A0A077Z790_TRITR Loading...

Ion trans 2 domain containing protein

AlphaFold DB , UniProt , Accession A0A077Z790, Species TRITR (Trichuris trichiura, Whipworm), Gene n/a, Length 245 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
1M61.8Low76.8Confident146 Ų14675.3 Ų75.372%0.71937%0.372SS*.  0-480-76.2-177-164.800112.6Q3 K4 K5M1-Q3 PolarHBondContact O-N 3.08Å; M1-K4 PolarHBondContact O-N 3.43Å; M1-K4 VanDerWaalsContact O-N 3.15Å; M1-K5 PolarHBondContact O-N 3.5Å
2A68.2Low77.4Confident85 Ų8570.1 Ų70.170%0.70235%0.346SS*.Hα-helixtrans-53.2-47.6-177.500000114.4K5 D6A2-K5 WeakPolarHBondContact O-CB 3.26Å; A2-K5 PolarHBondContact O-N 3.12Å; A2-D6 PolarHBondContact O-N 3.32Å
3Q72.4Confident78.1Confident125 Ų12570.7 Ų70.758%0.58435%0.351SS*.Hα-helixtrans-63.2-42.4177.5-174.8177.8-10.200113.1M1 K5 D6 H7M1-Q3 PolarHBondContact O-N 3.08Å; Q3-K5 VanDerWaalsContact C-N 3.34Å; Q3-K5 PolarHBondContact O-N 2.85Å; Q3-D6 PolarHBondContact O-N 3.22Å; Q3-H7 PolarHBondContact O-N 2.96Å
4K73.3Confident78.8Confident49 Ų4968.6 Ų68.621%0.21334%0.341CS..Hα-helixtrans-62.6-41.1176.5-172.3170.8-176.3155.60111.7M1 H7 C8 D60 Y61 V62 L79M1-K4 PolarHBondContact O-N 3.43Å; M1-K4 VanDerWaalsContact O-N 3.15Å; K4-H7 PolarHBondContact O-N 3.47Å; K4-C8 PolarHBondContact O-N 2.9Å; K4-C8 PolarHBondContact O-SG 3.39Å; K4-C8 VanDerWaalsContact O-SG 3.37Å; K4-D60 HydrophobicContact CB-CB 4.36Å; K4-D60 WeakPolarHBondContact CD-O 3.49Å; K4-D60 VanDerWaalsContact CE-O 3.22Å; K4-D60 WeakPolarHBondContact CE-O 3.39Å; K4-D60 HydrophobicContact CG-CB 4.22Å; K4-D60 PolarHBondContact NZ-O 3.32Å; K4-Y61 WeakPolarHBondContact CE-O 3.49Å; K4-Y61 PolarHBondContact NZ-O 3Å; K4-V62 HydrophobicContact CG-CG2 3.81Å; K4-L79 HydrophobicContact CD-CD2 4.02Å; K4-L79 HydrophobicContact CG-CD2 4.13Å
5K74.5Confident79.4Confident73 Ų7365.8 Ų65.832%0.31733%0.327SS..Hα-helixtrans-60.4-49.4174.8-177.9176.3168.4172.80111.3M1 A2 Q3 H7 C8 Q9 L75 N76 L79M1-K5 PolarHBondContact O-N 3.5Å; A2-K5 WeakPolarHBondContact O-CB 3.26Å; A2-K5 PolarHBondContact O-N 3.12Å; Q3-K5 VanDerWaalsContact C-N 3.34Å; Q3-K5 PolarHBondContact O-N 2.85Å; K5-H7 VanDerWaalsContact C-N 3.34Å; K5-H7 PolarHBondContact O-N 2.91Å; K5-C8 PolarHBondContact O-N 3.48Å; K5-Q9 VanDerWaalsContact O-CB 3.32Å; K5-Q9 WeakPolarHBondContact O-CB 3.46Å; K5-Q9 PolarHBondContact O-N 3.27Å; K5-L75 HydrophobicContact CG-CD2 4.2Å; K5-N76 WeakPolarHBondContact CE-OD1 3.49Å; K5-N76 PolarHBondContact NZ-OD1 2.84Å; K5-L79 HydrophobicContact CB-CD1 3.59Å; K5-L79 HydrophobicContact CG-CD1 3.97Å
6D80.5Confident79.9Confident68 Ų6866.1 Ų66.136%0.36433%0.33SS..Hα-helixtrans-59.9-42.7178.6-178.338.5000111.8A2 Q3 Q9 R10A2-D6 PolarHBondContact O-N 3.32Å; Q3-D6 PolarHBondContact O-N 3.22Å; D6-Q9 PolarHBondContact O-N 2.97Å; D6-R10 WeakPolarHBondContact O-CB 3.29Å; D6-R10 VanDerWaalsContact O-CG 3.32Å; D6-R10 WeakPolarHBondContact O-CG 3.4Å; D6-R10 PolarHBondContact O-N 3.04Å; D6-R10 IonicContact OD1-CZ 3.97Å; D6-R10 IonicContact OD1-NE 3.23Å; D6-R10 PolarHBondContact OD1-NE 3.45Å; D6-R10 IonicContact OD1-NH2 3.82Å; D6-R10 IonicContact OD2-CZ 3.28Å; D6-R10 VanDerWaalsContact OD2-CZ 3.28Å; D6-R10 IonicContact OD2-NE 3.25Å; D6-R10 PolarHBondContact OD2-NE 3.24Å; D6-R10 IonicContact OD2-NH2 2.65Å; D6-R10 PolarHBondContact OD2-NH2 2.93Å
7H81.5Confident80.4Confident48 Ų4869 Ų6922%0.22235%0.347CS..Hα-helixtrans-61.9-47.7173.1-82.8-179.7000113.4Q3 K4 K5 Q9 R10 I11 A56 D60 V62Q3-H7 PolarHBondContact O-N 2.96Å; K4-H7 PolarHBondContact O-N 3.47Å; K5-H7 VanDerWaalsContact C-N 3.34Å; K5-H7 PolarHBondContact O-N 2.91Å; H7-Q9 VanDerWaalsContact C-N 3.28Å; H7-Q9 PolarHBondContact O-N 3.27Å; H7-R10 PolarHBondContact O-N 2.92Å; H7-I11 WeakPolarHBondContact O-CD1 3.3Å; H7-I11 VanDerWaalsContact O-CG1 3.26Å; H7-I11 WeakPolarHBondContact O-CG1 3.48Å; H7-I11 PolarHBondContact O-N 3.46Å; H7-A56 HydrophobicContact CB-CB 4.42Å; H7-D60 IonicContact CE1-OD2 3.21Å; H7-D60 PolarHBondContact CE1-OD2 3.31Å; H7-D60 IonicContact CG-OD2 3.9Å; H7-D60 IonicContact ND1-OD2 3.93Å; H7-D60 PolarHBondContact ND1-OD2 3.32Å; H7-V62 HydrophobicContact CB-CG2 4.45Å
8C78.9Confident80.9Confident1 Ų166.8 Ų66.81%0.00733%0.334CS..Hα-helixtrans-58.2-43.5176.2-71.60000111.5K4 K5 I11 H12 V62 L75K4-C8 PolarHBondContact O-N 2.9Å; K4-C8 PolarHBondContact O-SG 3.39Å; K4-C8 VanDerWaalsContact O-SG 3.37Å; K5-C8 PolarHBondContact O-N 3.48Å; C8-I11 PolarHBondContact O-N 2.94Å; C8-H12 WeakPolarHBondContact O-CB 3.48Å; C8-H12 PolarHBondContact O-N 3.2Å; C8-V62 WeakPolarHBondContact SG-CG1 3.44Å; C8-L75 HydrophobicContact CB-CD1 3.38Å; C8-L75 HydrophobicContact CB-CD2 3.66Å; C8-L75 HydrophobicContact CB-CG 4.17Å
9Q82Confident81.3Confident87 Ų8767.5 Ų67.541%0.40734%0.338SS..Hα-helixtrans-68.8-43.3-176.8-158.9154.1-2.200111.5K5 D6 H7 I11 H12 D13 L75K5-Q9 VanDerWaalsContact O-CB 3.32Å; K5-Q9 WeakPolarHBondContact O-CB 3.46Å; K5-Q9 PolarHBondContact O-N 3.27Å; D6-Q9 PolarHBondContact O-N 2.97Å; H7-Q9 VanDerWaalsContact C-N 3.28Å; H7-Q9 PolarHBondContact O-N 3.27Å; Q9-I11 VanDerWaalsContact C-N 3.29Å; Q9-I11 PolarHBondContact O-N 3.09Å; Q9-H12 WeakPolarHBondContact O-CB 3.36Å; Q9-H12 PolarHBondContact O-N 3.39Å; Q9-D13 VanDerWaalsContact O-CG 3.23Å; Q9-D13 PolarHBondContact O-N 2.6Å; Q9-L75 HydrophobicContact CB-CD2 4.17Å
10R85.2Confident81.6Confident144 Ų14468.9 Ų68.954%0.54335%0.346SS..Hα-helixtrans-59-38.8171.8-73.6-177.7-153.3-171.64.1113.1D6 H7 M14D6-R10 WeakPolarHBondContact O-CB 3.29Å; D6-R10 VanDerWaalsContact O-CG 3.32Å; D6-R10 WeakPolarHBondContact O-CG 3.4Å; D6-R10 PolarHBondContact O-N 3.04Å; D6-R10 IonicContact OD1-CZ 3.97Å; D6-R10 IonicContact OD1-NE 3.23Å; D6-R10 PolarHBondContact OD1-NE 3.45Å; D6-R10 IonicContact OD1-NH2 3.82Å; D6-R10 IonicContact OD2-CZ 3.28Å; D6-R10 VanDerWaalsContact OD2-CZ 3.28Å; D6-R10 IonicContact OD2-NE 3.25Å; D6-R10 PolarHBondContact OD2-NE 3.24Å; D6-R10 IonicContact OD2-NH2 2.65Å; D6-R10 PolarHBondContact OD2-NH2 2.93Å; H7-R10 PolarHBondContact O-N 2.92Å; R10-M14 WeakPolarHBondContact O-CB 3.34Å; R10-M14 PolarHBondContact O-N 3.33Å
11I86.1Confident81.8Confident2 Ų269.2 Ų69.21%0.0135%0.349CS..Hα-helixtrans-69.5-43.1178.3-66.9163000110.5H7 C8 Q9 M14 I15 V52 L53 A56 V62 I67H7-I11 WeakPolarHBondContact O-CD1 3.3Å; H7-I11 VanDerWaalsContact O-CG1 3.26Å; H7-I11 WeakPolarHBondContact O-CG1 3.48Å; H7-I11 PolarHBondContact O-N 3.46Å; C8-I11 PolarHBondContact O-N 2.94Å; Q9-I11 VanDerWaalsContact C-N 3.29Å; Q9-I11 PolarHBondContact O-N 3.09Å; I11-M14 HydrophobicContact CG1-CE 4.49Å; I11-M14 HydrophobicContact CG2-CE 4.3Å; I11-M14 PolarHBondContact O-N 2.9Å; I11-I15 HydrophobicContact CG2-CD1 3.8Å; I11-I15 HydrophobicContact CG2-CG1 4.38Å; I11-I15 VanDerWaalsContact O-CG1 3.27Å; I11-I15 WeakPolarHBondContact O-CG1 3.42Å; I11-I15 PolarHBondContact O-N 3.25Å; I11-V52 HydrophobicContact CD1-CG1 4.34Å; I11-V52 HydrophobicContact CG1-CG1 3.79Å; I11-L53 HydrophobicContact CD1-CD1 4.33Å; I11-L53 HydrophobicContact CG2-CD1 3.88Å; I11-A56 HydrophobicContact CD1-CB 3.52Å; I11-V62 HydrophobicContact CD1-CG1 4.35Å; I11-I67 HydrophobicContact CB-CD1 3.95Å; I11-I67 HydrophobicContact CD1-CD1 4.18Å; I11-I67 HydrophobicContact CG2-CD1 3.46Å; I11-I67 VanDerWaalsContact CG2-CD1 3.46Å; I11-I67 HydrophobicContact CG2-CG1 4.44Å
12H84.5Confident82.9Confident13 Ų1364 Ų646%0.0632%0.324CS..Hα-helixtrans-55.8-52.4174.4-179.2100.1000110.7C8 Q9 M14 I15 L16 I67 D68C8-H12 WeakPolarHBondContact O-CB 3.48Å; C8-H12 PolarHBondContact O-N 3.2Å; Q9-H12 WeakPolarHBondContact O-CB 3.36Å; Q9-H12 PolarHBondContact O-N 3.39Å; H12-M14 PolarHBondContact O-N 3.4Å; H12-I15 PolarHBondContact O-N 3.44Å; H12-I15 VanDerWaalsContact O-N 3.15Å; H12-L16 WeakPolarHBondContact NE2-CD1 3.44Å; H12-L16 PolarHBondContact O-N 3.23Å; H12-I67 HydrophobicContact CB-CG2 4.24Å; H12-D68 PolarHBondContact CE1-O 3.08Å; H12-D68 VanDerWaalsContact CE1-O 3.25Å; H12-D68 PolarHBondContact ND1-O 3.14Å; H12-D68 VanDerWaalsContact ND1-O 3.16Å
13D86.1Confident83.7Confident78 Ų7868 Ų6842%0.41732%0.321SS..Hα-helixtrans-60.6-44179.3-64.6-18.2000111.5Q9 I15 L16 D17Q9-D13 VanDerWaalsContact O-CG 3.23Å; Q9-D13 PolarHBondContact O-N 2.6Å; D13-I15 VanDerWaalsContact C-N 3.31Å; D13-I15 PolarHBondContact O-N 2.95Å; D13-L16 PolarHBondContact O-N 3.46Å; D13-D17 WeakPolarHBondContact O-CB 3.38Å; D13-D17 PolarHBondContact O-N 3Å
14M88.3Confident84.2Confident41 Ų4169.6 Ų69.620%0.20233%0.326CS..Hα-helixtrans-61.9-37.1177.1-179.3-173.554.200112.6R10 I11 H12 Y18 I49 V52R10-M14 WeakPolarHBondContact O-CB 3.34Å; R10-M14 PolarHBondContact O-N 3.33Å; I11-M14 HydrophobicContact CG1-CE 4.49Å; I11-M14 HydrophobicContact CG2-CE 4.3Å; I11-M14 PolarHBondContact O-N 2.9Å; H12-M14 PolarHBondContact O-N 3.4Å; M14-Y18 VanDerWaalsContact O-CB 3.28Å; M14-Y18 WeakPolarHBondContact O-CB 3.37Å; M14-Y18 PolarHBondContact O-N 3.38Å; M14-Y18 VanDerWaalsContact O-N 3.08Å; M14-I49 HydrophobicContact CE-CB 4.18Å; M14-I49 HydrophobicContact CE-CG1 3.88Å; M14-I49 HydrophobicContact CE-CG2 4.26Å; M14-I49 HydrophobicContact CG-CG1 4.31Å; M14-I49 HydrophobicContact SD-CG1 4.23Å; M14-V52 HydrophobicContact CE-CB 3.77Å; M14-V52 HydrophobicContact CE-CG1 3.88Å; M14-V52 HydrophobicContact CE-CG2 4.15Å; M14-V52 HydrophobicContact SD-CB 4.32Å; M14-V52 HydrophobicContact SD-CG2 4.01Å
15I87.9Confident84.5Confident27 Ų2768.9 Ų68.914%0.13832%0.324CS..Hα-helixtrans-67.7-44.3175.8-69.3165.3000110.1I11 H12 D13 Y18 I19 I49 I67 L69I11-I15 HydrophobicContact CG2-CD1 3.8Å; I11-I15 HydrophobicContact CG2-CG1 4.38Å; I11-I15 VanDerWaalsContact O-CG1 3.27Å; I11-I15 WeakPolarHBondContact O-CG1 3.42Å; I11-I15 PolarHBondContact O-N 3.25Å; H12-I15 PolarHBondContact O-N 3.44Å; H12-I15 VanDerWaalsContact O-N 3.15Å; D13-I15 VanDerWaalsContact C-N 3.31Å; D13-I15 PolarHBondContact O-N 2.95Å; I15-Y18 PolarHBondContact O-N 2.87Å; I15-I19 HydrophobicContact CG2-CD1 3.81Å; I15-I19 HydrophobicContact CG2-CG1 4.41Å; I15-I19 VanDerWaalsContact O-CG1 3.3Å; I15-I19 WeakPolarHBondContact O-CG1 3.21Å; I15-I19 PolarHBondContact O-N 3.45Å; I15-I49 HydrophobicContact CD1-CG2 4.27Å; I15-I49 HydrophobicContact CG1-CD1 4.25Å; I15-I49 HydrophobicContact CG1-CG1 4.47Å; I15-I49 HydrophobicContact CG1-CG2 3.84Å; I15-I67 HydrophobicContact CD1-CG2 4.09Å; I15-L69 HydrophobicContact CB-CD2 3.97Å; I15-L69 HydrophobicContact CD1-CD2 4.23Å; I15-L69 HydrophobicContact CG2-CD1 3.76Å; I15-L69 HydrophobicContact CG2-CD2 3.61Å; I15-L69 HydrophobicContact CG2-CG 4.35Å
16L87Confident84.6Confident71 Ų7172.6 Ų72.637%0.37234%0.336SS..Hα-helixtrans-61.9-47.6177.3-69.8-178.5000111.9H12 D13 Y18 I19 D20H12-L16 WeakPolarHBondContact NE2-CD1 3.44Å; H12-L16 PolarHBondContact O-N 3.23Å; D13-L16 PolarHBondContact O-N 3.46Å; L16-Y18 PolarHBondContact O-N 3.31Å; L16-I19 PolarHBondContact O-N 2.75Å; L16-I19 VanDerWaalsContact O-N 3.13Å; L16-D20 PolarHBondContact O-N 3.13Å
17D89Confident84.1Confident115 Ų11578 Ų7862%0.61536%0.357SS*.Hα-helixtrans-57-40.3176.2-82.2-13.2000111.7D13 D20 L21D13-D17 WeakPolarHBondContact O-CB 3.38Å; D13-D17 PolarHBondContact O-N 3Å; D17-D20 PolarHBondContact O-N 3.39Å; D17-L21 WeakPolarHBondContact O-CB 3.45Å; D17-L21 PolarHBondContact O-N 3.19Å
18Y89.7Confident83.4Confident30 Ų3082.5 Ų82.512%0.11838%0.378CS..Hα-helixtrans-69.1-40.9177.8178.8-110.4000112.4M14 I15 L16 D20 L21 L22 L42 G45 I49M14-Y18 VanDerWaalsContact O-CB 3.28Å; M14-Y18 WeakPolarHBondContact O-CB 3.37Å; M14-Y18 PolarHBondContact O-N 3.38Å; M14-Y18 VanDerWaalsContact O-N 3.08Å; I15-Y18 PolarHBondContact O-N 2.87Å; L16-Y18 PolarHBondContact O-N 3.31Å; Y18-D20 VanDerWaalsContact C-N 3.34Å; Y18-D20 PolarHBondContact O-N 3.21Å; Y18-L21 WeakPolarHBondContact O-CB 3.44Å; Y18-L21 PolarHBondContact O-N 3.3Å; Y18-L22 HydrophobicContact CD1-CD1 4.12Å; Y18-L22 HydrophobicContact CE1-CD1 3.57Å; Y18-L22 HydrophobicContact CE1-CG 4.27Å; Y18-L22 HydrophobicContact CE2-CD1 4.38Å; Y18-L22 HydrophobicContact CE2-CD2 4.3Å; Y18-L22 HydrophobicContact CE2-CG 4.25Å; Y18-L22 WeakPolarHBondContact O-CG 3.47Å; Y18-L22 PolarHBondContact O-N 3.21Å; Y18-L42 VanDerWaalsContact OH-C 3.23Å; Y18-L42 WeakPolarHBondContact OH-CA 3.4Å; Y18-L42 WeakPolarHBondContact OH-CG 3.43Å; Y18-L42 PolarHBondContact OH-O 3.33Å; Y18-G45 VanDerWaalsContact CE2-CA 3.49Å; Y18-I49 HydrophobicContact CD1-CD1 3.37Å; Y18-I49 HydrophobicContact CE1-CD1 4.03Å; Y18-I49 HydrophobicContact CG-CD1 3.65Å
19I87.4Confident82.5Confident80 Ų8084 Ų8441%0.4139%0.387SS..Hα-helixtrans-60.5-45.1174-70.4166.8000110.4I15 L16 L21 L22 W23I15-I19 HydrophobicContact CG2-CD1 3.81Å; I15-I19 HydrophobicContact CG2-CG1 4.41Å; I15-I19 VanDerWaalsContact O-CG1 3.3Å; I15-I19 WeakPolarHBondContact O-CG1 3.21Å; I15-I19 PolarHBondContact O-N 3.45Å; L16-I19 PolarHBondContact O-N 2.75Å; L16-I19 VanDerWaalsContact O-N 3.13Å; I19-L21 PolarHBondContact O-N 2.95Å; I19-L22 PolarHBondContact O-N 2.65Å; I19-W23 PolarHBondContact O-N 3.23Å
20D88.2Confident81.4Confident95 Ų9586.3 Ų86.351%0.50841%0.407SS..Hα-helixtrans-64-40178.5-91.1-7.8000112.6L16 D17 Y18 L22 W23 K24L16-D20 PolarHBondContact O-N 3.13Å; D17-D20 PolarHBondContact O-N 3.39Å; Y18-D20 VanDerWaalsContact C-N 3.34Å; Y18-D20 PolarHBondContact O-N 3.21Å; D20-L22 VanDerWaalsContact C-N 3.34Å; D20-L22 PolarHBondContact O-N 3.25Å; D20-W23 PolarHBondContact O-N 3.36Å; D20-K24 PolarHBondContact O-N 2.85Å
21L85.5Confident80Confident75 Ų7586.4 Ų86.439%0.39342%0.416SS..Hα-helixtrans-58.7-46.2173.2-172.888.7000111.1D17 Y18 I19 K24 N25D17-L21 WeakPolarHBondContact O-CB 3.45Å; D17-L21 PolarHBondContact O-N 3.19Å; Y18-L21 WeakPolarHBondContact O-CB 3.44Å; Y18-L21 PolarHBondContact O-N 3.3Å; I19-L21 PolarHBondContact O-N 2.95Å; L21-K24 PolarHBondContact O-N 3.35Å; L21-N25 WeakPolarHBondContact O-CB 3.41Å; L21-N25 PolarHBondContact O-N 3.32Å
22L85.6Confident78.6Confident38 Ų3891 Ų9120%0.19945%0.454CS..Hα-helixtrans-64.1-41.2178.2-69.1179.4000111.7Y18 I19 D20 N25 R26 W38 L42Y18-L22 HydrophobicContact CD1-CD1 4.12Å; Y18-L22 HydrophobicContact CE1-CD1 3.57Å; Y18-L22 HydrophobicContact CE1-CG 4.27Å; Y18-L22 HydrophobicContact CE2-CD1 4.38Å; Y18-L22 HydrophobicContact CE2-CD2 4.3Å; Y18-L22 HydrophobicContact CE2-CG 4.25Å; Y18-L22 WeakPolarHBondContact O-CG 3.47Å; Y18-L22 PolarHBondContact O-N 3.21Å; I19-L22 PolarHBondContact O-N 2.65Å; D20-L22 VanDerWaalsContact C-N 3.34Å; D20-L22 PolarHBondContact O-N 3.25Å; L22-N25 PolarHBondContact O-N 2.98Å; L22-R26 PolarHBondContact O-N 3.15Å; L22-W38 HydrophobicContact CD2-CZ2 4.41Å; L22-L42 HydrophobicContact CD1-CD1 4.23Å; L22-L42 HydrophobicContact CD1-CG 4.16Å; L22-L42 HydrophobicContact CD2-CB 4.32Å; L22-L42 HydrophobicContact CD2-CD1 3.82Å; L22-L42 HydrophobicContact CD2-CG 3.78Å
23W84.4Confident77.6Confident168 Ų16893.1 Ų93.164%0.63648%0.479SS*.Hα-helixtrans-62.8-42.7177.9-175-108.8000112.4I19 D20 R26I19-W23 PolarHBondContact O-N 3.23Å; D20-W23 PolarHBondContact O-N 3.36Å; W23-R26 WeakPolarHBondContact O-CB 3.35Å
24K83.5Confident77.1Confident159 Ų15991.4 Ų91.469%0.69147%0.471SS*.Hα-helixtrans-63.4-46.2174.9-78.7176.5179.8166.80111.8D20 L21 R26D20-K24 PolarHBondContact O-N 2.85Å; L21-K24 PolarHBondContact O-N 3.35Å; K24-R26 VanDerWaalsContact C-N 3.32Å; K24-R26 PolarHBondContact O-N 3.21Å
25N78.7Confident76.6Confident34 Ų3495.4 Ų95.418%0.18249%0.488CS..Hα-helixtrans-76.1-17.7-174.7-70.7-8.5000113.7L21 L22 K27 Q28 T29L21-N25 WeakPolarHBondContact O-CB 3.41Å; L21-N25 PolarHBondContact O-N 3.32Å; L22-N25 PolarHBondContact O-N 2.98Å; N25-K27 PolarHBondContact O-N 3.41Å; N25-K27 VanDerWaalsContact O-N 3.15Å; N25-Q28 PolarHBondContact O-N 3.13Å; N25-Q28 VanDerWaalsContact O-N 3.13Å; N25-T29 PolarHBondContact O-OG1 3.03Å
26R75.7Confident76.3Confident150 Ų150102.2 Ų102.257%0.56652%0.516SS*.G310 helixtrans-46.2-45.8175170.3-175171.9-167-0.1112.8L22 W23 K24 Q28 T29L22-R26 PolarHBondContact O-N 3.15Å; W23-R26 WeakPolarHBondContact O-CB 3.35Å; K24-R26 VanDerWaalsContact C-N 3.32Å; K24-R26 PolarHBondContact O-N 3.21Å; R26-Q28 VanDerWaalsContact C-N 3.28Å; R26-Q28 PolarHBondContact O-N 3.03Å; R26-T29 PolarHBondContact O-N 3.37Å; R26-T29 PolarHBondContact O-OG1 3.44Å
