG 3.17Å
124P86.4Confident87.3Confident92 Ų9257.2 Ų57.260%0.59732%0.317SS*.Hα-helixtrans-67.2-32.9-178.825.2-34.4000112.9L127 F128P124-L127 PolarHBondContact O-N 2.99Å; P124-F128 WeakPolarHBondContact O-CB 3.15Å; P124-F128 PolarHBondContact O-N 3.4Å
125L86.2Confident87.4Confident68 Ų6861.3 Ų61.336%0.35634%0.338SS..Hα-helixtrans-69.9-36.1175.6-65.5-175.2000111.6S117 A120 S122 A123 F128 T129S117-L125 VanDerWaalsContact OG-C 3.3Å; S117-L125 VanDerWaalsContact OG-CB 3.25Å; S117-L125 WeakPolarHBondContact OG-CB 3.42Å; A120-L125 HydrophobicContact CB-CD1 4.3Å; S122-L125 PolarHBondContact O-N 2.93Å; S122-L125 WeakPolarHBondContact OG-CB 3.48Å; S122-L125 WeakPolarHBondContact OG-CD1 3.38Å; S122-L125 WeakPolarHBondContact OG-CG 3.13Å; A123-L125 VanDerWaalsContact C-N 3.33Å; A123-L125 PolarHBondContact O-N 3.47Å; L125-F128 PolarHBondContact O-N 3.01Å; L125-T129 VanDerWaalsContact O-CB 3.27Å; L125-T129 WeakPolarHBondContact O-CB 3.31Å; L125-T129 PolarHBondContact O-N 3.25Å; L125-T129 PolarHBondContact O-OG1 2.99Å
126L86.7Confident87.5Confident3 Ų356.6 Ų56.62%0.01631%0.313CS..Hα-helixtrans-64.1-41.5175.1-73.6174.6000111.4L8 S117 S122 A123 G130 L195 A198 A199L8-L126 HydrophobicContact CD2-CD2 3.66Å; S117-L126 WeakPolarHBondContact OG-CA 3.47Å; S117-L126 VanDerWaalsContact OG-CD2 3.32Å; S117-L126 WeakPolarHBondContact OG-CD2 3.49Å; S117-L126 WeakPolarHBondContact OG-CG 3.42Å; S117-L126 PolarHBondContact OG-N 3.32Å; S122-L126 PolarHBondContact O-N 2.83Å; A123-L126 PolarHBondContact O-N 3.2Å; L126-G130 PolarHBondContact O-N 3.49Å; L126-L195 HydrophobicContact CD2-CD2 3.8Å; L126-A198 HydrophobicContact CD1-CB 4.27Å; L126-A199 HydrophobicContact CB-CB 3.77Å; L126-A199 HydrophobicContact CD1-CB 4.35Å
127L88.4Confident87.5Confident65 Ų6552.1 Ų52.134%0.3429%0.292SS..Hα-helixtrans-62.8-47.9175.7-70.1176.4000111.3A123 P124 T129 G130 C131 L196 A199A123-L127 WeakPolarHBondContact O-CG 3.32Å; A123-L127 PolarHBondContact O-N 3.3Å; A123-L127 VanDerWaalsContact O-N 3.11Å; P124-L127 PolarHBondContact O-N 2.99Å; L127-T129 VanDerWaalsContact C-N 3.33Å; L127-T129 PolarHBondContact O-N 3.4Å; L127-G130 PolarHBondContact O-N 3.47Å; L127-C131 PolarHBondContact O-N 2.81Å; L127-C131 PolarHBondContact O-SG 3.18Å; L127-C131 VanDerWaalsContact O-SG 3.34Å; L127-L196 HydrophobicContact CD2-CD2 3.62Å; L127-A199 HydrophobicContact CD2-CB 3.66Å; L127-A199 HydrophobicContact CG-CB 3.88Å
128F89.4Confident87.8Confident102 Ų10256.3 Ų56.345%0.44732%0.317SS..Hα-helixtrans-60.8-43.9179.4-172.5-120000112.1P124 L125 G130 C131 Y132P124-F128 WeakPolarHBondContact O-CB 3.15Å; P124-F128 PolarHBondContact O-N 3.4Å; L125-F128 PolarHBondContact O-N 3.01Å; F128-G130 PolarHBondContact O-N 3.23Å; F128-C131 WeakPolarHBondContact O-CB 3.35Å; F128-C131 PolarHBondContact O-N 2.82Å; F128-Y132 AromaticContact CD1-CD2 3.98Å; F128-Y132 HydrophobicContact CD1-CD2 3.98Å; F128-Y132 AromaticContact CD1-CE2 3.55Å; F128-Y132 HydrophobicContact CD1-CE2 3.55Å; F128-Y132 HydrophobicContact CD2-CE2 4.46Å; F128-Y132 AromaticContact CE1-CD2 3.92Å; F128-Y132 HydrophobicContact CE1-CD2 3.92Å; F128-Y132 AromaticContact CE1-CE2 3.02Å; F128-Y132 HydrophobicContact CE1-CE2 3.02Å; F128-Y132 AromaticContact CE1-CZ 3.62Å; F128-Y132 HydrophobicContact CE2-CE2 4Å; F128-Y132 HydrophobicContact CG-CD2 4.48Å; F128-Y132 HydrophobicContact CG-CE2 4.27Å; F128-Y132 HydrophobicContact CZ-CD2 4.28Å; F128-Y132 HydrophobicContact CZ-CE1 4.45Å; F128-Y132 AromaticContact CZ-CE2 3.28Å; F128-Y132 HydrophobicContact CZ-CE2 3.28Å; F128-Y132 AromaticContact CZ-CZ 3.35Å; F128-Y132 WeakPolarHBondContact CZ-OH 3.49Å; F128-Y132 PolarHBondContact O-N 3.13Å
129T90.5Very high88.1Confident0 Ų055.4 Ų55.40%031%0.307CS..Hα-helixtrans-59.5-46.5174.5-58.50000111.6G110 C113 S114 L125 L127 C131 Y132 F133 L195G110-T129 VanDerWaalsContact O-CG2 3.32Å; G110-T129 WeakPolarHBondContact O-CG2 3.19Å; C113-T129 WeakPolarHBondContact CB-OG1 3.48Å; S114-T129 VanDerWaalsContact CB-CG2 3.49Å; L125-T129 VanDerWaalsContact O-CB 3.27Å; L125-T129 WeakPolarHBondContact O-CB 3.31Å; L125-T129 PolarHBondContact O-N 3.25Å; L125-T129 PolarHBondContact O-OG1 2.99Å; L127-T129 VanDerWaalsContact C-N 3.33Å; L127-T129 PolarHBondContact O-N 3.4Å; T129-C131 VanDerWaalsContact C-N 3.31Å; T129-C131 PolarHBondContact O-N 2.87Å; T129-Y132 PolarHBondContact O-N 2.73Å; T129-F133 HydrophobicContact CG2-CD2 3.96Å; T129-F133 HydrophobicContact CG2-CE2 3.66Å; T129-F133 VanDerWaalsContact O-CD2 3.28Å; T129-F133 WeakPolarHBondContact O-CD2 3.39Å; T129-F133 PolarHBondContact O-N 3.33Å; T129-F133 VanDerWaalsContact O-N 3.14Å; T129-L195 HydrophobicContact CG2-CD1 3.59Å
130G89.4Confident88.2Confident0 Ų048 Ų480%027%0.268CS..Hα-helixtrans-59.5-40.8176.200000112.6L126 L127 F128 F133 L134L126-G130 PolarHBondContact O-N 3.49Å; L127-G130 PolarHBondContact O-N 3.47Å; F128-G130 PolarHBondContact O-N 3.23Å; G130-F133 PolarHBondContact O-N 3.33Å; G130-L134 WeakPolarHBondContact O-CG 3.44Å; G130-L134 PolarHBondContact O-N 3.37Å
131C89.9Confident88.5Confident64 Ų6447.2 Ų47.243%0.43226%0.256SS..Hα-helixtrans-62.6-41.1175-68.40000112.4L127 F128 T129 L134 L135L127-C131 PolarHBondContact O-N 2.81Å; L127-C131 PolarHBondContact O-SG 3.18Å; L127-C131 VanDerWaalsContact O-SG 3.34Å; F128-C131 WeakPolarHBondContact O-CB 3.35Å; F128-C131 PolarHBondContact O-N 2.82Å; T129-C131 VanDerWaalsContact C-N 3.31Å; T129-C131 PolarHBondContact O-N 2.87Å; C131-L134 PolarHBondContact O-N 2.81Å; C131-L135 WeakPolarHBondContact O-CB 3.12Å; C131-L135 VanDerWaalsContact O-CG 3.3Å; C131-L135 WeakPolarHBondContact O-CG 3.41Å; C131-L135 PolarHBondContact O-N 2.84Å
