A0A077ZE77_TRITR Loading...

PTR2 domain containing protein

AlphaFold DB , UniProt , Accession A0A077ZE77, Species TRITR (Trichuris trichiura, Whipworm), Gene n/a, Length 459 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
1M76.3Confident81.6Confident42 Ų4224.6 Ų24.621%0.20712%0.115CC..  0-65.50-66.4-48.9-77.800113.2A3 L4 L5 Y27 H63 L66 L80 I83 F144M1-A3 VanDerWaalsContact C-N 3.26Å; M1-A3 PolarHBondContact O-N 3.26Å; M1-A3 VanDerWaalsContact O-N 3.09Å; M1-L4 PolarHBondContact O-N 3.18Å; M1-L5 HydrophobicContact CE-CD1 4.15Å; M1-L5 WeakPolarHBondContact O-CB 3.34Å; M1-L5 PolarHBondContact O-N 2.84Å; M1-Y27 HydrophobicContact CB-CE1 4.21Å; M1-Y27 WeakPolarHBondContact CB-OH 3.3Å; M1-H63 WeakPolarHBondContact CG-NE2 3.39Å; M1-L66 HydrophobicContact CE-CD2 3.56Å; M1-L66 HydrophobicContact SD-CD2 4.04Å; M1-L80 HydrophobicContact CE-CD2 3.65Å; M1-I83 HydrophobicContact CE-CD1 4.1Å; M1-I83 HydrophobicContact CG-CD1 4.43Å; M1-I83 HydrophobicContact SD-CD1 4.38Å; M1-F144 HydrophobicContact CE-CE1 4.24Å; M1-F144 HydrophobicContact SD-CD1 3.93Å; M1-F144 HydrophobicContact SD-CE1 3.85Å
2R77.9Confident81.5Confident79 Ų7928.4 Ų28.430%0.29813%0.132SC..Hα-helixtrans-46.4-45.9-176.7-171.5178.2171.6-175.4-2.9114.5L4 F24 A255R2-L4 PolarHBondContact O-N 3.18Å; R2-F24 HydrophobicContact CG-CE2 4.06Å; R2-F24 HydrophobicContact CG-CZ 3.84Å; R2-A255 PolarHBondContact NH2-O 2.91Å
3A76.2Confident81.5Confident7 Ų728.5 Ų28.56%0.05813%0.134CC..Hα-helixtrans-72.5-21.6-177.600000115.4M1 L7 P128 A282 Q285M1-A3 VanDerWaalsContact C-N 3.26Å; M1-A3 PolarHBondContact O-N 3.26Å; M1-A3 VanDerWaalsContact O-N 3.09Å; A3-L7 WeakPolarHBondContact O-CD1 3.48Å; A3-P128 HydrophobicContact CB-CB 3.9Å; A3-P128 HydrophobicContact CB-CG 4.29Å; A3-A282 HydrophobicContact CB-CB 3.93Å; A3-Q285 HydrophobicContact CB-CB 4.14Å; A3-Q285 HydrophobicContact CB-CG 3.64Å
4L83.8Confident81.5Confident7 Ų730.8 Ų30.84%0.03717%0.169CC..Hα-helixtrans-111.5-31.3-174-69.3-179.3000112.9M1 R2 I6 L7 Y8 C131 A135 W140 F144 A282M1-L4 PolarHBondContact O-N 3.18Å; R2-L4 PolarHBondContact O-N 3.18Å; L4-I6 PolarHBondContact O-N 2.98Å; L4-L7 PolarHBondContact O-N 2.89Å; L4-Y8 VanDerWaalsContact O-CB 3.22Å; L4-Y8 WeakPolarHBondContact O-CB 3.25Å; L4-Y8 PolarHBondContact O-N 3.11Å; L4-C131 HydrophobicContact CD1-CB 3.68Å; L4-A135 HydrophobicContact CD2-CB 4.04Å; L4-W140 HydrophobicContact CB-CZ3 4.48Å; L4-W140 HydrophobicContact CD2-CZ3 4.05Å; L4-F144 HydrophobicContact CB-CE1 3.89Å; L4-F144 HydrophobicContact CB-CZ 4.19Å; L4-F144 HydrophobicContact CD1-CD1 4.32Å; L4-F144 HydrophobicContact CD1-CE1 4.16Å; L4-A282 HydrophobicContact CD2-CB 4.03Å
5L84.9Confident81.6Confident0 Ų030.7 Ų30.70%017%0.166CC..Hα-helixtrans-60.8-49.1-166.8179.760.4000111.7M1 L7 Y8 L9 F24 Y27 L80M1-L5 HydrophobicContact CE-CD1 4.15Å; M1-L5 WeakPolarHBondContact O-CB 3.34Å; M1-L5 PolarHBondContact O-N 2.84Å; L5-L7 VanDerWaalsContact C-N 3.33Å; L5-L7 PolarHBondContact O-N 3.21Å; L5-Y8 HydrophobicContact CD1-CD1 4.4Å; L5-Y8 PolarHBondContact O-N 3.13Å; L5-L9 HydrophobicContact CD1-CD1 4.18Å; L5-L9 HydrophobicContact CD1-CG 4.18Å; L5-L9 HydrophobicContact CG-CD1 4.04Å; L5-L9 HydrophobicContact CG-CG 4.47Å; L5-L9 WeakPolarHBondContact O-CG 3.42Å; L5-L9 PolarHBondContact O-N 3.13Å; L5-F24 HydrophobicContact CB-CD2 4.32Å; L5-F24 HydrophobicContact CD2-CD2 4.13Å; L5-F24 HydrophobicContact CG-CD2 4.39Å; L5-Y27 HydrophobicContact CD2-CD1 3.59Å; L5-Y27 HydrophobicContact CD2-CE1 4.08Å; L5-Y27 HydrophobicContact CD2-CG 3.97Å; L5-L80 HydrophobicContact CD1-CD1 4.34Å; L5-L80 HydrophobicContact CD1-CD2 3.99Å; L5-L80 HydrophobicContact CD2-CD1 4.32Å; L5-L80 HydrophobicContact CD2-CD2 4Å
6I85Confident81.9Confident0 Ų034.3 Ų34.30%019%0.185CC..Hα-helixtrans-64.4-41.2-178.8-163.4168000111.8L4 Y8 L9 T10 A20 I21 F24 G259 L264L4-I6 PolarHBondContact O-N 2.98Å; I6-Y8 VanDerWaalsContact C-N 3.33Å; I6-Y8 PolarHBondContact O-N 3.19Å; I6-L9 PolarHBondContact O-N 2.76Å; I6-T10 WeakPolarHBondContact O-CG2 3.15Å; I6-T10 PolarHBondContact O-N 2.99Å; I6-T10 VanDerWaalsContact O-N 3.07Å; I6-T10 PolarHBondContact O-OG1 3.01Å; I6-A20 HydrophobicContact CG1-CB 4.4Å; I6-I21 HydrophobicContact CD1-CG1 4.06Å; I6-F24 HydrophobicContact CB-CD2 4.26Å; I6-G259 WeakPolarHBondContact CG2-O 3.41Å; I6-L264 HydrophobicContact CD1-CD1 3.85Å; I6-L264 HydrophobicContact CD1-CD2 4.3Å; I6-L264 HydrophobicContact CD1-CG 3.9Å; I6-L264 HydrophobicContact CG1-CD1 4.46Å; I6-L264 HydrophobicContact CG1-CD2 4.19Å; I6-L264 HydrophobicContact CG1-CG 4.33Å
7L84.9Confident82.1Confident7 Ų732.7 Ų32.74%0.03718%0.177CC..Hα-helixtrans-65.9-38.7178.6-58172.4000111.3A3 L4 L5 T10 H11 W140 D267 T281A3-L7 WeakPolarHBondContact O-CD1 3.48Å; L4-L7 PolarHBondContact O-N 2.89Å; L5-L7 VanDerWaalsContact C-N 3.33Å; L5-L7 PolarHBondContact O-N 3.21Å; L7-T10 PolarHBondContact O-N 3.07Å; L7-T10 PolarHBondContact O-OG1 3.39Å; L7-T10 VanDerWaalsContact O-OG1 3.14Å; L7-H11 VanDerWaalsContact O-CB 3.24Å; L7-H11 WeakPolarHBondContact O-CB 3.21Å; L7-H11 PolarHBondContact O-CD2 2.79Å; L7-H11 VanDerWaalsContact O-CD2 3.28Å; L7-H11 PolarHBondContact O-N 2.95Å; L7-W140 HydrophobicContact CB-CH2 3.61Å; L7-W140 HydrophobicContact CB-CZ3 4.15Å; L7-D267 HydrophobicContact CD2-CB 3.84Å; L7-T281 HydrophobicContact CD1-CG2 4.21Å; L7-T281 HydrophobicContact CD2-CG2 4.25Å
8Y85.5Confident82.3Confident0 Ų034.4 Ų34.40%019%0.186CC..Hα-helixtrans-65.8-42.4176.1167.8-114.7000112.2L4 L5 I6 T10 Q12 L13 L66 T70 L76 W140 F144L4-Y8 VanDerWaalsContact O-CB 3.22Å; L4-Y8 WeakPolarHBondContact O-CB 3.25Å; L4-Y8 PolarHBondContact O-N 3.11Å; L5-Y8 HydrophobicContact CD1-CD1 4.4Å; L5-Y8 PolarHBondContact O-N 3.13Å; I6-Y8 VanDerWaalsContact C-N 3.33Å; I6-Y8 PolarHBondContact O-N 3.19Å; Y8-T10 VanDerWaalsContact C-N 3.34Å; Y8-T10 PolarHBondContact O-N 3.39Å; Y8-Q12 HydrophobicContact CD2-CB 3.52Å; Y8-Q12 HydrophobicContact CD2-CG 4.07Å; Y8-Q12 HydrophobicContact CE2-CB 3.65Å; Y8-Q12 HydrophobicContact CE2-CG 3.69Å; Y8-Q12 WeakPolarHBondContact O-CB 3.36Å; Y8-Q12 PolarHBondContact O-N 3.4Å; Y8-L13 HydrophobicContact CE1-CD1 4.41Å; Y8-L13 PolarHBondContact O-N 3.03Å; Y8-L66 HydrophobicContact CE1-CD1 3.92Å; Y8-T70 HydrophobicContact CE2-CG2 4.25Å; Y8-T70 VanDerWaalsContact OH-C 3.25Å; Y8-T70 WeakPolarHBondContact OH-CA 3.27Å; Y8-T70 PolarHBondContact OH-O 3.46Å; Y8-L76 HydrophobicContact CD1-CD1 3.99Å; Y8-L76 HydrophobicContact CE1-CD1 3.39Å; Y8-L76 HydrophobicContact CE1-CG 4.19Å; Y8-W140 HydrophobicContact CD2-CB 4.12Å; Y8-W140 HydrophobicContact CD2-CD2 4.06Å; Y8-W140 HydrophobicContact CD2-CE3 4.17Å; Y8-W140 HydrophobicContact CD2-CG 4.03Å; Y8-W140 HydrophobicContact CE2-CB 4.38Å; Y8-W140 HydrophobicContact CG-CE3 4.44Å; Y8-F144 AromaticContact CD1-CE2 3.86Å; Y8-F144 HydrophobicContact CD1-CE2 3.86Å; Y8-F144 AromaticContact CD1-CZ 3.73Å; Y8-F144 HydrophobicContact CD1-CZ 3.73Å; Y8-F144 AromaticContact CD2-CE2 3.57Å; Y8-F144 HydrophobicContact CD2-CE2 3.57Å; Y8-F144 HydrophobicContact CD2-CZ 4.09Å; Y8-F144 HydrophobicContact CE1-CE2 4.08Å; Y8-F144 HydrophobicContact CE1-CZ 4.3Å; Y8-F144 AromaticContact CE2-CE2 3.85Å; Y8-F144 HydrophobicContact CE2-CE2 3.85Å; Y8-F144 AromaticContact CG-CE2 3.57Å; Y8-F144 HydrophobicContact CG-CE2 3.57Å; Y8-F144 AromaticContact CG-CZ 3.59Å; Y8-F144 HydrophobicContact CG-CZ 3.59Å