27K70.6Confident76Confident182 Ų182105.3 Ų105.379%0.79153%0.529SS*.G310 helixtrans-69.5-20.5-172.7-69-174.5179.5-179.80113.8N25 T29N25-K27 PolarHBondContact O-N 3.41Å; N25-K27 VanDerWaalsContact O-N 3.15Å; K27-T29 VanDerWaalsContact C-N 3.34Å
28Q66.6Low75.6Confident142 Ų142103.2 Ų103.266%0.66451%0.512SS*.G310 helixtrans-84-6.3-179.8-76.5176.2-20.700113.6N25 R26 T30N25-Q28 PolarHBondContact O-N 3.13Å; N25-Q28 VanDerWaalsContact O-N 3.13Å; R26-Q28 VanDerWaalsContact C-N 3.28Å; R26-Q28 PolarHBondContact O-N 3.03Å; Q28-T30 VanDerWaalsContact C-N 3.33Å; Q28-T30 PolarHBondContact O-N 3.49Å
29T60.2Low75.3Confident34 Ų34106.1 Ų106.121%0.20953%0.527CS..THydrogen-bonded Turntrans-84.38.2-166.8-27.70000115.2N25 R26 K27 M31 K35 W38N25-T29 PolarHBondContact O-OG1 3.03Å; R26-T29 PolarHBondContact O-N 3.37Å; R26-T29 PolarHBondContact O-OG1 3.44Å; K27-T29 VanDerWaalsContact C-N 3.34Å; T29-M31 VanDerWaalsContact C-N 3.27Å; T29-M31 PolarHBondContact O-N 3Å; T29-K35 HydrophobicContact CG2-CB 4.43Å; T29-W38 HydrophobicContact CG2-CB 3.85Å; T29-W38 HydrophobicContact CG2-CD2 4.39Å; T29-W38 HydrophobicContact CG2-CG 3.97Å
30T59.7Low75.2Confident135 Ų135105.2 Ų105.283%0.82853%0.532SS*.THydrogen-bonded Turntrans-73.5-6.8-17243.30000115.6Q28Q28-T30 VanDerWaalsContact C-N 3.33Å; Q28-T30 PolarHBondContact O-N 3.49Å
31M55.4Low75Confident146 Ų146105.3 Ų105.372%0.71953%0.529SS*.SBendtrans-104.5137.1171.6-70.6-160.817800112T29 G33 T34T29-M31 VanDerWaalsContact C-N 3.27Å; T29-M31 PolarHBondContact O-N 3Å; M31-G33 PolarHBondContact O-N 2.85Å; M31-G33 VanDerWaalsContact O-N 3.12Å; M31-T34 WeakPolarHBondContact O-CA 3.46Å; M31-T34 VanDerWaalsContact O-CB 3.26Å; M31-T34 WeakPolarHBondContact O-CB 3.32Å; M31-T34 PolarHBondContact O-N 3.33Å; M31-T34 PolarHBondContact O-OG1 2.93Å; M31-T34 VanDerWaalsContact O-OG1 3.08Å
32A57.5Low75.1Confident99 Ų99103.5 Ų103.582%0.81852%0.52SS*.Hα-helixtrans-58-29.2-171.600000114.7T34A32-T34 VanDerWaalsContact C-N 3.3Å; A32-T34 PolarHBondContact O-N 2.96Å
33G62.8Low75.3Confident57 Ų57106.5 Ų106.559%0.58854%0.536SS*.Hα-helixtrans-67.8-28.8172.900000113.5M31M31-G33 PolarHBondContact O-N 2.85Å; M31-G33 VanDerWaalsContact O-N 3.12Å
34T75.5Confident75.5Confident41 Ų41106.4 Ų106.425%0.25254%0.54SS..Hα-helixtrans-77.4-26.4-178.4-30.70000112.1M31 A32 K36 Q37 W38M31-T34 WeakPolarHBondContact O-CA 3.46Å; M31-T34 VanDerWaalsContact O-CB 3.26Å; M31-T34 WeakPolarHBondContact O-CB 3.32Å; M31-T34 PolarHBondContact O-N 3.33Å; M31-T34 PolarHBondContact O-OG1 2.93Å; M31-T34 VanDerWaalsContact O-OG1 3.08Å; A32-T34 VanDerWaalsContact C-N 3.3Å; A32-T34 PolarHBondContact O-N 2.96Å; T34-K36 PolarHBondContact O-N 2.89Å; T34-Q37 PolarHBondContact O-N 2.93Å; T34-W38 VanDerWaalsContact O-CB 3.29Å; T34-W38 WeakPolarHBondContact O-CB 3.34Å; T34-W38 PolarHBondContact O-N 3.48Å
35K77.3Confident75.7Confident125 Ų12599.7 Ų99.754%0.54352%0.515SS..Hα-helixtrans-61.9-44.9179.7-174.1179.8179.3-1790112.5T29 W38 Q39T29-K35 HydrophobicContact CG2-CB 4.43Å; K35-W38 PolarHBondContact O-N 2.93Å; K35-Q39 WeakPolarHBondContact O-CB 3.28Å; K35-Q39 WeakPolarHBondContact O-CG 3.42Å; K35-Q39 PolarHBondContact O-N 3.44Å
36K81.6Confident76.3Confident170 Ų170102.4 Ų102.474%0.73953%0.529SS*.Hα-helixtrans-63.7-42.1177.3-100.9-171.7176.7-177.80111.7T34 Q39 A40T34-K36 PolarHBondContact O-N 2.89Å; K36-Q39 PolarHBondContact O-N 3.5Å; K36-A40 WeakPolarHBondContact O-CB 3.35Å; K36-A40 PolarHBondContact O-N 3.49Å
37Q81.2Confident77Confident136 Ų136100.3 Ų100.364%0.63653%0.529SS*.Hα-helixtrans-64.3-43.6176.7-72.4178.9-3200111.5T34 A40 Q41T34-Q37 PolarHBondContact O-N 2.93Å; Q37-A40 PolarHBondContact O-N 3.13Å; Q37-Q41 PolarHBondContact O-N 3.28Å
38W79.9Confident78.1Confident72 Ų7295.9 Ų95.927%0.27351%0.514SS..Hα-helixtrans-61.2-45.1176-173.984.8000111.7L22 T29 T34 K35 A40 Q41 L42L22-W38 HydrophobicContact CD2-CZ2 4.41Å; T29-W38 HydrophobicContact CG2-CB 3.85Å; T29-W38 HydrophobicContact CG2-CD2 4.39Å; T29-W38 HydrophobicContact CG2-CG 3.97Å; T34-W38 VanDerWaalsContact O-CB 3.29Å; T34-W38 WeakPolarHBondContact O-CB 3.34Å; T34-W38 PolarHBondContact O-N 3.48Å; K35-W38 PolarHBondContact O-N 2.93Å; W38-A40 PolarHBondContact O-N 3.37Å; W38-Q41 PolarHBondContact O-N 3.08Å; W38-L42 HydrophobicContact CD2-CD1 4.41Å; W38-L42 HydrophobicContact CE3-CD1 4.07Å; W38-L42 HydrophobicContact CH2-CD1 3.2Å; W38-L42 HydrophobicContact CZ2-CD1 3.58Å; W38-L42 HydrophobicContact CZ3-CD1 3.47Å; W38-L42 VanDerWaalsContact CZ3-CD1 3.47Å; W38-L42 WeakPolarHBondContact O-CB 3.26Å; W38-L42 PolarHBondContact O-N 2.9Å
39Q83.3Confident79.2Confident91 Ų9190.3 Ų90.343%0.42549%0.488SS..Hα-helixtrans-60.4-42174-76.1178.6-43.500112.6K35 K36 Q41 L42 N43K35-Q39 WeakPolarHBondContact O-CB 3.28Å; K35-Q39 WeakPolarHBondContact O-CG 3.42Å; K35-Q39 PolarHBondContact O-N 3.44Å; K36-Q39 PolarHBondContact O-N 3.5Å; Q39-Q41 VanDerWaalsContact C-N 3.33Å; Q39-Q41 PolarHBondContact O-N 2.97Å; Q39-L42 PolarHBondContact O-N 3.24Å; Q39-N43 PolarHBondContact O-N 3.47Å
40A85.5Confident80.6Confident61 Ų6192.1 Ų92.150%0.50450%0.5SS..Hα-helixtrans-63.5-40.2177.500000111.9K36 Q37 W38 K44K36-A40 WeakPolarHBondContact O-CB 3.35Å; K36-A40 PolarHBondContact O-N 3.49Å; Q37-A40 PolarHBondContact O-N 3.13Å; W38-A40 PolarHBondContact O-N 3.37Å; A40-K44 WeakPolarHBondContact O-CB 3.3Å; A40-K44 PolarHBondContact O-N 3.29Å
41Q84.2Confident82.2Confident96 Ų9690.4 Ų90.445%0.44949%0.485SS..Hα-helixtrans-67.7-38.9176.4-163.2172.69.600111.7Q37 W38 Q39 K44 G45Q37-Q41 PolarHBondContact O-N 3.28Å; W38-Q41 PolarHBondContact O-N 3.08Å; Q39-Q41 VanDerWaalsContact C-N 3.33Å; Q39-Q41 PolarHBondContact O-N 2.97Å; Q41-K44 PolarHBondContact O-N 3.49Å; Q41-G45 PolarHBondContact O-N 2.86Å; Q41-G45 VanDerWaalsContact O-N 3.08Å
42L87.1Confident83.8Confident38 Ų3885.9 Ų85.920%0.19947%0.466CS..Hα-helixtrans-61.9-54.6175.6-152.5151.6000110Y18 L22 W38 Q39 K44 G45 L46Y18-L42 VanDerWaalsContact OH-C 3.23Å; Y18-L42 WeakPolarHBondContact OH-CA 3.4Å; Y18-L42 WeakPolarHBondContact OH-CG 3.43Å; Y18-L42 PolarHBondContact OH-O 3.33Å; L22-L42 HydrophobicContact CD1-CD1 4.23Å; L22-L42 HydrophobicContact CD1-CG 4.16Å; L22-L42 HydrophobicContact CD2-CB 4.32Å; L22-L42 HydrophobicContact CD2-CD1 3.82Å; L22-L42 HydrophobicContact CD2-CG 3.78Å; W38-L42 HydrophobicContact CD2-CD1 4.41Å; W38-L42 HydrophobicContact CE3-CD1 4.07Å; W38-L42 HydrophobicContact CH2-CD1 3.2Å; W38-L42 HydrophobicContact CZ2-CD1 3.58Å; W38-L42 HydrophobicContact CZ3-CD1 3.47Å; W38-L42 VanDerWaalsContact CZ3-CD1 3.47Å; W38-L42 WeakPolarHBondContact O-CB 3.26Å; W38-L42 PolarHBondContact O-N 2.9Å; Q39-L42 PolarHBondContact O-N 3.24Å; L42-K44 VanDerWaalsContact C-N 3.26Å; L42-K44 PolarHBondContact O-N 3.39Å; L42-G45 PolarHBondContact O-N 2.89Å; L42-G45 VanDerWaalsContact O-N 3.14Å; L42-L46 HydrophobicContact CD2-CD1 4.32Å; L42-L46 PolarHBondContact O-N 2.94Å
43N89.7Confident85.2Confident100 Ų10083.5 Ų83.554%0.53544%0.439SS..Hα-helixtrans-56-39.9177.2-73.5-13.6000112.8Q39 L46 L47Q39-N43 PolarHBondContact O-N 3.47Å; N43-L46 PolarHBondContact O-N 3.15Å; N43-L47 WeakPolarHBondContact O-CB 3.28Å; N43-L47 WeakPolarHBondContact O-CD1 3.22Å; N43-L47 VanDerWaalsContact O-CG 3.3Å; N43-L47 WeakPolarHBondContact O-CG 3.42Å; N43-L47 PolarHBondContact O-N 3.36Å
44K89.6Confident86.4Confident167 Ų16788.3 Ų88.373%0.72644%0.44SS*.Hα-helixtrans-64.2-43.8179-169.5174.9-178.3179.90112.5A40 Q41 L42 N48A40-K44 WeakPolarHBondContact O-CB 3.3Å; A40-K44 PolarHBondContact O-N 3.29Å; Q41-K44 PolarHBondContact O-N 3.49Å; L42-K44 VanDerWaalsContact C-N 3.26Å; L42-K44 PolarHBondContact O-N 3.39Å; K44-N48 PolarHBondContact O-N 2.86Å; K44-N48 VanDerWaalsContact O-N 3.09Å
45G88.4Confident87Confident17 Ų1788.5 Ų88.518%0.17545%0.446CS..Hα-helixtrans-70.3-38.3177.200000112.8Y18 Q41 L42 N48 I49Y18-G45 VanDerWaalsContact CE2-CA 3.49Å; Q41-G45 PolarHBondContact O-N 2.86Å; Q41-G45 VanDerWaalsContact O-N 3.08Å; L42-G45 PolarHBondContact O-N 2.89Å; L42-G45 VanDerWaalsContact O-N 3.14Å; G45-N48 WeakPolarHBondContact O-CB 3.27Å; G45-N48 PolarHBondContact O-N 3.41Å; G45-I49 WeakPolarHBondContact O-CG1 3.39Å; G45-I49 PolarHBondContact O-N 3.01Å
46L89.6Confident87.4Confident91 Ų9182.8 Ų82.848%0.47642%0.422SS..Hα-helixtrans-62.8-45.9176.3-150.8118000111L42 N43 N48 I49 T50L42-L46 HydrophobicContact CD2-CD1 4.32Å; L42-L46 PolarHBondContact O-N 2.94Å; N43-L46 PolarHBondContact O-N 3.15Å; L46-N48 VanDerWaalsContact C-N 3.3Å; L46-N48 PolarHBondContact O-N 2.95Å; L46-I49 PolarHBondContact O-N 3.44Å; L46-T50 PolarHBondContact O-N 2.9Å; L46-T50 PolarHBondContact O-OG1 2.96Å
47L92.2Very high87.5Confident107 Ų10780.2 Ų80.256%0.5641%0.409SS*.Hα-helixtrans-58.9-39.6173.5-79.4164.8000112.5N43 T50 N51N43-L47 WeakPolarHBondContact O-CB 3.28Å; N43-L47 WeakPolarHBondContact O-CD1 3.22Å; N43-L47 VanDerWaalsContact O-CG 3.3Å; N43-L47 WeakPolarHBondContact O-CG 3.42Å; N43-L47 PolarHBondContact O-N 3.36Å; L47-T50 PolarHBondContact O-N 3.36Å; L47-N51 WeakPolarHBondContact O-CB 3.46Å; L47-N51 VanDerWaalsContact O-CG 3.22Å; L47-N51 PolarHBondContact O-N 3.04Å; L47-N51 PolarHBondContact O-ND2 3.46Å
48N92.5Very high87.5Confident89 Ų8977.1 Ų77.148%0.47640%0.4SS..Hα-helixtrans-64-46.8176.9-16945.8000111.3K44 G45 L46 T50 N51 V52K44-N48 PolarHBondContact O-N 2.86Å; K44-N48 VanDerWaalsContact O-N 3.09Å; G45-N48 WeakPolarHBondContact O-CB 3.27Å; G45-N48 PolarHBondContact O-N 3.41Å; L46-N48 VanDerWaalsContact C-N 3.3Å; L46-N48 PolarHBondContact O-N 2.95Å; N48-T50 VanDerWaalsContact C-N 3.34Å; N48-T50 PolarHBondContact O-N 2.86Å; N48-N51 PolarHBondContact O-N 3.3Å; N48-V52 WeakPolarHBondContact O-CG2 3.47Å; N48-V52 PolarHBondContact O-N 3.2Å
49I90.8Very high87.6Confident24 Ų2477.1 Ų77.112%0.12341%0.408CS..Hα-helixtrans-59.1-47.6176-68.3164000110.3M14 I15 Y18 G45 L46 N51 V52 L53M14-I49 HydrophobicContact CE-CB 4.18Å; M14-I49 HydrophobicContact CE-CG1 3.88Å; M14-I49 HydrophobicContact CE-CG2 4.26Å; M14-I49 HydrophobicContact CG-CG1 4.31Å; M14-I49 HydrophobicContact SD-CG1 4.23Å; I15-I49 HydrophobicContact CD1-CG2 4.27Å; I15-I49 HydrophobicContact CG1-CD1 4.25Å; I15-I49 HydrophobicContact CG1-CG1 4.47Å; I15-I49 HydrophobicContact CG1-CG2 3.84Å; Y18-I49 HydrophobicContact CD1-CD1 3.37Å; Y18-I49 HydrophobicContact CE1-CD1 4.03Å; Y18-I49 HydrophobicContact CG-CD1 3.65Å; G45-I49 WeakPolarHBondContact O-CG1 3.39Å; G45-I49 PolarHBondContact O-N 3.01Å; L46-I49 PolarHBondContact O-N 3.44Å; I49-N51 VanDerWaalsContact C-N 3.32Å; I49-N51 PolarHBondContact O-N 3.33Å; I49-V52 PolarHBondContact O-N 2.89Å; I49-L53 VanDerWaalsContact O-CB 3.28Å; I49-L53 WeakPolarHBondContact O-CB 3.26Å; I49-L53 PolarHBondContact O-N 2.92Å
50T89.5Confident87.2Confident73 Ų7373.6 Ų73.645%0.44839%0.392SS..Hα-helixtrans-59.6-42.3178.2-53.70000111.9L46 L47 N48 L53 Y54L46-T50 PolarHBondContact O-N 2.9Å; L46-T50 PolarHBondContact O-OG1 2.96Å; L47-T50 PolarHBondContact O-N 3.36Å; N48-T50 VanDerWaalsContact C-N 3.34Å; N48-T50 PolarHBondContact O-N 2.86Å; T50-L53 PolarHBondContact O-N 3.31Å; T50-Y54 VanDerWaalsContact O-CB 3.26Å; T50-Y54 WeakPolarHBondContact O-CB 3.13Å; T50-Y54 PolarHBondContact O-N 3.34Å
51N91.6Very high86.7Confident99 Ų9974.8 Ų74.853%0.52938%0.384SS..Hα-helixtrans-64.3-43.5178.2-76.7-22.1000112.4L47 N48 I49 Y54 A55L47-N51 WeakPolarHBondContact O-CB 3.46Å; L47-N51 VanDerWaalsContact O-CG 3.22Å; L47-N51 PolarHBondContact O-N 3.04Å; L47-N51 PolarHBondContact O-ND2 3.46Å; N48-N51 PolarHBondContact O-N 3.3Å; I49-N51 VanDerWaalsContact C-N 3.32Å; I49-N51 PolarHBondContact O-N 3.33Å; N51-Y54 PolarHBondContact O-N 3.39Å; N51-A55 WeakPolarHBondContact O-CB 3.5Å; N51-A55 PolarHBondContact O-N 2.89Å
52V89.8Confident86.3Confident51 Ų5170.3 Ų70.331%0.30936%0.363SS..Hα-helixtrans-68.4-41.3178.1176.80000110.7I11 M14 N48 I49 Y54 A55 A56I11-V52 HydrophobicContact CD1-CG1 4.34Å; I11-V52 HydrophobicContact CG1-CG1 3.79Å; M14-V52 HydrophobicContact CE-CB 3.77Å; M14-V52 HydrophobicContact CE-CG1 3.88Å; M14-V52 HydrophobicContact CE-CG2 4.15Å; M14-V52 HydrophobicContact SD-CB 4.32Å; M14-V52 HydrophobicContact SD-CG2 4.01Å; N48-V52 WeakPolarHBondContact O-CG2 3.47Å; N48-V52 PolarHBondContact O-N 3.2Å; I49-V52 PolarHBondContact O-N 2.89Å; V52-Y54 VanDerWaalsContact C-N 3.34Å; V52-Y54 PolarHBondContact O-N 2.75Å; V52-A55 PolarHBondContact O-N 3.25Å; V52-A56 WeakPolarHBondContact O-CB 3.45Å; V52-A56 PolarHBondContact O-N 3.22Å
53L87.9Confident85.6Confident49 Ų4970.4 Ų70.426%0.25737%0.367SS..Hα-helixtrans-60-46175.4-16683.2000110.7I11 I49 T50 A56 Y57 I67I11-L53 HydrophobicContact CD1-CD1 4.33Å; I11-L53 HydrophobicContact CG2-CD1 3.88Å; I49-L53 VanDerWaalsContact O-CB 3.28Å; I49-L53 WeakPolarHBondContact O-CB 3.26Å; I49-L53 PolarHBondContact O-N 2.92Å; T50-L53 PolarHBondContact O-N 3.31Å; L53-A56 PolarHBondContact O-N 2.89Å; L53-Y57 WeakPolarHBondContact O-CB 3.46Å; L53-Y57 PolarHBondContact O-N 3.36Å; L53-I67 HydrophobicContact CD1-CD1 3.29Å
54Y87.2Confident84.9Confident157 Ų15774.1 Ų74.162%0.61637%0.374SS*.Hα-helixtrans-63.2-44.4176.5-178.5-100.5000111.8T50 N51 V52 A56 Y57 T58T50-Y54 VanDerWaalsContact O-CB 3.26Å; T50-Y54 WeakPolarHBondContact O-CB 3.13Å; T50-Y54 PolarHBondContact O-N 3.34Å; N51-Y54 PolarHBondContact O-N 3.39Å; V52-Y54 VanDerWaalsContact C-N 3.34Å; V52-Y54 PolarHBondContact O-N 2.75Å; Y54-A56 PolarHBondContact O-N 3.47Å; Y54-Y57 WeakPolarHBondContact O-CB 3.42Å; Y54-Y57 PolarHBondContact O-N 2.98Å; Y54-T58 HydrophobicContact CD1-CG2 4.25Å; Y54-T58 HydrophobicContact CE1-CG2 3.81Å; Y54-T58 HydrophobicContact CE2-CG2 4.21Å; Y54-T58 WeakPolarHBondContact O-CG2 3.4Å; Y54-T58 PolarHBondContact O-N 3.32Å; Y54-T58 PolarHBondContact O-OG1 3.36Å
55A88.4Confident83.9Confident45 Ų4569.3 Ų69.337%0.37236%0.362SS..Hα-helixtrans-58.5-48.9175.700000111.2N51 V52 Y57 T58 T59N51-A55 WeakPolarHBondContact O-CB 3.5Å; N51-A55 PolarHBondContact O-N 2.89Å; V52-A55 PolarHBondContact O-N 3.25Å; A55-Y57 VanDerWaalsContact C-N 3.31Å; A55-Y57 PolarHBondContact O-N 2.98Å; A55-T58 PolarHBondContact O-N 3.43Å; A55-T58 VanDerWaalsContact O-N 3.13Å; A55-T58 PolarHBondContact O-OG1 2.94Å; A55-T59 WeakPolarHBondContact O-CG2 3.48Å; A55-T59 PolarHBondContact O-N 3.43Å; A55-T59 PolarHBondContact O-OG1 3.02Å
56A84.9Confident83Confident5 Ų569.7 Ų69.74%0.04136%0.36CS..Hα-helixtrans-65.2-32.517800000113.3H7 I11 V52 L53 Y54 D60 Y61 V62H7-A56 HydrophobicContact CB-CB 4.42Å; I11-A56 HydrophobicContact CD1-CB 3.52Å; V52-A56 WeakPolarHBondContact O-CB 3.45Å; V52-A56 PolarHBondContact O-N 3.22Å; L53-A56 PolarHBondContact O-N 2.89Å; Y54-A56 PolarHBondContact O-N 3.47Å; A56-D60 PolarHBondContact O-N 3.37Å; A56-Y61 PolarHBondContact O-N 3.13Å; A56-V62 HydrophobicContact CB-CB 3.99Å; A56-V62 HydrophobicContact CB-CG2 4.21Å; A56-V62 PolarHBondContact O-N 3.13Å
57Y83.8Confident82.1Confident116 Ų11666.3 Ų66.346%0.45534%0.342SS..Hα-helixtrans-62.9-48.3170.2177.8-98.6000110.9L53 Y54 A55 T59 Y61 V62L53-Y57 WeakPolarHBondContact O-CB 3.46Å; L53-Y57 PolarHBondContact O-N 3.36Å; Y54-Y57 WeakPolarHBondContact O-CB 3.42Å; Y54-Y57 PolarHBondContact O-N 2.98Å; A55-Y57 VanDerWaalsContact C-N 3.31Å; A55-Y57 PolarHBondContact O-N 2.98Å; Y57-T59 PolarHBondContact O-N 3.15Å; Y57-Y61 WeakPolarHBondContact O-CA 3.2Å; Y57-Y61 PolarHBondContact O-N 3.35Å; Y57-V62 WeakPolarHBondContact CA-O 3.32Å; Y57-V62 WeakPolarHBondContact CB-O 3.29Å
58T81.8Confident81.1Confident72 Ų7264.4 Ų64.444%0.44233%0.333SS..Hα-helixtrans-67.7-32.6-179.158.70000113.8Y54 A55Y54-T58 HydrophobicContact CD1-CG2 4.25Å; Y54-T58 HydrophobicContact CE1-CG2 3.81Å; Y54-T58 HydrophobicContact CE2-CG2 4.21Å; Y54-T58 WeakPolarHBondContact O-CG2 3.4Å; Y54-T58 PolarHBondContact O-N 3.32Å; Y54-T58 PolarHBondContact O-OG1 3.36Å; A55-T58 PolarHBondContact O-N 3.43Å; A55-T58 VanDerWaalsContact O-N 3.13Å; A55-T58 PolarHBondContact O-OG1 2.94Å