132Y90Very high88.9Confident62 Ų6243.6 Ų43.624%0.24324%0.243CC..Hα-helixtrans-62-43.3176.1-82.9-51.3000112.9L106 F128 T129 L134 L135 G136L106-Y132 HydrophobicContact CD2-CD1 4Å; L106-Y132 HydrophobicContact CD2-CE1 4.06Å; F128-Y132 AromaticContact CD1-CD2 3.98Å; F128-Y132 HydrophobicContact CD1-CD2 3.98Å; F128-Y132 AromaticContact CD1-CE2 3.55Å; F128-Y132 HydrophobicContact CD1-CE2 3.55Å; F128-Y132 HydrophobicContact CD2-CE2 4.46Å; F128-Y132 AromaticContact CE1-CD2 3.92Å; F128-Y132 HydrophobicContact CE1-CD2 3.92Å; F128-Y132 AromaticContact CE1-CE2 3.02Å; F128-Y132 HydrophobicContact CE1-CE2 3.02Å; F128-Y132 AromaticContact CE1-CZ 3.62Å; F128-Y132 HydrophobicContact CE2-CE2 4Å; F128-Y132 HydrophobicContact CG-CD2 4.48Å; F128-Y132 HydrophobicContact CG-CE2 4.27Å; F128-Y132 HydrophobicContact CZ-CD2 4.28Å; F128-Y132 HydrophobicContact CZ-CE1 4.45Å; F128-Y132 AromaticContact CZ-CE2 3.28Å; F128-Y132 HydrophobicContact CZ-CE2 3.28Å; F128-Y132 AromaticContact CZ-CZ 3.35Å; F128-Y132 WeakPolarHBondContact CZ-OH 3.49Å; F128-Y132 PolarHBondContact O-N 3.13Å; T129-Y132 PolarHBondContact O-N 2.73Å; Y132-L134 VanDerWaalsContact C-N 3.34Å; Y132-L134 PolarHBondContact O-N 2.69Å; Y132-L135 PolarHBondContact O-N 3.38Å; Y132-G136 PolarHBondContact O-N 2.98Å
133F89.6Confident89Confident1 Ų142.2 Ų42.20%0.00423%0.233CC..Hα-helixtrans-62.8-40.2175.6-78.6-66.5000112.2A15 L107 T129 G130 G136 G137 L195A15-F133 HydrophobicContact CB-CE1 3.61Å; A15-F133 HydrophobicContact CB-CE2 4.32Å; A15-F133 HydrophobicContact CB-CZ 3.43Å; A15-F133 VanDerWaalsContact CB-CZ 3.43Å; L107-F133 HydrophobicContact CD1-CD1 4.04Å; L107-F133 HydrophobicContact CD1-CE1 4.2Å; L107-F133 HydrophobicContact CG-CD1 4.31Å; L107-F133 HydrophobicContact CG-CE1 3.99Å; T129-F133 HydrophobicContact CG2-CD2 3.96Å; T129-F133 HydrophobicContact CG2-CE2 3.66Å; T129-F133 VanDerWaalsContact O-CD2 3.28Å; T129-F133 WeakPolarHBondContact O-CD2 3.39Å; T129-F133 PolarHBondContact O-N 3.33Å; T129-F133 VanDerWaalsContact O-N 3.14Å; G130-F133 PolarHBondContact O-N 3.33Å; F133-G136 PolarHBondContact O-N 3.35Å; F133-G137 PolarHBondContact O-N 3.09Å; F133-L195 HydrophobicContact CD2-CD1 3.67Å; F133-L195 HydrophobicContact CE2-CD1 3.79Å
134L90.8Very high88.9Confident74 Ų7441.8 Ų41.839%0.38723%0.229SC..Hα-helixtrans-67.2-41.2176-68.3176.1000112.5G130 C131 Y132 G137 V138 L196G130-L134 WeakPolarHBondContact O-CG 3.44Å; G130-L134 PolarHBondContact O-N 3.37Å; C131-L134 PolarHBondContact O-N 2.81Å; Y132-L134 VanDerWaalsContact C-N 3.34Å; Y132-L134 PolarHBondContact O-N 2.69Å; L134-G137 PolarHBondContact O-N 3.02Å; L134-V138 WeakPolarHBondContact O-CG2 3.36Å; L134-V138 PolarHBondContact O-N 2.87Å; L134-L196 HydrophobicContact CD1-CD1 4.11Å
135L90.9Very high88.9Confident97 Ų9739.9 Ų39.951%0.50822%0.218SC..Hα-helixtrans-63.9-42.3175.3-74.6168.7000111.5C131 Y132 G137 V138 L139C131-L135 WeakPolarHBondContact O-CB 3.12Å; C131-L135 VanDerWaalsContact O-CG 3.3Å; C131-L135 WeakPolarHBondContact O-CG 3.41Å; C131-L135 PolarHBondContact O-N 2.84Å; Y132-L135 PolarHBondContact O-N 3.38Å; L135-G137 VanDerWaalsContact C-N 3.3Å; L135-G137 PolarHBondContact O-N 3.48Å; L135-V138 PolarHBondContact O-N 2.57Å; L135-L139 WeakPolarHBondContact O-CG 3.44Å; L135-L139 PolarHBondContact O-N 2.77Å
136G89.7Confident88.8Confident0 Ų038.4 Ų38.40%021%0.21CC..Hα-helixtrans-53.5-48169.900000111.3Y132 F133 V138 L139 T140 E188Y132-G136 PolarHBondContact O-N 2.98Å; F133-G136 PolarHBondContact O-N 3.35Å; G136-V138 VanDerWaalsContact C-N 3.35Å; G136-V138 PolarHBondContact O-N 2.94Å; G136-L139 PolarHBondContact O-N 3.3Å; G136-L139 VanDerWaalsContact O-N 3.13Å; G136-T140 WeakPolarHBondContact O-CG2 3.5Å; G136-T140 PolarHBondContact O-N 3.37Å; G136-T140 PolarHBondContact O-OG1 3.24Å; G136-E188 VanDerWaalsContact C-OE2 3.24Å
137G89.4Confident88.4Confident8 Ų839.3 Ų39.38%0.08221%0.213CC..Hα-helixtrans-64.4-33.4179.400000114.8F133 L134 L135 T140 L141 E188F133-G137 PolarHBondContact O-N 3.09Å; L134-G137 PolarHBondContact O-N 3.02Å; L135-G137 VanDerWaalsContact C-N 3.3Å; L135-G137 PolarHBondContact O-N 3.48Å; G137-T140 WeakPolarHBondContact CA-OG1 3.28Å; G137-T140 PolarHBondContact O-OG1 3.49Å; G137-L141 WeakPolarHBondContact O-CB 3.44Å; G137-L141 PolarHBondContact O-N 2.7Å; G137-L141 VanDerWaalsContact O-N 3.11Å; G137-E188 WeakPolarHBondContact CA-OE2 3.45Å; G137-E188 PolarHBondContact N-OE2 3.07Å
138V91.9Very high87.9Confident87 Ų8739.9 Ų39.953%0.52722%0.216SC..Hα-helixtrans-73.8-38.2174173.90000110.6L134 L135 G136 L141 T142L134-V138 WeakPolarHBondContact O-CG2 3.36Å; L134-V138 PolarHBondContact O-N 2.87Å; L135-V138 PolarHBondContact O-N 2.57Å; G136-V138 VanDerWaalsContact C-N 3.35Å; G136-V138 PolarHBondContact O-N 2.94Å; V138-L141 PolarHBondContact O-N 2.84Å; V138-T142 VanDerWaalsContact O-CB 3.3Å; V138-T142 WeakPolarHBondContact O-CB 3.3Å; V138-T142 PolarHBondContact O-N 3.05Å; V138-T142 PolarHBondContact O-OG1 3.11Å
139L90Very high87.5Confident43 Ų4338 Ų3823%0.22522%0.215CC..Hα-helixtrans-69-42.8176.9-75.7164.4000111.9V99 L106 L135 G136 L141 T142 G143V99-L139 HydrophobicContact CG1-CB 4.25Å; V99-L139 HydrophobicContact CG1-CD2 4.16Å; V99-L139 WeakPolarHBondContact CG1-O 3.13Å; L106-L139 HydrophobicContact CD1-CD1 3.21Å; L135-L139 WeakPolarHBondContact O-CG 3.44Å; L135-L139 PolarHBondContact O-N 2.77Å; G136-L139 PolarHBondContact O-N 3.3Å; G136-L139 VanDerWaalsContact O-N 3.13Å; L139-L141 VanDerWaalsContact C-N 3.35Å; L139-L141 PolarHBondContact O-N 3.45Å; L139-T142 PolarHBondContact O-N 2.84Å; L139-G143 PolarHBondContact O-N 2.94Å
140T88.4Confident86.8Confident2 Ų240.3 Ų40.31%0.01222%0.224CC..Hα-helixtrans-59.6-46.9172.853.10000110.4L22 S103 G136 G137 T142 G143 V144L22-T140 HydrophobicContact CD1-CG2 3.72Å; L22-T140 HydrophobicContact CD2-CG2 3.79Å; L22-T140 HydrophobicContact CG-CG2 4.43Å; S103-T140 VanDerWaalsContact OG-CG2 3.29Å; S103-T140 WeakPolarHBondContact OG-CG2 3.29Å; G136-T140 WeakPolarHBondContact O-CG2 3.5Å; G136-T140 PolarHBondContact O-N 3.37Å; G136-T140 PolarHBondContact O-OG1 3.24Å; G137-T140 WeakPolarHBondContact CA-OG1 3.28Å; G137-T140 PolarHBondContact O-OG1 3.49Å; T140-T142 VanDerWaalsContact C-N 3.31Å; T140-T142 PolarHBondContact O-N 2.85Å; T140-G143 PolarHBondContact O-N 3.5Å; T140-V144 VanDerWaalsContact O-CB 3.28Å; T140-V144 WeakPolarHBondContact O-CB 3.43Å; T140-V144 WeakPolarHBondContact O-CG2 3.33Å; T140-V144 PolarHBondContact O-N 3.19Å