9L83.6Confident82.5Confident0 Ų035.5 Ų35.50%019%0.189CC..Hα-helixtrans-60.5-43.9175.8-69.7170.8000111.4L5 I6 L13 G14 F15 A20 L23 L76L5-L9 HydrophobicContact CD1-CD1 4.18Å; L5-L9 HydrophobicContact CD1-CG 4.18Å; L5-L9 HydrophobicContact CG-CD1 4.04Å; L5-L9 HydrophobicContact CG-CG 4.47Å; L5-L9 WeakPolarHBondContact O-CG 3.42Å; L5-L9 PolarHBondContact O-N 3.13Å; I6-L9 PolarHBondContact O-N 2.76Å; L9-L13 HydrophobicContact CD2-CD1 4.21Å; L9-G14 PolarHBondContact O-N 3.12Å; L9-F15 HydrophobicContact CB-CD2 4.38Å; L9-F15 HydrophobicContact CD2-CD2 3.77Å; L9-F15 HydrophobicContact CD2-CE2 3.89Å; L9-F15 WeakPolarHBondContact O-CB 3.44Å; L9-F15 PolarHBondContact O-N 2.89Å; L9-A20 HydrophobicContact CB-CB 3.81Å; L9-A20 HydrophobicContact CD1-CB 4.32Å; L9-L23 HydrophobicContact CD1-CB 4.28Å; L9-L23 HydrophobicContact CD1-CD2 4.11Å; L9-L23 HydrophobicContact CD1-CG 4.24Å; L9-L23 HydrophobicContact CD2-CD2 3.7Å; L9-L76 HydrophobicContact CD2-CD1 3.29Å; L9-L76 HydrophobicContact CD2-CD2 4.32Å; L9-L76 HydrophobicContact CD2-CG 4.48Å; L9-L76 HydrophobicContact CG-CD1 4.43Å
10T79.8Confident82.8Confident19 Ų1933.8 Ų33.812%0.11718%0.18CC..Hα-helixtrans-78-42-178.357.30000113.2I6 L7 Y8 G14 A20 L264I6-T10 WeakPolarHBondContact O-CG2 3.15Å; I6-T10 PolarHBondContact O-N 2.99Å; I6-T10 VanDerWaalsContact O-N 3.07Å; I6-T10 PolarHBondContact O-OG1 3.01Å; L7-T10 PolarHBondContact O-N 3.07Å; L7-T10 PolarHBondContact O-OG1 3.39Å; L7-T10 VanDerWaalsContact O-OG1 3.14Å; Y8-T10 VanDerWaalsContact C-N 3.34Å; Y8-T10 PolarHBondContact O-N 3.39Å; T10-G14 WeakPolarHBondContact O-CA 3.47Å; T10-A20 HydrophobicContact CG2-CB 3.75Å; T10-L264 HydrophobicContact CG2-CD2 3.92Å
11H80.2Confident83.1Confident110 Ų11032.1 Ų32.151%0.50917%0.171SC..Hα-helixtrans-86.9-45.7-174.2-77.1-82.9000113.9L7 W140 D267L7-H11 VanDerWaalsContact O-CB 3.24Å; L7-H11 WeakPolarHBondContact O-CB 3.21Å; L7-H11 PolarHBondContact O-CD2 2.79Å; L7-H11 VanDerWaalsContact O-CD2 3.28Å; L7-H11 PolarHBondContact O-N 2.95Å; H11-W140 HydrophobicContact CB-CZ2 4.01Å; H11-D267 IonicContact CD2-OD2 3.67Å; H11-D267 IonicContact CE1-OD2 2.65Å; H11-D267 IonicContact NE2-OD1 3.2Å; H11-D267 IonicContact NE2-OD2 3.55Å; H11-D267 PolarHBondContact NE2-OD2 3.42Å
12Q80.1Confident83.7Confident70 Ų7031 Ų3133%0.32717%0.168SC..THydrogen-bonded Turntrans-86.7-45.9-173.7-171.369.51800111.7Y8 N71Y8-Q12 HydrophobicContact CD2-CB 3.52Å; Y8-Q12 HydrophobicContact CD2-CG 4.07Å; Y8-Q12 HydrophobicContact CE2-CB 3.65Å; Y8-Q12 HydrophobicContact CE2-CG 3.69Å; Y8-Q12 WeakPolarHBondContact O-CB 3.36Å; Y8-Q12 PolarHBondContact O-N 3.4Å; Q12-N71 PolarHBondContact NE2-OD1 3.39Å
13L81.6Confident84.3Confident30 Ų3027.2 Ų27.216%0.15715%0.153CC..SBendtrans-90.2-10.7-178.6-69.5-178000113.6Y8 L9 F15 L76Y8-L13 HydrophobicContact CE1-CD1 4.41Å; Y8-L13 PolarHBondContact O-N 3.03Å; L9-L13 HydrophobicContact CD2-CD1 4.21Å; L13-F15 HydrophobicContact CB-CD1 3.86Å; L13-F15 HydrophobicContact CB-CE1 3.9Å; L13-F15 HydrophobicContact CB-CG 4.35Å; L13-F15 HydrophobicContact CB-CZ 4.42Å; L13-F15 HydrophobicContact CD1-CE1 4.31Å; L13-F15 HydrophobicContact CD1-CE2 4.37Å; L13-F15 HydrophobicContact CD1-CZ 4.06Å; L13-F15 PolarHBondContact O-N 3.32Å; L13-L76 HydrophobicContact CD1-CB 4.37Å; L13-L76 HydrophobicContact CD1-CD1 3.25Å; L13-L76 HydrophobicContact CD1-CG 4.42Å
14G81Confident85Confident60 Ų6027.2 Ų27.262%0.61915%0.152SC*.  trans63.829178.400000113.3L9 T10L9-G14 PolarHBondContact O-N 3.12Å; T10-G14 WeakPolarHBondContact O-CA 3.47Å
15F83.7Confident85.4Confident30 Ų3027.2 Ų27.213%0.13215%0.153CC..  trans-69141.3176-73.54000110.2L9 L13 H19 A20 L23 T73L9-F15 HydrophobicContact CB-CD2 4.38Å; L9-F15 HydrophobicContact CD2-CD2 3.77Å; L9-F15 HydrophobicContact CD2-CE2 3.89Å; L9-F15 WeakPolarHBondContact O-CB 3.44Å; L9-F15 PolarHBondContact O-N 2.89Å; L13-F15 HydrophobicContact CB-CD1 3.86Å; L13-F15 HydrophobicContact CB-CE1 3.9Å; L13-F15 HydrophobicContact CB-CG 4.35Å; L13-F15 HydrophobicContact CB-CZ 4.42Å; L13-F15 HydrophobicContact CD1-CE1 4.31Å; L13-F15 HydrophobicContact CD1-CE2 4.37Å; L13-F15 HydrophobicContact CD1-CZ 4.06Å; L13-F15 PolarHBondContact O-N 3.32Å; F15-H19 AromaticContact CD2-CD2 3.15Å; F15-H19 WeakPolarHBondContact CD2-CD2 3.32Å; F15-H19 AromaticContact CD2-NE2 3.69Å; F15-H19 AromaticContact CE2-CD2 3.38Å; F15-H19 WeakPolarHBondContact CE2-CD2 3.48Å; F15-H19 AromaticContact CE2-NE2 3.39Å; F15-H19 WeakPolarHBondContact CE2-NE2 3.41Å; F15-H19 AromaticContact CG-CD2 3.59Å; F15-H19 AromaticContact CZ-CD2 4Å; F15-H19 AromaticContact CZ-NE2 3.93Å; F15-A20 HydrophobicContact CB-CB 4.41Å; F15-L23 HydrophobicContact CE2-CD2 4.09Å; F15-T73 HydrophobicContact CZ-CG2 3.74Å
16D86.5Confident85.7Confident87 Ų8727.3 Ų27.347%0.46515%0.153SC..  trans-61.1151.7168-176.536.3000110.3N18 H19 A20D16-N18 PolarHBondContact O-N 3.09Å; D16-H19 PolarHBondContact O-N 3.17Å; D16-A20 PolarHBondContact O-N 3.34Å
17D84.2Confident86Confident8 Ų828.2 Ų28.24%0.04316%0.157CC..Hα-helixtrans-58.6-38.4-174-71.4-13000111.8H19 A20 I21 L264 R268 T406D17-H19 VanDerWaalsContact C-N 3.28Å; D17-H19 PolarHBondContact O-N 2.95Å; D17-A20 PolarHBondContact O-N 3.4Å; D17-I21 HydrophobicContact CB-CD1 4.34Å; D17-I21 WeakPolarHBondContact O-CB 3.22Å; D17-I21 WeakPolarHBondContact O-CD1 3.4Å; D17-I21 WeakPolarHBondContact O-CG1 3.24Å; D17-I21 PolarHBondContact O-N 3.26Å; D17-L264 HydrophobicContact CB-CD1 4.49Å; D17-R268 VanDerWaalsContact CG-NH2 3.3Å; D17-R268 IonicContact OD1-CZ 2.69Å; D17-R268 IonicContact OD1-NH1 2.71Å; D17-R268 IonicContact OD1-NH2 3.8Å; D17-R268 PolarHBondContact OD1-NH2 3.11Å; D17-R268 IonicContact OD2-CZ 3.77Å; D17-R268 IonicContact OD2-NH1 2.67Å; D17-R268 PolarHBondContact OD2-NH1 3.13Å; D17-R268 IonicContact OD2-NH2 3.52Å; D17-R268 PolarHBondContact OD2-NH2 2.94Å; D17-T406 HydrophobicContact CB-CG2 3.64Å
18N85.6Confident86.4Confident63 Ų6328.4 Ų28.434%0.33716%0.159SC..Hα-helixtrans-58.5-43.1177.6-79.9-35.1000112D16 S22 Q403 T406D16-N18 PolarHBondContact O-N 3.09Å; N18-S22 WeakPolarHBondContact O-CB 3.32Å; N18-S22 PolarHBondContact O-N 2.92Å; N18-S22 PolarHBondContact O-OG 3.18Å; N18-Q403 PolarHBondContact O-NE2 2.71Å; N18-T406 HydrophobicContact CB-CG2 4.27Å; N18-T406 VanDerWaalsContact ND2-CG2 3.28Å; N18-T406 WeakPolarHBondContact ND2-CG2 3.22Å; N18-T406 WeakPolarHBondContact OD1-CB 3.49Å; N18-T406 WeakPolarHBondContact OD1-CG2 3.27Å; N18-T406 PolarHBondContact OD1-OG1 3.4Å
19H86.5Confident86.7Confident56 Ų5628.6 Ų28.626%0.25916%0.161SC..Hα-helixtrans-76-38.7-179.8-169.148.6000111.8F15 D16 D17 I21 S22 L23 Y77F15-H19 AromaticContact CD2-CD2 3.15Å; F15-H19 WeakPolarHBondContact CD2-CD2 3.32Å; F15-H19 AromaticContact CD2-NE2 3.69Å; F15-H19 AromaticContact CE2-CD2 3.38Å; F15-H19 WeakPolarHBondContact CE2-CD2 3.48Å; F15-H19 AromaticContact CE2-NE2 3.39Å; F15-H19 WeakPolarHBondContact CE2-NE2 3.41Å; F15-H19 AromaticContact CG-CD2 3.59Å; F15-H19 AromaticContact CZ-CD2 4Å; F15-H19 AromaticContact CZ-NE2 3.93Å; D16-H19 PolarHBondContact O-N 3.17Å; D17-H19 VanDerWaalsContact C-N 3.28Å; D17-H19 PolarHBondContact O-N 2.95Å; H19-I21 VanDerWaalsContact C-N 3.35Å; H19-I21 PolarHBondContact O-N 3.32Å; H19-S22 WeakPolarHBondContact CA-OG 3.41Å; H19-S22 PolarHBondContact O-OG 2.94Å; H19-L23 VanDerWaalsContact O-CB 3.29Å; H19-L23 WeakPolarHBondContact O-CB 3.46Å; H19-L23 PolarHBondContact O-N 2.96Å; H19-Y77 PolarHBondContact CE1-OH 2.79Å; H19-Y77 PolarHBondContact NE2-OH 3.41Å