59T81.7Confident79.9Confident72 Ų7263.5 Ų63.544%0.44233%0.327SS..Hα-helixtrans-85.4-45.9-178.758.70000112.7A55 Y57A55-T59 WeakPolarHBondContact O-CG2 3.48Å; A55-T59 PolarHBondContact O-N 3.43Å; A55-T59 PolarHBondContact O-OG1 3.02Å; Y57-T59 PolarHBondContact O-N 3.15Å
60D75.4Confident78.7Confident17 Ų1769.9 Ų69.99%0.09136%0.362CS..Hα-helixtrans-126.75.8-166.4-62.7-74.2000113.7K4 H7 A56 V62K4-D60 HydrophobicContact CB-CB 4.36Å; K4-D60 WeakPolarHBondContact CD-O 3.49Å; K4-D60 VanDerWaalsContact CE-O 3.22Å; K4-D60 WeakPolarHBondContact CE-O 3.39Å; K4-D60 HydrophobicContact CG-CB 4.22Å; K4-D60 PolarHBondContact NZ-O 3.32Å; H7-D60 IonicContact CE1-OD2 3.21Å; H7-D60 PolarHBondContact CE1-OD2 3.31Å; H7-D60 IonicContact CG-OD2 3.9Å; H7-D60 IonicContact ND1-OD2 3.93Å; H7-D60 PolarHBondContact ND1-OD2 3.32Å; A56-D60 PolarHBondContact O-N 3.37Å; D60-V62 HydrophobicContact CB-CG2 4.07Å; D60-V62 PolarHBondContact O-N 3.33Å
61Y74.3Confident77.6Confident86 Ų8671.8 Ų71.834%0.33737%0.365SS..  trans54.541.8-176-59.6-93.7000111.5K4 A56 Y57 S63 V105K4-Y61 WeakPolarHBondContact CE-O 3.49Å; K4-Y61 PolarHBondContact NZ-O 3Å; A56-Y61 PolarHBondContact O-N 3.13Å; Y57-Y61 WeakPolarHBondContact O-CA 3.2Å; Y57-Y61 PolarHBondContact O-N 3.35Å; Y61-S63 PolarHBondContact O-N 3.3Å; Y61-V105 HydrophobicContact CD1-CG2 3.78Å; Y61-V105 HydrophobicContact CD2-CG2 3.62Å; Y61-V105 HydrophobicContact CE1-CG2 4.06Å; Y61-V105 HydrophobicContact CE2-CG2 3.93Å; Y61-V105 HydrophobicContact CG-CG2 3.54Å
62V76.4Confident76Confident1 Ų171.9 Ų71.91%0.00637%0.37CS..  trans-74.6109.3171.1175.50000108.5K4 H7 C8 I11 A56 Y57 D60 I67K4-V62 HydrophobicContact CG-CG2 3.81Å; H7-V62 HydrophobicContact CB-CG2 4.45Å; C8-V62 WeakPolarHBondContact SG-CG1 3.44Å; I11-V62 HydrophobicContact CD1-CG1 4.35Å; A56-V62 HydrophobicContact CB-CB 3.99Å; A56-V62 HydrophobicContact CB-CG2 4.21Å; A56-V62 PolarHBondContact O-N 3.13Å; Y57-V62 WeakPolarHBondContact CA-O 3.32Å; Y57-V62 WeakPolarHBondContact CB-O 3.29Å; D60-V62 HydrophobicContact CB-CG2 4.07Å; D60-V62 PolarHBondContact O-N 3.33Å; V62-I67 HydrophobicContact CG1-CD1 3.97Å; V62-I67 HydrophobicContact CG1-CG1 4.39Å
63S72.2Confident74.7Confident41 Ų4175.2 Ų75.229%0.28739%0.386SS..  trans-90.6155.4171.4-174.50000110.5Y61 S65 L66Y61-S63 PolarHBondContact O-N 3.3Å; S63-S65 PolarHBondContact O-N 3.33Å; S63-S65 VanDerWaalsContact O-N 3.15Å; S63-L66 WeakPolarHBondContact O-CB 3.39Å; S63-L66 PolarHBondContact O-N 3.09Å
64Y74.3Confident73.4Confident177 Ų17773.1 Ų73.169%0.69438%0.376SS*.G310 helixtrans-57.4-28.3175.978.3-84.9000112.3L66 I67Y64-L66 PolarHBondContact O-N 3.34Å; Y64-I67 PolarHBondContact O-N 2.8Å
65S68.7Low72.2Confident67 Ų6766.4 Ų66.447%0.46935%0.351SS..G310 helixtrans-65.3-15.9177.263.10000113.8S63S63-S65 PolarHBondContact O-N 3.33Å; S63-S65 VanDerWaalsContact O-N 3.15Å
66L69.5Low71.1Confident24 Ų2466.7 Ų66.713%0.12635%0.346CS..G310 helixtrans-87.1-14.5173.8-62.8171.8000112.3S63 Y64 L75 L78S63-L66 WeakPolarHBondContact O-CB 3.39Å; S63-L66 PolarHBondContact O-N 3.09Å; Y64-L66 PolarHBondContact O-N 3.34Å; L66-L75 WeakPolarHBondContact O-CD1 3.22Å; L66-L78 HydrophobicContact CD2-CB 4.09Å
67I71.9Confident70.2Confident20 Ų2073.2 Ų73.210%0.10337%0.373CS..  trans-103.978.6-178.6-58.8159.1000106.5I11 H12 I15 L53 V62 Y64 L69I11-I67 HydrophobicContact CB-CD1 3.95Å; I11-I67 HydrophobicContact CD1-CD1 4.18Å; I11-I67 HydrophobicContact CG2-CD1 3.46Å; I11-I67 VanDerWaalsContact CG2-CD1 3.46Å; I11-I67 HydrophobicContact CG2-CG1 4.44Å; H12-I67 HydrophobicContact CB-CG2 4.24Å; I15-I67 HydrophobicContact CD1-CG2 4.09Å; L53-I67 HydrophobicContact CD1-CD1 3.29Å; V62-I67 HydrophobicContact CG1-CD1 3.97Å; V62-I67 HydrophobicContact CG1-CG1 4.39Å; Y64-I67 PolarHBondContact O-N 2.8Å; I67-L69 HydrophobicContact CG2-CD2 4.28Å
68D69.9Low69.2Low68 Ų6870.7 Ų70.736%0.36437%0.367SS..  trans-80.3119.3167.8-160.9-24.1000108.6H12 N70H12-D68 PolarHBondContact CE1-O 3.08Å; H12-D68 VanDerWaalsContact CE1-O 3.25Å; H12-D68 PolarHBondContact ND1-O 3.14Å; H12-D68 VanDerWaalsContact ND1-O 3.16Å; D68-N70 VanDerWaalsContact C-N 3.26Å; D68-N70 WeakPolarHBondContact OD1-CB 3.38Å; D68-N70 PolarHBondContact OD1-N 2.99Å
69L67.8Low68.5Low70 Ų7067.9 Ų67.937%0.36635%0.35SS..SBendtrans-76-18.4178-64.2174.3000112I15 I67I15-L69 HydrophobicContact CB-CD2 3.97Å; I15-L69 HydrophobicContact CD1-CD2 4.23Å; I15-L69 HydrophobicContact CG2-CD1 3.76Å; I15-L69 HydrophobicContact CG2-CD2 3.61Å; I15-L69 HydrophobicContact CG2-CG 4.35Å; I67-L69 HydrophobicContact CG2-CD2 4.28Å
70N66.2Low67.7Low157 Ų15771.3 Ų71.384%0.8436%0.36SS*.SBendtrans-90.8-12.3-177.8-71.5-21.4000113.2D68D68-N70 VanDerWaalsContact C-N 3.26Å; D68-N70 WeakPolarHBondContact OD1-CB 3.38Å; D68-N70 PolarHBondContact OD1-N 2.99Å
71E66.7Low67.3Low113 Ų11374.6 Ų74.653%0.52838%0.378SS..  trans-142.995.9-171.8-146.9177.3-147.700112.1D73 G74E71-D73 VanDerWaalsContact C-N 3.3Å; E71-D73 PolarHBondContact O-N 3.25Å; E71-G74 PolarHBondContact O-N 3.16Å; E71-G74 VanDerWaalsContact O-N 3.13Å
72T56Low67.1Low102 Ų10272 Ų7263%0.62638%0.375SS*.THydrogen-bonded Turntrans-65.4-30.6177.140.30000113
73D62.7Low67.2Low121 Ų12176.8 Ų76.865%0.64739%0.393SS*.THydrogen-bonded Turntrans-80.9-19.8173.3-113.3-12.4000113E71 L75 N76 K77E71-D73 VanDerWaalsContact C-N 3.3Å; E71-D73 PolarHBondContact O-N 3.25Å; D73-L75 PolarHBondContact O-N 2.87Å; D73-N76 PolarHBondContact O-N 2.93Å; D73-K77 PolarHBondContact O-N 3.45Å
74G62.1Low67.8Low4 Ų476.4 Ų76.44%0.04139%0.389CS..Hα-helixtrans-60.6-33.1177.300000112.1E71 N76 K77 L78E71-G74 PolarHBondContact O-N 3.16Å; E71-G74 VanDerWaalsContact O-N 3.13Å; G74-N76 PolarHBondContact O-N 3.24Å; G74-K77 PolarHBondContact O-N 2.93Å; G74-L78 WeakPolarHBondContact O-CB 3.34Å; G74-L78 WeakPolarHBondContact O-CG 3.2Å; G74-L78 PolarHBondContact O-N 3.24Å
75L61.6Low68.4Low17 Ų1775.4 Ų75.49%0.08940%0.395CS..Hα-helixtrans-58.9-43.3177178.162.7000112.6K5 C8 Q9 L66 D73 L79K5-L75 HydrophobicContact CG-CD2 4.2Å; C8-L75 HydrophobicContact CB-CD1 3.38Å; C8-L75 HydrophobicContact CB-CD2 3.66Å; C8-L75 HydrophobicContact CB-CG 4.17Å; Q9-L75 HydrophobicContact CB-CD2 4.17Å; L66-L75 WeakPolarHBondContact O-CD1 3.22Å; D73-L75 PolarHBondContact O-N 2.87Å; L75-L79 HydrophobicContact CD1-CD1 3.97Å; L75-L79 HydrophobicContact CD1-CG 4.15Å; L75-L79 HydrophobicContact CG-CD1 4.08Å; L75-L79 WeakPolarHBondContact O-CB 3.33Å; L75-L79 VanDerWaalsContact O-CG 3.29Å; L75-L79 WeakPolarHBondContact O-CG 3.44Å; L75-L79 PolarHBondContact O-N 3.44Å
76N64.4Low69.2Low51 Ų5177.3 Ų77.327%0.27339%0.394SS..Hα-helixtrans-64.8-45.6178.8-71.4-39.5000110.5K5 D73 G74 L78 L79 E80K5-N76 WeakPolarHBondContact CE-OD1 3.49Å; K5-N76 PolarHBondContact NZ-OD1 2.84Å; D73-N76 PolarHBondContact O-N 2.93Å; G74-N76 PolarHBondContact O-N 3.24Å; N76-L78 PolarHBondContact O-N 3.5Å; N76-L79 PolarHBondContact O-N 2.95Å; N76-E80 WeakPolarHBondContact O-CB 3.3Å; N76-E80 WeakPolarHBondContact O-CG 3.02Å; N76-E80 PolarHBondContact O-N 3.33Å
77K67.1Low69.9Low141 Ų14177 Ų7761%0.61339%0.394SS*.Hα-helixtrans-64-40.9179.9-145175.2-173.8179.50111.8D73 G74 N81D73-K77 PolarHBondContact O-N 3.45Å; G74-K77 PolarHBondContact O-N 2.93Å; K77-N81 WeakPolarHBondContact O-CB 3.41Å; K77-N81 PolarHBondContact O-N 3.08Å; K77-N81 PolarHBondContact O-ND2 3.44Å
78L63.2Low70.8Confident63 Ų6377.6 Ų77.633%0.3340%0.402SS..Hα-helixtrans-67.4-38.5176.5-72.4169.7000112.3L66 G74 N76 A82L66-L78 HydrophobicContact CD2-CB 4.09Å; G74-L78 WeakPolarHBondContact O-CB 3.34Å; G74-L78 WeakPolarHBondContact O-CG 3.2Å; G74-L78 PolarHBondContact O-N 3.24Å; N76-L78 PolarHBondContact O-N 3.5Å; L78-A82 PolarHBondContact O-N 3.13Å; L78-A82 VanDerWaalsContact O-N 3.15Å
79L65.5Low71.8Confident14 Ų1476.7 Ų76.77%0.07340%0.404CS..Hα-helixtrans-71.4-38176.2-73.4173.7000112.6K4 K5 L75 N76 A82K4-L79 HydrophobicContact CD-CD2 4.02Å; K4-L79 HydrophobicContact CG-CD2 4.13Å; K5-L79 HydrophobicContact CB-CD1 3.59Å; K5-L79 HydrophobicContact CG-CD1 3.97Å; L75-L79 HydrophobicContact CD1-CD1 3.97Å; L75-L79 HydrophobicContact CD1-CG 4.15Å; L75-L79 HydrophobicContact CG-CD1 4.08Å; L75-L79 WeakPolarHBondContact O-CB 3.33Å; L75-L79 VanDerWaalsContact O-CG 3.29Å; L75-L79 WeakPolarHBondContact O-CG 3.44Å; L75-L79 PolarHBondContact O-N 3.44Å; N76-L79 PolarHBondContact O-N 2.95Å; L79-A82 WeakPolarHBondContact O-CB 3.4Å; L79-A82 PolarHBondContact O-N 2.69Å
80E66.6Low72.8Confident143 Ų14376.5 Ų76.567%0.66840%0.4SS*.Hα-helixtrans-66.7-41.8172.7-77.1-176168.100111.3N76 A82N76-E80 WeakPolarHBondContact O-CB 3.3Å; N76-E80 WeakPolarHBondContact O-CG 3.02Å; N76-E80 PolarHBondContact O-N 3.33Å; E80-A82 PolarHBondContact O-N 2.84Å
81N65.7Low74Confident87 Ų8770.5 Ų70.547%0.46537%0.367SS..Hα-helixtrans-68.1-18.5178.4-73.1-12.7000113.4K77 W83K77-N81 WeakPolarHBondContact O-CB 3.41Å; K77-N81 PolarHBondContact O-N 3.08Å; K77-N81 PolarHBondContact O-ND2 3.44Å; N81-W83 VanDerWaalsContact C-N 3.29Å; N81-W83 PolarHBondContact O-N 3.48Å
82A70.8Confident75.3Confident32 Ų3267 Ų6726%0.26435%0.354SS..THydrogen-bonded Turntrans-62.1-34.4-178.400000113.1L78 L79 E80 S87L78-A82 PolarHBondContact O-N 3.13Å; L78-A82 VanDerWaalsContact O-N 3.15Å; L79-A82 WeakPolarHBondContact O-CB 3.4Å; L79-A82 PolarHBondContact O-N 2.69Å; E80-A82 PolarHBondContact O-N 2.84Å; A82-S87 WeakPolarHBondContact O-CB 3.22Å; A82-S87 PolarHBondContact O-OG 3.15Å
83W79.4Confident77.1Confident101 Ų10165.9 Ų65.938%0.38335%0.348SS..THydrogen-bonded Turntrans-124.652.5179.8-73.7104.2000112N81 A88 F91 V104N81-W83 VanDerWaalsContact C-N 3.29Å; N81-W83 PolarHBondContact O-N 3.48Å; W83-A88 HydrophobicContact CE3-CB 4.08Å; W83-A88 HydrophobicContact CZ3-CB 4.36Å; W83-F91 HydrophobicContact CH2-CB 4.38Å; W83-F91 AromaticContact CH2-CD1 3.64Å; W83-F91 HydrophobicContact CH2-CD1 3.64Å; W83-F91 HydrophobicContact CH2-CD2 4.09Å; W83-F91 AromaticContact CH2-CE1 3.91Å; W83-F91 HydrophobicContact CH2-CE1 3.91Å; W83-F91 HydrophobicContact CH2-CE2 4.33Å; W83-F91 AromaticContact CH2-CG 3.74Å; W83-F91 HydrophobicContact CH2-CG 3.74Å; W83-F91 HydrophobicContact CH2-CZ 4.26Å; W83-F91 HydrophobicContact CZ3-CB 4.12Å; W83-F91 AromaticContact CZ3-CD1 3.72Å; W83-F91 HydrophobicContact CZ3-CD1 3.72Å; W83-F91 HydrophobicContact CZ3-CE1 4.36Å; W83-F91 AromaticContact CZ3-CG 3.89Å; W83-F91 HydrophobicContact CZ3-CG 3.89Å; W83-V104 HydrophobicContact CD2-CG1 3.96Å; W83-V104 HydrophobicContact CE3-CG1 4.17Å; W83-V104 HydrophobicContact CH2-CG1 3.69Å; W83-V104 HydrophobicContact CZ2-CG1 3.44Å; W83-V104 VanDerWaalsContact CZ2-CG1 3.44Å; W83-V104 HydrophobicContact CZ3-CG1 4.04Å
84T84.5Confident78.5Confident33 Ų3360.4 Ų60.420%0.20232%0.319CS..  trans-68.9162.816464.90000110.5K86 S87 A88T84-K86 PolarHBondContact O-N 2.91Å; T84-S87 PolarHBondContact O-N 2.94Å; T84-S87 WeakPolarHBondContact OG1-CB 3.45Å; T84-S87 PolarHBondContact OG1-N 3.47Å; T84-S87 VanDerWaalsContact OG1-N 3.08Å; T84-A88 VanDerWaalsContact O-CB 3.31Å; T84-A88 WeakPolarHBondContact O-CB 3.33Å; T84-A88 PolarHBondContact O-N 2.97Å
85L86.6Confident80.1Confident156 Ų15661.3 Ų61.382%0.81732%0.324SS*.Hα-helixtrans-55.3-38.8174.7-178.764.4000112A89L85-A89 WeakPolarHBondContact O-CB 3.41Å; L85-A89 PolarHBondContact O-N 2.96Å
86K85.2Confident81.7Confident107 Ų10763 Ų6347%0.46533%0.332SS..Hα-helixtrans-68.9-47.7177.9-66.6-177.6-177.9179.90111.6T84 A88 A89 F90 D244 P245T84-K86 PolarHBondContact O-N 2.91Å; K86-A88 VanDerWaalsContact C-N 3.3Å; K86-A88 PolarHBondContact O-N 3.18Å; K86-A89 PolarHBondContact O-N 3.49Å; K86-F90 WeakPolarHBondContact O-CB 3.14Å; K86-F90 PolarHBondContact O-N 3.13Å; K86-D244 WeakPolarHBondContact CB-OD1 3.48Å; K86-D244 HydrophobicContact CD-CB 3.89Å; K86-P245 PolarHBondContact NZ-O 3.37Å
87S84.7Confident83.2Confident17 Ų1763.5 Ų63.512%0.11934%0.337CS..Hα-helixtrans-59.7-40.4174.6178.60000111.8A82 T84 F90 F91A82-S87 WeakPolarHBondContact O-CB 3.22Å; A82-S87 PolarHBondContact O-OG 3.15Å; T84-S87 PolarHBondContact O-N 2.94Å; T84-S87 WeakPolarHBondContact OG1-CB 3.45Å; T84-S87 PolarHBondContact OG1-N 3.47Å; T84-S87 VanDerWaalsContact OG1-N 3.08Å; S87-F90 PolarHBondContact O-N 3.45Å; S87-F91 WeakPolarHBondContact O-CB 3.26Å; S87-F91 PolarHBondContact O-N 3.42Å
88A89.3Confident84.5Confident33 Ų3360.8 Ų60.827%0.27333%0.332SS..Hα-helixtrans-65.7-40.1176.400000112.4W83 T84 K86 F91 S92W83-A88 HydrophobicContact CE3-CB 4.08Å; W83-A88 HydrophobicContact CZ3-CB 4.36Å; T84-A88 VanDerWaalsContact O-CB 3.31Å; T84-A88 WeakPolarHBondContact O-CB 3.33Å; T84-A88 PolarHBondContact O-N 2.97Å; K86-A88 VanDerWaalsContact C-N 3.3Å; K86-A88 PolarHBondContact O-N 3.18Å; A88-F91 PolarHBondContact O-N 3.15Å; A88-S92 WeakPolarHBondContact O-CB 3.29Å; A88-S92 PolarHBondContact O-N 2.99Å; A88-S92 PolarHBondContact O-OG 2.92Å
89A90.9Very high86Confident48 Ų4859 Ų5940%0.39732%0.323SS..Hα-helixtrans-66.4-38173.700000112.1L85 K86 S92 T93L85-A89 WeakPolarHBondContact O-CB 3.41Å; L85-A89 PolarHBondContact O-N 2.96Å; K86-A89 PolarHBondContact O-N 3.49Å; A89-S92 WeakPolarHBondContact CA-OG 3.3Å; A89-S92 PolarHBondContact O-N 3.29Å; A89-S92 PolarHBondContact O-OG 3.18Å; A89-T93 VanDerWaalsContact O-CB 3.31Å; A89-T93 WeakPolarHBondContact O-CB 3.46Å; A89-T93 PolarHBondContact O-N 3.23Å; A89-T93 PolarHBondContact O-OG1 3.42Å
90F90.3Very high87.3Confident66 Ų6660.6 Ų60.629%0.28934%0.342SS..Hα-helixtrans-66-45.4174-177.3-101.2000111.6K86 S87 S92 T93 T94 Y101 V240K86-F90 WeakPolarHBondContact O-CB 3.14Å; K86-F90 PolarHBondContact O-N 3.13Å; S87-F90 PolarHBondContact O-N 3.45Å; F90-S92 PolarHBondContact O-N 3.45Å; F90-T93 PolarHBondContact O-N 3.15Å; F90-T94 HydrophobicContact CD1-CG2 4.25Å; F90-T94 HydrophobicContact CD2-CG2 4.35Å; F90-T94 HydrophobicContact CE1-CG2 3.94Å; F90-T94 HydrophobicContact CE2-CG2 4.05Å; F90-T94 HydrophobicContact CG-CG2 4.46Å; F90-T94 HydrophobicContact CZ-CG2 3.85Å; F90-T94 WeakPolarHBondContact O-CB 3.48Å; F90-T94 VanDerWaalsContact O-CG2 3.26Å; F90-T94 WeakPolarHBondContact O-CG2 3.49Å; F90-T94 PolarHBondContact O-N 2.93Å; F90-T94 PolarHBondContact O-OG1 3.42Å; F90-Y101 AromaticContact CE1-CD2 3.77Å; F90-Y101 HydrophobicContact CE1-CD2 3.77Å; F90-Y101 HydrophobicContact CE1-CE2 4.06Å; F90-Y101 HydrophobicContact CE2-CE2 4.39Å; F90-Y101 AromaticContact CZ-CD2 3.69Å; F90-Y101 HydrophobicContact CZ-CD2 3.69Å; F90-Y101 AromaticContact CZ-CE2 3.48Å; F90-Y101 HydrophobicContact CZ-CE2 3.48Å; F90-Y101 VanDerWaalsContact CZ-CE2 3.48Å; F90-V240 HydrophobicContact CE1-CG1 3.59Å; F90-V240 HydrophobicContact CZ-CG1 3.77Å
91F91.1Very high88.4Confident32 Ų3254.5 Ų54.514%0.1431%0.313CS..Hα-helixtrans-58-46.9173.5169.5-97.7000111.8W83 S87 A88 T94 T95 V104 P106W83-F91 HydrophobicContact CH2-CB 4.38Å; W83-F91 AromaticContact CH2-CD1 3.64Å; W83-F91 HydrophobicContact CH2-CD1 3.64Å; W83-F91 HydrophobicContact CH2-CD2 4.09Å; W83-F91 AromaticContact CH2-CE1 3.91Å; W83-F91 HydrophobicContact CH2-CE1 3.91Å; W83-F91 HydrophobicContact CH2-CE2 4.33Å; W83-F91 AromaticContact CH2-CG 3.74Å; W83-F91 HydrophobicContact CH2-CG 3.74Å; W83-F91 HydrophobicContact CH2-CZ 4.26Å; W83-F91 HydrophobicContact CZ3-CB 4.12Å; W83-F91 AromaticContact CZ3-CD1 3.72Å; W83-F91 HydrophobicContact CZ3-CD1 3.72Å; W83-F91 HydrophobicContact CZ3-CE1 4.36Å; W83-F91 AromaticContact CZ3-CG 3.89Å; W83-F91 HydrophobicContact CZ3-CG 3.89Å; S87-F91 WeakPolarHBondContact O-CB 3.26Å; S87-F91 PolarHBondContact O-N 3.42Å; A88-F91 PolarHBondContact O-N 3.15Å; F91-T94 PolarHBondContact O-OG1 3.34Å; F91-T94 VanDerWaalsContact O-OG1 3.05Å; F91-T95 VanDerWaalsContact O-CB 3.3Å; F91-T95 WeakPolarHBondContact O-CB 3.32Å; F91-T95 PolarHBondContact O-N 3.37Å; F91-T95 PolarHBondContact O-OG1 3.46Å; F91-V104 VanDerWaalsContact CD2-O 3.22Å; F91-V104 WeakPolarHBondContact CD2-O 3.45Å; F91-V104 WeakPolarHBondContact CE2-O 3.5Å; F91-P106 HydrophobicContact CZ-CG 4.27Å