141L89.8Confident85.9Confident46 Ų4641.8 Ų41.824%0.24124%0.235CC..Hα-helixtrans-58-43174.2-178.166.1000112.5G137 V138 L139 V144 S145G137-L141 WeakPolarHBondContact O-CB 3.44Å; G137-L141 PolarHBondContact O-N 2.7Å; G137-L141 VanDerWaalsContact O-N 3.11Å; V138-L141 PolarHBondContact O-N 2.84Å; L139-L141 VanDerWaalsContact C-N 3.35Å; L139-L141 PolarHBondContact O-N 3.45Å; L141-V144 PolarHBondContact O-N 3.34Å; L141-S145 WeakPolarHBondContact O-CB 3.5Å; L141-S145 PolarHBondContact O-N 3.49Å; L141-S145 PolarHBondContact O-OG 2.87Å
142T90.8Very high85Confident58 Ų5845.5 Ų45.536%0.35625%0.245SC..Hα-helixtrans-64.5-48.3-179.7-600000110.1V138 L139 T140 V144 S145 I146V138-T142 VanDerWaalsContact O-CB 3.3Å; V138-T142 WeakPolarHBondContact O-CB 3.3Å; V138-T142 PolarHBondContact O-N 3.05Å; V138-T142 PolarHBondContact O-OG1 3.11Å; L139-T142 PolarHBondContact O-N 2.84Å; T140-T142 VanDerWaalsContact C-N 3.31Å; T140-T142 PolarHBondContact O-N 2.85Å; T142-V144 VanDerWaalsContact C-N 3.31Å; T142-V144 PolarHBondContact O-N 2.94Å; T142-S145 PolarHBondContact O-N 3.12Å; T142-I146 HydrophobicContact CG2-CD1 3.77Å; T142-I146 HydrophobicContact CG2-CG1 4.41Å; T142-I146 WeakPolarHBondContact O-CB 3.42Å; T142-I146 WeakPolarHBondContact O-CG1 3.09Å; T142-I146 PolarHBondContact O-N 2.68Å
143G85.6Confident84.1Confident0 Ų046 Ų460%025%0.252CS..Hα-helixtrans-58.7-42.9175.200000112.3L139 T140 Y147L139-G143 PolarHBondContact O-N 2.94Å; T140-G143 PolarHBondContact O-N 3.5Å; G143-Y147 VanDerWaalsContact O-CB 3.3Å; G143-Y147 WeakPolarHBondContact O-CB 2.78Å; G143-Y147 PolarHBondContact O-N 3.18Å
144V84.1Confident83Confident6 Ų647 Ų474%0.03626%0.26CS..Hα-helixtrans-64.8-40.2176.21710000112.1T140 L141 T142 Y147 I148 M178 A181T140-V144 VanDerWaalsContact O-CB 3.28Å; T140-V144 WeakPolarHBondContact O-CB 3.43Å; T140-V144 WeakPolarHBondContact O-CG2 3.33Å; T140-V144 PolarHBondContact O-N 3.19Å; L141-V144 PolarHBondContact O-N 3.34Å; T142-V144 VanDerWaalsContact C-N 3.31Å; T142-V144 PolarHBondContact O-N 2.94Å; V144-Y147 WeakPolarHBondContact O-CB 2.81Å; V144-Y147 PolarHBondContact O-N 3.21Å; V144-I148 WeakPolarHBondContact O-CG1 3.3Å; V144-I148 PolarHBondContact O-N 3.35Å; V144-M178 HydrophobicContact CB-CE 4.48Å; V144-M178 HydrophobicContact CG1-CE 3.07Å; V144-M178 HydrophobicContact CG1-CG 4.4Å; V144-M178 HydrophobicContact CG1-SD 3.94Å; V144-A181 HydrophobicContact CG2-CB 3.95Å
145S85.4Confident81.9Confident52 Ų5246.4 Ų46.436%0.36426%0.255SS..Hα-helixtrans-70.6-40.9179.4-56.80000112.4L141 T142 Y147 I148 S149L141-S145 WeakPolarHBondContact O-CB 3.5Å; L141-S145 PolarHBondContact O-N 3.49Å; L141-S145 PolarHBondContact O-OG 2.87Å; T142-S145 PolarHBondContact O-N 3.12Å; S145-Y147 VanDerWaalsContact C-N 3.27Å; S145-Y147 PolarHBondContact O-N 3.41Å; S145-I148 PolarHBondContact O-N 3.4Å; S145-S149 PolarHBondContact O-N 2.64Å; S145-S149 VanDerWaalsContact O-N 3.09Å; S145-S149 PolarHBondContact O-OG 3.41Å
146I83.9Confident80.7Confident36 Ų3644.1 Ų44.119%0.18525%0.249CC..Hα-helixtrans-59.4-43.3171.3-71.4173.4000109.3L92 A95 V96 T142 S149 Y150L92-I146 HydrophobicContact CD1-CB 4.41Å; L92-I146 HydrophobicContact CD1-CG2 3.53Å; L92-I146 HydrophobicContact CG-CG2 3.57Å; L92-I146 WeakPolarHBondContact O-CG2 3.4Å; A95-I146 HydrophobicContact CB-CD1 4.35Å; A95-I146 HydrophobicContact CB-CG2 4.28Å; V96-I146 HydrophobicContact CG2-CB 4.12Å; V96-I146 HydrophobicContact CG2-CG2 3.42Å; V96-I146 VanDerWaalsContact CG2-CG2 3.42Å; T142-I146 HydrophobicContact CG2-CD1 3.77Å; T142-I146 HydrophobicContact CG2-CG1 4.41Å; T142-I146 WeakPolarHBondContact O-CB 3.42Å; T142-I146 WeakPolarHBondContact O-CG1 3.09Å; T142-I146 PolarHBondContact O-N 2.68Å; I146-S149 PolarHBondContact O-N 3.18Å; I146-Y150 WeakPolarHBondContact O-CB 3.3Å; I146-Y150 PolarHBondContact O-N 3.38Å
147Y77.5Confident79.5Confident22 Ų2247 Ų479%0.08626%0.263CS..Hα-helixtrans-62.3-44.6177.3-177.7-95000113.2W31 V96 G143 V144 S145 S149 Y150 S151 M178W31-Y147 HydrophobicContact CB-CE1 4.47Å; W31-Y147 HydrophobicContact CB-CE2 4.07Å; W31-Y147 WeakPolarHBondContact CB-OH 3.27Å; W31-Y147 HydrophobicContact CD2-CE2 4.35Å; W31-Y147 AromaticContact CE3-CD1 3.68Å; W31-Y147 HydrophobicContact CE3-CD1 3.68Å; W31-Y147 AromaticContact CE3-CD2 3.66Å; W31-Y147 HydrophobicContact CE3-CD2 3.66Å; W31-Y147 AromaticContact CE3-CE1 3.72Å; W31-Y147 HydrophobicContact CE3-CE1 3.72Å; W31-Y147 AromaticContact CE3-CE2 3.69Å; W31-Y147 HydrophobicContact CE3-CE2 3.69Å; W31-Y147 AromaticContact CE3-CG 3.68Å; W31-Y147 HydrophobicContact CE3-CG 3.68Å; W31-Y147 AromaticContact CE3-CZ 3.75Å; W31-Y147 AromaticContact CZ3-CD1 3.96Å; W31-Y147 HydrophobicContact CZ3-CD1 3.96Å; W31-Y147 HydrophobicContact CZ3-CD2 4.08Å; W31-Y147 HydrophobicContact CZ3-CE1 4.45Å; W31-Y147 AromaticContact CZ3-CG 3.79Å; W31-Y147 HydrophobicContact CZ3-CG 3.79Å; W31-Y147 PolarHBondContact O-OH 3.4Å; W31-Y147 VanDerWaalsContact O-OH 3.05Å; V96-Y147 HydrophobicContact CG1-CD2 4.35Å; G143-Y147 VanDerWaalsContact O-CB 3.3Å; G143-Y147 WeakPolarHBondContact O-CB 2.78Å; G143-Y147 PolarHBondContact O-N 3.18Å; V144-Y147 WeakPolarHBondContact O-CB 2.81Å; V144-Y147 PolarHBondContact O-N 3.21Å; S145-Y147 VanDerWaalsContact C-N 3.27Å; S145-Y147 PolarHBondContact O-N 3.41Å; Y147-S149 VanDerWaalsContact C-N 3.3Å; Y147-S149 PolarHBondContact O-N 3.4Å; Y147-Y150 WeakPolarHBondContact O-CB 3.4Å; Y147-Y150 PolarHBondContact O-N 2.97Å; Y147-S151 PolarHBondContact O-N 3.28Å; Y147-M178 HydrophobicContact CD1-SD 4.35Å
148I79.2Confident78.1Confident77 Ų7749.9 Ų49.940%0.39528%0.279SS..Hα-helixtrans-58-46.5174.1-64.4165.9000110.2V144 S145 Y150 S151 H152 M178V144-I148 WeakPolarHBondContact O-CG1 3.3Å; V144-I148 PolarHBondContact O-N 3.35Å; S145-I148 PolarHBondContact O-N 3.4Å; I148-Y150 VanDerWaalsContact C-N 3.31Å; I148-Y150 PolarHBondContact O-N 2.91Å; I148-S151 PolarHBondContact O-N 3.5Å; I148-S151 PolarHBondContact O-OG 3.09Å; I148-H152 PolarHBondContact O-N 3.08Å; I148-H152 VanDerWaalsContact O-N 3.12Å; I148-M178 HydrophobicContact CD1-CE 3.46Å; I148-M178 VanDerWaalsContact CD1-CE 3.46Å; I148-M178 HydrophobicContact CG1-CE 3.48Å; I148-M178 VanDerWaalsContact CG1-CE 3.48Å; I148-M178 HydrophobicContact CG1-SD 4.45Å