20A88.1Confident87.1Confident0 Ų028.8 Ų28.80%016%0.162CC..Hα-helixtrans-63-42.2174.400000111.7I6 L9 T10 F15 D16 D17 F24I6-A20 HydrophobicContact CG1-CB 4.4Å; L9-A20 HydrophobicContact CB-CB 3.81Å; L9-A20 HydrophobicContact CD1-CB 4.32Å; T10-A20 HydrophobicContact CG2-CB 3.75Å; F15-A20 HydrophobicContact CB-CB 4.41Å; D16-A20 PolarHBondContact O-N 3.34Å; D17-A20 PolarHBondContact O-N 3.4Å; A20-F24 WeakPolarHBondContact O-CB 3.33Å; A20-F24 PolarHBondContact O-N 3.49Å
21I89.6Confident87.6Confident0 Ų028.4 Ų28.40%016%0.159CC..Hα-helixtrans-69.8-43.1178.3-70165.8000111.2I6 D17 H19 S25 L264 G399 A402 Q403I6-I21 HydrophobicContact CD1-CG1 4.06Å; D17-I21 HydrophobicContact CB-CD1 4.34Å; D17-I21 WeakPolarHBondContact O-CB 3.22Å; D17-I21 WeakPolarHBondContact O-CD1 3.4Å; D17-I21 WeakPolarHBondContact O-CG1 3.24Å; D17-I21 PolarHBondContact O-N 3.26Å; H19-I21 VanDerWaalsContact C-N 3.35Å; H19-I21 PolarHBondContact O-N 3.32Å; I21-S25 VanDerWaalsContact O-CB 3.29Å; I21-S25 WeakPolarHBondContact O-CB 3.15Å; I21-S25 PolarHBondContact O-N 3.43Å; I21-S25 PolarHBondContact O-OG 2.89Å; I21-L264 HydrophobicContact CD1-CD1 4.27Å; I21-L264 HydrophobicContact CG1-CD1 4.42Å; I21-G399 VanDerWaalsContact CG2-O 3.3Å; I21-G399 WeakPolarHBondContact CG2-O 3.16Å; I21-A402 HydrophobicContact CD1-CB 4.14Å; I21-A402 HydrophobicContact CG2-CB 3.64Å; I21-Q403 HydrophobicContact CB-CG 4.38Å; I21-Q403 HydrophobicContact CG2-CG 3.89Å
22S89.1Confident88.1Confident18 Ų1826.7 Ų26.713%0.12615%0.149CC..Hα-helixtrans-61.3-47.6177.2640000110.7N18 H19 S25 A26N18-S22 WeakPolarHBondContact O-CB 3.32Å; N18-S22 PolarHBondContact O-N 2.92Å; N18-S22 PolarHBondContact O-OG 3.18Å; H19-S22 WeakPolarHBondContact CA-OG 3.41Å; H19-S22 PolarHBondContact O-OG 2.94Å; S22-S25 PolarHBondContact O-N 3.22Å; S22-S25 PolarHBondContact O-OG 2.94Å; S22-A26 WeakPolarHBondContact O-CB 3.34Å; S22-A26 PolarHBondContact O-N 3.39Å
23L90.4Very high88.5Confident0 Ų023.9 Ų23.90%014%0.137CC..Hα-helixtrans-66.5-43.3-179.7-178.451.3000112.3L9 F15 H19 A26 Y27 L76 Y77 L80 L204L9-L23 HydrophobicContact CD1-CB 4.28Å; L9-L23 HydrophobicContact CD1-CD2 4.11Å; L9-L23 HydrophobicContact CD1-CG 4.24Å; L9-L23 HydrophobicContact CD2-CD2 3.7Å; F15-L23 HydrophobicContact CE2-CD2 4.09Å; H19-L23 VanDerWaalsContact O-CB 3.29Å; H19-L23 WeakPolarHBondContact O-CB 3.46Å; H19-L23 PolarHBondContact O-N 2.96Å; L23-A26 PolarHBondContact O-N 3.32Å; L23-Y27 VanDerWaalsContact O-CB 3.32Å; L23-Y27 WeakPolarHBondContact O-CB 3.26Å; L23-Y27 PolarHBondContact O-N 3.09Å; L23-L76 HydrophobicContact CD2-CD2 3.82Å; L23-Y77 HydrophobicContact CD1-CD1 4.01Å; L23-Y77 HydrophobicContact CD1-CE1 3.56Å; L23-Y77 HydrophobicContact CD2-CD1 4.26Å; L23-Y77 HydrophobicContact CD2-CE1 3.51Å; L23-Y77 HydrophobicContact CG-CE1 4.17Å; L23-L80 HydrophobicContact CD1-CD1 4.11Å; L23-L80 HydrophobicContact CG-CD1 4.27Å; L23-L204 HydrophobicContact CD1-CB 4.15Å; L23-L204 HydrophobicContact CD1-CD1 4.41Å; L23-L204 HydrophobicContact CD1-CD2 3.92Å; L23-L204 HydrophobicContact CD1-CG 4.38Å
24F91Very high88.8Confident7 Ų722.9 Ų22.93%0.03113%0.132CC..Hα-helixtrans-60.4-47.6176.2172-90.3000111.8R2 L5 I6 A20 Y27 A28 G259R2-F24 HydrophobicContact CG-CE2 4.06Å; R2-F24 HydrophobicContact CG-CZ 3.84Å; L5-F24 HydrophobicContact CB-CD2 4.32Å; L5-F24 HydrophobicContact CD2-CD2 4.13Å; L5-F24 HydrophobicContact CG-CD2 4.39Å; I6-F24 HydrophobicContact CB-CD2 4.26Å; A20-F24 WeakPolarHBondContact O-CB 3.33Å; A20-F24 PolarHBondContact O-N 3.49Å; F24-Y27 PolarHBondContact O-N 3.5Å; F24-A28 WeakPolarHBondContact O-CB 3.45Å; F24-A28 PolarHBondContact O-N 2.84Å; F24-G259 VanDerWaalsContact CZ-O 3.26Å; F24-G259 WeakPolarHBondContact CZ-O 3.37Å
25S91.2Very high89.2Confident7 Ų720.7 Ų20.75%0.04911%0.107CC..Hα-helixtrans-68.5-38.3-179.558.50000112.1I21 S22 A28 S29 N395I21-S25 VanDerWaalsContact O-CB 3.29Å; I21-S25 WeakPolarHBondContact O-CB 3.15Å; I21-S25 PolarHBondContact O-N 3.43Å; I21-S25 PolarHBondContact O-OG 2.89Å; S22-S25 PolarHBondContact O-N 3.22Å; S22-S25 PolarHBondContact O-OG 2.94Å; S25-A28 PolarHBondContact O-N 3.15Å; S25-S29 VanDerWaalsContact O-CB 3.26Å; S25-S29 WeakPolarHBondContact O-CB 3.41Å; S25-S29 PolarHBondContact O-N 3.33Å; S25-S29 PolarHBondContact O-OG 3.26Å; S25-N395 VanDerWaalsContact CB-O 3.27Å; S25-N395 WeakPolarHBondContact CB-O 3.11Å
26A92.1Very high89.2Confident1 Ų123.3 Ų23.31%0.00812%0.121CC..Hα-helixtrans-59.5-51.1171.800000111.2S22 L23 A28 S29 L30 L204 S209S22-A26 WeakPolarHBondContact O-CB 3.34Å; S22-A26 PolarHBondContact O-N 3.39Å; L23-A26 PolarHBondContact O-N 3.32Å; A26-A28 PolarHBondContact O-N 3.16Å; A26-S29 PolarHBondContact O-N 3.24Å; A26-L30 VanDerWaalsContact O-CG 3.25Å; A26-L30 WeakPolarHBondContact O-CG 3.47Å; A26-L30 PolarHBondContact O-N 3.02Å; A26-L204 HydrophobicContact CB-CD2 3.81Å; A26-S209 VanDerWaalsContact CB-OG 3.24Å; A26-S209 WeakPolarHBondContact CB-OG 3.42Å
27Y92.4Very high89.1Confident19 Ų1924.4 Ų24.48%0.07513%0.127CC..Hα-helixtrans-55.8-53.2175.5164.2-100.7000111.7M1 L5 L23 F24 S29 L30 V31 L80 I83 I84M1-Y27 HydrophobicContact CB-CE1 4.21Å; M1-Y27 WeakPolarHBondContact CB-OH 3.3Å; L5-Y27 HydrophobicContact CD2-CD1 3.59Å; L5-Y27 HydrophobicContact CD2-CE1 4.08Å; L5-Y27 HydrophobicContact CD2-CG 3.97Å; L23-Y27 VanDerWaalsContact O-CB 3.32Å; L23-Y27 WeakPolarHBondContact O-CB 3.26Å; L23-Y27 PolarHBondContact O-N 3.09Å; F24-Y27 PolarHBondContact O-N 3.5Å; Y27-S29 VanDerWaalsContact C-N 3.26Å; Y27-S29 PolarHBondContact O-N 3.42Å; Y27-L30 PolarHBondContact O-N 3.38Å; Y27-V31 HydrophobicContact CD2-CG2 4.09Å; Y27-V31 HydrophobicContact CE1-CG2 4.19Å; Y27-V31 HydrophobicContact CE2-CG2 3.65Å; Y27-V31 VanDerWaalsContact O-CG2 3.28Å; Y27-V31 WeakPolarHBondContact O-CG2 3.45Å; Y27-V31 PolarHBondContact O-N 2.92Å; Y27-L80 HydrophobicContact CD2-CB 4.14Å; Y27-L80 HydrophobicContact CD2-CD1 4.43Å; Y27-L80 HydrophobicContact CD2-CD2 3.79Å; Y27-L80 HydrophobicContact CD2-CG 4.34Å; Y27-L80 HydrophobicContact CE2-CD2 3.9Å; Y27-L80 HydrophobicContact CG-CD2 4.3Å; Y27-I83 HydrophobicContact CE2-CG2 4.05Å; Y27-I83 WeakPolarHBondContact OH-CG2 3.25Å; Y27-I84 HydrophobicContact CD2-CD1 3.83Å; Y27-I84 HydrophobicContact CD2-CG1 3.7Å; Y27-I84 HydrophobicContact CE2-CG1 3.92Å
28A92.5Very high89.1Confident11 Ų1124.2 Ų24.29%0.09113%0.126CC..Hα-helixtrans-61.2-37.8-178.400000111.5F24 S25 A26 Y32 N395F24-A28 WeakPolarHBondContact O-CB 3.45Å; F24-A28 PolarHBondContact O-N 2.84Å; S25-A28 PolarHBondContact O-N 3.15Å; A26-A28 PolarHBondContact O-N 3.16Å; A28-Y32 VanDerWaalsContact O-CD2 3.25Å; A28-Y32 WeakPolarHBondContact O-CD2 3.33Å; A28-Y32 PolarHBondContact O-N 3.43Å; A28-N395 HydrophobicContact CB-CB 3.87Å; A28-N395 VanDerWaalsContact CB-OD1 3.3Å; A28-N395 WeakPolarHBondContact CB-OD1 3.42Å
29S92.1Very high89Confident4 Ų421.7 Ų21.73%0.02812%0.115CC..Hα-helixtrans-65-47.7177-57.30000112S25 A26 Y27 V31 Y32 V33 A392 W396S25-S29 VanDerWaalsContact O-CB 3.26Å; S25-S29 WeakPolarHBondContact O-CB 3.41Å; S25-S29 PolarHBondContact O-N 3.33Å; S25-S29 PolarHBondContact O-OG 3.26Å; A26-S29 PolarHBondContact O-N 3.24Å; Y27-S29 VanDerWaalsContact C-N 3.26Å; Y27-S29 PolarHBondContact O-N 3.42Å; S29-V31 VanDerWaalsContact C-N 3.3Å; S29-V31 PolarHBondContact O-N 3.46Å; S29-Y32 PolarHBondContact O-N 3Å; S29-V33 WeakPolarHBondContact O-CG2 3.18Å; S29-V33 PolarHBondContact O-N 3.5Å; S29-V33 VanDerWaalsContact O-N 3.14Å; S29-A392 WeakPolarHBondContact CB-O 3.36Å; S29-A392 WeakPolarHBondContact O-CB 3.38Å; S29-A392 PolarHBondContact OG-O 2.84Å; S29-W396 WeakPolarHBondContact OG-CA 3.21Å; S29-W396 WeakPolarHBondContact OG-CB 3.4Å; S29-W396 PolarHBondContact OG-N 3.07Å