92S93.5Very high89.3Confident38 Ų3852.5 Ų52.527%0.26631%0.313SS..Hα-helixtrans-66.2-42.1-179.469.90000111.7A88 A89 F90 T95 I96 F118A88-S92 WeakPolarHBondContact O-CB 3.29Å; A88-S92 PolarHBondContact O-N 2.99Å; A88-S92 PolarHBondContact O-OG 2.92Å; A89-S92 WeakPolarHBondContact CA-OG 3.3Å; A89-S92 PolarHBondContact O-N 3.29Å; A89-S92 PolarHBondContact O-OG 3.18Å; F90-S92 PolarHBondContact O-N 3.45Å; S92-T95 PolarHBondContact O-N 2.72Å; S92-I96 WeakPolarHBondContact O-CG1 3.34Å; S92-I96 PolarHBondContact O-N 3.3Å; S92-F118 WeakPolarHBondContact O-CE1 3.45Å
93T93Very high89.7Confident79 Ų7954.9 Ų54.949%0.48532%0.321SS..Hα-helixtrans-63.2-49.5177.3-56.30000111.2A89 F90 T95 I96 V97A89-T93 VanDerWaalsContact O-CB 3.31Å; A89-T93 WeakPolarHBondContact O-CB 3.46Å; A89-T93 PolarHBondContact O-N 3.23Å; A89-T93 PolarHBondContact O-OG1 3.42Å; F90-T93 PolarHBondContact O-N 3.15Å; T93-T95 VanDerWaalsContact C-N 3.26Å; T93-T95 PolarHBondContact O-N 2.89Å; T93-I96 PolarHBondContact O-N 2.8Å; T93-V97 HydrophobicContact CG2-CG2 4.44Å; T93-V97 WeakPolarHBondContact O-CB 3.27Å; T93-V97 WeakPolarHBondContact O-CG2 3.16Å; T93-V97 PolarHBondContact O-N 3.42Å
94T94Very high89.8Confident7 Ų751 Ų514%0.04331%0.308CS..Hα-helixtrans-66.3-28.5179.7540000112.7F90 F91 T98 I99 G100 Y101F90-T94 HydrophobicContact CD1-CG2 4.25Å; F90-T94 HydrophobicContact CD2-CG2 4.35Å; F90-T94 HydrophobicContact CE1-CG2 3.94Å; F90-T94 HydrophobicContact CE2-CG2 4.05Å; F90-T94 HydrophobicContact CG-CG2 4.46Å; F90-T94 HydrophobicContact CZ-CG2 3.85Å; F90-T94 WeakPolarHBondContact O-CB 3.48Å; F90-T94 VanDerWaalsContact O-CG2 3.26Å; F90-T94 WeakPolarHBondContact O-CG2 3.49Å; F90-T94 PolarHBondContact O-N 2.93Å; F90-T94 PolarHBondContact O-OG1 3.42Å; F91-T94 PolarHBondContact O-OG1 3.34Å; F91-T94 VanDerWaalsContact O-OG1 3.05Å; T94-T98 PolarHBondContact O-N 3.09Å; T94-T98 VanDerWaalsContact O-N 3.17Å; T94-I99 PolarHBondContact O-N 2.9Å; T94-G100 PolarHBondContact O-N 2.98Å; T94-Y101 HydrophobicContact CG2-CD2 3.85Å; T94-Y101 HydrophobicContact CG2-CE2 3.73Å
95T95.1Very high89.7Confident23 Ų2351.2 Ų51.214%0.14131%0.31CS..Hα-helixtrans-71.2-46.3172.9-59.60000111.4F91 S92 T93 T98 F118 A119F91-T95 VanDerWaalsContact O-CB 3.3Å; F91-T95 WeakPolarHBondContact O-CB 3.32Å; F91-T95 PolarHBondContact O-N 3.37Å; F91-T95 PolarHBondContact O-OG1 3.46Å; S92-T95 PolarHBondContact O-N 2.72Å; T93-T95 VanDerWaalsContact C-N 3.26Å; T93-T95 PolarHBondContact O-N 2.89Å; T95-T98 PolarHBondContact O-N 3.11Å; T95-F118 HydrophobicContact CG2-CD1 3.98Å; T95-F118 HydrophobicContact CG2-CE1 4.11Å; T95-A119 HydrophobicContact CG2-CB 4.2Å
96I95.3Very high89.7Confident52 Ų5244.9 Ų44.927%0.26728%0.278SS..Hα-helixtrans-61.9-43.5177.4-75176.5000111.3S92 T93 T98 F118 A126S92-I96 WeakPolarHBondContact O-CG1 3.34Å; S92-I96 PolarHBondContact O-N 3.3Å; T93-I96 PolarHBondContact O-N 2.8Å; I96-T98 PolarHBondContact O-N 3.46Å; I96-F118 HydrophobicContact CD1-CE1 4.07Å; I96-F118 HydrophobicContact CD1-CE2 3.87Å; I96-F118 HydrophobicContact CD1-CZ 3.3Å; I96-F118 HydrophobicContact CG1-CE1 3.62Å; I96-F118 HydrophobicContact CG1-CE2 4.2Å; I96-F118 HydrophobicContact CG1-CZ 3.39Å; I96-A126 HydrophobicContact CG2-CB 3.57Å; I96-A126 WeakPolarHBondContact O-CB 3.49Å
97V94.6Very high89.4Confident61 Ų6142.2 Ų42.237%0.3728%0.276SS..THydrogen-bonded Turntrans-81.92.3-179.3-174.80000111.7T93 I99T93-V97 HydrophobicContact CG2-CG2 4.44Å; T93-V97 WeakPolarHBondContact O-CB 3.27Å; T93-V97 WeakPolarHBondContact O-CG2 3.16Å; T93-V97 PolarHBondContact O-N 3.42Å; V97-I99 HydrophobicContact CB-CD1 4.37Å; V97-I99 HydrophobicContact CB-CG1 4.26Å; V97-I99 HydrophobicContact CG1-CD1 4.02Å; V97-I99 HydrophobicContact CG1-CG1 3.95Å; V97-I99 PolarHBondContact O-N 2.68Å
98T95.7Very high89.5Confident84 Ų8445.5 Ų45.552%0.51530%0.296SS..THydrogen-bonded Turntrans57.826.5178640000114.9T94 T95 I96 C123T94-T98 PolarHBondContact O-N 3.09Å; T94-T98 VanDerWaalsContact O-N 3.17Å; T95-T98 PolarHBondContact O-N 3.11Å; I96-T98 PolarHBondContact O-N 3.46Å; T98-C123 HydrophobicContact CG2-CB 4.22Å; T98-C123 VanDerWaalsContact CG2-SG 3.55Å
99I95.3Very high89.5Confident27 Ų2747.7 Ų47.714%0.13831%0.313CS..  trans-77-51.7173.3-55.8172.9000109.9T94 V97 Y101 T233T94-I99 PolarHBondContact O-N 2.9Å; V97-I99 HydrophobicContact CB-CD1 4.37Å; V97-I99 HydrophobicContact CB-CG1 4.26Å; V97-I99 HydrophobicContact CG1-CD1 4.02Å; V97-I99 HydrophobicContact CG1-CG1 3.95Å; V97-I99 PolarHBondContact O-N 2.68Å; I99-Y101 HydrophobicContact CG2-CD1 4.04Å; I99-Y101 HydrophobicContact CG2-CD2 4.26Å; I99-Y101 HydrophobicContact CG2-CE1 3.58Å; I99-Y101 HydrophobicContact CG2-CE2 3.8Å; I99-Y101 HydrophobicContact CG2-CG 4.36Å; I99-Y101 VanDerWaalsContact CG2-CZ 3.44Å; I99-T233 HydrophobicContact CG1-CG2 4.29Å
100G91.9Very high89.6Confident46 Ų4652.5 Ų52.547%0.47433%0.327SS..  trans54.557.9170.700000116.9T94 G102T94-G100 PolarHBondContact O-N 2.98Å; G100-G102 PolarHBondContact O-N 3.14Å
101Y89.7Confident89.6Confident15 Ų1550.2 Ų50.26%0.05932%0.323CS..  trans-54.4-21.7-179-63.8-62.7000116.4F90 T94 I99 N103 F226 S230 G235 G237 V240F90-Y101 AromaticContact CE1-CD2 3.77Å; F90-Y101 HydrophobicContact CE1-CD2 3.77Å; F90-Y101 HydrophobicContact CE1-CE2 4.06Å; F90-Y101 HydrophobicContact CE2-CE2 4.39Å; F90-Y101 AromaticContact CZ-CD2 3.69Å; F90-Y101 HydrophobicContact CZ-CD2 3.69Å; F90-Y101 AromaticContact CZ-CE2 3.48Å; F90-Y101 HydrophobicContact CZ-CE2 3.48Å; F90-Y101 VanDerWaalsContact CZ-CE2 3.48Å; T94-Y101 HydrophobicContact CG2-CD2 3.85Å; T94-Y101 HydrophobicContact CG2-CE2 3.73Å; I99-Y101 HydrophobicContact CG2-CD1 4.04Å; I99-Y101 HydrophobicContact CG2-CD2 4.26Å; I99-Y101 HydrophobicContact CG2-CE1 3.58Å; I99-Y101 HydrophobicContact CG2-CE2 3.8Å; I99-Y101 HydrophobicContact CG2-CG 4.36Å; I99-Y101 VanDerWaalsContact CG2-CZ 3.44Å; Y101-N103 PolarHBondContact O-N 3.18Å; Y101-F226 HydrophobicContact CE1-CE2 4.06Å; Y101-F226 HydrophobicContact CE2-CE2 4.46Å; Y101-F226 AromaticContact CZ-CE2 3.73Å; Y101-F226 WeakPolarHBondContact OH-CE2 3.44Å; Y101-S230 VanDerWaalsContact OH-CB 3.3Å; Y101-S230 WeakPolarHBondContact OH-CB 3.46Å; Y101-S230 PolarHBondContact OH-OG 2.92Å; Y101-G235 WeakPolarHBondContact CA-O 3.17Å; Y101-G237 WeakPolarHBondContact O-CA 3.34Å; Y101-V240 HydrophobicContact CD1-CG2 4.42Å; Y101-V240 HydrophobicContact CD2-CG1 4.45Å; Y101-V240 HydrophobicContact CD2-CG2 4.48Å; Y101-V240 HydrophobicContact CG-CG2 4.08Å
102G85.2Confident89.7Confident45 Ų4553.9 Ų53.946%0.46434%0.336SS..SBendtrans73.25.5178.600000115.3G100G100-G102 PolarHBondContact O-N 3.14Å
103N78.2Confident89.8Confident82 Ų8256.8 Ų56.844%0.43935%0.348SS..SBendtrans-68.1-35.2174.666.6-46.9000112.4Y101 V240Y101-N103 PolarHBondContact O-N 3.18Å; N103-V240 HydrophobicContact CB-CG2 4.19Å
104V80.9Confident90Very high19 Ų1958.7 Ų58.712%0.11535%0.354CS..SBendtrans-126.9125.9174.5178.70000108.3W83 F91W83-V104 HydrophobicContact CD2-CG1 3.96Å; W83-V104 HydrophobicContact CE3-CG1 4.17Å; W83-V104 HydrophobicContact CH2-CG1 3.69Å; W83-V104 HydrophobicContact CZ2-CG1 3.44Å; W83-V104 VanDerWaalsContact CZ2-CG1 3.44Å; W83-V104 HydrophobicContact CZ3-CG1 4.04Å; F91-V104 VanDerWaalsContact CD2-O 3.22Å; F91-V104 WeakPolarHBondContact CD2-O 3.45Å; F91-V104 WeakPolarHBondContact CE2-O 3.5Å
105V83.8Confident90Very high39 Ų3959.8 Ų59.824%0.23636%0.362CS..  trans-141.6147.3-178-63.40000111.4Y61 A107Y61-V105 HydrophobicContact CD1-CG2 3.78Å; Y61-V105 HydrophobicContact CD2-CG2 3.62Å; Y61-V105 HydrophobicContact CE1-CG2 4.06Å; Y61-V105 HydrophobicContact CE2-CG2 3.93Å; Y61-V105 HydrophobicContact CG-CG2 3.54Å; V105-A107 PolarHBondContact O-N 2.91Å; V105-A107 VanDerWaalsContact O-N 3.13Å
106P87Confident90.1Very high23 Ų2364 Ų6415%0.14938%0.382CS..  trans-69111.4175.526.8-32.7000110.4F91 R112 C115F91-P106 HydrophobicContact CZ-CG 4.27Å; P106-R112 HydrophobicContact CB-CG 4.37Å; P106-R112 HydrophobicContact CG-CG 4.17Å; P106-R112 WeakPolarHBondContact O-CG 3.43Å; P106-R112 PolarHBondContact O-NE 3.05Å; P106-R112 VanDerWaalsContact O-NE 3.13Å; P106-C115 HydrophobicContact CG-CB 4Å
107A78.6Confident90.2Very high50 Ų5065.5 Ų65.541%0.41339%0.39SS..  trans-76.4-28.7177.500000112.8V105 R112V105-A107 PolarHBondContact O-N 2.91Å; V105-A107 VanDerWaalsContact O-N 3.13Å; A107-R112 PolarHBondContact O-NH2 2.83Å
108T86.3Confident90.3Very high87 Ų8766.4 Ų66.453%0.53439%0.39SS..SBendtrans-81.2147-175620000112.1H110 G111 R112T108-H110 VanDerWaalsContact C-N 3.31Å; T108-H110 PolarHBondContact O-N 3.19Å; T108-G111 PolarHBondContact O-N 3.17Å; T108-G111 VanDerWaalsContact O-N 3.13Å; T108-G111 PolarHBondContact OG1-N 2.94Å; T108-G111 VanDerWaalsContact OG1-N 3.09Å; T108-R112 WeakPolarHBondContact O-CG 3.34Å; T108-R112 PolarHBondContact O-N 3.36Å
109A88.7Confident90.3Very high78 Ų7863.7 Ų63.765%0.64538%0.376SS*.Hα-helixtrans-55.9-45.1176.900000112.3R112 L113A109-R112 PolarHBondContact O-N 3.34Å; A109-L113 PolarHBondContact O-N 2.9Å
110H93.2Very high90.3Very high149 Ų14967.5 Ų67.569%0.6940%0.396SS*.Hα-helixtrans-64-41.1176.2-60.596.8000112.5T108 R112 L113 L114T108-H110 VanDerWaalsContact C-N 3.31Å; T108-H110 PolarHBondContact O-N 3.19Å; H110-R112 VanDerWaalsContact C-N 3.32Å; H110-R112 PolarHBondContact O-N 3.37Å; H110-L113 PolarHBondContact O-N 2.82Å; H110-L114 WeakPolarHBondContact O-CG 3.49Å; H110-L114 PolarHBondContact O-N 3.24Å
111G91.6Very high90.6Very high19 Ų1972.5 Ų72.520%0.19641%0.405CS..Hα-helixtrans-63.8-38.4176.700000112.3T108 L114 C115T108-G111 PolarHBondContact O-N 3.17Å; T108-G111 VanDerWaalsContact O-N 3.13Å; T108-G111 PolarHBondContact OG1-N 2.94Å; T108-G111 VanDerWaalsContact OG1-N 3.09Å; G111-L114 PolarHBondContact O-N 3.38Å; G111-C115 VanDerWaalsContact O-CB 3.3Å; G111-C115 WeakPolarHBondContact O-CB 3.41Å; G111-C115 PolarHBondContact O-N 2.95Å
112R92.3Very high90.9Very high108 Ų10872.2 Ų72.241%0.40841%0.406SS..Hα-helixtrans-65.6-43.8174.2-67176.4-170.8178.15.1111.6P106 A107 T108 A109 H110 L114 C115 I116P106-R112 HydrophobicContact CB-CG 4.37Å; P106-R112 HydrophobicContact CG-CG 4.17Å; P106-R112 WeakPolarHBondContact O-CG 3.43Å; P106-R112 PolarHBondContact O-NE 3.05Å; P106-R112 VanDerWaalsContact O-NE 3.13Å; A107-R112 PolarHBondContact O-NH2 2.83Å; T108-R112 WeakPolarHBondContact O-CG 3.34Å; T108-R112 PolarHBondContact O-N 3.36Å; A109-R112 PolarHBondContact O-N 3.34Å; H110-R112 VanDerWaalsContact C-N 3.32Å; H110-R112 PolarHBondContact O-N 3.37Å; R112-L114 PolarHBondContact O-N 2.97Å; R112-C115 WeakPolarHBondContact O-CB 3.21Å; R112-C115 PolarHBondContact O-N 3.23Å; R112-I116 VanDerWaalsContact O-CG1 3.29Å; R112-I116 WeakPolarHBondContact O-CG1 3.39Å; R112-I116 PolarHBondContact O-N 3.38Å
113L96.4Very high91.4Very high100 Ų10071.3 Ų71.352%0.52439%0.392SS..Hα-helixtrans-60.4-45.8175.9-179.663.1000111.8A109 H110 C115 I116 L117A109-L113 PolarHBondContact O-N 2.9Å; H110-L113 PolarHBondContact O-N 2.82Å; L113-C115 VanDerWaalsContact C-N 3.33Å; L113-C115 PolarHBondContact O-N 3.48Å; L113-I116 PolarHBondContact O-N 3.33Å; L113-L117 PolarHBondContact O-N 3.2Å; L113-L117 VanDerWaalsContact O-N 3.08Å
114L95.7Very high92.3Very high119 Ų11970.5 Ų70.562%0.62339%0.392SS*.Hα-helixtrans-62.5-40.7175.6-72.3174.3000111.8H110 G111 R112 I116 L117 F118H110-L114 WeakPolarHBondContact O-CG 3.49Å; H110-L114 PolarHBondContact O-N 3.24Å; G111-L114 PolarHBondContact O-N 3.38Å; R112-L114 PolarHBondContact O-N 2.97Å; L114-I116 VanDerWaalsContact C-N 3.32Å; L114-I116 PolarHBondContact O-N 3.09Å; L114-L117 PolarHBondContact O-N 2.87Å; L114-F118 WeakPolarHBondContact O-CB 3.26Å; L114-F118 PolarHBondContact O-N 3.36Å
115C95.5Very high92.9Very high30 Ų3074.9 Ų74.920%0.20341%0.414CS..Hα-helixtrans-61.5-39.1175.3-1730000112.2P106 G111 R112 L113 F118 A119P106-C115 HydrophobicContact CG-CB 4Å; G111-C115 VanDerWaalsContact O-CB 3.3Å; G111-C115 WeakPolarHBondContact O-CB 3.41Å; G111-C115 PolarHBondContact O-N 2.95Å; R112-C115 WeakPolarHBondContact O-CB 3.21Å; R112-C115 PolarHBondContact O-N 3.23Å; L113-C115 VanDerWaalsContact C-N 3.33Å; L113-C115 PolarHBondContact O-N 3.48Å; C115-F118 PolarHBondContact O-N 3.48Å; C115-A119 WeakPolarHBondContact O-CB 3.33Å; C115-A119 PolarHBondContact O-N 3.41Å
116I96.1Very high93.5Very high110 Ų11073.6 Ų73.656%0.56441%0.407SS*.Hα-helixtrans-62.8-49.5175.9-69163.1000110.3R112 L113 L114 F118 A119 L120R112-I116 VanDerWaalsContact O-CG1 3.29Å; R112-I116 WeakPolarHBondContact O-CG1 3.39Å; R112-I116 PolarHBondContact O-N 3.38Å; L113-I116 PolarHBondContact O-N 3.33Å; L114-I116 VanDerWaalsContact C-N 3.32Å; L114-I116 PolarHBondContact O-N 3.09Å; I116-F118 VanDerWaalsContact C-N 3.31Å; I116-F118 PolarHBondContact O-N 3.5Å; I116-A119 PolarHBondContact O-N 3.26Å; I116-L120 WeakPolarHBondContact O-CB 3.42Å; I116-L120 PolarHBondContact O-N 3.48Å
117L97.1Very high93.9Very high84 Ų8478.4 Ų78.444%0.4443%0.43SS..Hα-helixtrans-62.5-40.8178.1-66.8174.4000111.7L113 L114 L120 F121L113-L117 PolarHBondContact O-N 3.2Å; L113-L117 VanDerWaalsContact O-N 3.08Å; L114-L117 PolarHBondContact O-N 2.87Å; L117-L120 PolarHBondContact O-N 3.49Å; L117-F121 WeakPolarHBondContact O-CD2 3.38Å; L117-F121 PolarHBondContact O-N 2.88Å
118F96.4Very high94.7Very high81 Ų8181 Ų8136%0.35544%0.436SS..Hα-helixtrans-62.8-46.5176.9176.3-108.8000112S92 T95 I96 L114 C115 I116 G122S92-F118 WeakPolarHBondContact O-CE1 3.45Å; T95-F118 HydrophobicContact CG2-CD1 3.98Å; T95-F118 HydrophobicContact CG2-CE1 4.11Å; I96-F118 HydrophobicContact CD1-CE1 4.07Å; I96-F118 HydrophobicContact CD1-CE2 3.87Å; I96-F118 HydrophobicContact CD1-CZ 3.3Å; I96-F118 HydrophobicContact CG1-CE1 3.62Å; I96-F118 HydrophobicContact CG1-CE2 4.2Å; I96-F118 HydrophobicContact CG1-CZ 3.39Å; L114-F118 WeakPolarHBondContact O-CB 3.26Å; L114-F118 PolarHBondContact O-N 3.36Å; C115-F118 PolarHBondContact O-N 3.48Å; I116-F118 VanDerWaalsContact C-N 3.31Å; I116-F118 PolarHBondContact O-N 3.5Å; F118-G122 WeakPolarHBondContact O-CA 3.45Å; F118-G122 PolarHBondContact O-N 3.47Å
119A96.2Very high95.2Very high27 Ų2780.5 Ų80.522%0.22343%0.433CS..Hα-helixtrans-66.7-37.1177.400000112.3T95 C115 I116 F121 G122 C123T95-A119 HydrophobicContact CG2-CB 4.2Å; C115-A119 WeakPolarHBondContact O-CB 3.33Å; C115-A119 PolarHBondContact O-N 3.41Å; I116-A119 PolarHBondContact O-N 3.26Å; A119-F121 VanDerWaalsContact C-N 3.31Å; A119-F121 PolarHBondContact O-N 2.97Å; A119-G122 PolarHBondContact O-N 3.4Å; A119-C123 WeakPolarHBondContact O-CB 3.49Å; A119-C123 PolarHBondContact O-N 2.95Å; A119-C123 PolarHBondContact O-SG 3.31Å
120L96.5Very high95.4Very high107 Ų10781.2 Ų81.256%0.5643%0.429SS*.Hα-helixtrans-57.4-41.6-179.9-179.366000112.6I116 L117 P124I116-L120 WeakPolarHBondContact O-CB 3.42Å; I116-L120 PolarHBondContact O-N 3.48Å; L117-L120 PolarHBondContact O-N 3.49Å; L120-P124 WeakPolarHBondContact O-CD 3.48Å; L120-P124 VanDerWaalsContact O-CG 3.26Å; L120-P124 WeakPolarHBondContact O-CG 3.39Å
121F96.1Very high95.5Very high151 Ų15175.9 Ų75.966%0.66241%0.414SS*.Hα-helixtrans-93.9-31.2177.1-64.3-72.2000113L117 A119 L125L117-F121 WeakPolarHBondContact O-CD2 3.38Å; L117-F121 PolarHBondContact O-N 2.88Å; A119-F121 VanDerWaalsContact C-N 3.31Å; A119-F121 PolarHBondContact O-N 2.97Å; F121-L125 WeakPolarHBondContact O-CB 3.37Å; F121-L125 PolarHBondContact O-N 3.29Å
122G96.4Very high95.7Very high8 Ų879.2 Ų79.28%0.08243%0.428CS..Hα-helixtrans-67.9-45.5-177.900000113.3F118 A119 L125 A126F118-G122 WeakPolarHBondContact O-CA 3.45Å; F118-G122 PolarHBondContact O-N 3.47Å; A119-G122 PolarHBondContact O-N 3.4Å; G122-L125 PolarHBondContact O-N 2.74Å; G122-A126 WeakPolarHBondContact O-CB 3.46Å; G122-A126 PolarHBondContact O-N 2.86Å
123C96.1Very high95.8Very high26 Ų2678.8 Ų78.818%0.17643%0.433CS..Hα-helixtrans-65.7-45.4-176.8-54.60000112.6T98 A119 L125 A126 I127T98-C123 HydrophobicContact CG2-CB 4.22Å; T98-C123 VanDerWaalsContact CG2-SG 3.55Å; A119-C123 WeakPolarHBondContact O-CB 3.49Å; A119-C123 PolarHBondContact O-N 2.95Å; A119-C123 PolarHBondContact O-SG 3.31Å; C123-L125 VanDerWaalsContact C-N 3.32Å; C123-L125 PolarHBondContact O-N 3.31Å; C123-A126 WeakPolarHBondContact O-CB 3.35Å; C123-A126 PolarHBondContact O-N 2.81Å; C123-I127 WeakPolarHBondContact O-CG1 3.31Å; C123-I127 PolarHBondContact O-N 3.25Å