149S80.2Confident76.7Confident62 Ų6247 Ų4743%0.43426%0.264SS..Hα-helixtrans-62.8-40.3-178.5-560000111.6S145 I146 Y147 H152 L153S145-S149 PolarHBondContact O-N 2.64Å; S145-S149 VanDerWaalsContact O-N 3.09Å; S145-S149 PolarHBondContact O-OG 3.41Å; I146-S149 PolarHBondContact O-N 3.18Å; Y147-S149 VanDerWaalsContact C-N 3.3Å; Y147-S149 PolarHBondContact O-N 3.4Å; S149-H152 PolarHBondContact O-N 3.01Å; S149-L153 WeakPolarHBondContact O-CD1 3.5Å; S149-L153 WeakPolarHBondContact O-CG 3.5Å; S149-L153 PolarHBondContact O-N 2.94Å
150Y75.4Confident75.2Confident49 Ų4955 Ų5519%0.19229%0.292CS..Hα-helixtrans-59.1-48.7173.1169.8-93.8000111.5L89 L92 H93 I146 Y147 I148 H152 L153 A154L89-Y150 HydrophobicContact CB-CE2 4.33Å; L89-Y150 HydrophobicContact CD1-CD2 4.19Å; L89-Y150 HydrophobicContact CD1-CE2 4.42Å; L89-Y150 HydrophobicContact CD2-CE2 3.96Å; L89-Y150 HydrophobicContact CG-CD2 3.72Å; L89-Y150 HydrophobicContact CG-CE2 3.52Å; L89-Y150 WeakPolarHBondContact O-CD2 3.41Å; L89-Y150 WeakPolarHBondContact O-CE2 3.49Å; L92-Y150 HydrophobicContact CB-CD2 4.39Å; L92-Y150 VanDerWaalsContact CD2-CA 3.45Å; L92-Y150 VanDerWaalsContact CD2-N 3.3Å; H93-Y150 HydrophobicContact CB-CD2 4.22Å; H93-Y150 HydrophobicContact CB-CE2 3.87Å; I146-Y150 WeakPolarHBondContact O-CB 3.3Å; I146-Y150 PolarHBondContact O-N 3.38Å; Y147-Y150 WeakPolarHBondContact O-CB 3.4Å; Y147-Y150 PolarHBondContact O-N 2.97Å; I148-Y150 VanDerWaalsContact C-N 3.31Å; I148-Y150 PolarHBondContact O-N 2.91Å; Y150-H152 VanDerWaalsContact C-N 3.32Å; Y150-H152 PolarHBondContact O-N 3.34Å; Y150-L153 PolarHBondContact O-N 3.46Å; Y150-A154 WeakPolarHBondContact O-CB 3.43Å; Y150-A154 PolarHBondContact O-N 2.92Å
151S70.7Confident73.6Confident31 Ų3162.3 Ų62.322%0.21733%0.325CS..Hα-helixtrans-61.2-39.2-177.672.90000112.8Y147 I148 A154 F155Y147-S151 PolarHBondContact O-N 3.28Å; I148-S151 PolarHBondContact O-N 3.5Å; I148-S151 PolarHBondContact O-OG 3.09Å; S151-A154 PolarHBondContact O-N 2.95Å; S151-F155 WeakPolarHBondContact O-CB 3.19Å; S151-F155 PolarHBondContact O-N 3.26Å
152H71.1Confident71.8Confident142 Ų14269.1 Ų69.166%0.65735%0.349SS*.Hα-helixtrans-68.2-39.1179.5-170-83.8000112I148 S149 Y150 A156I148-H152 PolarHBondContact O-N 3.08Å; I148-H152 VanDerWaalsContact O-N 3.12Å; S149-H152 PolarHBondContact O-N 3.01Å; Y150-H152 VanDerWaalsContact C-N 3.32Å; Y150-H152 PolarHBondContact O-N 3.34Å; H152-A156 WeakPolarHBondContact O-CB 3.39Å; H152-A156 PolarHBondContact O-N 3.22Å
153L71.7Confident69.8Low73 Ų7367.4 Ų67.438%0.38234%0.344SS..Hα-helixtrans-69.4-42.1176.4-72.7162.4000111.7L89 L92 S149 Y150 F155 A156 E157L89-L153 HydrophobicContact CD1-CB 3.34Å; L89-L153 HydrophobicContact CD1-CD1 4.31Å; L89-L153 HydrophobicContact CD1-CG 4.44Å; L92-L153 HydrophobicContact CD2-CD1 4.27Å; S149-L153 WeakPolarHBondContact O-CD1 3.5Å; S149-L153 WeakPolarHBondContact O-CG 3.5Å; S149-L153 PolarHBondContact O-N 2.94Å; Y150-L153 PolarHBondContact O-N 3.46Å; L153-F155 VanDerWaalsContact C-N 3.31Å; L153-F155 PolarHBondContact O-N 3.09Å; L153-A156 PolarHBondContact O-N 3.28Å; L153-E157 PolarHBondContact O-N 3.24Å; L153-E157 VanDerWaalsContact O-N 3.11Å
154A66.8Low68.1Low21 Ų2172.5 Ų72.517%0.17438%0.377CS..Hα-helixtrans-61.9-39.4176.600000111.9L89 Y150 S151 T158L89-A154 HydrophobicContact CD2-CB 4.08Å; Y150-A154 WeakPolarHBondContact O-CB 3.43Å; Y150-A154 PolarHBondContact O-N 2.92Å; S151-A154 PolarHBondContact O-N 2.95Å; A154-T158 PolarHBondContact O-N 3.12Å; A154-T158 VanDerWaalsContact O-N 3.15Å; A154-T158 PolarHBondContact O-OG1 3.37Å
155F67Low66.1Low63 Ų6380.9 Ų80.928%0.27642%0.415SS..Hα-helixtrans-67.6-40175.3-169.9-96.3000112.4S151 L153 E157 T158 A159 V170S151-F155 WeakPolarHBondContact O-CB 3.19Å; S151-F155 PolarHBondContact O-N 3.26Å; L153-F155 VanDerWaalsContact C-N 3.31Å; L153-F155 PolarHBondContact O-N 3.09Å; F155-E157 VanDerWaalsContact C-N 3.33Å; F155-E157 PolarHBondContact O-N 2.92Å; F155-T158 VanDerWaalsContact CA-OG1 3.3Å; F155-T158 WeakPolarHBondContact CA-OG1 3.3Å; F155-T158 PolarHBondContact O-N 3.33Å; F155-T158 PolarHBondContact O-OG1 3.19Å; F155-A159 VanDerWaalsContact O-CB 3.27Å; F155-A159 WeakPolarHBondContact O-CB 3.47Å; F155-A159 PolarHBondContact O-N 2.9Å; F155-V170 HydrophobicContact CE2-CB 4.41Å; F155-V170 HydrophobicContact CE2-CG1 4.14Å
156A67.1Low64.3Low48 Ų4885 Ų8540%0.39743%0.429SS..Hα-helixtrans-64-37.7178.400000112.6H152 L153 R160H152-A156 WeakPolarHBondContact O-CB 3.39Å; H152-A156 PolarHBondContact O-N 3.22Å; L153-A156 PolarHBondContact O-N 3.28Å; A156-R160 PolarHBondContact O-N 3.28Å
157E64.6Low62.5Low61 Ų6185.3 Ų85.329%0.28543%0.432SS..Hα-helixtrans-70.8-44.8177.6-159.868.9-114.500111.2S85 L153 F155 A159 R160 Q161S85-E157 PolarHBondContact OG-OE2 3.01Å; L153-E157 PolarHBondContact O-N 3.24Å; L153-E157 VanDerWaalsContact O-N 3.11Å; F155-E157 VanDerWaalsContact C-N 3.33Å; F155-E157 PolarHBondContact O-N 2.92Å; E157-A159 VanDerWaalsContact C-N 3.35Å; E157-A159 PolarHBondContact O-N 3.11Å; E157-R160 PolarHBondContact O-N 2.79Å; E157-Q161 PolarHBondContact O-N 3.39Å; E157-Q161 VanDerWaalsContact O-N 3.11Å
158T59.7Low60.6Low69 Ų6993.2 Ų93.242%0.42347%0.47SS..Hα-helixtrans-63.1-38.4175.437.60000112.6A154 F155 R160 Q161 Y162A154-T158 PolarHBondContact O-N 3.12Å; A154-T158 VanDerWaalsContact O-N 3.15Å; A154-T158 PolarHBondContact O-OG1 3.37Å; F155-T158 VanDerWaalsContact CA-OG1 3.3Å; F155-T158 WeakPolarHBondContact CA-OG1 3.3Å; F155-T158 PolarHBondContact O-N 3.33Å; F155-T158 PolarHBondContact O-OG1 3.19Å; T158-R160 VanDerWaalsContact C-N 3.33Å; T158-R160 PolarHBondContact O-N 3.03Å; T158-Q161 PolarHBondContact O-N 3Å; T158-Y162 PolarHBondContact O-N 3.02Å; T158-Y162 VanDerWaalsContact O-N 3.08Å
159A61Low58.8Low26 Ų2690.7 Ų90.722%0.21546%0.463CS..Hα-helixtrans-64.5-3417500000113.2F155 E157 G163 V167F155-A159 VanDerWaalsContact O-CB 3.27Å; F155-A159 WeakPolarHBondContact O-CB 3.47Å; F155-A159 PolarHBondContact O-N 2.9Å; E157-A159 VanDerWaalsContact C-N 3.35Å; E157-A159 PolarHBondContact O-N 3.11Å; A159-G163 PolarHBondContact O-N 3.29Å; A159-V167 HydrophobicContact CB-CG1 4.24Å