30L90.8Very high88.9Confident4 Ų425.1 Ų25.12%0.02113%0.126CC..Hα-helixtrans-63.8-36.8-179.6-68.3171.1000112.1A26 Y27 Y32 V33 T34 I84 F200 L203 L204 L212A26-L30 VanDerWaalsContact O-CG 3.25Å; A26-L30 WeakPolarHBondContact O-CG 3.47Å; A26-L30 PolarHBondContact O-N 3.02Å; Y27-L30 PolarHBondContact O-N 3.38Å; L30-Y32 PolarHBondContact O-N 3.29Å; L30-V33 PolarHBondContact O-N 3.46Å; L30-T34 WeakPolarHBondContact O-CG2 3.42Å; L30-T34 PolarHBondContact O-N 2.92Å; L30-T34 PolarHBondContact O-OG1 3.41Å; L30-I84 HydrophobicContact CB-CD1 3.94Å; L30-I84 HydrophobicContact CB-CG1 4.21Å; L30-I84 HydrophobicContact CB-CG2 3.93Å; L30-I84 HydrophobicContact CD1-CD1 3.83Å; L30-F200 HydrophobicContact CD1-CD1 4.06Å; L30-F200 HydrophobicContact CD1-CE1 4.49Å; L30-F200 HydrophobicContact CD2-CD1 4.39Å; L30-F200 HydrophobicContact CD2-CE1 4.04Å; L30-L203 HydrophobicContact CD1-CD2 3.6Å; L30-L203 HydrophobicContact CD2-CD2 4.02Å; L30-L203 HydrophobicContact CG-CD2 4.38Å; L30-L204 HydrophobicContact CD1-CD2 3.81Å; L30-L204 HydrophobicContact CD1-CG 4.36Å; L30-L212 HydrophobicContact CD2-CD2 3.71Å
31V91.5Very high88.6Confident12 Ų1227 Ų277%0.07314%0.136CC..Hα-helixtrans-57.8-26.9173.2165.60000112.5Y27 S29 P35 I84 Y87Y27-V31 HydrophobicContact CD2-CG2 4.09Å; Y27-V31 HydrophobicContact CE1-CG2 4.19Å; Y27-V31 HydrophobicContact CE2-CG2 3.65Å; Y27-V31 VanDerWaalsContact O-CG2 3.28Å; Y27-V31 WeakPolarHBondContact O-CG2 3.45Å; Y27-V31 PolarHBondContact O-N 2.92Å; S29-V31 VanDerWaalsContact C-N 3.3Å; S29-V31 PolarHBondContact O-N 3.46Å; V31-P35 WeakPolarHBondContact O-CD 3.32Å; V31-P35 WeakPolarHBondContact O-CG 3.48Å; V31-I84 HydrophobicContact CG2-CG1 3.95Å; V31-Y87 HydrophobicContact CB-CD1 4.29Å; V31-Y87 HydrophobicContact CG1-CD1 3.37Å; V31-Y87 HydrophobicContact CG1-CD2 4.21Å; V31-Y87 HydrophobicContact CG1-CE1 3.33Å; V31-Y87 HydrophobicContact CG1-CE2 4.18Å; V31-Y87 HydrophobicContact CG1-CG 3.81Å; V31-Y87 WeakPolarHBondContact O-CD1 3.31Å; V31-Y87 VanDerWaalsContact O-CE1 3.23Å; V31-Y87 WeakPolarHBondContact O-CE1 3.48Å
32Y89.7Confident88.2Confident73 Ų7327.1 Ų27.129%0.28614%0.137SC..Hα-helixtrans-91.7-20.5173.6-78.3-76.4000114.3A28 S29 L30 G391 N395A28-Y32 VanDerWaalsContact O-CD2 3.25Å; A28-Y32 WeakPolarHBondContact O-CD2 3.33Å; A28-Y32 PolarHBondContact O-N 3.43Å; S29-Y32 PolarHBondContact O-N 3Å; L30-Y32 PolarHBondContact O-N 3.29Å; Y32-G391 VanDerWaalsContact CG-CA 3.45Å; Y32-N395 WeakPolarHBondContact CE2-ND2 3.44Å
33V88.1Confident87.9Confident12 Ų1230.1 Ų30.17%0.07315%0.151CC..Hα-helixtrans-80.8-44.8175.6176.90000111.5S29 L30 I36 L213 V216 L388 A392S29-V33 WeakPolarHBondContact O-CG2 3.18Å; S29-V33 PolarHBondContact O-N 3.5Å; S29-V33 VanDerWaalsContact O-N 3.14Å; L30-V33 PolarHBondContact O-N 3.46Å; V33-I36 WeakPolarHBondContact O-CB 3.41Å; V33-I36 PolarHBondContact O-N 3Å; V33-L213 HydrophobicContact CG2-CD1 4.24Å; V33-V216 HydrophobicContact CG1-CG2 4.3Å; V33-L388 HydrophobicContact CG2-CD1 4.01Å; V33-A392 HydrophobicContact CG2-CB 3.49Å; V33-A392 VanDerWaalsContact CG2-CB 3.49Å
34T88.4Confident87.3Confident8 Ų837.5 Ų37.55%0.04918%0.179CC..Hα-helixtrans-63-29.3-173.657.70000115.5L30 I36 L37 G38 I84 G88 F200L30-T34 WeakPolarHBondContact O-CG2 3.42Å; L30-T34 PolarHBondContact O-N 2.92Å; L30-T34 PolarHBondContact O-OG1 3.41Å; T34-I36 PolarHBondContact O-N 3.19Å; T34-L37 PolarHBondContact O-N 2.98Å; T34-L37 VanDerWaalsContact O-N 3.13Å; T34-G38 PolarHBondContact O-N 3.28Å; T34-I84 HydrophobicContact CG2-CG2 3.44Å; T34-I84 VanDerWaalsContact CG2-CG2 3.44Å; T34-I84 PolarHBondContact OG1-O 3.49Å; T34-G88 VanDerWaalsContact OG1-CA 3.27Å; T34-G88 WeakPolarHBondContact OG1-CA 3.38Å; T34-G88 PolarHBondContact OG1-N 2.99Å; T34-F200 HydrophobicContact CG2-CE1 4.18Å; T34-F200 HydrophobicContact CG2-CE2 4.15Å; T34-F200 HydrophobicContact CG2-CZ 3.53Å
35P89.2Confident86.5Confident15 Ų1538.7 Ų38.710%0.09719%0.185CC..Hα-helixtrans-60.1-28175.2-27.136.6000114.6V31 G38 G39 Y87 G88 K91 S92V31-P35 WeakPolarHBondContact O-CD 3.32Å; V31-P35 WeakPolarHBondContact O-CG 3.48Å; P35-G38 PolarHBondContact O-N 3.03Å; P35-G39 PolarHBondContact O-N 2.98Å; P35-Y87 HydrophobicContact CG-CD1 4.02Å; P35-Y87 HydrophobicContact CG-CE1 4.03Å; P35-G88 WeakPolarHBondContact CA-O 3.29Å; P35-K91 HydrophobicContact CB-CB 4.5Å; P35-K91 HydrophobicContact CG-CB 4.21Å; P35-S92 WeakPolarHBondContact O-CB 3.48Å; P35-S92 PolarHBondContact O-OG 3.44Å
36I85.1Confident85.8Confident84 Ų8439.3 Ų39.343%0.43119%0.188SC..Hα-helixtrans-64.7-46.6175.9-57.5174.5000109.7V33 T34 W40 L388V33-I36 WeakPolarHBondContact O-CB 3.41Å; V33-I36 PolarHBondContact O-N 3Å; T34-I36 PolarHBondContact O-N 3.19Å; I36-W40 PolarHBondContact O-N 3.03Å; I36-L388 HydrophobicContact CD1-CB 4.35Å; I36-L388 HydrophobicContact CD1-CD1 4.06Å
37L84.2Confident85.2Confident111 Ų11139.6 Ų39.658%0.58119%0.191SC*.Hα-helixtrans-68.2-42.2176.6-63176.4000111.2T34 G39 W40 L41T34-L37 PolarHBondContact O-N 2.98Å; T34-L37 VanDerWaalsContact O-N 3.13Å; L37-G39 PolarHBondContact O-N 3.47Å; L37-W40 PolarHBondContact O-N 2.96Å; L37-L41 WeakPolarHBondContact O-CB 3.5Å; L37-L41 PolarHBondContact O-N 2.91Å
38G84.3Confident84.8Confident4 Ų439 Ų394%0.04119%0.189CC..Hα-helixtrans-65.7-35.4-179.700000113.7T34 P35 A42 G88 N93T34-G38 PolarHBondContact O-N 3.28Å; P35-G38 PolarHBondContact O-N 3.03Å; G38-A42 WeakPolarHBondContact O-CB 3.39Å; G38-A42 PolarHBondContact O-N 2.75Å; G38-A42 VanDerWaalsContact O-N 3.09Å; G38-G88 WeakPolarHBondContact CA-O 3.34Å; G38-N93 PolarHBondContact O-ND2 2.96Å
39G83.4Confident84.4Confident9 Ų941.7 Ų41.79%0.09320%0.197CC..Hα-helixtrans-66.8-48.9173.700000111.6P35 L37 L41 A42 D43 S92 N93P35-G39 PolarHBondContact O-N 2.98Å; L37-G39 PolarHBondContact O-N 3.47Å; G39-L41 VanDerWaalsContact C-N 3.26Å; G39-L41 PolarHBondContact O-N 3.36Å; G39-A42 PolarHBondContact O-N 3Å; G39-A42 VanDerWaalsContact O-N 3.15Å; G39-D43 VanDerWaalsContact O-CG 3.3Å; G39-D43 PolarHBondContact O-N 3.36Å; G39-S92 PolarHBondContact N-OG 2.99Å; G39-N93 WeakPolarHBondContact CA-OD1 3.36Å
40W83.4Confident84.1Confident128 Ų12843.8 Ų43.849%0.48521%0.21SC..Hα-helixtrans-58.2-38.6176.3177.388.8000113I36 L37 R44I36-W40 PolarHBondContact O-N 3.03Å; L37-W40 PolarHBondContact O-N 2.96Å; W40-R44 VanDerWaalsContact NE1-CZ 3.28Å; W40-R44 PolarHBondContact O-N 3.45Å
41L82.1Confident84Confident40 Ų4043.6 Ų43.621%0.20921%0.209CC..Hα-helixtrans-68.5-39.8178.3-161.572.1000112L37 G39 L45 L46 L89 L189L37-L41 WeakPolarHBondContact O-CB 3.5Å; L37-L41 PolarHBondContact O-N 2.91Å; G39-L41 VanDerWaalsContact C-N 3.26Å; G39-L41 PolarHBondContact O-N 3.36Å; L41-L45 HydrophobicContact CD1-CD1 3.8Å; L41-L45 WeakPolarHBondContact O-CB 3.38Å; L41-L45 PolarHBondContact O-N 3.38Å; L41-L46 HydrophobicContact CD2-CD1 3.62Å; L41-L46 HydrophobicContact CG-CD1 3.91Å; L41-L46 PolarHBondContact O-N 3.43Å; L41-L89 HydrophobicContact CD2-CD2 3.97Å; L41-L189 HydrophobicContact CD1-CD2 3.74Å; L41-L189 HydrophobicContact CD2-CD2 3.91Å; L41-L189 HydrophobicContact CG-CD2 4.07Å