124P96.4Very high95.5Very high66 Ų6675.8 Ų75.843%0.42943%0.426SS..Hα-helixtrans-59.7-41.5174.4-25.735.8000112.8L120 A126 I127 I128L120-P124 WeakPolarHBondContact O-CD 3.48Å; L120-P124 VanDerWaalsContact O-CG 3.26Å; L120-P124 WeakPolarHBondContact O-CG 3.39Å; P124-A126 VanDerWaalsContact C-N 3.34Å; P124-A126 PolarHBondContact O-N 3.4Å; P124-I127 PolarHBondContact O-N 3.47Å; P124-I128 WeakPolarHBondContact O-CG1 3.24Å; P124-I128 PolarHBondContact O-N 2.81Å; P124-I128 VanDerWaalsContact O-N 3.09Å
125L95.5Very high95.4Very high111 Ų11176.3 Ų76.358%0.58142%0.424SS*.Hα-helixtrans-61.9-44175.9-177.462.5000110.9F121 G122 C123 I127 I128 T129F121-L125 WeakPolarHBondContact O-CB 3.37Å; F121-L125 PolarHBondContact O-N 3.29Å; G122-L125 PolarHBondContact O-N 2.74Å; C123-L125 VanDerWaalsContact C-N 3.32Å; C123-L125 PolarHBondContact O-N 3.31Å; L125-I127 PolarHBondContact O-N 2.7Å; L125-I128 PolarHBondContact O-N 2.99Å; L125-T129 HydrophobicContact CD1-CG2 4.45Å; L125-T129 WeakPolarHBondContact O-CG2 3.18Å; L125-T129 PolarHBondContact O-N 2.99Å; L125-T129 PolarHBondContact O-OG1 3.25Å
126A95.1Very high95.3Very high11 Ų1181 Ų819%0.09144%0.441CS..Hα-helixtrans-57.7-49.3176.100000111.6I96 G122 C123 P124 I128 T129 V130I96-A126 HydrophobicContact CG2-CB 3.57Å; I96-A126 WeakPolarHBondContact O-CB 3.49Å; G122-A126 WeakPolarHBondContact O-CB 3.46Å; G122-A126 PolarHBondContact O-N 2.86Å; C123-A126 WeakPolarHBondContact O-CB 3.35Å; C123-A126 PolarHBondContact O-N 2.81Å; P124-A126 VanDerWaalsContact C-N 3.34Å; P124-A126 PolarHBondContact O-N 3.4Å; A126-I128 VanDerWaalsContact C-N 3.32Å; A126-I128 PolarHBondContact O-N 3.37Å; A126-T129 WeakPolarHBondContact CA-OG1 3.38Å; A126-T129 PolarHBondContact O-N 3.37Å; A126-T129 VanDerWaalsContact O-N 3.16Å; A126-T129 PolarHBondContact O-OG1 3.31Å; A126-V130 WeakPolarHBondContact O-CB 3.42Å; A126-V130 VanDerWaalsContact O-CG2 3.27Å; A126-V130 WeakPolarHBondContact O-CG2 3.4Å; A126-V130 PolarHBondContact O-N 3.46Å
127I95Very high95.1Very high125 Ų12579.6 Ų79.664%0.64143%0.434SS*.Hα-helixtrans-59.3-43.4-179.5-67.3165.9000111C123 P124 L125 V130 G131C123-I127 WeakPolarHBondContact O-CG1 3.31Å; C123-I127 PolarHBondContact O-N 3.25Å; P124-I127 PolarHBondContact O-N 3.47Å; L125-I127 PolarHBondContact O-N 2.7Å; I127-V130 PolarHBondContact O-N 2.95Å; I127-G131 PolarHBondContact O-N 2.58Å
128I96.1Very high94.7Very high105 Ų10578.7 Ų78.754%0.53843%0.434SS..Hα-helixtrans-61.6-49.3176.5-66.1165.7000110.1P124 L125 A126 V130 G131 D132P124-I128 WeakPolarHBondContact O-CG1 3.24Å; P124-I128 PolarHBondContact O-N 2.81Å; P124-I128 VanDerWaalsContact O-N 3.09Å; L125-I128 PolarHBondContact O-N 2.99Å; A126-I128 VanDerWaalsContact C-N 3.32Å; A126-I128 PolarHBondContact O-N 3.37Å; I128-V130 VanDerWaalsContact C-N 3.32Å; I128-V130 PolarHBondContact O-N 3.4Å; I128-G131 PolarHBondContact O-N 3.38Å; I128-G131 VanDerWaalsContact O-N 3.14Å; I128-D132 PolarHBondContact O-N 3.27Å
129T95.9Very high94.4Very high75 Ų7581.3 Ų81.346%0.4645%0.448SS..Hα-helixtrans-63-37.7179.859.20000112.9L125 A126 G131 D132 L133L125-T129 HydrophobicContact CD1-CG2 4.45Å; L125-T129 WeakPolarHBondContact O-CG2 3.18Å; L125-T129 PolarHBondContact O-N 2.99Å; L125-T129 PolarHBondContact O-OG1 3.25Å; A126-T129 WeakPolarHBondContact CA-OG1 3.38Å; A126-T129 PolarHBondContact O-N 3.37Å; A126-T129 VanDerWaalsContact O-N 3.16Å; A126-T129 PolarHBondContact O-OG1 3.31Å; T129-G131 VanDerWaalsContact C-N 3.35Å; T129-D132 PolarHBondContact O-N 3.23Å; T129-L133 VanDerWaalsContact O-CB 3.24Å; T129-L133 WeakPolarHBondContact O-CB 3.26Å; T129-L133 PolarHBondContact O-N 3.06Å
130V94.2Very high94.1Very high93 Ų9384.2 Ų84.256%0.56446%0.459SS*.Hα-helixtrans-66.7-38.9175.7169.50000110.4A126 I127 I128 G134A126-V130 WeakPolarHBondContact O-CB 3.42Å; A126-V130 VanDerWaalsContact O-CG2 3.27Å; A126-V130 WeakPolarHBondContact O-CG2 3.4Å; A126-V130 PolarHBondContact O-N 3.46Å; I127-V130 PolarHBondContact O-N 2.95Å; I128-V130 VanDerWaalsContact C-N 3.32Å; I128-V130 PolarHBondContact O-N 3.4Å; V130-G134 PolarHBondContact O-N 2.67Å
131G94.5Very high93.7Very high37 Ų3780.9 Ų80.938%0.38144%0.443SS..Hα-helixtrans-61.9-4517500000112.7I127 I128 T129 G134 K135I127-G131 PolarHBondContact O-N 2.58Å; I128-G131 PolarHBondContact O-N 3.38Å; I128-G131 VanDerWaalsContact O-N 3.14Å; T129-G131 VanDerWaalsContact C-N 3.35Å; G131-G134 PolarHBondContact O-N 3.42Å; G131-K135 PolarHBondContact O-N 3.19Å; G131-K135 VanDerWaalsContact O-N 3.14Å
132D95.4Very high93.3Very high90 Ų9076 Ų7648%0.48143%0.426SS..Hα-helixtrans-70.9-40.5178.4-70.4-23.1000112.2I128 T129 G134 K135 F136I128-D132 PolarHBondContact O-N 3.27Å; T129-D132 PolarHBondContact O-N 3.23Å; D132-G134 VanDerWaalsContact C-N 3.28Å; D132-G134 PolarHBondContact O-N 3.23Å; D132-K135 PolarHBondContact O-N 3.14Å; D132-K135 IonicContact OD1-NZ 2.75Å; D132-F136 PolarHBondContact O-N 3.42Å; D132-F136 VanDerWaalsContact O-N 3.15Å
133L94.6Very high92.9Very high98 Ų9881.1 Ų81.151%0.51345%0.447SS..Hα-helixtrans-61.3-39.4172.3-17761.7000111.3T129 K135 F136 L137T129-L133 VanDerWaalsContact O-CB 3.24Å; T129-L133 WeakPolarHBondContact O-CB 3.26Å; T129-L133 PolarHBondContact O-N 3.06Å; L133-K135 PolarHBondContact O-N 2.93Å; L133-F136 HydrophobicContact CD1-CD1 4.41Å; L133-F136 PolarHBondContact O-N 2.8Å; L133-L137 HydrophobicContact CD1-CG 4.42Å; L133-L137 HydrophobicContact CG-CD1 4.16Å; L133-L137 HydrophobicContact CG-CG 4.47Å; L133-L137 WeakPolarHBondContact O-CG 3.33Å; L133-L137 PolarHBondContact O-N 3.16Å
134G91.8Very high92.5Very high37 Ų3783.4 Ų83.438%0.38146%0.463SS..Hα-helixtrans-61.2-40.7176.600000112.8V130 G131 D132 L137 S138V130-G134 PolarHBondContact O-N 2.67Å; G131-G134 PolarHBondContact O-N 3.42Å; D132-G134 VanDerWaalsContact C-N 3.28Å; D132-G134 PolarHBondContact O-N 3.23Å; G134-L137 PolarHBondContact O-N 3Å; G134-S138 VanDerWaalsContact O-CB 3.31Å; G134-S138 WeakPolarHBondContact O-CB 3.23Å; G134-S138 PolarHBondContact O-N 2.97Å
135K91.8Very high92Very high131 Ų13183.2 Ų83.257%0.5745%0.454SS*.Hα-helixtrans-62.9-48.7174-69.9171.7-171.9160.70111.6G131 D132 L133 L137 S138 E139G131-K135 PolarHBondContact O-N 3.19Å; G131-K135 VanDerWaalsContact O-N 3.14Å; D132-K135 PolarHBondContact O-N 3.14Å; D132-K135 IonicContact OD1-NZ 2.75Å; L133-K135 PolarHBondContact O-N 2.93Å; K135-L137 VanDerWaalsContact C-N 3.32Å; K135-L137 PolarHBondContact O-N 3.43Å; K135-S138 WeakPolarHBondContact O-CB 3.26Å; K135-S138 PolarHBondContact O-N 3.01Å; K135-S138 VanDerWaalsContact O-N 3.15Å; K135-E139 WeakPolarHBondContact O-CG 3.4Å; K135-E139 PolarHBondContact O-N 3.39Å
136F94Very high91.4Very high127 Ų12781.6 Ų81.656%0.55745%0.446SS*.Hα-helixtrans-57.5-45.3177.5172.3-103.1000112D132 L133 E139 L140D132-F136 PolarHBondContact O-N 3.42Å; D132-F136 VanDerWaalsContact O-N 3.15Å; L133-F136 HydrophobicContact CD1-CD1 4.41Å; L133-F136 PolarHBondContact O-N 2.8Å; F136-E139 PolarHBondContact O-N 3.33Å; F136-L140 PolarHBondContact O-N 2.73Å; F136-L140 VanDerWaalsContact O-N 3.09Å
137L91.3Very high91Very high82 Ų8288 Ų8843%0.42947%0.472SS..Hα-helixtrans-66.3-39.7176.7-69.6176.4000112L133 G134 K135 L140 V141L133-L137 HydrophobicContact CD1-CG 4.42Å; L133-L137 HydrophobicContact CG-CD1 4.16Å; L133-L137 HydrophobicContact CG-CG 4.47Å; L133-L137 WeakPolarHBondContact O-CG 3.33Å; L133-L137 PolarHBondContact O-N 3.16Å; G134-L137 PolarHBondContact O-N 3Å; K135-L137 VanDerWaalsContact C-N 3.32Å; K135-L137 PolarHBondContact O-N 3.43Å; L137-L140 WeakPolarHBondContact O-CB 3.41Å; L137-L140 PolarHBondContact O-N 3.26Å; L137-V141 WeakPolarHBondContact O-CG2 3.43Å; L137-V141 PolarHBondContact O-N 2.94Å
138S89.7Confident90.5Very high64 Ų6484 Ų8445%0.44846%0.461SS..Hα-helixtrans-61.9-43.6176.6-174.40000111.5G134 K135 L140 V141 V142G134-S138 VanDerWaalsContact O-CB 3.31Å; G134-S138 WeakPolarHBondContact O-CB 3.23Å; G134-S138 PolarHBondContact O-N 2.97Å; K135-S138 WeakPolarHBondContact O-CB 3.26Å; K135-S138 PolarHBondContact O-N 3.01Å; K135-S138 VanDerWaalsContact O-N 3.15Å; S138-L140 VanDerWaalsContact C-N 3.32Å; S138-L140 PolarHBondContact O-N 3.36Å; S138-V141 PolarHBondContact O-N 2.87Å; S138-V142 WeakPolarHBondContact O-CB 3.27Å; S138-V142 VanDerWaalsContact O-CG2 3.26Å; S138-V142 WeakPolarHBondContact O-CG2 3.5Å; S138-V142 PolarHBondContact O-N 3.2Å
139E90Very high89.8Confident136 Ų13682.6 Ų82.664%0.63645%0.449SS*.Hα-helixtrans-61.1-41.6175.3-72.2173.8-16800111.6K135 F136 V142 H143K135-E139 WeakPolarHBondContact O-CG 3.4Å; K135-E139 PolarHBondContact O-N 3.39Å; F136-E139 PolarHBondContact O-N 3.33Å; E139-V142 PolarHBondContact O-N 3.08Å; E139-H143 VanDerWaalsContact O-CB 3.26Å; E139-H143 WeakPolarHBondContact O-CB 3.3Å; E139-H143 PolarHBondContact O-N 2.96Å
140L90Very high89.2Confident88 Ų8886.5 Ų86.546%0.46146%0.459SS..Hα-helixtrans-63.3-44.2174.8-17668.7000111.8F136 L137 S138 H143 C144F136-L140 PolarHBondContact O-N 2.73Å; F136-L140 VanDerWaalsContact O-N 3.09Å; L137-L140 WeakPolarHBondContact O-CB 3.41Å; L137-L140 PolarHBondContact O-N 3.26Å; S138-L140 VanDerWaalsContact C-N 3.32Å; S138-L140 PolarHBondContact O-N 3.36Å; L140-H143 PolarHBondContact O-N 2.83Å; L140-C144 WeakPolarHBondContact O-CB 3.47Å; L140-C144 PolarHBondContact O-N 3.49Å; L140-C144 PolarHBondContact O-SG 2.71Å
141V88.1Confident88.9Confident37 Ų3787.8 Ų87.822%0.22446%0.463CS..Hα-helixtrans-63.4-46.6178170.70000110.5L137 S138 H143 C144 Y145 V196 V200L137-V141 WeakPolarHBondContact O-CG2 3.43Å; L137-V141 PolarHBondContact O-N 2.94Å; S138-V141 PolarHBondContact O-N 2.87Å; V141-H143 VanDerWaalsContact C-N 3.32Å; V141-H143 PolarHBondContact O-N 3.41Å; V141-C144 PolarHBondContact O-N 2.91Å; V141-Y145 VanDerWaalsContact O-CB 3.23Å; V141-Y145 WeakPolarHBondContact O-CB 3.39Å; V141-Y145 PolarHBondContact O-N 2.91Å; V141-V196 HydrophobicContact CG1-CG1 4.2Å; V141-V200 HydrophobicContact CG2-CG2 4.34Å
142V86.8Confident88.3Confident49 Ų4991.6 Ų91.630%0.29747%0.469SS..Hα-helixtrans-60.9-42.9176171.60000110.8S138 E139 Y145 N146 I192S138-V142 WeakPolarHBondContact O-CB 3.27Å; S138-V142 VanDerWaalsContact O-CG2 3.26Å; S138-V142 WeakPolarHBondContact O-CG2 3.5Å; S138-V142 PolarHBondContact O-N 3.2Å; E139-V142 PolarHBondContact O-N 3.08Å; V142-Y145 PolarHBondContact O-N 3.24Å; V142-N146 WeakPolarHBondContact CG1-ND2 3.33Å; V142-N146 VanDerWaalsContact O-CB 3.3Å; V142-N146 WeakPolarHBondContact O-CB 3.48Å; V142-N146 VanDerWaalsContact O-CG 3.24Å; V142-N146 PolarHBondContact O-N 3.25Å; V142-N146 PolarHBondContact O-ND2 2.66Å; V142-I192 HydrophobicContact CG2-CD1 3.42Å; V142-I192 VanDerWaalsContact CG2-CD1 3.42Å; V142-I192 HydrophobicContact CG2-CG1 4.32Å
143H88Confident87.6Confident116 Ų11691 Ų9154%0.53746%0.462SS..Hα-helixtrans-60.6-48.6177-177.387000111.6E139 L140 V141 K147E139-H143 VanDerWaalsContact O-CB 3.26Å; E139-H143 WeakPolarHBondContact O-CB 3.3Å; E139-H143 PolarHBondContact O-N 2.96Å; L140-H143 PolarHBondContact O-N 2.83Å; V141-H143 VanDerWaalsContact C-N 3.32Å; V141-H143 PolarHBondContact O-N 3.41Å; H143-K147 VanDerWaalsContact O-CB 3.32Å; H143-K147 WeakPolarHBondContact O-CB 3.33Å; H143-K147 PolarHBondContact O-N 3.28Å
144C88.2Confident87.2Confident74 Ų7488.9 Ų88.950%0.546%0.458SS..Hα-helixtrans-63.4-42.9177.1-73.10000111.9L140 V141 K147 G148L140-C144 WeakPolarHBondContact O-CB 3.47Å; L140-C144 PolarHBondContact O-N 3.49Å; L140-C144 PolarHBondContact O-SG 2.71Å; V141-C144 PolarHBondContact O-N 2.91Å; C144-K147 PolarHBondContact O-N 3.35Å; C144-G148 PolarHBondContact O-N 3.18Å
145Y85.7Confident86.9Confident61 Ų6190.1 Ų90.124%0.23946%0.458CS..Hα-helixtrans-60.4-51177.2179.3-101.4000111.1V141 V142 K147 G148 W149 V196V141-Y145 VanDerWaalsContact O-CB 3.23Å; V141-Y145 WeakPolarHBondContact O-CB 3.39Å; V141-Y145 PolarHBondContact O-N 2.91Å; V142-Y145 PolarHBondContact O-N 3.24Å; Y145-K147 VanDerWaalsContact C-N 3.31Å; Y145-K147 PolarHBondContact O-N 3Å; Y145-G148 PolarHBondContact O-N 2.84Å; Y145-W149 WeakPolarHBondContact O-CB 3.31Å; Y145-W149 PolarHBondContact O-N 3.23Å; Y145-V196 HydrophobicContact CD2-CG2 4.15Å; Y145-V196 HydrophobicContact CE2-CG2 4.12Å
146N84.2Confident86.3Confident78 Ų7886.4 Ų86.442%0.41744%0.444SS..Hα-helixtrans-63.7-36.3178.5-72.6-19.7000112.2V142 W149 K150V142-N146 WeakPolarHBondContact CG1-ND2 3.33Å; V142-N146 VanDerWaalsContact O-CB 3.3Å; V142-N146 WeakPolarHBondContact O-CB 3.48Å; V142-N146 VanDerWaalsContact O-CG 3.24Å; V142-N146 PolarHBondContact O-N 3.25Å; V142-N146 PolarHBondContact O-ND2 2.66Å; N146-W149 PolarHBondContact O-N 2.84Å; N146-K150 WeakPolarHBondContact O-CG 3.46Å; N146-K150 PolarHBondContact O-N 3.02Å
147K86.4Confident85.7Confident146 Ų14684 Ų8464%0.63543%0.434SS*.Hα-helixtrans-67.6-43.3175.1-168.8173.3-175.9177.60111.5H143 C144 Y145 W149 K150 L151H143-K147 VanDerWaalsContact O-CB 3.32Å; H143-K147 WeakPolarHBondContact O-CB 3.33Å; H143-K147 PolarHBondContact O-N 3.28Å; C144-K147 PolarHBondContact O-N 3.35Å; Y145-K147 VanDerWaalsContact C-N 3.31Å; Y145-K147 PolarHBondContact O-N 3Å; K147-W149 VanDerWaalsContact C-N 3.32Å; K147-K150 PolarHBondContact O-N 3.14Å; K147-L151 PolarHBondContact O-N 3.26Å
148G84.9Confident85.2Confident40 Ų4087.8 Ų87.841%0.41244%0.444SS..Hα-helixtrans-62.1-39.8173.400000112.2C144 Y145 L151 K152C144-G148 PolarHBondContact O-N 3.18Å; Y145-G148 PolarHBondContact O-N 2.84Å; G148-L151 PolarHBondContact O-N 3.22Å; G148-K152 WeakPolarHBondContact O-CB 3.42Å; G148-K152 PolarHBondContact O-N 2.97Å
149W80.6Confident84.6Confident76 Ų7690.1 Ų90.129%0.28845%0.45SS..Hα-helixtrans-62.1-47.4174.9-174-96.5000112.1Y145 N146 K147 L151 K152 K153Y145-W149 WeakPolarHBondContact O-CB 3.31Å; Y145-W149 PolarHBondContact O-N 3.23Å; N146-W149 PolarHBondContact O-N 2.84Å; K147-W149 VanDerWaalsContact C-N 3.32Å; W149-L151 VanDerWaalsContact C-N 3.29Å; W149-L151 PolarHBondContact O-N 3.18Å; W149-K152 PolarHBondContact O-N 3.46Å; W149-K153 WeakPolarHBondContact O-CB 3.35Å; W149-K153 PolarHBondContact O-N 3.38Å
150K83.8Confident83.8Confident156 Ų15686.1 Ų86.168%0.67844%0.44SS*.Hα-helixtrans-58.8-41.6175.1-74177.2-177.3-175.80112N146 K147 K153 A154N146-K150 WeakPolarHBondContact O-CG 3.46Å; N146-K150 PolarHBondContact O-N 3.02Å; K147-K150 PolarHBondContact O-N 3.14Å; K150-K153 PolarHBondContact O-N 2.81Å; K150-A154 WeakPolarHBondContact O-CB 3.4Å; K150-A154 PolarHBondContact O-N 3.28Å
151L86.8Confident82.9Confident121 Ų12189.1 Ų89.163%0.63445%0.451SS*.Hα-helixtrans-64.5-46.3176.2-171.670.2000111.2K147 G148 W149 K153 A154 V155K147-L151 PolarHBondContact O-N 3.26Å; G148-L151 PolarHBondContact O-N 3.22Å; W149-L151 VanDerWaalsContact C-N 3.29Å; W149-L151 PolarHBondContact O-N 3.18Å; L151-K153 VanDerWaalsContact C-N 3.34Å; L151-K153 PolarHBondContact O-N 3.42Å; L151-A154 PolarHBondContact O-N 2.95Å; L151-V155 VanDerWaalsContact O-CG2 3.31Å; L151-V155 WeakPolarHBondContact O-CG2 3.36Å; L151-V155 PolarHBondContact O-N 3.39Å
152K82.9Confident82Confident117 Ų11791.5 Ų91.551%0.50947%0.466SS..Hα-helixtrans-59.7-44177.1-172.6-173.5176.4-167.40111.5G148 W149 V155 I156G148-K152 WeakPolarHBondContact O-CB 3.42Å; G148-K152 PolarHBondContact O-N 2.97Å; W149-K152 PolarHBondContact O-N 3.46Å; K152-V155 PolarHBondContact O-N 3.29Å; K152-I156 HydrophobicContact CG-CD1 4.1Å; K152-I156 WeakPolarHBondContact O-CG1 3.49Å; K152-I156 PolarHBondContact O-N 3.14Å
153K80.8Confident80.9Confident78 Ų7892.8 Ų92.834%0.33948%0.477SS..Hα-helixtrans-58.7-48.9175.5-179.5173.8172.9172.20111.3W149 K150 L151 V155 I156 E157 I186W149-K153 WeakPolarHBondContact O-CB 3.35Å; W149-K153 PolarHBondContact O-N 3.38Å; K150-K153 PolarHBondContact O-N 2.81Å; L151-K153 VanDerWaalsContact C-N 3.34Å; L151-K153 PolarHBondContact O-N 3.42Å; K153-V155 VanDerWaalsContact C-N 3.28Å; K153-V155 PolarHBondContact O-N 3.43Å; K153-I156 PolarHBondContact O-N 2.87Å; K153-E157 WeakPolarHBondContact CE-OE1 3.3Å; K153-E157 IonicContact NZ-OE1 3.83Å; K153-E157 PolarHBondContact O-N 2.6Å; K153-I186 HydrophobicContact CD-CD1 4.18Å