160R58.7Low57Low212 Ų21289.2 Ų89.280%0.845%0.451SS*.Hα-helixtrans-69.4-36.8173.5-89.7-163.3176.3148.70.2112.7A156 E157 T158A156-R160 PolarHBondContact O-N 3.28Å; E157-R160 PolarHBondContact O-N 2.79Å; T158-R160 VanDerWaalsContact C-N 3.33Å; T158-R160 PolarHBondContact O-N 3.03Å
161Q54.9Low55.4Low154 Ų15496.4 Ų96.472%0.7248%0.478SS*.Hα-helixtrans-81.3-32.1-172-149146.9-1500113E157 T158E157-Q161 PolarHBondContact O-N 3.39Å; E157-Q161 VanDerWaalsContact O-N 3.11Å; T158-Q161 PolarHBondContact O-N 3Å
162Y52.9Low54.2Low189 Ų18999.2 Ų99.274%0.74149%0.494SS*.Hα-helixtrans-101.9-4.5-179.5-77.3-87.5000115.1T158T158-Y162 PolarHBondContact O-N 3.02Å; T158-Y162 VanDerWaalsContact O-N 3.08Å
163G48.6Very low53.4Low23 Ų2394.2 Ų94.224%0.23748%0.475CS..  trans78.8151.1176.100000114.4A159 Q165A159-G163 PolarHBondContact O-N 3.29Å; G163-Q165 PolarHBondContact O-N 2.97Å
164P49.3Very low52.7Low107 Ų10797 Ų9770%0.69548%0.484SS*.THydrogen-bonded Turntrans-67.3-4.5-168.925.8-34.7000115.5V167P164-V167 WeakPolarHBondContact O-CG2 3.44Å
165Q42.9Very low52.6Low182 Ų18296.3 Ų96.385%0.8548%0.478SS*.THydrogen-bonded Turntrans-87.6-20.2-175.1-68.3-165.7-14.900114.4G163G163-Q165 PolarHBondContact O-N 2.97Å
166H47.4Very low52.7Low138 Ų138102.3 Ų102.364%0.63950%0.499SS*.SBendtrans-97.7-8.1176.4-94.578.8000114.2
167V46.6Very low53.1Low43 Ų43100 Ų10026%0.26148%0.48SS..G310 helixtrans-94-3.6-175.4-72.50000114.3A159 P164 G169A159-V167 HydrophobicContact CB-CG1 4.24Å; P164-V167 WeakPolarHBondContact O-CG2 3.44Å; V167-G169 PolarHBondContact O-N 2.77Å
168Q38Very low53.8Low187 Ų18797.4 Ų97.487%0.87447%0.468SS*.G310 helixtrans-72.7-10.4177.4-74.5-154.2-23.100114.1
169G39.7Very low54.8Low25 Ų2596.7 Ų96.726%0.25847%0.469SS..G310 helixtrans-101.5-9.6176.900000115.3A37 V167 R171A37-G169 WeakPolarHBondContact CA-O 3.36Å; A37-G169 WeakPolarHBondContact CB-O 3.47Å; A37-G169 PolarHBondContact N-O 2.95Å; A37-G169 VanDerWaalsContact N-O 3.11Å; V167-G169 PolarHBondContact O-N 2.77Å; G169-R171 PolarHBondContact O-N 3.22Å; G169-R171 VanDerWaalsContact O-N 3.09Å
170V43.8Very low55.9Low30 Ų3096.8 Ų96.818%0.18247%0.466CS..EExtended strand (participates in β ladder)trans-85100.2-169.7-174.80000110.1E35 F155E35-V170 WeakPolarHBondContact O-CA 3.47Å; F155-V170 HydrophobicContact CE2-CB 4.41Å; F155-V170 HydrophobicContact CE2-CG1 4.14Å
171R40.7Very low57.2Low200 Ų20086.8 Ų86.876%0.75543%0.428SS*.EExtended strand (participates in β ladder)trans-86.6111.9173.8-160.2-179.9-59.6-149.22.6107.7G169 S173G169-R171 PolarHBondContact O-N 3.22Å; G169-R171 VanDerWaalsContact O-N 3.09Å; R171-S173 PolarHBondContact O-N 3.41Å
172V46.7Very low58.7Low91 Ų9185.3 Ų85.355%0.55242%0.417SS*.EExtended strand (participates in β ladder)trans-75.195175.9-177.30000108.1
173S52.6Low60.3Low37 Ų3777.7 Ų77.726%0.25940%0.395SS..PPolyproline II helixtrans-77.5133.2168.557.30000109.6I33 R171I33-S173 WeakPolarHBondContact CG2-OG 3.34Å; R171-S173 PolarHBondContact O-N 3.41Å
174F57.1Low62.3Low130 Ų13076.6 Ų76.657%0.5738%0.384SS*.PPolyproline II helixtrans-75127.8179.6-158.9-103.7000110.3M178F174-M178 HydrophobicContact CD1-CB 3.83Å; F174-M178 HydrophobicContact CD1-CG 4.18Å; F174-M178 HydrophobicContact CE1-CB 3.36Å; F174-M178 HydrophobicContact CE1-CE 4.25Å; F174-M178 HydrophobicContact CE1-CG 3.23Å; F174-M178 HydrophobicContact CE1-SD 4.02Å; F174-M178 HydrophobicContact CE2-CE 3.73Å; F174-M178 HydrophobicContact CE2-CG 4.12Å; F174-M178 HydrophobicContact CE2-SD 3.78Å; F174-M178 HydrophobicContact CZ-CB 3.82Å; F174-M178 HydrophobicContact CZ-CE 3.27Å; F174-M178 HydrophobicContact CZ-CG 3.23Å; F174-M178 HydrophobicContact CZ-SD 3.42Å; F174-M178 WeakPolarHBondContact CZ-SD 3.46Å
175S66.6Low64.2Low7 Ų775.1 Ų75.15%0.04936%0.364CS..PPolyproline II helixtrans-76.3150.9-167.6-38.10000113.6Y30 W31 Y32 S177 M178 A179Y30-S175 WeakPolarHBondContact O-CB 3.19Å; W31-S175 WeakPolarHBondContact O-CB 3.36Å; W31-S175 PolarHBondContact O-OG 3.03Å; Y32-S175 PolarHBondContact N-OG 3.46Å; S175-S177 PolarHBondContact O-N 2.96Å; S175-M178 PolarHBondContact O-N 3.07Å; S175-A179 PolarHBondContact O-N 3.24Å
176W68.9Low66.5Low189 Ų18969.3 Ų69.372%0.71635%0.348SS*.Hα-helixtrans-54-37.7-179.8-174.6-101.4000112.5M178 A179 L180W176-M178 PolarHBondContact O-N 3.01Å; W176-A179 WeakPolarHBondContact O-CB 3.17Å; W176-A179 PolarHBondContact O-N 3.43Å; W176-A179 VanDerWaalsContact O-N 3.09Å; W176-L180 WeakPolarHBondContact O-CG 3.36Å; W176-L180 PolarHBondContact O-N 3.24Å
177S75.3Confident68.4Low0 Ų063.4 Ų63.40%032%0.322CS..Hα-helixtrans-60-32178.1-50.30000113.1S28 Y30 S175 L180 A181S28-S177 WeakPolarHBondContact CB-OG 3.49Å; S28-S177 VanDerWaalsContact OG-CB 3.3Å; S28-S177 WeakPolarHBondContact OG-CB 3.17Å; S28-S177 PolarHBondContact OG-OG 2.91Å; Y30-S177 VanDerWaalsContact C-OG 3.29Å; Y30-S177 VanDerWaalsContact O-CB 3.27Å; Y30-S177 WeakPolarHBondContact O-CB 3.21Å; Y30-S177 PolarHBondContact O-OG 3.39Å; S175-S177 PolarHBondContact O-N 2.96Å; S177-L180 PolarHBondContact O-N 3.15Å; S177-A181 WeakPolarHBondContact O-CB 3.3Å; S177-A181 PolarHBondContact O-N 3.45Å
178M77.7Confident70.6Confident6 Ų661.3 Ų61.33%0.0331%0.309CS..Hα-helixtrans-77.2-36177.1-163140.8160.700111.9V144 Y147 I148 F174 S175 W176 L180 A181 W182V144-M178 HydrophobicContact CB-CE 4.48Å; V144-M178 HydrophobicContact CG1-CE 3.07Å; V144-M178 HydrophobicContact CG1-CG 4.4Å; V144-M178 HydrophobicContact CG1-SD 3.94Å; Y147-M178 HydrophobicContact CD1-SD 4.35Å; I148-M178 HydrophobicContact CD1-CE 3.46Å; I148-M178 VanDerWaalsContact CD1-CE 3.46Å; I148-M178 HydrophobicContact CG1-CE 3.48Å; I148-M178 VanDerWaalsContact CG1-CE 3.48Å; I148-M178 HydrophobicContact CG1-SD 4.45Å; F174-M178 HydrophobicContact CD1-CB 3.83Å; F174-M178 HydrophobicContact CD1-CG 4.18Å; F174-M178 HydrophobicContact CE1-CB 3.36Å; F174-M178 HydrophobicContact CE1-CE 4.25Å; F174-M178 HydrophobicContact CE1-CG 3.23Å; F174-M178 HydrophobicContact CE1-SD 4.02Å; F174-M178 HydrophobicContact CE2-CE 3.73Å; F174-M178 HydrophobicContact CE2-CG 4.12Å; F174-M178 HydrophobicContact CE2-SD 3.78Å; F174-M178 HydrophobicContact CZ-CB 3.82Å; F174-M178 HydrophobicContact CZ-CE 3.27Å; F174-M178 HydrophobicContact CZ-CG 3.23Å; F174-M178 HydrophobicContact CZ-SD 3.42Å; F174-M178 WeakPolarHBondContact CZ-SD 3.46Å; S175-M178 PolarHBondContact O-N 3.07Å; W176-M178 PolarHBondContact O-N 3.01Å; M178-L180 VanDerWaalsContact C-N 3.27Å; M178-L180 PolarHBondContact O-N 3.35Å; M178-A181 PolarHBondContact O-N 3Å; M178-W182 VanDerWaalsContact O-CD1 3.22Å; M178-W182 PolarHBondContact O-N 3.19Å