42A81.7Confident83.9Confident3 Ų343.1 Ų43.13%0.02521%0.206CC..Iπ-helixtrans-68-43.6177.500000112.1G38 G39 R44 G47 A51 N93G38-A42 WeakPolarHBondContact O-CB 3.39Å; G38-A42 PolarHBondContact O-N 2.75Å; G38-A42 VanDerWaalsContact O-N 3.09Å; G39-A42 PolarHBondContact O-N 3Å; G39-A42 VanDerWaalsContact O-N 3.15Å; A42-R44 PolarHBondContact O-N 3.37Å; A42-G47 WeakPolarHBondContact O-CA 3.37Å; A42-G47 PolarHBondContact O-N 3.4Å; A42-A51 HydrophobicContact CB-CB 3.75Å; A42-N93 VanDerWaalsContact CB-CG 3.45Å; A42-N93 WeakPolarHBondContact CB-OD1 3.41Å
43D81.5Confident83.9Confident81 Ų8141.2 Ų41.243%0.43320%0.2SC..Iπ-helixtrans-59.9-30.9-179.4-73.5-21.3000113.2G39 R169G39-D43 VanDerWaalsContact O-CG 3.3Å; G39-D43 PolarHBondContact O-N 3.36Å; D43-R169 PolarHBondContact O-NH2 2.9Å
44R77.5Confident84Confident155 Ų15542 Ų4259%0.58521%0.208SC*.Iπ-helixtrans-103.5-34.2-173.6-68.7-172.4176-162.10.1114.9W40 A42W40-R44 VanDerWaalsContact NE1-CZ 3.28Å; W40-R44 PolarHBondContact O-N 3.45Å; A42-R44 PolarHBondContact O-N 3.37Å
45L76Confident84.2Confident31 Ų3141.6 Ų41.616%0.16221%0.205CC..Iπ-helixtrans-127.4-57.9-165.3-60.3175.9000113.1L41 A175 V185 L189L41-L45 HydrophobicContact CD1-CD1 3.8Å; L41-L45 WeakPolarHBondContact O-CB 3.38Å; L41-L45 PolarHBondContact O-N 3.38Å; L45-A175 HydrophobicContact CD2-CB 4.22Å; L45-V185 HydrophobicContact CD1-CG1 3.85Å; L45-V185 HydrophobicContact CD2-CG1 3.76Å; L45-V185 HydrophobicContact CG-CG1 4.41Å; L45-L189 HydrophobicContact CB-CD1 4.34Å; L45-L189 HydrophobicContact CD1-CD1 4.33Å; L45-L189 HydrophobicContact CD1-CD2 4.01Å; L45-L189 HydrophobicContact CD1-CG 4.46Å
46L75Confident84.4Confident21 Ų2141 Ų4111%0.1120%0.202CC..Iπ-helixtrans-84.8-29.9-166.3-68.1166.8000113.3L41 T50 A51 L89 M171 L189L41-L46 HydrophobicContact CD2-CD1 3.62Å; L41-L46 HydrophobicContact CG-CD1 3.91Å; L41-L46 PolarHBondContact O-N 3.43Å; L46-T50 WeakPolarHBondContact O-CB 3.23Å; L46-T50 PolarHBondContact O-OG1 2.88Å; L46-A51 HydrophobicContact CB-CB 4.4Å; L46-A51 HydrophobicContact CD1-CB 4.44Å; L46-L89 HydrophobicContact CD1-CD2 4.33Å; L46-M171 WeakPolarHBondContact O-CB 3.21Å; L46-M171 VanDerWaalsContact O-CG 3.3Å; L46-M171 WeakPolarHBondContact O-CG 3.49Å; L46-L189 HydrophobicContact CD2-CD1 3.91Å; L46-L189 HydrophobicContact CG-CD1 4.36Å
47G80.4Confident84.8Confident7 Ų740.8 Ų40.87%0.07220%0.201CC..  trans72.6149.8-161.600000112A42 R49 T50 A51A42-G47 WeakPolarHBondContact O-CA 3.37Å; A42-G47 PolarHBondContact O-N 3.4Å; G47-R49 VanDerWaalsContact C-N 3.33Å; G47-R49 PolarHBondContact O-N 3.25Å; G47-T50 PolarHBondContact O-N 3.13Å; G47-A51 PolarHBondContact O-N 2.96Å; G47-A51 VanDerWaalsContact O-N 3.09Å
48N83.6Confident85.2Confident5 Ų536.4 Ų36.43%0.02718%0.178CC..Hα-helixtrans-59.3-41.4-173.1-75.2-40000112.7A51 V52 N93 C96 L97 E100N48-A51 PolarHBondContact O-N 3.43Å; N48-V52 VanDerWaalsContact O-CG2 3.29Å; N48-V52 WeakPolarHBondContact O-CG2 3.37Å; N48-V52 PolarHBondContact O-N 3.11Å; N48-N93 PolarHBondContact OD1-OD1 3.39Å; N48-N93 VanDerWaalsContact OD1-OD1 3.11Å; N48-C96 WeakPolarHBondContact ND2-CB 3.47Å; N48-L97 HydrophobicContact CB-CB 4.1Å; N48-L97 HydrophobicContact CB-CD1 4.18Å; N48-E100 PolarHBondContact ND2-OE1 3.44Å
49R84.7Confident85.6Confident69 Ų6937 Ų3726%0.2618%0.18SC..Hα-helixtrans-60.7-48.7178.6-179.1-179166.9-144.3-6.4113G47 A51 V52 I53 L97 F158 H162G47-R49 VanDerWaalsContact C-N 3.33Å; G47-R49 PolarHBondContact O-N 3.25Å; R49-A51 VanDerWaalsContact C-N 3.32Å; R49-V52 PolarHBondContact O-N 3.04Å; R49-I53 HydrophobicContact CG-CD1 4.15Å; R49-I53 WeakPolarHBondContact O-CG1 3.15Å; R49-I53 PolarHBondContact O-N 3.19Å; R49-I53 VanDerWaalsContact O-N 3.13Å; R49-L97 HydrophobicContact CB-CD1 4.21Å; R49-F158 HydrophobicContact CG-CE1 4.4Å; R49-F158 HydrophobicContact CG-CZ 4.48Å; R49-H162 PolarHBondContact NH1-CE1 3.4Å; R49-H162 PolarHBondContact NH1-ND1 2.98Å; R49-H162 PolarHBondContact NH2-CD2 2.86Å; R49-H162 PolarHBondContact NH2-CE1 2.85Å; R49-H162 PolarHBondContact NH2-ND1 2.89Å; R49-H162 PolarHBondContact NH2-NE2 3.33Å
50T85.8Confident86.2Confident48 Ų4837.3 Ų37.329%0.29418%0.18SC..Hα-helixtrans-67.1-38.6-178.7-42.40000110.6L46 G47 I53 A54 M171L46-T50 WeakPolarHBondContact O-CB 3.23Å; L46-T50 PolarHBondContact O-OG1 2.88Å; G47-T50 PolarHBondContact O-N 3.13Å; T50-I53 PolarHBondContact O-N 3.45Å; T50-A54 WeakPolarHBondContact O-CB 3.48Å; T50-A54 PolarHBondContact O-N 3.34Å; T50-M171 HydrophobicContact CG2-SD 4.04Å
51A88.2Confident86.6Confident0 Ų035.9 Ų35.90%018%0.182CC..Hα-helixtrans-63.5-41.917700000112A42 L46 G47 N48 R49 A54 G55 L89 N93A42-A51 HydrophobicContact CB-CB 3.75Å; L46-A51 HydrophobicContact CB-CB 4.4Å; L46-A51 HydrophobicContact CD1-CB 4.44Å; G47-A51 PolarHBondContact O-N 2.96Å; G47-A51 VanDerWaalsContact O-N 3.09Å; N48-A51 PolarHBondContact O-N 3.43Å; R49-A51 VanDerWaalsContact C-N 3.32Å; A51-A54 PolarHBondContact O-N 3.28Å; A51-G55 PolarHBondContact O-N 3.27Å; A51-L89 CarbonylContact C-O 3.52Å; A51-N93 HydrophobicContact CB-CB 4.06Å; A51-N93 WeakPolarHBondContact CB-ND2 3.32Å
52V90Very high87Confident2 Ų234 Ų341%0.01217%0.172CC..Hα-helixtrans-60.5-46.9174.21690000111.5N48 R49 G55 A56 F90 N93 I94 L97 F158N48-V52 VanDerWaalsContact O-CG2 3.29Å; N48-V52 WeakPolarHBondContact O-CG2 3.37Å; N48-V52 PolarHBondContact O-N 3.11Å; R49-V52 PolarHBondContact O-N 3.04Å; V52-G55 PolarHBondContact O-N 2.93Å; V52-A56 WeakPolarHBondContact O-CB 3.41Å; V52-A56 PolarHBondContact O-N 3.47Å; V52-F90 HydrophobicContact CG1-CD2 3.95Å; V52-F90 HydrophobicContact CG1-CE2 3.81Å; V52-N93 HydrophobicContact CG2-CB 3.89Å; V52-I94 HydrophobicContact CG1-CD1 3.98Å; V52-I94 HydrophobicContact CG2-CB 4.1Å; V52-I94 HydrophobicContact CG2-CD1 4.2Å; V52-L97 HydrophobicContact CG2-CD2 4.43Å; V52-F158 HydrophobicContact CB-CZ 4.38Å; V52-F158 HydrophobicContact CG1-CD1 4.49Å; V52-F158 HydrophobicContact CG1-CE1 4.04Å; V52-F158 HydrophobicContact CG1-CE2 4.12Å; V52-F158 HydrophobicContact CG1-CZ 3.84Å
53I90.3Very high87.5Confident32 Ų3234.4 Ų34.416%0.16417%0.173CC..Hα-helixtrans-63-48.6179.2-67.1167.4000110.8R49 T50 G55 A56 L57 L155 F158 L159R49-I53 HydrophobicContact CG-CD1 4.15Å; R49-I53 WeakPolarHBondContact O-CG1 3.15Å; R49-I53 PolarHBondContact O-N 3.19Å; R49-I53 VanDerWaalsContact O-N 3.13Å; T50-I53 PolarHBondContact O-N 3.45Å; I53-G55 VanDerWaalsContact C-N 3.33Å; I53-G55 PolarHBondContact O-N 3.45Å; I53-A56 PolarHBondContact O-N 2.97Å; I53-L57 HydrophobicContact CG2-CD1 4.01Å; I53-L57 WeakPolarHBondContact O-CB 3.46Å; I53-L57 WeakPolarHBondContact O-CG 3.29Å; I53-L57 PolarHBondContact O-N 3.46Å; I53-L155 HydrophobicContact CG2-CD1 4.26Å; I53-F158 HydrophobicContact CD1-CE1 4.11Å; I53-F158 HydrophobicContact CG1-CD1 3.97Å; I53-F158 HydrophobicContact CG1-CE1 3.67Å; I53-L159 HydrophobicContact CD1-CD2 3.81Å; I53-L159 HydrophobicContact CG1-CD2 4.12Å; I53-L159 HydrophobicContact CG2-CD2 4.47Å
54A89.8Confident88Confident28 Ų2833.7 Ų33.723%0.23117%0.172CC..Hα-helixtrans-61.3-43178.200000111.4T50 A51 L57 L58 L89T50-A54 WeakPolarHBondContact O-CB 3.48Å; T50-A54 PolarHBondContact O-N 3.34Å; A51-A54 PolarHBondContact O-N 3.28Å; A54-L57 PolarHBondContact O-N 3.27Å; A54-L58 WeakPolarHBondContact O-CG 3.34Å; A54-L58 PolarHBondContact O-N 2.89Å; A54-L89 HydrophobicContact CB-CD1 4.26Å