154A85.3Confident79.3Confident52 Ų5294.5 Ų94.543%0.4348%0.48SS..Hα-helixtrans-60.4-36.5177.700000112.8K150 L151 Y158K150-A154 WeakPolarHBondContact O-CB 3.4Å; K150-A154 PolarHBondContact O-N 3.28Å; L151-A154 PolarHBondContact O-N 2.95Å; A154-Y158 WeakPolarHBondContact O-CB 3.32Å; A154-Y158 PolarHBondContact O-N 2.97Å; A154-Y158 VanDerWaalsContact O-N 3.12Å
155V84.7Confident78.1Confident63 Ų63100.4 Ų100.438%0.38250%0.497SS..Hα-helixtrans-67.5-43.1175.8172.50000111.5L151 K152 K153 Y158 M159L151-V155 VanDerWaalsContact O-CG2 3.31Å; L151-V155 WeakPolarHBondContact O-CG2 3.36Å; L151-V155 PolarHBondContact O-N 3.39Å; K152-V155 PolarHBondContact O-N 3.29Å; K153-V155 VanDerWaalsContact C-N 3.28Å; K153-V155 PolarHBondContact O-N 3.43Å; V155-Y158 PolarHBondContact O-N 2.91Å; V155-M159 HydrophobicContact CG1-CE 3.62Å; V155-M159 HydrophobicContact CG1-SD 4.01Å; V155-M159 VanDerWaalsContact O-CG 3.29Å; V155-M159 WeakPolarHBondContact O-CG 3.44Å; V155-M159 PolarHBondContact O-N 3.24Å
156I80.7Confident76.9Confident54 Ų54102.5 Ų102.528%0.27752%0.521SS..Hα-helixtrans-65.4-44.5178.5-68.1168.8000110.8K152 K153 Y158 M159 A160 L185K152-I156 HydrophobicContact CG-CD1 4.1Å; K152-I156 WeakPolarHBondContact O-CG1 3.49Å; K152-I156 PolarHBondContact O-N 3.14Å; K153-I156 PolarHBondContact O-N 2.87Å; I156-Y158 VanDerWaalsContact C-N 3.34Å; I156-Y158 PolarHBondContact O-N 3.3Å; I156-M159 PolarHBondContact O-N 3.41Å; I156-A160 WeakPolarHBondContact O-CB 3.33Å; I156-A160 PolarHBondContact O-N 3.34Å; I156-L185 HydrophobicContact CD1-CD2 3.9Å
157E80.1Confident75.4Confident75 Ų75103.2 Ų103.235%0.3553%0.525SS..Hα-helixtrans-58-45.1176.1-74.8172.7170.700111.3K153 M159 A160 E161 Y182K153-E157 WeakPolarHBondContact CE-OE1 3.3Å; K153-E157 IonicContact NZ-OE1 3.83Å; K153-E157 PolarHBondContact O-N 2.6Å; E157-M159 PolarHBondContact O-N 2.93Å; E157-A160 PolarHBondContact O-N 3.49Å; E157-E161 PolarHBondContact O-N 2.73Å; E157-Y182 WeakPolarHBondContact CG-OH 3.24Å; E157-Y182 PolarHBondContact OE1-OH 3.03Å
158Y81.7Confident73.9Confident163 Ų163104.3 Ų104.364%0.63953%0.53SS*.Hα-helixtrans-61.9-41175.6177.9-101.8000113.3A154 V155 I156 T162A154-Y158 WeakPolarHBondContact O-CB 3.32Å; A154-Y158 PolarHBondContact O-N 2.97Å; A154-Y158 VanDerWaalsContact O-N 3.12Å; V155-Y158 PolarHBondContact O-N 2.91Å; I156-Y158 VanDerWaalsContact C-N 3.34Å; I156-Y158 PolarHBondContact O-N 3.3Å; Y158-T162 PolarHBondContact O-N 2.9Å; Y158-T162 PolarHBondContact O-OG1 3.28Å
159M77.4Confident72.5Confident113 Ų113108.5 Ų108.556%0.55755%0.547SS*.Hα-helixtrans-68.2-39.8177.4-72.6176.7175.700111.8V155 I156 E157 T162 S163V155-M159 HydrophobicContact CG1-CE 3.62Å; V155-M159 HydrophobicContact CG1-SD 4.01Å; V155-M159 VanDerWaalsContact O-CG 3.29Å; V155-M159 WeakPolarHBondContact O-CG 3.44Å; V155-M159 PolarHBondContact O-N 3.24Å; I156-M159 PolarHBondContact O-N 3.41Å; E157-M159 PolarHBondContact O-N 2.93Å; M159-T162 PolarHBondContact O-N 3.42Å; M159-S163 PolarHBondContact O-N 3.02Å; M159-S163 PolarHBondContact O-OG 2.99Å
160A73.4Confident71.3Confident52 Ų52110.1 Ų110.143%0.4356%0.561SS.*Hα-helixtrans-64.7-43.7178.200000111.7I156 E157 T162 S163 Y164I156-A160 WeakPolarHBondContact O-CB 3.33Å; I156-A160 PolarHBondContact O-N 3.34Å; E157-A160 PolarHBondContact O-N 3.49Å; A160-T162 VanDerWaalsContact C-N 3.29Å; A160-T162 PolarHBondContact O-N 3.31Å; A160-S163 WeakPolarHBondContact O-CB 3.36Å; A160-S163 PolarHBondContact O-N 3.08Å; A160-S163 VanDerWaalsContact O-N 3.11Å; A160-Y164 PolarHBondContact O-N 3.42Å
161E71.1Confident70Confident151 Ų151107.4 Ų107.471%0.70655%0.55SS**Hα-helixtrans-60.6-38.8175-76.2-175172.600112.3E157 S163 Y164E157-E161 PolarHBondContact O-N 2.73Å; E161-S163 VanDerWaalsContact C-N 3.31Å; E161-S163 PolarHBondContact O-N 3.43Å; E161-Y164 PolarHBondContact O-N 3.18Å
162T68.5Low68.5Low87 Ų87108.4 Ų108.453%0.53456%0.556SS.*Hα-helixtrans-67.2-32.9176-56.40000112.1Y158 M159 A160Y158-T162 PolarHBondContact O-N 2.9Å; Y158-T162 PolarHBondContact O-OG1 3.28Å; M159-T162 PolarHBondContact O-N 3.42Å; A160-T162 VanDerWaalsContact C-N 3.29Å; A160-T162 PolarHBondContact O-N 3.31Å
163S63.4Low67.1Low76 Ų76114.4 Ų114.453%0.53158%0.576SS.*Hα-helixtrans-75.6-34.7179.9-49.80000112.3M159 A160 E161 F165 S166M159-S163 PolarHBondContact O-N 3.02Å; M159-S163 PolarHBondContact O-OG 2.99Å; A160-S163 WeakPolarHBondContact O-CB 3.36Å; A160-S163 PolarHBondContact O-N 3.08Å; A160-S163 VanDerWaalsContact O-N 3.11Å; E161-S163 VanDerWaalsContact C-N 3.31Å; E161-S163 PolarHBondContact O-N 3.43Å; S163-F165 VanDerWaalsContact C-N 3.29Å; S163-F165 PolarHBondContact O-N 3.46Å; S163-S166 PolarHBondContact O-N 3.43Å; S163-S166 VanDerWaalsContact O-N 3.16Å
164Y55.2Low66.2Low152 Ų152114.9 Ų114.960%0.59658%0.582SS**Hα-helixtrans-67-25.1-178.8-165.6-103.2000113.6A160 E161 S166 Q171A160-Y164 PolarHBondContact O-N 3.42Å; E161-Y164 PolarHBondContact O-N 3.18Å; Y164-S166 PolarHBondContact O-N 3.38Å; Y164-Q171 PolarHBondContact OH-NE2 3.46Å
165F62.4Low65.2Low197 Ų197116 Ų11686%0.86459%0.587SS**THydrogen-bonded Turntrans-68.4-23.3175-170.6-102.3000113S163S163-F165 VanDerWaalsContact C-N 3.29Å; S163-F165 PolarHBondContact O-N 3.46Å
166S60.3Low64.4Low105 Ų105119 Ų11973%0.73460%0.601SS**THydrogen-bonded Turntrans-86.3-19-178.5-168.10000114.2S163 Y164S163-S166 PolarHBondContact O-N 3.43Å; S163-S166 VanDerWaalsContact O-N 3.16Å; Y164-S166 PolarHBondContact O-N 3.38Å
167D52.7Low63.9Low94 Ų94122.2 Ų122.250%0.50362%0.618SS.*  trans-124.437.6-163.3-153.89000114.8T169D167-T169 PolarHBondContact O-N 3.07Å
168K56Low63.4Low169 Ų169124.4 Ų124.474%0.73563%0.631SS**THydrogen-bonded Turntrans-66.112.9178.5-147.7179-175.4178.90114.4
169T55.3Low62.7Low127 Ų127119.3 Ų119.378%0.77962%0.62SS**THydrogen-bonded Turntrans-109.5-12.2-168.9-26.90000113.8D167D167-T169 PolarHBondContact O-N 3.07Å
170I55.6Low62.3Low111 Ų111118.9 Ų118.957%0.56962%0.619SS**SBendtrans-131.966.1-175.4-48.1-179.5000110
171Q56.2Low62.1Low98 Ų98122.1 Ų122.146%0.45863%0.625SS.*  trans-96.4-11.5-157.5-144175.81.400117.7Y164Y164-Q171 PolarHBondContact OH-NE2 3.46Å
172N53.8Low61.9Low143 Ų143119 Ų11977%0.76561%0.608SS**SBendtrans-117-10.5-162.4-79.64.1000118.1
173W54.2Low61.8Low242 Ų242120.3 Ų120.392%0.91761%0.608SS**SBendtrans-117.3-15.9179.6-70.185.9000114.3
174D62.6Low62Low88 Ų88122.2 Ų122.247%0.47161%0.612SS.*SBendtrans-92.7-13.1-178.9-75.2-37.1000114.2D176 L177 L178D174-D176 PolarHBondContact O-N 3.28Å; D174-L177 PolarHBondContact O-N 2.87Å; D174-L178 VanDerWaalsContact O-CB 3.28Å; D174-L178 WeakPolarHBondContact O-CB 3.28Å; D174-L178 PolarHBondContact O-N 3.43Å
175S63.4Low62.6Low77 Ų77118.6 Ų118.654%0.53860%0.602SS.*Hα-helixtrans-65.7-35.8-173.4-167.90000113.5S179S175-S179 WeakPolarHBondContact O-CB 3.29Å; S175-S179 PolarHBondContact O-N 3Å; S175-S179 PolarHBondContact O-OG 3.35Å
176D67.9Low62.6Low126 Ų126111.5 Ų111.567%0.67457%0.573SS**Hα-helixtrans-78.1-31.9179.4-73.1-21000112.2D174 S179 L180D174-D176 PolarHBondContact O-N 3.28Å; D176-S179 WeakPolarHBondContact CA-OG 3.39Å; D176-S179 PolarHBondContact O-OG 3.04Å; D176-L180 WeakPolarHBondContact O-CG 3.49Å; D176-L180 PolarHBondContact O-N 3.12Å; D176-L180 VanDerWaalsContact O-N 3.14Å
177L70.1Confident62.5Low121 Ų121111.7 Ų111.763%0.63457%0.565SS**Hα-helixtrans-72.9-38.7175.4-164.576.8000111D174 H181D174-L177 PolarHBondContact O-N 2.87Å; L177-H181 PolarHBondContact O-N 2.92Å
178L70Confident62.9Low120 Ų120109.5 Ų109.563%0.62856%0.564SS**Hα-helixtrans-68.9-38.2176.6-169.671.5000111.6D174 H181 Y182D174-L178 VanDerWaalsContact O-CB 3.28Å; D174-L178 WeakPolarHBondContact O-CB 3.28Å; D174-L178 PolarHBondContact O-N 3.43Å; L178-H181 PolarHBondContact O-N 3.34Å; L178-Y182 WeakPolarHBondContact O-CB 3.42Å; L178-Y182 PolarHBondContact O-N 3.32Å
179S67.2Low63Low56 Ų56109.2 Ų109.239%0.39257%0.566SS.*Hα-helixtrans-68-37.4176.467.90000112.2S175 D176 Y182 E183S175-S179 WeakPolarHBondContact O-CB 3.29Å; S175-S179 PolarHBondContact O-N 3Å; S175-S179 PolarHBondContact O-OG 3.35Å; D176-S179 WeakPolarHBondContact CA-OG 3.39Å; D176-S179 PolarHBondContact O-OG 3.04Å; S179-Y182 WeakPolarHBondContact O-CB 3.47Å; S179-Y182 PolarHBondContact O-N 3.17Å; S179-E183 PolarHBondContact O-N 2.9Å
180L68.9Low63.1Low104 Ų104106.7 Ų106.755%0.54557%0.565SS.*Hα-helixtrans-64.1-45171.2-82.8166.1000112.2D176 Y182 E183 D184D176-L180 WeakPolarHBondContact O-CG 3.49Å; D176-L180 PolarHBondContact O-N 3.12Å; D176-L180 VanDerWaalsContact O-N 3.14Å; L180-Y182 PolarHBondContact O-N 3.41Å; L180-E183 PolarHBondContact O-N 3.26Å; L180-D184 PolarHBondContact O-N 3.15Å
181H70Confident63.6Low121 Ų121107.2 Ų107.256%0.5657%0.569SS**Hα-helixtrans-62.5-33.8175.2-171.467.7000112.2L177 L178 L185L177-H181 PolarHBondContact O-N 2.92Å; L178-H181 PolarHBondContact O-N 3.34Å; H181-L185 WeakPolarHBondContact O-CB 3.2Å; H181-L185 PolarHBondContact O-N 3.2Å; H181-L185 VanDerWaalsContact O-N 3.09Å
182Y66.2Low64.5Low85 Ų85105.3 Ų105.333%0.33356%0.561SS.*Hα-helixtrans-69.4-43.2175.6-171.8-100000112.3E157 L178 S179 L180 L185 I186E157-Y182 WeakPolarHBondContact CG-OH 3.24Å; E157-Y182 PolarHBondContact OE1-OH 3.03Å; L178-Y182 WeakPolarHBondContact O-CB 3.42Å; L178-Y182 PolarHBondContact O-N 3.32Å; S179-Y182 WeakPolarHBondContact O-CB 3.47Å; S179-Y182 PolarHBondContact O-N 3.17Å; L180-Y182 PolarHBondContact O-N 3.41Å; Y182-L185 PolarHBondContact O-N 3.42Å; Y182-I186 HydrophobicContact CD1-CD1 3.89Å; Y182-I186 HydrophobicContact CE1-CD1 3.29Å; Y182-I186 HydrophobicContact CE1-CG1 4.45Å; Y182-I186 HydrophobicContact CE2-CD1 4.09Å; Y182-I186 WeakPolarHBondContact O-CG1 3.36Å; Y182-I186 PolarHBondContact O-N 3.23Å
183E67.2Low65.8Low115 Ų115101.2 Ų101.254%0.53754%0.544SS..Hα-helixtrans-62.5-45.5174.2-80-120.1132.500111.4S179 L180 L185 I186 L187S179-E183 PolarHBondContact O-N 2.9Å; L180-E183 PolarHBondContact O-N 3.26Å; E183-L185 VanDerWaalsContact C-N 3.3Å; E183-L185 PolarHBondContact O-N 2.96Å; E183-I186 PolarHBondContact O-N 3.15Å; E183-I186 VanDerWaalsContact O-N 3.11Å; E183-L187 HydrophobicContact CB-CD1 4.27Å; E183-L187 VanDerWaalsContact O-CB 3.22Å; E183-L187 WeakPolarHBondContact O-CB 3.27Å; E183-L187 WeakPolarHBondContact O-CG 3.35Å; E183-L187 PolarHBondContact O-N 2.86Å
184D67.8Low67.2Low116 Ų11692.9 Ų92.962%0.6253%0.527SS*.Hα-helixtrans-62.7-35176.8-77.8-22000112.5L180 I186 G188L180-D184 PolarHBondContact O-N 3.15Å; D184-I186 VanDerWaalsContact C-N 3.3Å; D184-I186 PolarHBondContact O-N 3.32Å; D184-G188 PolarHBondContact O-N 2.91Å
185L66.9Low68.3Low75 Ų7591.9 Ų91.939%0.39353%0.526SS..Hα-helixtrans-68-29.8176.2-130.298.2000112.9I156 H181 Y182 E183I156-L185 HydrophobicContact CD1-CD2 3.9Å; H181-L185 WeakPolarHBondContact O-CB 3.2Å; H181-L185 PolarHBondContact O-N 3.2Å; H181-L185 VanDerWaalsContact O-N 3.09Å; Y182-L185 PolarHBondContact O-N 3.42Å; E183-L185 VanDerWaalsContact C-N 3.3Å; E183-L185 PolarHBondContact O-N 2.96Å
186I62.6Low69.5Low49 Ų4989.9 Ų89.925%0.25151%0.511SS..Hα-helixtrans-94.4-33.2-176.8-67.8-173.9000112.1K153 Y182 E183 D184K153-I186 HydrophobicContact CD-CD1 4.18Å; Y182-I186 HydrophobicContact CD1-CD1 3.89Å; Y182-I186 HydrophobicContact CE1-CD1 3.29Å; Y182-I186 HydrophobicContact CE1-CG1 4.45Å; Y182-I186 HydrophobicContact CE2-CD1 4.09Å; Y182-I186 WeakPolarHBondContact O-CG1 3.36Å; Y182-I186 PolarHBondContact O-N 3.23Å; E183-I186 PolarHBondContact O-N 3.15Å; E183-I186 VanDerWaalsContact O-N 3.11Å; D184-I186 VanDerWaalsContact C-N 3.3Å; D184-I186 PolarHBondContact O-N 3.32Å
187L58.8Low70.5Confident109 Ų10988.1 Ų88.157%0.57151%0.505SS*.Hα-helixtrans-90.8-4.6-178.2-69.6172.9000113.6E183 E189E183-L187 HydrophobicContact CB-CD1 4.27Å; E183-L187 VanDerWaalsContact O-CB 3.22Å; E183-L187 WeakPolarHBondContact O-CB 3.27Å; E183-L187 WeakPolarHBondContact O-CG 3.35Å; E183-L187 PolarHBondContact O-N 2.86Å; L187-E189 WeakPolarHBondContact O-CA 3.37Å; L187-E189 PolarHBondContact O-N 3.39Å
188G59.7Low71.5Confident47 Ų4787 Ų8749%0.48550%0.498SS..SBendtrans-46.1108.916800000109.5D184D184-G188 PolarHBondContact O-N 2.91Å
189E59Low72.5Confident163 Ų16384.1 Ų84.176%0.76249%0.488SS*.  trans-47.9137.4-155.5-75.7173.1139.300112.8L187 D191L187-E189 WeakPolarHBondContact O-CA 3.37Å; L187-E189 PolarHBondContact O-N 3.39Å; E189-D191 PolarHBondContact O-N 3.28Å
190G57.8Low73.7Confident74 Ų7484.8 Ų84.876%0.76349%0.49SS*.  trans-65.426.7-176.800000115.6
191D65.4Low74.8Confident123 Ų12383.2 Ų83.266%0.65848%0.479SS*.  trans-78.6128.5170.8-70.9-20.5000109.1E189 S193E189-D191 PolarHBondContact O-N 3.28Å; D191-S193 PolarHBondContact O-N 3.47Å
192I74.7Confident76Confident57 Ų5781.3 Ų81.329%0.29247%0.472SS..  trans-58.6109.5173.2-58.9170.5000106.8V142 A194 V196 V197V142-I192 HydrophobicContact CG2-CD1 3.42Å; V142-I192 VanDerWaalsContact CG2-CD1 3.42Å; V142-I192 HydrophobicContact CG2-CG1 4.32Å; I192-A194 PolarHBondContact O-N 3.48Å; I192-V196 HydrophobicContact CG2-CB 3.88Å; I192-V196 HydrophobicContact CG2-CG1 4.08Å; I192-V197 HydrophobicContact CG2-CG2 3.94Å
193S81.4Confident77.4Confident58 Ų5882 Ų8241%0.40648%0.481SS..  trans-53.6133.6177.6-179.10000109.2D191 S195 V196D191-S193 PolarHBondContact O-N 3.47Å; S193-S195 WeakPolarHBondContact CB-OG 3.44Å; S193-S195 PolarHBondContact O-N 2.89Å; S193-S195 PolarHBondContact OG-OG 2.8Å; S193-V196 WeakPolarHBondContact O-CB 3.31Å; S193-V196 PolarHBondContact O-N 2.79Å
194A84.3Confident78.7Confident67 Ų6783.6 Ų83.655%0.55448%0.483SS*.Hα-helixtrans-51.2-28.217600000112.1I192 V196 V197 I198I192-A194 PolarHBondContact O-N 3.48Å; A194-V196 VanDerWaalsContact C-N 3.31Å; A194-V196 PolarHBondContact O-N 2.93Å; A194-V197 PolarHBondContact O-N 2.75Å; A194-I198 VanDerWaalsContact O-CG1 3.27Å; A194-I198 WeakPolarHBondContact O-CG1 3.41Å; A194-I198 PolarHBondContact O-N 2.87Å
195S85Confident80Confident66 Ų6678 Ų7846%0.46245%0.453SS..Hα-helixtrans-57.4-38.5172.866.10000113.6S193 S199S193-S195 WeakPolarHBondContact CB-OG 3.44Å; S193-S195 PolarHBondContact O-N 2.89Å; S193-S195 PolarHBondContact OG-OG 2.8Å; S195-S199 VanDerWaalsContact O-CB 3.28Å; S195-S199 WeakPolarHBondContact O-CB 3.5Å; S195-S199 PolarHBondContact O-N 2.93Å; S195-S199 PolarHBondContact O-OG 3.27Å
196V88.1Confident81.4Confident36 Ų3677.2 Ų77.222%0.21845%0.451CS..Hα-helixtrans-66.9-46.1178.1177.80000110.1V141 Y145 I192 S193 A194 S199 V200V141-V196 HydrophobicContact CG1-CG1 4.2Å; Y145-V196 HydrophobicContact CD2-CG2 4.15Å; Y145-V196 HydrophobicContact CE2-CG2 4.12Å; I192-V196 HydrophobicContact CG2-CB 3.88Å; I192-V196 HydrophobicContact CG2-CG1 4.08Å; S193-V196 WeakPolarHBondContact O-CB 3.31Å; S193-V196 PolarHBondContact O-N 2.79Å; A194-V196 VanDerWaalsContact C-N 3.31Å; A194-V196 PolarHBondContact O-N 2.93Å; V196-S199 WeakPolarHBondContact O-CB 3.31Å; V196-S199 PolarHBondContact O-N 2.87Å; V196-V200 WeakPolarHBondContact O-CG2 3.2Å; V196-V200 PolarHBondContact O-N 2.88Å
197V88.8Confident83Confident88 Ų8879.9 Ų79.953%0.53347%0.465SS..Hα-helixtrans-62.9-46.6179.3-176.90000110.8I192 A194 S199 V200 F201I192-V197 HydrophobicContact CG2-CG2 3.94Å; A194-V197 PolarHBondContact O-N 2.75Å; V197-S199 VanDerWaalsContact C-N 3.3Å; V197-S199 PolarHBondContact O-N 3.48Å; V197-V200 PolarHBondContact O-N 2.67Å; V197-F201 PolarHBondContact O-N 2.94Å
198I91.5Very high84.8Confident98 Ų9875.7 Ų75.750%0.50345%0.448SS..Hα-helixtrans-61-41.3176.4-67.1166000110.6A194 F201 L202A194-I198 VanDerWaalsContact O-CG1 3.27Å; A194-I198 WeakPolarHBondContact O-CG1 3.41Å; A194-I198 PolarHBondContact O-N 2.87Å; I198-F201 PolarHBondContact O-N 2.9Å; I198-L202 HydrophobicContact CG2-CD1 3.92Å; I198-L202 HydrophobicContact CG2-CG 4.31Å; I198-L202 WeakPolarHBondContact O-CG 3.45Å; I198-L202 PolarHBondContact O-N 3.17Å