179A82.4Confident73.1Confident55 Ų5554.5 Ų54.546%0.45529%0.285SS..Hα-helixtrans-59.5-41.3168.900000111.2S175 W176 W182 G183S175-A179 PolarHBondContact O-N 3.24Å; W176-A179 WeakPolarHBondContact O-CB 3.17Å; W176-A179 PolarHBondContact O-N 3.43Å; W176-A179 VanDerWaalsContact O-N 3.09Å; A179-W182 PolarHBondContact O-N 3.47Å; A179-G183 PolarHBondContact O-N 2.92Å
180L83.3Confident75.6Confident27 Ų2759.1 Ų59.114%0.14130%0.298CS..Hα-helixtrans-63-42.9174.1-62.9177000112.2L21 A24 A25 W176 S177 M178 G183 S184L21-L180 HydrophobicContact CD2-CD2 3.5Å; L21-L180 VanDerWaalsContact CD2-CD2 3.5Å; A24-L180 HydrophobicContact CB-CD1 4.02Å; A25-L180 HydrophobicContact CB-CB 4.12Å; W176-L180 WeakPolarHBondContact O-CG 3.36Å; W176-L180 PolarHBondContact O-N 3.24Å; S177-L180 PolarHBondContact O-N 3.15Å; M178-L180 VanDerWaalsContact C-N 3.27Å; M178-L180 PolarHBondContact O-N 3.35Å; L180-G183 PolarHBondContact O-N 3.22Å; L180-S184 PolarHBondContact O-N 2.86Å
181A85.6Confident77.9Confident2 Ų257.7 Ų57.72%0.01729%0.289CS..Hα-helixtrans-64-42.3177.400000112.5A25 V144 S177 M178 G183 S184 R185A25-A181 HydrophobicContact CB-CB 4.4Å; V144-A181 HydrophobicContact CG2-CB 3.95Å; S177-A181 WeakPolarHBondContact O-CB 3.3Å; S177-A181 PolarHBondContact O-N 3.45Å; M178-A181 PolarHBondContact O-N 3Å; A181-G183 VanDerWaalsContact C-N 3.34Å; A181-S184 PolarHBondContact O-N 3.11Å; A181-R185 WeakPolarHBondContact O-CB 3.37Å; A181-R185 PolarHBondContact O-N 3.4Å
182W86.2Confident80.2Confident124 Ų12448.1 Ų48.147%0.4725%0.253SS..Hα-helixtrans-63.3-40.7172.5-85.490.6000111.9M178 A179 R185 A186M178-W182 VanDerWaalsContact O-CD1 3.22Å; M178-W182 PolarHBondContact O-N 3.19Å; A179-W182 PolarHBondContact O-N 3.47Å; W182-R185 PolarHBondContact O-N 2.98Å; W182-A186 WeakPolarHBondContact O-CB 3.15Å; W182-A186 PolarHBondContact O-N 3.12Å
183G86.4Confident82.4Confident28 Ų2846.1 Ų46.129%0.28925%0.246SC..Hα-helixtrans-59.6-45.8173.500000112.3A179 L180 A181 R185 A186 S187A179-G183 PolarHBondContact O-N 2.92Å; L180-G183 PolarHBondContact O-N 3.22Å; A181-G183 VanDerWaalsContact C-N 3.34Å; G183-R185 PolarHBondContact O-N 3.18Å; G183-A186 PolarHBondContact O-N 3.49Å; G183-S187 PolarHBondContact O-N 3.44Å; G183-S187 PolarHBondContact O-OG 3.35Å; G183-S187 VanDerWaalsContact O-OG 3.12Å
184S90.9Very high84.3Confident0 Ų045.5 Ų45.50%024%0.24CC..Hα-helixtrans-59.7-47.7175.5-171.90000111.6S18 L22 L180 A181 A186 S187 E188S18-S184 PolarHBondContact O-OG 3.45Å; S18-S184 PolarHBondContact OG-OG 2.92Å; L22-S184 WeakPolarHBondContact CB-OG 3.37Å; L180-S184 PolarHBondContact O-N 2.86Å; A181-S184 PolarHBondContact O-N 3.11Å; S184-A186 VanDerWaalsContact C-N 3.27Å; S184-A186 PolarHBondContact O-N 3.24Å; S184-S187 WeakPolarHBondContact CA-OG 3.44Å; S184-S187 PolarHBondContact O-N 3.44Å; S184-S187 PolarHBondContact O-OG 3.14Å; S184-E188 WeakPolarHBondContact O-CB 3.43Å; S184-E188 VanDerWaalsContact O-CG 3.24Å; S184-E188 WeakPolarHBondContact O-CG 3.43Å; S184-E188 PolarHBondContact O-N 2.83Å; S184-E188 PolarHBondContact OG-OE1 3.02Å
185R88.7Confident85.8Confident77 Ų7739.4 Ų39.429%0.29121%0.213SC..Hα-helixtrans-62.6-35.7-179.4-172.1-92.5-167.7117.4-4.4112A181 W182 G183 A189A181-R185 WeakPolarHBondContact O-CB 3.37Å; A181-R185 PolarHBondContact O-N 3.4Å; W182-R185 PolarHBondContact O-N 2.98Å; G183-R185 PolarHBondContact O-N 3.18Å; R185-A189 WeakPolarHBondContact O-CB 3.37Å; R185-A189 PolarHBondContact O-N 3.24Å; R185-A189 VanDerWaalsContact O-N 3.15Å
186A91.4Very high86.9Confident60 Ų6041.6 Ų41.650%0.49622%0.224SC..Hα-helixtrans-68.9-43.5174.600000112.2W182 G183 S184 A189 F190W182-A186 WeakPolarHBondContact O-CB 3.15Å; W182-A186 PolarHBondContact O-N 3.12Å; G183-A186 PolarHBondContact O-N 3.49Å; S184-A186 VanDerWaalsContact C-N 3.27Å; S184-A186 PolarHBondContact O-N 3.24Å; A186-A189 PolarHBondContact O-N 3.28Å; A186-F190 WeakPolarHBondContact O-CB 3.07Å; A186-F190 PolarHBondContact O-N 3.08Å
187S88.6Confident87.9Confident13 Ų1335.4 Ų35.49%0.09121%0.21CC..Hα-helixtrans-70.5-30.717855.60000112.8S18 G183 S184 S191S18-S187 WeakPolarHBondContact CA-OG 3.43Å; S18-S187 WeakPolarHBondContact CB-OG 3.3Å; S18-S187 PolarHBondContact N-OG 2.96Å; G183-S187 PolarHBondContact O-N 3.44Å; G183-S187 PolarHBondContact O-OG 3.35Å; G183-S187 VanDerWaalsContact O-OG 3.12Å; S184-S187 WeakPolarHBondContact CA-OG 3.44Å; S184-S187 PolarHBondContact O-N 3.44Å; S184-S187 PolarHBondContact O-OG 3.14Å; S187-S191 VanDerWaalsContact O-CB 3.31Å; S187-S191 WeakPolarHBondContact O-CB 3.27Å; S187-S191 PolarHBondContact O-N 3.34Å; S187-S191 PolarHBondContact O-OG 3.05Å
188E92.2Very high88.5Confident0 Ų035.4 Ų35.40%021%0.21CC..Hα-helixtrans-61.3-51.5169.4-77.2164.7-137.700111.7S18 L107 G136 G137 S184 F190 S191 G192S18-E188 WeakPolarHBondContact OG-CG 3.49Å; S18-E188 PolarHBondContact OG-OE1 2.05Å; L107-E188 VanDerWaalsContact CD1-CD 3.4Å; L107-E188 HydrophobicContact CD1-CG 3.5Å; L107-E188 WeakPolarHBondContact CD1-OE1 3.49Å; G136-E188 VanDerWaalsContact C-OE2 3.24Å; G137-E188 WeakPolarHBondContact CA-OE2 3.45Å; G137-E188 PolarHBondContact N-OE2 3.07Å; S184-E188 WeakPolarHBondContact O-CB 3.43Å; S184-E188 VanDerWaalsContact O-CG 3.24Å; S184-E188 WeakPolarHBondContact O-CG 3.43Å; S184-E188 PolarHBondContact O-N 2.83Å; S184-E188 PolarHBondContact OG-OE1 3.02Å; E188-F190 VanDerWaalsContact C-N 3.32Å; E188-F190 PolarHBondContact O-N 3.24Å; E188-S191 PolarHBondContact O-N 3.07Å; E188-G192 PolarHBondContact O-N 3.22Å
189A91.1Very high89Confident44 Ų4435.1 Ų35.136%0.36421%0.208SC..Hα-helixtrans-61.5-42.3178.700000111.4R185 A186 A193R185-A189 WeakPolarHBondContact O-CB 3.37Å; R185-A189 PolarHBondContact O-N 3.24Å; R185-A189 VanDerWaalsContact O-N 3.15Å; A186-A189 PolarHBondContact O-N 3.28Å; A189-A193 VanDerWaalsContact O-CB 3.32Å; A189-A193 WeakPolarHBondContact O-CB 3.41Å; A189-A193 PolarHBondContact O-N 3.19Å