55G92.1Very high88.6Confident0 Ų028.2 Ų28.20%016%0.155CC..Hα-helixtrans-60.7-48.8177.200000112.7A51 V52 I53 L57 L58 M59 G86A51-G55 PolarHBondContact O-N 3.27Å; V52-G55 PolarHBondContact O-N 2.93Å; I53-G55 VanDerWaalsContact C-N 3.33Å; I53-G55 PolarHBondContact O-N 3.45Å; G55-L57 PolarHBondContact O-N 2.99Å; G55-L58 PolarHBondContact O-N 3.28Å; G55-M59 VanDerWaalsContact O-CG 3.29Å; G55-M59 WeakPolarHBondContact O-CG 3.28Å; G55-M59 PolarHBondContact O-N 3.25Å; G55-G86 CarbonylContact C-O 3.55Å; G55-G86 WeakPolarHBondContact CA-O 3.22Å; G55-G86 VanDerWaalsContact O-CA 3.32Å; G55-G86 WeakPolarHBondContact O-CA 3.39Å
56A93.7Very high89.1Confident3 Ų326.8 Ų26.83%0.02515%0.148CC..Hα-helixtrans-64.5-38.3177.900000112.7V52 I53 M59 T60 F90 M151 L155V52-A56 WeakPolarHBondContact O-CB 3.41Å; V52-A56 PolarHBondContact O-N 3.47Å; I53-A56 PolarHBondContact O-N 2.97Å; A56-M59 PolarHBondContact O-N 3.12Å; A56-T60 WeakPolarHBondContact O-CB 3.49Å; A56-T60 PolarHBondContact O-N 3.37Å; A56-T60 PolarHBondContact O-OG1 2.99Å; A56-F90 HydrophobicContact CB-CD2 4.02Å; A56-F90 HydrophobicContact CB-CE2 4.15Å; A56-M151 HydrophobicContact CB-SD 4.05Å; A56-L155 HydrophobicContact CB-CB 4.29Å; A56-L155 HydrophobicContact CB-CD1 4.03Å
57L93.3Very high89.5Confident80 Ų8026.3 Ų26.342%0.41915%0.148SC..Hα-helixtrans-61.9-49.2173.9-79.7170.9000111.6I53 A54 G55 M59 T60 L61 L155I53-L57 HydrophobicContact CG2-CD1 4.01Å; I53-L57 WeakPolarHBondContact O-CB 3.46Å; I53-L57 WeakPolarHBondContact O-CG 3.29Å; I53-L57 PolarHBondContact O-N 3.46Å; A54-L57 PolarHBondContact O-N 3.27Å; G55-L57 PolarHBondContact O-N 2.99Å; L57-M59 PolarHBondContact O-N 3.07Å; L57-T60 WeakPolarHBondContact O-CB 3.41Å; L57-T60 PolarHBondContact O-N 3.24Å; L57-L61 WeakPolarHBondContact O-CG 3.49Å; L57-L61 PolarHBondContact O-N 3.15Å; L57-L155 HydrophobicContact CD2-CD2 3.4Å; L57-L155 VanDerWaalsContact CD2-CD2 3.4Å; L57-L155 HydrophobicContact CG-CD2 3.65Å
58L92.7Very high89.8Confident19 Ų1932.1 Ų32.110%0.09918%0.176CC..Hα-helixtrans-59.6-47.5176.2-71173.8000111.2A54 G55 T60 L61 G62 I82 C85 L89 L193A54-L58 WeakPolarHBondContact O-CG 3.34Å; A54-L58 PolarHBondContact O-N 2.89Å; G55-L58 PolarHBondContact O-N 3.28Å; L58-T60 VanDerWaalsContact C-N 3.27Å; L58-T60 PolarHBondContact O-N 3.36Å; L58-L61 PolarHBondContact O-N 3.13Å; L58-L61 VanDerWaalsContact O-N 3.16Å; L58-G62 PolarHBondContact O-N 3.11Å; L58-I82 HydrophobicContact CB-CG2 4.21Å; L58-I82 HydrophobicContact CD2-CG2 4.33Å; L58-I82 WeakPolarHBondContact O-CG2 3.45Å; L58-C85 HydrophobicContact CD1-CB 4.13Å; L58-L89 HydrophobicContact CD1-CD1 4.05Å; L58-L193 HydrophobicContact CD1-CD1 3.52Å; L58-L193 HydrophobicContact CD2-CD1 3.88Å; L58-L193 HydrophobicContact CD2-CG 4.5Å; L58-L193 HydrophobicContact CG-CD1 4.14Å
59M93.3Very high89.8Confident17 Ų1735.1 Ų35.18%0.08419%0.192CC..Hα-helixtrans-58.4-41.5177.6-70.6179.875.200111.8G55 A56 L57 G62 H63 Y87 F90 M151G55-M59 VanDerWaalsContact O-CG 3.29Å; G55-M59 WeakPolarHBondContact O-CG 3.28Å; G55-M59 PolarHBondContact O-N 3.25Å; A56-M59 PolarHBondContact O-N 3.12Å; L57-M59 PolarHBondContact O-N 3.07Å; M59-G62 PolarHBondContact O-N 2.92Å; M59-H63 PolarHBondContact O-N 2.97Å; M59-H63 VanDerWaalsContact O-N 3.14Å; M59-H63 PolarHBondContact O-ND1 3.14Å; M59-Y87 HydrophobicContact CE-CD2 3.83Å; M59-Y87 HydrophobicContact SD-CD2 4.3Å; M59-F90 HydrophobicContact SD-CB 4.11Å; M59-F90 HydrophobicContact SD-CG 4.36Å; M59-M151 HydrophobicContact CB-CE 4.14Å; M59-M151 HydrophobicContact CB-CG 4.15Å; M59-M151 HydrophobicContact CE-CE 3.4Å; M59-M151 HydrophobicContact SD-CE 3.57Å; M59-M151 VanDerWaalsContact SD-CE 3.57Å
60T94.3Very high89.3Confident14 Ų1431.9 Ų31.99%0.08618%0.18CC..Hα-helixtrans-61.4-50175.3-55.80000110.8A56 L57 L58 G62 H63 V64 M151 F152A56-T60 WeakPolarHBondContact O-CB 3.49Å; A56-T60 PolarHBondContact O-N 3.37Å; A56-T60 PolarHBondContact O-OG1 2.99Å; L57-T60 WeakPolarHBondContact O-CB 3.41Å; L57-T60 PolarHBondContact O-N 3.24Å; L58-T60 VanDerWaalsContact C-N 3.27Å; L58-T60 PolarHBondContact O-N 3.36Å; T60-G62 VanDerWaalsContact C-N 3.34Å; T60-G62 PolarHBondContact O-N 2.92Å; T60-H63 PolarHBondContact O-N 3.38Å; T60-V64 HydrophobicContact CG2-CG2 4.49Å; T60-V64 WeakPolarHBondContact O-CG2 3.38Å; T60-V64 PolarHBondContact O-N 2.74Å; T60-M151 WeakPolarHBondContact OG1-CG 3.33Å; T60-F152 HydrophobicContact CG2-CB 3.82Å; T60-F152 HydrophobicContact CG2-CD2 4.09Å; T60-F152 HydrophobicContact CG2-CG 4.35Å
61L92.2Very high88.9Confident98 Ų9834.7 Ų34.751%0.51319%0.193SC..Hα-helixtrans-58.3-43.9178.2-72172.3000112L57 L58 H63 V64 V65 I82L57-L61 WeakPolarHBondContact O-CG 3.49Å; L57-L61 PolarHBondContact O-N 3.15Å; L58-L61 PolarHBondContact O-N 3.13Å; L58-L61 VanDerWaalsContact O-N 3.16Å; L61-H63 PolarHBondContact O-N 3.03Å; L61-V64 WeakPolarHBondContact O-CB 3.35Å; L61-V64 PolarHBondContact O-N 3.45Å; L61-V64 VanDerWaalsContact O-N 3.16Å; L61-V65 WeakPolarHBondContact O-CG2 3.48Å; L61-V65 PolarHBondContact O-N 2.84Å; L61-I82 HydrophobicContact CB-CG2 4.41Å
62G91.9Very high88.7Confident0 Ų036.5 Ų36.50%021%0.206CC..Hα-helixtrans-63-39.2178.400000113.1L58 M59 T60 V65 L66 A79L58-G62 PolarHBondContact O-N 3.11Å; M59-G62 PolarHBondContact O-N 2.92Å; T60-G62 VanDerWaalsContact C-N 3.34Å; T60-G62 PolarHBondContact O-N 2.92Å; G62-V65 PolarHBondContact O-N 3.36Å; G62-L66 WeakPolarHBondContact O-CB 3.49Å; G62-L66 PolarHBondContact O-N 3.26Å; G62-A79 VanDerWaalsContact O-CB 3.26Å; G62-A79 WeakPolarHBondContact O-CB 3.18Å
63H92Very high88.5Confident13 Ų1338.9 Ų38.96%0.0622%0.221CC..Hα-helixtrans-69.8-32.7173.6-72.582.8000112.7M1 M59 T60 L61 L66 G67 G148M1-H63 WeakPolarHBondContact CG-NE2 3.39Å; M59-H63 PolarHBondContact O-N 2.97Å; M59-H63 VanDerWaalsContact O-N 3.14Å; M59-H63 PolarHBondContact O-ND1 3.14Å; T60-H63 PolarHBondContact O-N 3.38Å; L61-H63 PolarHBondContact O-N 3.03Å; H63-L66 PolarHBondContact O-N 3.01Å; H63-G67 PolarHBondContact O-N 2.93Å; H63-G148 VanDerWaalsContact CB-CA 3.46Å
64V90.9Very high88.2Confident66 Ų6643.2 Ų43.240%0.424%0.238SC..Hα-helixtrans-66.1-45.6173.9169.90000110.7T60 L61 L66 G67 I68T60-V64 HydrophobicContact CG2-CG2 4.49Å; T60-V64 WeakPolarHBondContact O-CG2 3.38Å; T60-V64 PolarHBondContact O-N 2.74Å; L61-V64 WeakPolarHBondContact O-CB 3.35Å; L61-V64 PolarHBondContact O-N 3.45Å; L61-V64 VanDerWaalsContact O-N 3.16Å; V64-L66 VanDerWaalsContact C-N 3.32Å; V64-L66 PolarHBondContact O-N 3.43Å; V64-G67 PolarHBondContact O-N 3.18Å; V64-G67 VanDerWaalsContact O-N 3.13Å; V64-I68 HydrophobicContact CG1-CD1 3.6Å; V64-I68 HydrophobicContact CG1-CG1 4.29Å; V64-I68 VanDerWaalsContact O-CG1 3.3Å; V64-I68 WeakPolarHBondContact O-CG1 3.4Å; V64-I68 PolarHBondContact O-N 3.46Å
65V89.7Confident88.1Confident40 Ų4042.2 Ų42.224%0.24223%0.23CC..Hα-helixtrans-57.5-47.2174.7173.20000110.3L61 G62 G67 I68 D69 S75 A79 I82L61-V65 WeakPolarHBondContact O-CG2 3.48Å; L61-V65 PolarHBondContact O-N 2.84Å; G62-V65 PolarHBondContact O-N 3.36Å; V65-G67 VanDerWaalsContact C-N 3.29Å; V65-G67 PolarHBondContact O-N 2.92Å; V65-I68 PolarHBondContact O-N 3.48Å; V65-D69 PolarHBondContact O-N 3.35Å; V65-S75 PolarHBondContact O-OG 3.43Å; V65-A79 HydrophobicContact CB-CB 4.22Å; V65-A79 HydrophobicContact CG1-CB 4.06Å; V65-I82 HydrophobicContact CG2-CD1 4.42Å