199S91.5Very high86.5Confident60 Ų6073.4 Ų73.442%0.4243%0.425SS..Hα-helixtrans-63-44.2178-610000111.8S195 V196 V197 F201 L202 I203S195-S199 VanDerWaalsContact O-CB 3.28Å; S195-S199 WeakPolarHBondContact O-CB 3.5Å; S195-S199 PolarHBondContact O-N 2.93Å; S195-S199 PolarHBondContact O-OG 3.27Å; V196-S199 WeakPolarHBondContact O-CB 3.31Å; V196-S199 PolarHBondContact O-N 2.87Å; V197-S199 VanDerWaalsContact C-N 3.3Å; V197-S199 PolarHBondContact O-N 3.48Å; S199-F201 VanDerWaalsContact C-N 3.34Å; S199-F201 PolarHBondContact O-N 3.25Å; S199-L202 PolarHBondContact O-N 2.8Å; S199-I203 WeakPolarHBondContact O-CB 3.43Å; S199-I203 WeakPolarHBondContact O-CD1 3.4Å; S199-I203 WeakPolarHBondContact O-CG1 3.34Å; S199-I203 PolarHBondContact O-N 3.38Å
200V92.5Very high88.3Confident69 Ų6968.9 Ų68.942%0.41841%0.408SS..Hα-helixtrans-60.1-45.5175.9171.80000110.7V141 V196 V197 L202 I203 Y204V141-V200 HydrophobicContact CG2-CG2 4.34Å; V196-V200 WeakPolarHBondContact O-CG2 3.2Å; V196-V200 PolarHBondContact O-N 2.88Å; V197-V200 PolarHBondContact O-N 2.67Å; V200-L202 PolarHBondContact O-N 3.21Å; V200-I203 PolarHBondContact O-N 3.46Å; V200-Y204 WeakPolarHBondContact O-CB 3.39Å; V200-Y204 PolarHBondContact O-N 3.09Å
201F92.2Very high90.1Very high72 Ų7269 Ų6932%0.31639%0.393SS..Hα-helixtrans-60.7-45.4177.6177-98.9000112.4V197 I198 S199 Y204 N205 F228 I231V197-F201 PolarHBondContact O-N 2.94Å; I198-F201 PolarHBondContact O-N 2.9Å; S199-F201 VanDerWaalsContact C-N 3.34Å; S199-F201 PolarHBondContact O-N 3.25Å; F201-Y204 PolarHBondContact O-N 3.45Å; F201-N205 WeakPolarHBondContact CE1-ND2 3.29Å; F201-N205 WeakPolarHBondContact CE2-ND2 3.38Å; F201-N205 VanDerWaalsContact CZ-ND2 3.3Å; F201-N205 WeakPolarHBondContact CZ-ND2 3.48Å; F201-N205 PolarHBondContact O-N 3.45Å; F201-N205 VanDerWaalsContact O-N 3.08Å; F201-N205 PolarHBondContact O-ND2 2.9Å; F201-F228 AromaticContact CE1-CD2 3.82Å; F201-F228 HydrophobicContact CE1-CD2 3.82Å; F201-F228 AromaticContact CE1-CE2 3.75Å; F201-F228 HydrophobicContact CE1-CE2 3.75Å; F201-F228 AromaticContact CZ-CD2 3.69Å; F201-F228 HydrophobicContact CZ-CD2 3.69Å; F201-F228 AromaticContact CZ-CE2 3.72Å; F201-F228 HydrophobicContact CZ-CE2 3.72Å; F201-I231 HydrophobicContact CE2-CG2 3.86Å
202L94.9Very high91.4Very high80 Ų8065.6 Ų65.642%0.41937%0.373SS..Hα-helixtrans-68.4-39.2179.4-70.7176.3000112.5I198 S199 V200 Y204 N205 T206 F224I198-L202 HydrophobicContact CG2-CD1 3.92Å; I198-L202 HydrophobicContact CG2-CG 4.31Å; I198-L202 WeakPolarHBondContact O-CG 3.45Å; I198-L202 PolarHBondContact O-N 3.17Å; S199-L202 PolarHBondContact O-N 2.8Å; V200-L202 PolarHBondContact O-N 3.21Å; L202-Y204 VanDerWaalsContact C-N 3.35Å; L202-N205 PolarHBondContact O-N 3.37Å; L202-T206 WeakPolarHBondContact O-CB 3.31Å; L202-T206 PolarHBondContact O-N 3.38Å; L202-T206 PolarHBondContact O-OG1 2.86Å; L202-F224 HydrophobicContact CD2-CZ 4.16Å
203I95.1Very high92.3Very high100 Ų10067.9 Ų67.951%0.51338%0.381SS..Hα-helixtrans-61.7-46.2175.5-71.7165.4000109.8S199 V200 N205 T206 I207S199-I203 WeakPolarHBondContact O-CB 3.43Å; S199-I203 WeakPolarHBondContact O-CD1 3.4Å; S199-I203 WeakPolarHBondContact O-CG1 3.34Å; S199-I203 PolarHBondContact O-N 3.38Å; V200-I203 PolarHBondContact O-N 3.46Å; I203-N205 PolarHBondContact O-N 3.31Å; I203-T206 PolarHBondContact O-N 2.95Å; I203-I207 HydrophobicContact CG2-CD1 3.75Å; I203-I207 HydrophobicContact CG2-CG1 4.39Å; I203-I207 VanDerWaalsContact O-CG1 3.31Å; I203-I207 WeakPolarHBondContact O-CG1 3.35Å; I203-I207 PolarHBondContact O-N 3.33Å
204Y94.1Very high92.9Very high148 Ų14871.5 Ų71.558%0.5839%0.394SS*.Hα-helixtrans-59-47.4178.1177.7-111.2000112.2V200 F201 L202 T206 I207 G208 I231V200-Y204 WeakPolarHBondContact O-CB 3.39Å; V200-Y204 PolarHBondContact O-N 3.09Å; F201-Y204 PolarHBondContact O-N 3.45Å; L202-Y204 VanDerWaalsContact C-N 3.35Å; Y204-T206 VanDerWaalsContact C-N 3.32Å; Y204-T206 PolarHBondContact O-N 3.45Å; Y204-I207 PolarHBondContact O-N 2.78Å; Y204-G208 PolarHBondContact O-N 3.35Å; Y204-G208 VanDerWaalsContact O-N 3.07Å; Y204-I231 HydrophobicContact CD1-CD1 3.51Å; Y204-I231 HydrophobicContact CD1-CG1 4.45Å; Y204-I231 HydrophobicContact CE1-CD1 3.21Å; Y204-I231 HydrophobicContact CE1-CG1 3.78Å
205N95.5Very high93.3Very high0 Ų072.2 Ų72.20%039%0.392CS..Hα-helixtrans-62.2-38.8175.7-81.3-87.9000112.4F201 L202 I203 G208 A209 F224 F228 I231F201-N205 WeakPolarHBondContact CE1-ND2 3.29Å; F201-N205 WeakPolarHBondContact CE2-ND2 3.38Å; F201-N205 VanDerWaalsContact CZ-ND2 3.3Å; F201-N205 WeakPolarHBondContact CZ-ND2 3.48Å; F201-N205 PolarHBondContact O-N 3.45Å; F201-N205 VanDerWaalsContact O-N 3.08Å; F201-N205 PolarHBondContact O-ND2 2.9Å; L202-N205 PolarHBondContact O-N 3.37Å; I203-N205 PolarHBondContact O-N 3.31Å; N205-G208 PolarHBondContact O-N 2.86Å; N205-A209 VanDerWaalsContact O-CB 3.31Å; N205-A209 WeakPolarHBondContact O-CB 3.37Å; N205-A209 PolarHBondContact O-N 3.02Å; N205-F224 HydrophobicContact CB-CD2 4.16Å; N205-F224 HydrophobicContact CB-CE2 3.55Å; N205-F224 HydrophobicContact CB-CZ 3.86Å; N205-F228 VanDerWaalsContact OD1-CA 3.28Å; N205-F228 WeakPolarHBondContact OD1-CA 3.47Å; N205-F228 PolarHBondContact OD1-N 3.32Å; N205-I231 WeakPolarHBondContact OD1-CD1 3.44Å
206T96.8Very high93.5Very high58 Ų5870.4 Ų70.436%0.35638%0.376SS..Hα-helixtrans-66.4-42.5179.5-570000111.6L202 I203 Y204 A209 V210 F220L202-T206 WeakPolarHBondContact O-CB 3.31Å; L202-T206 PolarHBondContact O-N 3.38Å; L202-T206 PolarHBondContact O-OG1 2.86Å; I203-T206 PolarHBondContact O-N 2.95Å; Y204-T206 VanDerWaalsContact C-N 3.32Å; Y204-T206 PolarHBondContact O-N 3.45Å; T206-A209 PolarHBondContact O-N 2.95Å; T206-V210 WeakPolarHBondContact O-CG2 3.2Å; T206-V210 PolarHBondContact O-N 3.11Å; T206-F220 HydrophobicContact CG2-CE2 4.3Å; T206-F220 HydrophobicContact CG2-CZ 4.19Å
207I96.8Very high93.5Very high105 Ų10571.8 Ų71.854%0.53840%0.398SS..Hα-helixtrans-61.1-48.2175.8-66.9166.5000109.8I203 Y204 A209 V210 V211I203-I207 HydrophobicContact CG2-CD1 3.75Å; I203-I207 HydrophobicContact CG2-CG1 4.39Å; I203-I207 VanDerWaalsContact O-CG1 3.31Å; I203-I207 WeakPolarHBondContact O-CG1 3.35Å; I203-I207 PolarHBondContact O-N 3.33Å; Y204-I207 PolarHBondContact O-N 2.78Å; I207-A209 VanDerWaalsContact C-N 3.33Å; I207-A209 PolarHBondContact O-N 2.76Å; I207-V210 PolarHBondContact O-N 3.35Å; I207-V211 PolarHBondContact O-N 2.9Å
208G95.3Very high93.7Very high20 Ų2069.6 Ų69.621%0.20638%0.38CS..Hα-helixtrans-58-44.8175.900000112.4Y204 N205 V210 V211 F212Y204-G208 PolarHBondContact O-N 3.35Å; Y204-G208 VanDerWaalsContact O-N 3.07Å; N205-G208 PolarHBondContact O-N 2.86Å; G208-V210 VanDerWaalsContact C-N 3.31Å; G208-V210 PolarHBondContact O-N 3.28Å; G208-V211 WeakPolarHBondContact O-CB 3.28Å; G208-V211 PolarHBondContact O-N 3.32Å; G208-V211 VanDerWaalsContact O-N 3.12Å; G208-F212 VanDerWaalsContact O-CD2 3.31Å; G208-F212 WeakPolarHBondContact O-CD2 3.49Å; G208-F212 PolarHBondContact O-N 3.4Å
209A96.4Very high93.9Very high0 Ų068.7 Ų68.70%038%0.379CS..Hα-helixtrans-60.7-39.4179.500000112.5N205 T206 I207 K213 F220 S223 F224 C227N205-A209 VanDerWaalsContact O-CB 3.31Å; N205-A209 WeakPolarHBondContact O-CB 3.37Å; N205-A209 PolarHBondContact O-N 3.02Å; T206-A209 PolarHBondContact O-N 2.95Å; I207-A209 VanDerWaalsContact C-N 3.33Å; I207-A209 PolarHBondContact O-N 2.76Å; A209-K213 WeakPolarHBondContact O-CB 3.37Å; A209-K213 PolarHBondContact O-N 3.34Å; A209-F220 HydrophobicContact CB-CD2 4.19Å; A209-F220 HydrophobicContact CB-CE2 3.81Å; A209-F220 HydrophobicContact CB-CZ 4.4Å; A209-S223 WeakPolarHBondContact O-CB 3.34Å; A209-F224 HydrophobicContact CB-CB 3.85Å; A209-F224 HydrophobicContact CB-CD2 4.14Å; A209-F224 HydrophobicContact CB-CG 4.49Å; A209-C227 PolarHBondContact N-SG 3.24Å
210V96.9Very high94.1Very high67 Ų6769.7 Ų69.741%0.40638%0.376SS..Hα-helixtrans-63.5-42.6175.7171.40000111T206 I207 G208 I214 F220T206-V210 WeakPolarHBondContact O-CG2 3.2Å; T206-V210 PolarHBondContact O-N 3.11Å; I207-V210 PolarHBondContact O-N 3.35Å; G208-V210 VanDerWaalsContact C-N 3.31Å; G208-V210 PolarHBondContact O-N 3.28Å; V210-I214 HydrophobicContact CG1-CD1 4.05Å; V210-I214 WeakPolarHBondContact O-CG1 3.45Å; V210-I214 PolarHBondContact O-N 3.38Å; V210-F220 HydrophobicContact CG2-CE2 4.38Å
211V95Very high94.3Very high76 Ų7672.9 Ų72.946%0.46139%0.388SS..Hα-helixtrans-61.3-54.1177.3175.60000110.5I207 G208 K213 I214 T215I207-V211 PolarHBondContact O-N 2.9Å; G208-V211 WeakPolarHBondContact O-CB 3.28Å; G208-V211 PolarHBondContact O-N 3.32Å; G208-V211 VanDerWaalsContact O-N 3.12Å; V211-K213 VanDerWaalsContact C-N 3.31Å; V211-K213 PolarHBondContact O-N 2.97Å; V211-I214 PolarHBondContact O-N 3.21Å; V211-T215 HydrophobicContact CG1-CG2 4.29Å; V211-T215 PolarHBondContact O-N 3.18Å; V211-T215 PolarHBondContact O-OG1 3.36Å
212F93.4Very high94.5Very high53 Ų5372 Ų7223%0.23239%0.387CS..Hα-helixtrans-65.9-31.8-177.9-75.9-67000113.6G208 I214 T215 E216 W218 F226 P241G208-F212 VanDerWaalsContact O-CD2 3.31Å; G208-F212 WeakPolarHBondContact O-CD2 3.49Å; G208-F212 PolarHBondContact O-N 3.4Å; F212-I214 VanDerWaalsContact C-N 3.29Å; F212-I214 PolarHBondContact O-N 3.38Å; F212-T215 WeakPolarHBondContact CA-OG1 3.39Å; F212-E216 HydrophobicContact CD1-CG 4.25Å; F212-E216 WeakPolarHBondContact O-CB 3.31Å; F212-E216 PolarHBondContact O-N 3.09Å; F212-W218 HydrophobicContact CB-CE3 4.32Å; F212-W218 HydrophobicContact CB-CZ3 4.39Å; F212-W218 HydrophobicContact CD1-CZ3 4.47Å; F212-F226 HydrophobicContact CD1-CD1 4.46Å; F212-F226 HydrophobicContact CD1-CE1 4.2Å; F212-F226 AromaticContact CD2-CD1 3.91Å; F212-F226 HydrophobicContact CD2-CD1 3.91Å; F212-F226 AromaticContact CD2-CE1 3.97Å; F212-F226 HydrophobicContact CD2-CE1 3.97Å; F212-F226 AromaticContact CE1-CE1 3.88Å; F212-F226 HydrophobicContact CE1-CE1 3.88Å; F212-F226 HydrophobicContact CE2-CD1 4.01Å; F212-F226 AromaticContact CE2-CE1 3.62Å; F212-F226 HydrophobicContact CE2-CE1 3.62Å; F212-F226 HydrophobicContact CG-CD1 4.15Å; F212-F226 HydrophobicContact CG-CE1 4.25Å; F212-F226 HydrophobicContact CZ-CD1 4.36Å; F212-F226 AromaticContact CZ-CE1 3.59Å; F212-F226 HydrophobicContact CZ-CE1 3.59Å; F212-P241 HydrophobicContact CD1-CG 4.34Å; F212-P241 HydrophobicContact CE1-CG 3.74Å
213K94.3Very high94.5Very high105 Ų10568.2 Ų68.246%0.45737%0.367SS..Hα-helixtrans-58.3-43.2171.1178-170.5178.2-172.80111.3A209 V211 G217 W218 F220 S223A209-K213 WeakPolarHBondContact O-CB 3.37Å; A209-K213 PolarHBondContact O-N 3.34Å; V211-K213 VanDerWaalsContact C-N 3.31Å; V211-K213 PolarHBondContact O-N 2.97Å; K213-G217 VanDerWaalsContact O-CA 3.29Å; K213-G217 WeakPolarHBondContact O-CA 3.33Å; K213-G217 PolarHBondContact O-N 3.45Å; K213-G217 VanDerWaalsContact O-N 3.17Å; K213-W218 WeakPolarHBondContact CG-O 3.26Å; K213-F220 HydrophobicContact CD-CB 4.39Å; K213-S223 WeakPolarHBondContact CA-OG 3.26Å; K213-S223 PolarHBondContact N-OG 2.92Å; K213-S223 VanDerWaalsContact N-OG 3.14Å
214I93.2Very high94.6Very high133 Ų13365.7 Ų65.768%0.68235%0.352SS*.Hα-helixtrans-74.6-43.6-178.1-64.1165.8000110.7V210 V211 F212V210-I214 HydrophobicContact CG1-CD1 4.05Å; V210-I214 WeakPolarHBondContact O-CG1 3.45Å; V210-I214 PolarHBondContact O-N 3.38Å; V211-I214 PolarHBondContact O-N 3.21Å; F212-I214 VanDerWaalsContact C-N 3.29Å; F212-I214 PolarHBondContact O-N 3.38Å
215T91.4Very high94.7Very high82 Ų8262.2 Ų62.250%0.50334%0.338SS..Hα-helixtrans-77.2-43-174.258.10000112.9V211 F212V211-T215 HydrophobicContact CG1-CG2 4.29Å; V211-T215 PolarHBondContact O-N 3.18Å; V211-T215 PolarHBondContact O-OG1 3.36Å; F212-T215 WeakPolarHBondContact CA-OG1 3.39Å
216E89.4Confident94.7Very high29 Ų2962.5 Ų62.514%0.13634%0.339CS..Hα-helixtrans-99-8.2-175.1-63.1-66.2141.300113.2F212 W218 P241 K242 H243F212-E216 HydrophobicContact CD1-CG 4.25Å; F212-E216 WeakPolarHBondContact O-CB 3.31Å; F212-E216 PolarHBondContact O-N 3.09Å; E216-W218 HydrophobicContact CB-CD2 3.61Å; E216-W218 VanDerWaalsContact CB-CE2 3.44Å; E216-W218 HydrophobicContact CB-CE3 4.16Å; E216-W218 HydrophobicContact CB-CG 3.87Å; E216-W218 HydrophobicContact CB-CH2 4.39Å; E216-W218 HydrophobicContact CB-CZ2 3.87Å; E216-W218 HydrophobicContact CG-CD2 4.27Å; E216-W218 HydrophobicContact CG-CE3 4.45Å; E216-W218 HydrophobicContact CG-CH2 4Å; E216-W218 HydrophobicContact CG-CZ2 3.78Å; E216-W218 HydrophobicContact CG-CZ3 4.32Å; E216-W218 PolarHBondContact O-N 2.86Å; E216-P241 HydrophobicContact CG-CB 4.45Å; E216-P241 WeakPolarHBondContact OE1-CB 2.87Å; E216-K242 PolarHBondContact OE2-N 3.32Å; E216-H243 IonicContact OE2-ND1 3.53Å
217G89.3Confident94.7Very high65 Ų6560 Ų6067%0.6733%0.325SS*.  trans68.316.7-177.800000114K213K213-G217 VanDerWaalsContact O-CA 3.29Å; K213-G217 WeakPolarHBondContact O-CA 3.33Å; K213-G217 PolarHBondContact O-N 3.45Å; K213-G217 VanDerWaalsContact O-N 3.17Å
218W92.3Very high94.7Very high42 Ų4259.3 Ų59.316%0.15932%0.318CS..  trans-71.6163.7177.3-61.9-16.3000112.1F212 K213 E216 D222 S223 F226 F239 P241F212-W218 HydrophobicContact CB-CE3 4.32Å; F212-W218 HydrophobicContact CB-CZ3 4.39Å; F212-W218 HydrophobicContact CD1-CZ3 4.47Å; K213-W218 WeakPolarHBondContact CG-O 3.26Å; E216-W218 HydrophobicContact CB-CD2 3.61Å; E216-W218 VanDerWaalsContact CB-CE2 3.44Å; E216-W218 HydrophobicContact CB-CE3 4.16Å; E216-W218 HydrophobicContact CB-CG 3.87Å; E216-W218 HydrophobicContact CB-CH2 4.39Å; E216-W218 HydrophobicContact CB-CZ2 3.87Å; E216-W218 HydrophobicContact CG-CD2 4.27Å; E216-W218 HydrophobicContact CG-CE3 4.45Å; E216-W218 HydrophobicContact CG-CH2 4Å; E216-W218 HydrophobicContact CG-CZ2 3.78Å; E216-W218 HydrophobicContact CG-CZ3 4.32Å; E216-W218 PolarHBondContact O-N 2.86Å; W218-D222 HydrophobicContact CB-CB 4.26Å; W218-S223 WeakPolarHBondContact CB-OG 3.48Å; W218-F226 HydrophobicContact CH2-CD2 4.44Å; W218-F226 HydrophobicContact CH2-CG 4.39Å; W218-F226 HydrophobicContact CZ3-CB 3.99Å; W218-F226 AromaticContact CZ3-CD1 3.9Å; W218-F226 HydrophobicContact CZ3-CD1 3.9Å; W218-F226 HydrophobicContact CZ3-CD2 4.23Å; W218-F226 HydrophobicContact CZ3-CE1 4.48Å; W218-F226 AromaticContact CZ3-CG 3.75Å; W218-F226 HydrophobicContact CZ3-CG 3.75Å; W218-F239 AromaticContact CD2-CD1 3.98Å; W218-F239 HydrophobicContact CD2-CD1 3.98Å; W218-F239 AromaticContact CE2-CD1 3.94Å; W218-F239 HydrophobicContact CE3-CD1 4.27Å; W218-F239 HydrophobicContact CG-CD1 4.44Å; W218-F239 HydrophobicContact CH2-CB 4.07Å; W218-F239 HydrophobicContact CZ2-CB 4.42Å; W218-F239 HydrophobicContact CZ2-CD1 4.23Å; W218-F239 HydrophobicContact CZ3-CB 4.25Å; W218-P241 HydrophobicContact CH2-CG 4.43Å
219T96Very high94.7Very high79 Ų7958.6 Ų58.649%0.48531%0.309SS..  trans-68.4157.1170.477.10000110.1M221 D222 S223T219-M221 PolarHBondContact O-N 3.31Å; T219-D222 WeakPolarHBondContact CB-OD2 3.46Å; T219-D222 PolarHBondContact O-N 3.14Å; T219-D222 PolarHBondContact OG1-N 3.33Å; T219-D222 PolarHBondContact OG1-OD2 3.04Å; T219-S223 PolarHBondContact O-N 3.05Å; T219-S223 PolarHBondContact O-OG 2.86Å
220F96.1Very high94.6Very high80 Ų8059.3 Ų59.335%0.35131%0.314SS..Hα-helixtrans-57.3-38.5177.8175.5-97.7000112.1T206 A209 V210 K213 F224T206-F220 HydrophobicContact CG2-CE2 4.3Å; T206-F220 HydrophobicContact CG2-CZ 4.19Å; A209-F220 HydrophobicContact CB-CD2 4.19Å; A209-F220 HydrophobicContact CB-CE2 3.81Å; A209-F220 HydrophobicContact CB-CZ 4.4Å; V210-F220 HydrophobicContact CG2-CE2 4.38Å; K213-F220 HydrophobicContact CD-CB 4.39Å; F220-F224 HydrophobicContact CZ-CD2 4.27Å; F220-F224 WeakPolarHBondContact O-CB 3.42Å; F220-F224 PolarHBondContact O-N 2.92Å
221M96.4Very high94.5Very high136 Ų13659.1 Ų59.167%0.6731%0.31SS*.Hα-helixtrans-68.6-41179.6-83.5-55.6-164.600112.5T219 F224 Y225T219-M221 PolarHBondContact O-N 3.31Å; M221-F224 PolarHBondContact O-N 3.31Å; M221-Y225 VanDerWaalsContact O-CB 3.24Å; M221-Y225 WeakPolarHBondContact O-CB 3.23Å; M221-Y225 PolarHBondContact O-N 3.32Å