190F91.4Very high89.2Confident121 Ų12140.7 Ų40.753%0.53122%0.217SC..Hα-helixtrans-62.1-47.5176.2-175.8-105.9000111.7A186 E188 A193 L194A186-F190 WeakPolarHBondContact O-CB 3.07Å; A186-F190 PolarHBondContact O-N 3.08Å; E188-F190 VanDerWaalsContact C-N 3.32Å; E188-F190 PolarHBondContact O-N 3.24Å; F190-A193 PolarHBondContact O-N 3.11Å; F190-L194 HydrophobicContact CD1-CD1 3.78Å; F190-L194 HydrophobicContact CD1-CG 4.48Å; F190-L194 HydrophobicContact CE1-CD1 3.35Å; F190-L194 HydrophobicContact CE1-CG 4.22Å; F190-L194 HydrophobicContact CZ-CD1 3.77Å; F190-L194 HydrophobicContact CZ-CD2 4.45Å; F190-L194 HydrophobicContact CZ-CG 4.29Å; F190-L194 WeakPolarHBondContact O-CG 3.29Å; F190-L194 PolarHBondContact O-N 2.78Å
191S91.2Very high89.3Confident0 Ų042.3 Ų42.30%023%0.228CC..Hα-helixtrans-65.7-43179.9-54.20000112.1A11 G14 A15 S187 E188 A193 L194 L195A11-S191 PolarHBondContact O-OG 2.76Å; G14-S191 WeakPolarHBondContact CA-OG 3.21Å; A15-S191 PolarHBondContact N-OG 3.47Å; S187-S191 VanDerWaalsContact O-CB 3.31Å; S187-S191 WeakPolarHBondContact O-CB 3.27Å; S187-S191 PolarHBondContact O-N 3.34Å; S187-S191 PolarHBondContact O-OG 3.05Å; E188-S191 PolarHBondContact O-N 3.07Å; S191-A193 PolarHBondContact O-N 3.44Å; S191-L194 PolarHBondContact O-N 3.15Å; S191-L195 WeakPolarHBondContact O-CG 3.47Å; S191-L195 PolarHBondContact O-N 3.15Å
192G90.3Very high89.2Confident0 Ų043.7 Ų43.70%024%0.235CC..Hα-helixtrans-60.3-43.9174.500000112.3E188 L194 L195 L196E188-G192 PolarHBondContact O-N 3.22Å; G192-L194 PolarHBondContact O-N 2.98Å; G192-L195 PolarHBondContact O-N 3.49Å; G192-L196 VanDerWaalsContact O-CG 3.29Å; G192-L196 WeakPolarHBondContact O-CG 3.44Å; G192-L196 PolarHBondContact O-N 3.2Å
193A92.2Very high88.9Confident49 Ų4941.3 Ų41.341%0.40524%0.238SC..Hα-helixtrans-64-39.6176.700000112.6A189 F190 S191 S197A189-A193 VanDerWaalsContact O-CB 3.32Å; A189-A193 WeakPolarHBondContact O-CB 3.41Å; A189-A193 PolarHBondContact O-N 3.19Å; F190-A193 PolarHBondContact O-N 3.11Å; S191-A193 PolarHBondContact O-N 3.44Å; A193-S197 WeakPolarHBondContact O-CB 3.11Å; A193-S197 PolarHBondContact O-N 3.42Å; A193-S197 PolarHBondContact O-OG 3.09Å
194L91.9Very high88.4Confident24 Ų2446.9 Ų46.913%0.12626%0.26CS..Hα-helixtrans-64.8-42.1175.1-71.9176.8000112.1L7 A10 A11 F190 S191 G192 S197 A198L7-L194 HydrophobicContact CD2-CD2 3.71Å; A10-L194 HydrophobicContact CB-CD1 3.66Å; A11-L194 HydrophobicContact CB-CB 3.92Å; A11-L194 HydrophobicContact CB-CD1 4.33Å; F190-L194 HydrophobicContact CD1-CD1 3.78Å; F190-L194 HydrophobicContact CD1-CG 4.48Å; F190-L194 HydrophobicContact CE1-CD1 3.35Å; F190-L194 HydrophobicContact CE1-CG 4.22Å; F190-L194 HydrophobicContact CZ-CD1 3.77Å; F190-L194 HydrophobicContact CZ-CD2 4.45Å; F190-L194 HydrophobicContact CZ-CG 4.29Å; F190-L194 WeakPolarHBondContact O-CG 3.29Å; F190-L194 PolarHBondContact O-N 2.78Å; S191-L194 PolarHBondContact O-N 3.15Å; G192-L194 PolarHBondContact O-N 2.98Å; L194-S197 WeakPolarHBondContact O-CB 3.36Å; L194-S197 PolarHBondContact O-N 3.01Å; L194-A198 WeakPolarHBondContact O-CB 3.47Å; L194-A198 PolarHBondContact O-N 3.43Å
195L89.8Confident87.3Confident1 Ų150.5 Ų50.51%0.00529%0.285CS..Hα-helixtrans-65.6-41.7176.8-71.3169000112.3L8 A11 L126 T129 F133 S191 G192 S197 A198 A199L8-L195 HydrophobicContact CD2-CD2 4.12Å; A11-L195 HydrophobicContact CB-CD2 3.94Å; A11-L195 HydrophobicContact CB-CG 3.85Å; L126-L195 HydrophobicContact CD2-CD2 3.8Å; T129-L195 HydrophobicContact CG2-CD1 3.59Å; F133-L195 HydrophobicContact CD2-CD1 3.67Å; F133-L195 HydrophobicContact CE2-CD1 3.79Å; S191-L195 WeakPolarHBondContact O-CG 3.47Å; S191-L195 PolarHBondContact O-N 3.15Å; G192-L195 PolarHBondContact O-N 3.49Å; L195-S197 VanDerWaalsContact C-N 3.31Å; L195-S197 PolarHBondContact O-N 3.42Å; L195-A198 PolarHBondContact O-N 2.91Å; L195-A199 WeakPolarHBondContact O-CB 3.12Å; L195-A199 PolarHBondContact O-N 3.16Å
196L90.1Very high85.6Confident54 Ų5451.6 Ų51.628%0.28330%0.303SS..Hα-helixtrans-61.8-41.7173.3-71.1172.1000111L127 L134 G192 A199 R200L127-L196 HydrophobicContact CD2-CD2 3.62Å; L134-L196 HydrophobicContact CD1-CD1 4.11Å; G192-L196 VanDerWaalsContact O-CG 3.29Å; G192-L196 WeakPolarHBondContact O-CG 3.44Å; G192-L196 PolarHBondContact O-N 3.2Å; L196-A199 PolarHBondContact O-N 3.42Å; L196-R200 VanDerWaalsContact O-CG 3.31Å; L196-R200 WeakPolarHBondContact O-CG 3.1Å; L196-R200 PolarHBondContact O-N 3.28Å
197S88.4Confident83.7Confident59 Ų5954.3 Ų54.341%0.41332%0.315SS..Hα-helixtrans-63.8-44176.1-58.30000111.6A193 L194 L195 A199 R200 T201A193-S197 WeakPolarHBondContact O-CB 3.11Å; A193-S197 PolarHBondContact O-N 3.42Å; A193-S197 PolarHBondContact O-OG 3.09Å; L194-S197 WeakPolarHBondContact O-CB 3.36Å; L194-S197 PolarHBondContact O-N 3.01Å; L195-S197 VanDerWaalsContact C-N 3.31Å; L195-S197 PolarHBondContact O-N 3.42Å; S197-A199 PolarHBondContact O-N 3.42Å; S197-R200 PolarHBondContact O-N 3.5Å; S197-T201 WeakPolarHBondContact O-CG2 3.44Å; S197-T201 PolarHBondContact O-N 2.9Å; S197-T201 PolarHBondContact O-OG1 3.11Å
198A88.5Confident81.9Confident0 Ų062.2 Ų62.20%036%0.355CS..Hα-helixtrans-60.8-45.1174.800000111.3L4 L7 L8 L126 L194 L195 R200 T201 L202L4-A198 HydrophobicContact CD1-CB 4.5Å; L7-A198 HydrophobicContact CB-CB 4.27Å; L7-A198 HydrophobicContact CD1-CB 4.39Å; L8-A198 HydrophobicContact CD2-CB 4.16Å; L126-A198 HydrophobicContact CD1-CB 4.27Å; L194-A198 WeakPolarHBondContact O-CB 3.47Å; L194-A198 PolarHBondContact O-N 3.43Å; L195-A198 PolarHBondContact O-N 2.91Å; A198-R200 VanDerWaalsContact C-N 3.33Å; A198-R200 PolarHBondContact O-N 3.15Å; A198-T201 WeakPolarHBondContact CA-OG1 3.46Å; A198-T201 PolarHBondContact O-N 3.2Å; A198-T201 PolarHBondContact O-OG1 2.76Å; A198-L202 PolarHBondContact O-N 3.04Å