66L87.1Confident87.9Confident0 Ų042.2 Ų42.20%023%0.23CC..Hα-helixtrans-63.5-33.5177.2-162.866.6000113M1 Y8 G62 H63 V64 T70 L76 A79 F144M1-L66 HydrophobicContact CE-CD2 3.56Å; M1-L66 HydrophobicContact SD-CD2 4.04Å; Y8-L66 HydrophobicContact CE1-CD1 3.92Å; G62-L66 WeakPolarHBondContact O-CB 3.49Å; G62-L66 PolarHBondContact O-N 3.26Å; H63-L66 PolarHBondContact O-N 3.01Å; V64-L66 VanDerWaalsContact C-N 3.32Å; V64-L66 PolarHBondContact O-N 3.43Å; L66-T70 WeakPolarHBondContact O-CG2 3.39Å; L66-L76 HydrophobicContact CD1-CB 4.37Å; L66-L76 HydrophobicContact CD1-CG 4.28Å; L66-A79 HydrophobicContact CB-CB 3.8Å; L66-A79 HydrophobicContact CD1-CB 3.97Å; L66-A79 HydrophobicContact CG-CB 4.43Å; L66-F144 HydrophobicContact CD2-CB 4.23Å; L66-F144 HydrophobicContact CD2-CD1 3.39Å; L66-F144 HydrophobicContact CD2-CD2 3.9Å; L66-F144 HydrophobicContact CD2-CE1 3.56Å; L66-F144 HydrophobicContact CD2-CE2 4.05Å; L66-F144 HydrophobicContact CD2-CG 3.58Å; L66-F144 HydrophobicContact CD2-CZ 3.89Å; L66-F144 HydrophobicContact CG-CB 4.39Å; L66-F144 HydrophobicContact CG-CD1 4.27Å; L66-F144 HydrophobicContact CG-CD2 3.91Å; L66-F144 HydrophobicContact CG-CE2 4.21Å; L66-F144 HydrophobicContact CG-CG 3.94Å
67G84.1Confident87.7Confident11 Ų1142.8 Ų42.811%0.11323%0.231CC..Hα-helixtrans-77.6-29.1179.100000113.9H63 V64 V65 H141H63-G67 PolarHBondContact O-N 2.93Å; V64-G67 PolarHBondContact O-N 3.18Å; V64-G67 VanDerWaalsContact O-N 3.13Å; V65-G67 VanDerWaalsContact C-N 3.29Å; V65-G67 PolarHBondContact O-N 2.92Å; G67-H141 PolarHBondContact O-ND1 3.11Å
68I85.7Confident87.5Confident130 Ų13041.4 Ų41.467%0.66722%0.224SC*.Hα-helixtrans-78.9-47.4-179.7-69.3167.6000111.2V64 V65V64-I68 HydrophobicContact CG1-CD1 3.6Å; V64-I68 HydrophobicContact CG1-CG1 4.29Å; V64-I68 VanDerWaalsContact O-CG1 3.3Å; V64-I68 WeakPolarHBondContact O-CG1 3.4Å; V64-I68 PolarHBondContact O-N 3.46Å; V65-I68 PolarHBondContact O-N 3.48Å
69D83.1Confident87.4Confident67 Ų6740.5 Ų40.536%0.35822%0.219SC..  trans-125.486.8-174.4-177.47.4000110.4V65 N71 S72 S75V65-D69 PolarHBondContact O-N 3.35Å; D69-N71 PolarHBondContact OD1-N 2.93Å; D69-S72 VanDerWaalsContact CG-CB 3.42Å; D69-S72 VanDerWaalsContact OD1-CB 3.3Å; D69-S72 WeakPolarHBondContact OD1-CB 3.25Å; D69-S72 PolarHBondContact OD1-N 3.37Å; D69-S72 VanDerWaalsContact OD1-N 3.15Å; D69-S72 WeakPolarHBondContact OD2-CB 3.45Å; D69-S75 WeakPolarHBondContact O-CB 3.29Å; D69-S75 PolarHBondContact O-OG 3.39Å
70T75.9Confident87.4Confident1 Ų139.7 Ų39.71%0.00622%0.215CC..SBendtrans-87.4-6.7-179.559.40000114.2Y8 L66 H141Y8-T70 HydrophobicContact CE2-CG2 4.25Å; Y8-T70 VanDerWaalsContact OH-C 3.25Å; Y8-T70 WeakPolarHBondContact OH-CA 3.27Å; Y8-T70 PolarHBondContact OH-O 3.46Å; L66-T70 WeakPolarHBondContact O-CG2 3.39Å; T70-H141 HydrophobicContact CG2-CB 4.48Å; T70-H141 WeakPolarHBondContact CG2-CE1 3.44Å; T70-H141 WeakPolarHBondContact CG2-ND1 3.33Å; T70-H141 PolarHBondContact OG1-CE1 2.93Å; T70-H141 PolarHBondContact OG1-NE2 2.97Å
71N77.4Confident87.2Confident107 Ų10739 Ų3957%0.57221%0.211SC*.SBendtrans-101.2-18.6-175.7-65.6-20.2000111.5Q12 D69Q12-N71 PolarHBondContact NE2-OD1 3.39Å; D69-N71 PolarHBondContact OD1-N 2.93Å
72S83.2Confident87.2Confident38 Ų3835.3 Ų35.327%0.26619%0.192SC..  trans-87.2119.6177-1780000112.3D69 F74 S75 L76D69-S72 VanDerWaalsContact CG-CB 3.42Å; D69-S72 VanDerWaalsContact OD1-CB 3.3Å; D69-S72 WeakPolarHBondContact OD1-CB 3.25Å; D69-S72 PolarHBondContact OD1-N 3.37Å; D69-S72 VanDerWaalsContact OD1-N 3.15Å; D69-S72 WeakPolarHBondContact OD2-CB 3.45Å; S72-F74 PolarHBondContact O-N 2.87Å; S72-F74 PolarHBondContact OG-N 3.43Å; S72-S75 WeakPolarHBondContact O-CB 3.26Å; S72-S75 PolarHBondContact O-N 3.12Å; S72-S75 PolarHBondContact OG-N 3.23Å; S72-L76 PolarHBondContact O-N 3.11Å; S72-L76 VanDerWaalsContact O-N 3.1Å
73T85.1Confident87.3Confident53 Ų5335.4 Ų35.433%0.32519%0.192SC..Hα-helixtrans-56-38169.8-60.90000112.4F15 L76 Y77F15-T73 HydrophobicContact CZ-CG2 3.74Å; T73-L76 WeakPolarHBondContact O-CB 3.45Å; T73-L76 PolarHBondContact O-N 3.41Å; T73-Y77 HydrophobicContact CG2-CD2 3.78Å; T73-Y77 HydrophobicContact CG2-CE2 3.26Å; T73-Y77 VanDerWaalsContact O-CD2 3.23Å; T73-Y77 WeakPolarHBondContact O-CD2 3.39Å; T73-Y77 PolarHBondContact O-N 2.96Å
74F85.3Confident87.3Confident122 Ų12234.8 Ų34.854%0.53519%0.189SC..Hα-helixtrans-66.2-42.7178.1179.8-97.9000111.8S72 L76 Y77 L78S72-F74 PolarHBondContact O-N 2.87Å; S72-F74 PolarHBondContact OG-N 3.43Å; F74-L76 VanDerWaalsContact C-N 3.27Å; F74-L76 PolarHBondContact O-N 2.95Å; F74-Y77 PolarHBondContact O-N 3.42Å; F74-L78 HydrophobicContact CE1-CD2 4.36Å; F74-L78 WeakPolarHBondContact O-CB 3.28Å; F74-L78 PolarHBondContact O-N 3.46Å
75S86.5Confident87.3Confident8 Ų832.4 Ų32.46%0.05618%0.176CC..Hα-helixtrans-58.1-42.1174.4176.30000111.2V65 D69 S72 L78 A79V65-S75 PolarHBondContact O-OG 3.43Å; D69-S75 WeakPolarHBondContact O-CB 3.29Å; D69-S75 PolarHBondContact O-OG 3.39Å; S72-S75 WeakPolarHBondContact O-CB 3.26Å; S72-S75 PolarHBondContact O-N 3.12Å; S72-S75 PolarHBondContact OG-N 3.23Å; S75-L78 PolarHBondContact O-N 2.93Å; S75-A79 VanDerWaalsContact O-CB 3.26Å; S75-A79 WeakPolarHBondContact O-CB 3.39Å; S75-A79 PolarHBondContact O-N 3.23Å
76L88.4Confident87.4Confident0 Ų030.5 Ų30.50%016%0.164CC..Hα-helixtrans-59.3-53.5175.6-178.7160.5000111.8Y8 L9 L13 L23 L66 S72 T73 F74 L78 A79 L80Y8-L76 HydrophobicContact CD1-CD1 3.99Å; Y8-L76 HydrophobicContact CE1-CD1 3.39Å; Y8-L76 HydrophobicContact CE1-CG 4.19Å; L9-L76 HydrophobicContact CD2-CD1 3.29Å; L9-L76 HydrophobicContact CD2-CD2 4.32Å; L9-L76 HydrophobicContact CD2-CG 4.48Å; L9-L76 HydrophobicContact CG-CD1 4.43Å; L13-L76 HydrophobicContact CD1-CB 4.37Å; L13-L76 HydrophobicContact CD1-CD1 3.25Å; L13-L76 HydrophobicContact CD1-CG 4.42Å; L23-L76 HydrophobicContact CD2-CD2 3.82Å; L66-L76 HydrophobicContact CD1-CB 4.37Å; L66-L76 HydrophobicContact CD1-CG 4.28Å; S72-L76 PolarHBondContact O-N 3.11Å; S72-L76 VanDerWaalsContact O-N 3.1Å; T73-L76 WeakPolarHBondContact O-CB 3.45Å; T73-L76 PolarHBondContact O-N 3.41Å; F74-L76 VanDerWaalsContact C-N 3.27Å; F74-L76 PolarHBondContact O-N 2.95Å; L76-L78 VanDerWaalsContact C-N 3.28Å; L76-L78 PolarHBondContact O-N 2.93Å; L76-A79 PolarHBondContact O-N 3.36Å; L76-L80 HydrophobicContact CD2-CD1 3.41Å; L76-L80 VanDerWaalsContact CD2-CD1 3.41Å; L76-L80 HydrophobicContact CD2-CG 3.84Å; L76-L80 HydrophobicContact CG-CD1 4.41Å; L76-L80 HydrophobicContact CG-CG 4.46Å; L76-L80 WeakPolarHBondContact O-CG 3.44Å; L76-L80 PolarHBondContact O-N 2.99Å
77Y88.9Confident87.7Confident14 Ų1432.6 Ų32.66%0.05517%0.172CC..Hα-helixtrans-59.6-43-178.8-70.7-54.2000111.2H19 L23 T73 F74 L80 A81 L204 E205H19-Y77 PolarHBondContact CE1-OH 2.79Å; H19-Y77 PolarHBondContact NE2-OH 3.41Å; L23-Y77 HydrophobicContact CD1-CD1 4.01Å; L23-Y77 HydrophobicContact CD1-CE1 3.56Å; L23-Y77 HydrophobicContact CD2-CD1 4.26Å; L23-Y77 HydrophobicContact CD2-CE1 3.51Å; L23-Y77 HydrophobicContact CG-CE1 4.17Å; T73-Y77 HydrophobicContact CG2-CD2 3.78Å; T73-Y77 HydrophobicContact CG2-CE2 3.26Å; T73-Y77 VanDerWaalsContact O-CD2 3.23Å; T73-Y77 WeakPolarHBondContact O-CD2 3.39Å; T73-Y77 PolarHBondContact O-N 2.96Å; F74-Y77 PolarHBondContact O-N 3.42Å; Y77-L80 PolarHBondContact O-N 3.36Å; Y77-A81 VanDerWaalsContact O-CB 3.27Å; Y77-A81 WeakPolarHBondContact O-CB 3.42Å; Y77-A81 PolarHBondContact O-N 3.26Å; Y77-L204 HydrophobicContact CD1-CB 3.81Å; Y77-L204 HydrophobicContact CD1-CD1 4.5Å; Y77-L204 HydrophobicContact CE1-CB 4.2Å; Y77-E205 HydrophobicContact CD2-CB 4.44Å; Y77-E205 HydrophobicContact CE2-CB 4.37Å; Y77-E205 HydrophobicContact CE2-CG 4.32Å