222D95.7Very high94.4Very high55 Ų5557.9 Ų57.929%0.29430%0.303SS..Hα-helixtrans-65.6-41.5176.8-58.5-36.1000111.1W218 T219 Y225 F226 F239W218-D222 HydrophobicContact CB-CB 4.26Å; T219-D222 WeakPolarHBondContact CB-OD2 3.46Å; T219-D222 PolarHBondContact O-N 3.14Å; T219-D222 PolarHBondContact OG1-N 3.33Å; T219-D222 PolarHBondContact OG1-OD2 3.04Å; D222-Y225 PolarHBondContact O-N 3.49Å; D222-F226 WeakPolarHBondContact O-CB 3.44Å; D222-F226 PolarHBondContact O-N 2.95Å; D222-F239 HydrophobicContact CB-CD1 4.37Å; D222-F239 HydrophobicContact CB-CE1 3.75Å; D222-F239 HydrophobicContact CB-CE2 4.46Å; D222-F239 HydrophobicContact CB-CZ 3.79Å
223S96.3Very high94.5Very high0 Ų058.3 Ų58.30%031%0.31CS..Hα-helixtrans-64.3-40.1175.3-610000112.6A209 K213 W218 T219 C227A209-S223 WeakPolarHBondContact O-CB 3.34Å; K213-S223 WeakPolarHBondContact CA-OG 3.26Å; K213-S223 PolarHBondContact N-OG 2.92Å; K213-S223 VanDerWaalsContact N-OG 3.14Å; W218-S223 WeakPolarHBondContact CB-OG 3.48Å; T219-S223 PolarHBondContact O-N 3.05Å; T219-S223 PolarHBondContact O-OG 2.86Å; S223-C227 PolarHBondContact O-N 3.27Å; S223-C227 PolarHBondContact O-SG 2.87Å
224F96.8Very high94.6Very high46 Ų4656.7 Ų56.720%0.20231%0.309CS..Hα-helixtrans-67.5-44.4176.4-172.6-84.4000111.4L202 N205 A209 F220 M221 F226 C227 F228L202-F224 HydrophobicContact CD2-CZ 4.16Å; N205-F224 HydrophobicContact CB-CD2 4.16Å; N205-F224 HydrophobicContact CB-CE2 3.55Å; N205-F224 HydrophobicContact CB-CZ 3.86Å; A209-F224 HydrophobicContact CB-CB 3.85Å; A209-F224 HydrophobicContact CB-CD2 4.14Å; A209-F224 HydrophobicContact CB-CG 4.49Å; F220-F224 HydrophobicContact CZ-CD2 4.27Å; F220-F224 WeakPolarHBondContact O-CB 3.42Å; F220-F224 PolarHBondContact O-N 2.92Å; M221-F224 PolarHBondContact O-N 3.31Å; F224-F226 VanDerWaalsContact C-N 3.35Å; F224-F226 PolarHBondContact O-N 2.89Å; F224-C227 PolarHBondContact O-N 2.95Å; F224-F228 WeakPolarHBondContact O-CB 3.41Å; F224-F228 PolarHBondContact O-N 3.17Å
225Y96.5Very high94.6Very high75 Ų7550.7 Ų50.729%0.29428%0.279SS..Hα-helixtrans-55.8-50.2173.4164.7-101.6000110.9M221 D222 C227 F228 I229 F236 D238 F239M221-Y225 VanDerWaalsContact O-CB 3.24Å; M221-Y225 WeakPolarHBondContact O-CB 3.23Å; M221-Y225 PolarHBondContact O-N 3.32Å; D222-Y225 PolarHBondContact O-N 3.49Å; Y225-C227 PolarHBondContact O-N 2.85Å; Y225-F228 PolarHBondContact O-N 3.45Å; Y225-I229 HydrophobicContact CD1-CD1 4.29Å; Y225-I229 HydrophobicContact CD2-CG2 3.92Å; Y225-I229 HydrophobicContact CE1-CD1 3.69Å; Y225-I229 HydrophobicContact CE2-CD1 4.46Å; Y225-I229 HydrophobicContact CE2-CG2 3.58Å; Y225-I229 WeakPolarHBondContact O-CG1 3.22Å; Y225-I229 PolarHBondContact O-N 3.45Å; Y225-F236 VanDerWaalsContact OH-CD2 3.27Å; Y225-F236 WeakPolarHBondContact OH-CD2 3.49Å; Y225-D238 WeakPolarHBondContact CE1-OD2 3.28Å; Y225-D238 PolarHBondContact OH-OD2 2.99Å; Y225-F239 HydrophobicContact CD1-CD2 4.03Å; Y225-F239 HydrophobicContact CD1-CE2 4.37Å; Y225-F239 AromaticContact CE1-CD2 3.89Å; Y225-F239 HydrophobicContact CE1-CD2 3.89Å; Y225-F239 HydrophobicContact CE1-CE2 4.32Å
226F95.5Very high94.6Very high6 Ų653.1 Ų53.13%0.02628%0.283CS..Hα-helixtrans-54.4-51.5175.9172.6-103.2000111.3Y101 F212 W218 D222 F224 F228 I229 S230 F239 P241Y101-F226 HydrophobicContact CE1-CE2 4.06Å; Y101-F226 HydrophobicContact CE2-CE2 4.46Å; Y101-F226 AromaticContact CZ-CE2 3.73Å; Y101-F226 WeakPolarHBondContact OH-CE2 3.44Å; F212-F226 HydrophobicContact CD1-CD1 4.46Å; F212-F226 HydrophobicContact CD1-CE1 4.2Å; F212-F226 AromaticContact CD2-CD1 3.91Å; F212-F226 HydrophobicContact CD2-CD1 3.91Å; F212-F226 AromaticContact CD2-CE1 3.97Å; F212-F226 HydrophobicContact CD2-CE1 3.97Å; F212-F226 AromaticContact CE1-CE1 3.88Å; F212-F226 HydrophobicContact CE1-CE1 3.88Å; F212-F226 HydrophobicContact CE2-CD1 4.01Å; F212-F226 AromaticContact CE2-CE1 3.62Å; F212-F226 HydrophobicContact CE2-CE1 3.62Å; F212-F226 HydrophobicContact CG-CD1 4.15Å; F212-F226 HydrophobicContact CG-CE1 4.25Å; F212-F226 HydrophobicContact CZ-CD1 4.36Å; F212-F226 AromaticContact CZ-CE1 3.59Å; F212-F226 HydrophobicContact CZ-CE1 3.59Å; W218-F226 HydrophobicContact CH2-CD2 4.44Å; W218-F226 HydrophobicContact CH2-CG 4.39Å; W218-F226 HydrophobicContact CZ3-CB 3.99Å; W218-F226 AromaticContact CZ3-CD1 3.9Å; W218-F226 HydrophobicContact CZ3-CD1 3.9Å; W218-F226 HydrophobicContact CZ3-CD2 4.23Å; W218-F226 HydrophobicContact CZ3-CE1 4.48Å; W218-F226 AromaticContact CZ3-CG 3.75Å; W218-F226 HydrophobicContact CZ3-CG 3.75Å; D222-F226 WeakPolarHBondContact O-CB 3.44Å; D222-F226 PolarHBondContact O-N 2.95Å; F224-F226 VanDerWaalsContact C-N 3.35Å; F224-F226 PolarHBondContact O-N 2.89Å; F226-F228 VanDerWaalsContact C-N 3.33Å; F226-F228 PolarHBondContact O-N 3.26Å; F226-I229 VanDerWaalsContact O-CG1 3.26Å; F226-I229 WeakPolarHBondContact O-CG1 3.42Å; F226-I229 PolarHBondContact O-N 3.01Å; F226-S230 WeakPolarHBondContact O-CB 3.3Å; F226-S230 PolarHBondContact O-N 3.43Å; F226-S230 PolarHBondContact O-OG 3.03Å; F226-F239 HydrophobicContact CB-CB 4.32Å; F226-F239 HydrophobicContact CD2-CB 3.99Å; F226-F239 VanDerWaalsContact CD2-O 3.23Å; F226-F239 WeakPolarHBondContact CD2-O 3.43Å; F226-F239 VanDerWaalsContact CE2-O 3.26Å; F226-F239 WeakPolarHBondContact CE2-O 3.29Å; F226-P241 HydrophobicContact CE1-CG 4.37Å; F226-P241 HydrophobicContact CZ-CG 3.99Å
227C96Very high94.5Very high7 Ų752.8 Ų52.85%0.04729%0.288CS..Hα-helixtrans-58-46.1178.4-66.90000111.8A209 S223 F224 Y225 S230 I231A209-C227 PolarHBondContact N-SG 3.24Å; S223-C227 PolarHBondContact O-N 3.27Å; S223-C227 PolarHBondContact O-SG 2.87Å; F224-C227 PolarHBondContact O-N 2.95Å; Y225-C227 PolarHBondContact O-N 2.85Å; C227-S230 WeakPolarHBondContact O-CB 3.32Å; C227-S230 PolarHBondContact O-N 3.12Å; C227-I231 WeakPolarHBondContact O-CD1 3.46Å; C227-I231 VanDerWaalsContact O-CG1 3.29Å; C227-I231 WeakPolarHBondContact O-CG1 3.4Å; C227-I231 PolarHBondContact O-N 3.37Å
228F96.2Very high94.5Very high89 Ų8954 Ų5439%0.3928%0.279SS..Hα-helixtrans-62.5-49.3-178179.8-95.7000112.2F201 N205 F224 Y225 F226 S230 I231 T232F201-F228 AromaticContact CE1-CD2 3.82Å; F201-F228 HydrophobicContact CE1-CD2 3.82Å; F201-F228 AromaticContact CE1-CE2 3.75Å; F201-F228 HydrophobicContact CE1-CE2 3.75Å; F201-F228 AromaticContact CZ-CD2 3.69Å; F201-F228 HydrophobicContact CZ-CD2 3.69Å; F201-F228 AromaticContact CZ-CE2 3.72Å; F201-F228 HydrophobicContact CZ-CE2 3.72Å; N205-F228 VanDerWaalsContact OD1-CA 3.28Å; N205-F228 WeakPolarHBondContact OD1-CA 3.47Å; N205-F228 PolarHBondContact OD1-N 3.32Å; F224-F228 WeakPolarHBondContact O-CB 3.41Å; F224-F228 PolarHBondContact O-N 3.17Å; Y225-F228 PolarHBondContact O-N 3.45Å; F226-F228 VanDerWaalsContact C-N 3.33Å; F226-F228 PolarHBondContact O-N 3.26Å; F228-S230 VanDerWaalsContact C-N 3.25Å; F228-S230 PolarHBondContact O-N 2.99Å; F228-I231 PolarHBondContact O-N 3.2Å; F228-T232 HydrophobicContact CD2-CG2 4.41Å; F228-T232 HydrophobicContact CE1-CG2 4.14Å; F228-T232 HydrophobicContact CE2-CG2 4.04Å; F228-T232 HydrophobicContact CZ-CG2 3.89Å; F228-T232 WeakPolarHBondContact O-CB 3.34Å; F228-T232 WeakPolarHBondContact O-CG2 3.41Å; F228-T232 PolarHBondContact O-N 2.99Å; F228-T232 PolarHBondContact O-OG1 3.33Å
229I95.7Very high94.3Very high5 Ų554.6 Ų54.63%0.02628%0.283CS..Hα-helixtrans-67.6-27.517967.6173.8000112.3Y225 F226 T232 T233 V234 G235 F236Y225-I229 HydrophobicContact CD1-CD1 4.29Å; Y225-I229 HydrophobicContact CD2-CG2 3.92Å; Y225-I229 HydrophobicContact CE1-CD1 3.69Å; Y225-I229 HydrophobicContact CE2-CD1 4.46Å; Y225-I229 HydrophobicContact CE2-CG2 3.58Å; Y225-I229 WeakPolarHBondContact O-CG1 3.22Å; Y225-I229 PolarHBondContact O-N 3.45Å; F226-I229 VanDerWaalsContact O-CG1 3.26Å; F226-I229 WeakPolarHBondContact O-CG1 3.42Å; F226-I229 PolarHBondContact O-N 3.01Å; I229-T232 WeakPolarHBondContact CA-OG1 3.33Å; I229-T232 PolarHBondContact O-OG1 2.7Å; I229-T233 PolarHBondContact O-N 3.44Å; I229-V234 HydrophobicContact CB-CB 4.33Å; I229-V234 PolarHBondContact O-N 3.47Å; I229-G235 PolarHBondContact O-N 3.05Å; I229-G235 VanDerWaalsContact O-N 3.11Å; I229-F236 HydrophobicContact CD1-CB 4.37Å; I229-F236 HydrophobicContact CD1-CD2 4.29Å; I229-F236 HydrophobicContact CG2-CD2 4.2Å; I229-F236 HydrophobicContact CG2-CE2 4.38Å
230S95.3Very high93.9Very high15 Ų1551.5 Ų51.511%0.10526%0.264CS..Hα-helixtrans-68.8-50.2175.7-55.20000111Y101 F226 C227 F228 T233Y101-S230 VanDerWaalsContact OH-CB 3.3Å; Y101-S230 WeakPolarHBondContact OH-CB 3.46Å; Y101-S230 PolarHBondContact OH-OG 2.92Å; F226-S230 WeakPolarHBondContact O-CB 3.3Å; F226-S230 PolarHBondContact O-N 3.43Å; F226-S230 PolarHBondContact O-OG 3.03Å; C227-S230 WeakPolarHBondContact O-CB 3.32Å; C227-S230 PolarHBondContact O-N 3.12Å; F228-S230 VanDerWaalsContact C-N 3.25Å; F228-S230 PolarHBondContact O-N 2.99Å; S230-T233 WeakPolarHBondContact O-CA 3.45Å; S230-T233 PolarHBondContact O-N 3.04Å
231I93.5Very high93.3Very high63 Ų6349.5 Ų49.532%0.32326%0.259SS..Hα-helixtrans-71.8-36.7-175.1-67.5157.6000111.2F201 Y204 N205 C227 F228 T233F201-I231 HydrophobicContact CE2-CG2 3.86Å; Y204-I231 HydrophobicContact CD1-CD1 3.51Å; Y204-I231 HydrophobicContact CD1-CG1 4.45Å; Y204-I231 HydrophobicContact CE1-CD1 3.21Å; Y204-I231 HydrophobicContact CE1-CG1 3.78Å; N205-I231 WeakPolarHBondContact OD1-CD1 3.44Å; C227-I231 WeakPolarHBondContact O-CD1 3.46Å; C227-I231 VanDerWaalsContact O-CG1 3.29Å; C227-I231 WeakPolarHBondContact O-CG1 3.4Å; C227-I231 PolarHBondContact O-N 3.37Å; F228-I231 PolarHBondContact O-N 3.2Å; I231-T233 PolarHBondContact O-N 3.5Å
232T94.3Very high92.1Very high51 Ų5151.5 Ų51.531%0.31326%0.264SS..THydrogen-bonded Turntrans-74.83.117255.40000112.9F228 I229 V234F228-T232 HydrophobicContact CD2-CG2 4.41Å; F228-T232 HydrophobicContact CE1-CG2 4.14Å; F228-T232 HydrophobicContact CE2-CG2 4.04Å; F228-T232 HydrophobicContact CZ-CG2 3.89Å; F228-T232 WeakPolarHBondContact O-CB 3.34Å; F228-T232 WeakPolarHBondContact O-CG2 3.41Å; F228-T232 PolarHBondContact O-N 2.99Å; F228-T232 PolarHBondContact O-OG1 3.33Å; I229-T232 WeakPolarHBondContact CA-OG1 3.33Å; I229-T232 PolarHBondContact O-OG1 2.7Å; T232-V234 PolarHBondContact O-N 3.16Å; T232-V234 VanDerWaalsContact O-N 3.09Å; T232-V234 WeakPolarHBondContact OG1-CG2 3.38Å
233T94.8Very high90.2Very high62 Ų6255.2 Ų55.238%0.3828%0.279SS..THydrogen-bonded Turntrans52.928.7179.968.10000113.4I99 I229 S230 I231I99-T233 HydrophobicContact CG1-CG2 4.29Å; I229-T233 PolarHBondContact O-N 3.44Å; S230-T233 WeakPolarHBondContact O-CA 3.45Å; S230-T233 PolarHBondContact O-N 3.04Å; I231-T233 PolarHBondContact O-N 3.5Å
234V96.1Very high88Confident71 Ų7159.1 Ų59.143%0.4330%0.3SS..  trans-76.9-46175.51750000109.7I229 T232 F236I229-V234 HydrophobicContact CB-CB 4.33Å; I229-V234 PolarHBondContact O-N 3.47Å; T232-V234 PolarHBondContact O-N 3.16Å; T232-V234 VanDerWaalsContact O-N 3.09Å; T232-V234 WeakPolarHBondContact OG1-CG2 3.38Å; V234-F236 HydrophobicContact CG1-CD1 4.01Å; V234-F236 HydrophobicContact CG1-CD2 3.89Å; V234-F236 HydrophobicContact CG1-CE1 3.64Å; V234-F236 HydrophobicContact CG1-CE2 3.53Å; V234-F236 HydrophobicContact CG1-CG 4.13Å; V234-F236 HydrophobicContact CG1-CZ 3.39Å; V234-F236 PolarHBondContact O-N 3.11Å
235G93.1Very high85.3Confident6 Ų664.9 Ų64.96%0.06234%0.342CS..  trans58.449.516600000116Y101 I229 G237Y101-G235 WeakPolarHBondContact CA-O 3.17Å; I229-G235 PolarHBondContact O-N 3.05Å; I229-G235 VanDerWaalsContact O-N 3.11Å; G235-G237 PolarHBondContact O-N 2.95Å; G235-G237 VanDerWaalsContact O-N 3.14Å
236F91.9Very high84.7Confident133 Ų13364.4 Ų64.458%0.58334%0.344SS*.  trans-57.7-29.6-178.1-69-55.2000115.1Y225 I229 V234 D238Y225-F236 VanDerWaalsContact OH-CD2 3.27Å; Y225-F236 WeakPolarHBondContact OH-CD2 3.49Å; I229-F236 HydrophobicContact CD1-CB 4.37Å; I229-F236 HydrophobicContact CD1-CD2 4.29Å; I229-F236 HydrophobicContact CG2-CD2 4.2Å; I229-F236 HydrophobicContact CG2-CE2 4.38Å; V234-F236 HydrophobicContact CG1-CD1 4.01Å; V234-F236 HydrophobicContact CG1-CD2 3.89Å; V234-F236 HydrophobicContact CG1-CE1 3.64Å; V234-F236 HydrophobicContact CG1-CE2 3.53Å; V234-F236 HydrophobicContact CG1-CG 4.13Å; V234-F236 HydrophobicContact CG1-CZ 3.39Å; V234-F236 PolarHBondContact O-N 3.11Å; F236-D238 VanDerWaalsContact C-N 3.3Å; F236-D238 PolarHBondContact O-N 3.38Å
237G88Confident84.2Confident22 Ų2267.4 Ų67.423%0.22736%0.361CS..  trans78.412.3175.500000115Y101 G235Y101-G237 WeakPolarHBondContact O-CA 3.34Å; G235-G237 PolarHBondContact O-N 2.95Å; G235-G237 VanDerWaalsContact O-N 3.14Å
238D88.4Confident83.5Confident91 Ų9170.8 Ų70.849%0.48738%0.378SS..SBendtrans-69.8-40.3170.454.2-14.6000112.1Y225 F236Y225-D238 WeakPolarHBondContact CE1-OD2 3.28Å; Y225-D238 PolarHBondContact OH-OD2 2.99Å; F236-D238 VanDerWaalsContact C-N 3.3Å; F236-D238 PolarHBondContact O-N 3.38Å
239F88.6Confident82.8Confident55 Ų5569.7 Ų69.724%0.24138%0.377CS..SBendtrans-110125.4167-70.2-93.7000109.9W218 D222 Y225 F226W218-F239 AromaticContact CD2-CD1 3.98Å; W218-F239 HydrophobicContact CD2-CD1 3.98Å; W218-F239 AromaticContact CE2-CD1 3.94Å; W218-F239 HydrophobicContact CE3-CD1 4.27Å; W218-F239 HydrophobicContact CG-CD1 4.44Å; W218-F239 HydrophobicContact CH2-CB 4.07Å; W218-F239 HydrophobicContact CZ2-CB 4.42Å; W218-F239 HydrophobicContact CZ2-CD1 4.23Å; W218-F239 HydrophobicContact CZ3-CB 4.25Å; D222-F239 HydrophobicContact CB-CD1 4.37Å; D222-F239 HydrophobicContact CB-CE1 3.75Å; D222-F239 HydrophobicContact CB-CE2 4.46Å; D222-F239 HydrophobicContact CB-CZ 3.79Å; Y225-F239 HydrophobicContact CD1-CD2 4.03Å; Y225-F239 HydrophobicContact CD1-CE2 4.37Å; Y225-F239 AromaticContact CE1-CD2 3.89Å; Y225-F239 HydrophobicContact CE1-CD2 3.89Å; Y225-F239 HydrophobicContact CE1-CE2 4.32Å; F226-F239 HydrophobicContact CB-CB 4.32Å; F226-F239 HydrophobicContact CD2-CB 3.99Å; F226-F239 VanDerWaalsContact CD2-O 3.23Å; F226-F239 WeakPolarHBondContact CD2-O 3.43Å; F226-F239 VanDerWaalsContact CE2-O 3.26Å; F226-F239 WeakPolarHBondContact CE2-O 3.29Å
240V86.1Confident82Confident14 Ų1473.8 Ų73.89%0.08540%0.399CS..  trans-143.5137.1173-169.80000107.5F90 Y101 N103 K242F90-V240 HydrophobicContact CE1-CG1 3.59Å; F90-V240 HydrophobicContact CZ-CG1 3.77Å; Y101-V240 HydrophobicContact CD1-CG2 4.42Å; Y101-V240 HydrophobicContact CD2-CG1 4.45Å; Y101-V240 HydrophobicContact CD2-CG2 4.48Å; Y101-V240 HydrophobicContact CG-CG2 4.08Å; N103-V240 HydrophobicContact CB-CG2 4.19Å; V240-K242 WeakPolarHBondContact O-CG 3.44Å; V240-K242 PolarHBondContact O-N 3.23Å
241P83.3Confident81.1Confident38 Ų3877.7 Ų77.725%0.24742%0.419CS..  trans-54.3125.1177.1-2635.2000110.4F212 E216 W218 F226F212-P241 HydrophobicContact CD1-CG 4.34Å; F212-P241 HydrophobicContact CE1-CG 3.74Å; E216-P241 HydrophobicContact CG-CB 4.45Å; E216-P241 WeakPolarHBondContact OE1-CB 2.87Å; W218-P241 HydrophobicContact CH2-CG 4.43Å; F226-P241 HydrophobicContact CE1-CG 4.37Å; F226-P241 HydrophobicContact CZ-CG 3.99Å
242K71.3Confident80.2Confident178 Ų17878.7 Ų78.777%0.77443%0.426SS*.  trans-102.2-25.5-177.3-65.5-175.7-175.9174.50112.1E216 V240 D244E216-K242 PolarHBondContact OE2-N 3.32Å; V240-K242 WeakPolarHBondContact O-CG 3.44Å; V240-K242 PolarHBondContact O-N 3.23Å; K242-D244 PolarHBondContact O-N 2.83Å
243H57.4Low79.1Confident132 Ų13280.8 Ų80.861%0.61144%0.435SS*.SBendtrans-80.1117.7173.8-73.175.5000108E216 P245E216-H243 IonicContact OE2-ND1 3.53Å; H243-P245 WeakPolarHBondContact O-CD 3.31Å; H243-P245 VanDerWaalsContact O-N 3.15Å
244D49.8Very low77.8Confident83 Ų8382.4 Ų82.444%0.44444%0.439SS..  trans-54.5119.3161-92.4-28.4000106.8K86 K242K86-D244 WeakPolarHBondContact CB-OD1 3.48Å; K86-D244 HydrophobicContact CD-CB 3.89Å; K242-D244 PolarHBondContact O-N 2.83Å
245P39.6Very low76.1Confident166 Ų16683.5 Ų83.5100%1.07844%0.44SS*.  trans-61.60-176.423.6-33.7000112.8K86 H243K86-P245 PolarHBondContact NZ-O 3.37Å; H243-P245 WeakPolarHBondContact O-CD 3.31Å; H243-P245 VanDerWaalsContact O-N 3.15Å

Retrieved 245 of 245 residues in 108.5 ms (Link to these results)

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