199A87.6Confident79.7Confident0 Ų068.2 Ų68.20%040%0.396CS..Hα-helixtrans-57.9-44.5175.600000111.6L126 L127 L195 L196 S197 T201 L202 S203L126-A199 HydrophobicContact CB-CB 3.77Å; L126-A199 HydrophobicContact CD1-CB 4.35Å; L127-A199 HydrophobicContact CD2-CB 3.66Å; L127-A199 HydrophobicContact CG-CB 3.88Å; L195-A199 WeakPolarHBondContact O-CB 3.12Å; L195-A199 PolarHBondContact O-N 3.16Å; L196-A199 PolarHBondContact O-N 3.42Å; S197-A199 PolarHBondContact O-N 3.42Å; A199-T201 PolarHBondContact O-N 3.32Å; A199-L202 PolarHBondContact O-N 3.29Å; A199-S203 WeakPolarHBondContact O-CB 3.29Å; A199-S203 PolarHBondContact O-N 3.34Å; A199-S203 PolarHBondContact O-OG 3.06Å; A199-S203 VanDerWaalsContact O-OG 3.1Å
200R86.5Confident77.2Confident171 Ų17169.7 Ų69.765%0.64542%0.416SS*.Hα-helixtrans-60.7-44.6175.9-67.4-64179.688.21.4112L196 S197 A198 L202 S203 L204L196-R200 VanDerWaalsContact O-CG 3.31Å; L196-R200 WeakPolarHBondContact O-CG 3.1Å; L196-R200 PolarHBondContact O-N 3.28Å; S197-R200 PolarHBondContact O-N 3.5Å; A198-R200 VanDerWaalsContact C-N 3.33Å; A198-R200 PolarHBondContact O-N 3.15Å; R200-L202 PolarHBondContact O-N 2.73Å; R200-S203 PolarHBondContact O-N 2.89Å; R200-L204 WeakPolarHBondContact O-CB 3.43Å; R200-L204 WeakPolarHBondContact O-CD1 3.39Å; R200-L204 WeakPolarHBondContact O-CG 3.36Å; R200-L204 PolarHBondContact O-N 3.17Å
201T85.6Confident74.9Confident61 Ų6172.6 Ų72.637%0.37443%0.431SS..Hα-helixtrans-64.7-31.1177.458.30000112.8L4 S197 A198 A199 S205L4-T201 VanDerWaalsContact CD1-OG1 3.23Å; L4-T201 WeakPolarHBondContact CD1-OG1 3.34Å; S197-T201 WeakPolarHBondContact O-CG2 3.44Å; S197-T201 PolarHBondContact O-N 2.9Å; S197-T201 PolarHBondContact O-OG1 3.11Å; A198-T201 WeakPolarHBondContact CA-OG1 3.46Å; A198-T201 PolarHBondContact O-N 3.2Å; A198-T201 PolarHBondContact O-OG1 2.76Å; A199-T201 PolarHBondContact O-N 3.32Å; T201-S205 PolarHBondContact O-N 3.09Å; T201-S205 PolarHBondContact O-OG 2.83Å
202L83.3Confident72.7Confident31 Ų3180.8 Ų80.816%0.16247%0.474CS..Hα-helixtrans-76.9-41.1177.6-143.9103.3000111.8L4 Q121 A123 A198 A199 R200 L204 S205L4-L202 HydrophobicContact CD1-CB 4.49Å; L4-L202 HydrophobicContact CD1-CD1 3.56Å; L4-L202 HydrophobicContact CD2-CD1 3.58Å; L4-L202 HydrophobicContact CG-CD1 4.22Å; Q121-L202 HydrophobicContact CG-CD1 4.11Å; Q121-L202 VanDerWaalsContact O-CD2 3.23Å; Q121-L202 WeakPolarHBondContact O-CD2 3.17Å; A123-L202 HydrophobicContact CB-CB 4.42Å; A123-L202 HydrophobicContact CB-CD2 4.08Å; A198-L202 PolarHBondContact O-N 3.04Å; A199-L202 PolarHBondContact O-N 3.29Å; R200-L202 PolarHBondContact O-N 2.73Å; L202-L204 VanDerWaalsContact C-N 3.34Å; L202-S205 PolarHBondContact O-N 2.88Å
203S80Confident70.4Confident75 Ų7585.5 Ų85.552%0.52451%0.506SS..Hα-helixtrans-68.1-30.4176-63.40000113.4A123 A199 R200 S205A123-S203 WeakPolarHBondContact CB-OG 3.17Å; A199-S203 WeakPolarHBondContact O-CB 3.29Å; A199-S203 PolarHBondContact O-N 3.34Å; A199-S203 PolarHBondContact O-OG 3.06Å; A199-S203 VanDerWaalsContact O-OG 3.1Å; R200-S203 PolarHBondContact O-N 2.89Å; S203-S205 VanDerWaalsContact C-N 3.34Å
204L77.3Confident68Low144 Ų14488.7 Ų88.775%0.75452%0.523SS*.THydrogen-bonded Turntrans-81-15.3175.9-70.9168.6000112.8R200 L202 P206R200-L204 WeakPolarHBondContact O-CB 3.43Å; R200-L204 WeakPolarHBondContact O-CD1 3.39Å; R200-L204 WeakPolarHBondContact O-CG 3.36Å; R200-L204 PolarHBondContact O-N 3.17Å; L202-L204 VanDerWaalsContact C-N 3.34Å; L204-P206 WeakPolarHBondContact O-CD 3.16Å
205S66.3Low65.6Low76 Ų7695.5 Ų95.553%0.53155%0.554SS.*SBendtrans-80112.5171.6-63.40000107.6T201 L202 S203T201-S205 PolarHBondContact O-N 3.09Å; T201-S205 PolarHBondContact O-OG 2.83Å; L202-S205 PolarHBondContact O-N 2.88Å; S203-S205 VanDerWaalsContact C-N 3.34Å
206P53.9Low63.5Low101 Ų101104.4 Ų104.466%0.65660%0.596SS**  trans-58.5146.3-179.322.9-31.4000109.9L204 L208L204-P206 WeakPolarHBondContact O-CD 3.16Å; P206-L208 PolarHBondContact O-N 2.96Å
207P51.8Low61.4Low116 Ų116107.8 Ų107.875%0.75362%0.618SS**  trans-58.7119.7174.124.9-31.4000107.7C209P207-C209 PolarHBondContact O-N 3.06Å
208L49.6Very low59.5Low179 Ų179108.2 Ų108.294%0.93763%0.632SS**SBendtrans-72.558.2172.4-127.8101.2000109.1P206P206-L208 PolarHBondContact O-N 2.96Å
209C46.8Very low57.4Low126 Ų126111.8 Ų111.885%0.85167%0.669SS**  trans-145.572.2175.4-113.20000108P207P207-C209 PolarHBondContact O-N 3.06Å
210G39.7Very low55.5Low76 Ų76123.7 Ų123.778%0.78471%0.714SS**  trans-159.312.2175.300000114.1
211H42.4Very low53.9Low181 Ų181119.1 Ų119.184%0.83872%0.72SS**  trans-118.437.8-177.9-138.2-41000113.5
212L43.9Very low52.1Low173 Ų173119.3 Ų119.391%0.90673%0.734SS**  trans-105.791.5154.7-86.5159.7000107.7P214L212-P214 WeakPolarHBondContact O-CD 3.3Å
213S42.1Very low50.3Low98 Ų98129.7 Ų129.769%0.68579%0.79SS**  trans-66.6127169-161.90000109.2
214P42.3Very low48.8Very low116 Ų116132.4 Ų132.475%0.75380%0.803SS**  trans-86.4120.5143.824.9-12.1000107L212 Q216L212-P214 WeakPolarHBondContact O-CD 3.3Å; P214-Q216 PolarHBondContact O-N 2.66Å; P214-Q216 VanDerWaalsContact O-N 3.08Å
215Q42.7Very low47.3Very low167 Ų167131.8 Ų131.878%0.7881%0.806SS**  trans-55.4111.6174.5-153.8-165.216.200109.4V217Q215-V217 VanDerWaalsContact C-N 3.31Å; Q215-V217 HydrophobicContact CG-CG2 4.13Å; Q215-V217 PolarHBondContact O-N 3.36Å
216Q45.5Very low46.2Very low189 Ų189134.9 Ų134.988%0.88382%0.821SS**  trans-78.584169.3-165.6175.8-31.800107.9P214P214-Q216 PolarHBondContact O-N 2.66Å; P214-Q216 VanDerWaalsContact O-N 3.08Å
217V46Very low45.8Very low124 Ų124136.9 Ų136.975%0.75283%0.831SS**  trans-109.977.9158.9-179.60000107Q215Q215-V217 VanDerWaalsContact C-N 3.31Å; Q215-V217 HydrophobicContact CG-CG2 4.13Å; Q215-V217 PolarHBondContact O-N 3.36Å
218G48Very low45.4Very low69 Ų69138.2 Ų138.271%0.71184%0.835SS**  trans-135.6104.4166.300000107.5
219G44.3Very low45.1Very low74 Ų74135.5 Ų135.576%0.76383%0.829SS**  trans165.682.5171.700000115.3
220R47.8Very low45Very low250 Ų250136.1 Ų136.194%0.94383%0.827SS**  -178.8120119.3-114.3174.4166.6157.2-4.5111.5
221G51.5Low45.4Very low75 Ų75140.8 Ų140.877%0.77383%0.83SS**  trans-102.5162.8156.600000110.4
222G48.6Very low45.7Very low66 Ų66137.4 Ų137.468%0.6883%0.83SS**  trans66122.8173.600000113.9
223D45.3Very low45.8Very low248 Ų248134.2 Ų134.2100%1.32682%0.823SS**  cis-148.6039-71.2-37.2000111.7

Retrieved 223 of 223 residues in 312 ms (Link to these results)