78L90Very high88Confident51 Ų5132.1 Ų32.127%0.26717%0.168SC..Hα-helixtrans-60.5-46.4175.9-176.262.5000112F74 S75 L76 A81 I82 P197 T201F74-L78 HydrophobicContact CE1-CD2 4.36Å; F74-L78 WeakPolarHBondContact O-CB 3.28Å; F74-L78 PolarHBondContact O-N 3.46Å; S75-L78 PolarHBondContact O-N 2.93Å; L76-L78 VanDerWaalsContact C-N 3.28Å; L76-L78 PolarHBondContact O-N 2.93Å; L78-A81 PolarHBondContact O-N 3.46Å; L78-I82 HydrophobicContact CD1-CD1 4.15Å; L78-I82 HydrophobicContact CD1-CG1 4.44Å; L78-I82 HydrophobicContact CG-CD1 3.95Å; L78-I82 WeakPolarHBondContact O-CG1 3.42Å; L78-I82 PolarHBondContact O-N 3.23Å; L78-P197 HydrophobicContact CD1-CB 4.41Å; L78-T201 VanDerWaalsContact CA-CG2 3.41Å; L78-T201 HydrophobicContact CB-CG2 4.11Å; L78-T201 HydrophobicContact CD1-CG2 4.01Å
79A91.3Very high88.2Confident0 Ų026.9 Ų26.90%014%0.141CC..Hα-helixtrans-60.6-47.6176.600000112.1G62 V65 L66 S75 L76 A81 I82 I83G62-A79 VanDerWaalsContact O-CB 3.26Å; G62-A79 WeakPolarHBondContact O-CB 3.18Å; V65-A79 HydrophobicContact CB-CB 4.22Å; V65-A79 HydrophobicContact CG1-CB 4.06Å; L66-A79 HydrophobicContact CB-CB 3.8Å; L66-A79 HydrophobicContact CD1-CB 3.97Å; L66-A79 HydrophobicContact CG-CB 4.43Å; S75-A79 VanDerWaalsContact O-CB 3.26Å; S75-A79 WeakPolarHBondContact O-CB 3.39Å; S75-A79 PolarHBondContact O-N 3.23Å; L76-A79 PolarHBondContact O-N 3.36Å; A79-A81 VanDerWaalsContact C-N 3.34Å; A79-A81 PolarHBondContact O-N 2.96Å; A79-I82 PolarHBondContact O-N 3.31Å; A79-I83 WeakPolarHBondContact O-CB 3.34Å; A79-I83 VanDerWaalsContact O-CG1 3.22Å; A79-I83 WeakPolarHBondContact O-CG1 3.35Å; A79-I83 PolarHBondContact O-N 2.93Å
80L92Very high88.6Confident0 Ų026.1 Ų26.10%013%0.134CC..Hα-helixtrans-61.1-43.4177.6-69.1-172.5000111.6M1 L5 L23 Y27 L76 Y77 I83 I84 L204M1-L80 HydrophobicContact CE-CD2 3.65Å; L5-L80 HydrophobicContact CD1-CD1 4.34Å; L5-L80 HydrophobicContact CD1-CD2 3.99Å; L5-L80 HydrophobicContact CD2-CD1 4.32Å; L5-L80 HydrophobicContact CD2-CD2 4Å; L23-L80 HydrophobicContact CD1-CD1 4.11Å; L23-L80 HydrophobicContact CG-CD1 4.27Å; Y27-L80 HydrophobicContact CD2-CB 4.14Å; Y27-L80 HydrophobicContact CD2-CD1 4.43Å; Y27-L80 HydrophobicContact CD2-CD2 3.79Å; Y27-L80 HydrophobicContact CD2-CG 4.34Å; Y27-L80 HydrophobicContact CE2-CD2 3.9Å; Y27-L80 HydrophobicContact CG-CD2 4.3Å; L76-L80 HydrophobicContact CD2-CD1 3.41Å; L76-L80 VanDerWaalsContact CD2-CD1 3.41Å; L76-L80 HydrophobicContact CD2-CG 3.84Å; L76-L80 HydrophobicContact CG-CD1 4.41Å; L76-L80 HydrophobicContact CG-CG 4.46Å; L76-L80 WeakPolarHBondContact O-CG 3.44Å; L76-L80 PolarHBondContact O-N 2.99Å; Y77-L80 PolarHBondContact O-N 3.36Å; L80-I83 PolarHBondContact O-N 2.76Å; L80-I84 WeakPolarHBondContact O-CB 3.47Å; L80-I84 WeakPolarHBondContact O-CD1 3.42Å; L80-I84 WeakPolarHBondContact O-CG1 3.21Å; L80-I84 PolarHBondContact O-N 3.25Å; L80-L204 HydrophobicContact CB-CD1 3.92Å; L80-L204 HydrophobicContact CD1-CD1 4.43Å
81A91.3Very high89.2Confident0 Ų030.5 Ų30.50%015%0.154CC..Hα-helixtrans-60.4-45.3177.100000112.4Y77 L78 A79 I84 C85 P197 F200 T201Y77-A81 VanDerWaalsContact O-CB 3.27Å; Y77-A81 WeakPolarHBondContact O-CB 3.42Å; Y77-A81 PolarHBondContact O-N 3.26Å; L78-A81 PolarHBondContact O-N 3.46Å; A79-A81 VanDerWaalsContact C-N 3.34Å; A79-A81 PolarHBondContact O-N 2.96Å; A81-I84 PolarHBondContact O-N 3.38Å; A81-C85 PolarHBondContact O-N 2.9Å; A81-C85 PolarHBondContact O-SG 3.28Å; A81-P197 HydrophobicContact CB-CB 4.5Å; A81-P197 WeakPolarHBondContact CB-O 3.31Å; A81-F200 HydrophobicContact CB-CB 3.6Å; A81-T201 HydrophobicContact CB-CG2 3.67Å
82I92.4Very high89.6Confident21 Ų2126.7 Ų26.711%0.10814%0.135CC..Hα-helixtrans-62.6-43.6175.1-66.9166.9000110.4L58 L61 V65 L78 A79 C85 G86 P197L58-I82 HydrophobicContact CB-CG2 4.21Å; L58-I82 HydrophobicContact CD2-CG2 4.33Å; L58-I82 WeakPolarHBondContact O-CG2 3.45Å; L61-I82 HydrophobicContact CB-CG2 4.41Å; V65-I82 HydrophobicContact CG2-CD1 4.42Å; L78-I82 HydrophobicContact CD1-CD1 4.15Å; L78-I82 HydrophobicContact CD1-CG1 4.44Å; L78-I82 HydrophobicContact CG-CD1 3.95Å; L78-I82 WeakPolarHBondContact O-CG1 3.42Å; L78-I82 PolarHBondContact O-N 3.23Å; A79-I82 PolarHBondContact O-N 3.31Å; I82-C85 PolarHBondContact O-N 2.82Å; I82-G86 PolarHBondContact O-N 3.38Å; I82-P197 HydrophobicContact CG1-CB 4.06Å; I82-P197 HydrophobicContact CG1-CG 4.22Å
83I92.9Very high89.8Confident1 Ų124.9 Ų24.91%0.00512%0.123CC..Hα-helixtrans-63.8-41.9177.8-68.1166000111.2M1 Y27 A79 L80 C85 G86 Y87M1-I83 HydrophobicContact CE-CD1 4.1Å; M1-I83 HydrophobicContact CG-CD1 4.43Å; M1-I83 HydrophobicContact SD-CD1 4.38Å; Y27-I83 HydrophobicContact CE2-CG2 4.05Å; Y27-I83 WeakPolarHBondContact OH-CG2 3.25Å; A79-I83 WeakPolarHBondContact O-CB 3.34Å; A79-I83 VanDerWaalsContact O-CG1 3.22Å; A79-I83 WeakPolarHBondContact O-CG1 3.35Å; A79-I83 PolarHBondContact O-N 2.93Å; L80-I83 PolarHBondContact O-N 2.76Å; I83-C85 VanDerWaalsContact C-N 3.34Å; I83-C85 PolarHBondContact O-N 2.81Å; I83-G86 PolarHBondContact O-N 3.49Å; I83-Y87 VanDerWaalsContact O-CB 3.27Å; I83-Y87 WeakPolarHBondContact O-CB 3.11Å; I83-Y87 PolarHBondContact O-N 2.86Å
84I92Very high90Very high0 Ų024.1 Ų24.10%012%0.116CC..Hα-helixtrans-60.3-44.5177-74.5160.8000110.8Y27 L30 V31 T34 L80 A81 G88 F200 L204Y27-I84 HydrophobicContact CD2-CD1 3.83Å; Y27-I84 HydrophobicContact CD2-CG1 3.7Å; Y27-I84 HydrophobicContact CE2-CG1 3.92Å; L30-I84 HydrophobicContact CB-CD1 3.94Å; L30-I84 HydrophobicContact CB-CG1 4.21Å; L30-I84 HydrophobicContact CB-CG2 3.93Å; L30-I84 HydrophobicContact CD1-CD1 3.83Å; V31-I84 HydrophobicContact CG2-CG1 3.95Å; T34-I84 HydrophobicContact CG2-CG2 3.44Å; T34-I84 VanDerWaalsContact CG2-CG2 3.44Å; T34-I84 PolarHBondContact OG1-O 3.49Å; L80-I84 WeakPolarHBondContact O-CB 3.47Å; L80-I84 WeakPolarHBondContact O-CD1 3.42Å; L80-I84 WeakPolarHBondContact O-CG1 3.21Å; L80-I84 PolarHBondContact O-N 3.25Å; A81-I84 PolarHBondContact O-N 3.38Å; I84-G88 PolarHBondContact O-N 3.33Å; I84-F200 HydrophobicContact CG2-CD1 4.2Å; I84-F200 HydrophobicContact CG2-CD2 4.22Å; I84-F200 HydrophobicContact CG2-CE1 4.13Å; I84-F200 HydrophobicContact CG2-CE2 4.14Å; I84-F200 HydrophobicContact CG2-CG 4.26Å; I84-F200 HydrophobicContact CG2-CZ 4.11Å; I84-L204 HydrophobicContact CD1-CD1 4.06Å
85C91.6Very high90Very high17 Ų1720.3 Ų20.312%0.11511%0.105CC..Hα-helixtrans-63.6-47.8176.1-66.50000111.2L58 A81 I82 I83 G88 L89 F200L58-C85 HydrophobicContact CD1-CB 4.13Å; A81-C85 PolarHBondContact O-N 2.9Å; A81-C85 PolarHBondContact O-SG 3.28Å; I82-C85 PolarHBondContact O-N 2.82Å; I83-C85 VanDerWaalsContact C-N 3.34Å; I83-C85 PolarHBondContact O-N 2.81Å; C85-G88 PolarHBondContact O-N 3.27Å; C85-L89 PolarHBondContact O-N 3.44Å; C85-F200 WeakPolarHBondContact SG-CD2 3.5Å
86G92Very high90Very high0 Ų022.5 Ų22.50%012%0.12CC..Hα-helixtrans-62.2-45.1179.800000112.9G55 I82 I83 G88 L89 F90G55-G86 CarbonylContact C-O 3.55Å; G55-G86 WeakPolarHBondContact CA-O 3.22Å; G55-G86 VanDerWaalsContact O-CA 3.32Å; G55-G86 WeakPolarHBondContact O-CA 3.39Å; I82-G86 PolarHBondContact O-N 3.38Å; I83-G86 PolarHBondContact O-N 3.49Å; G86-G88 VanDerWaalsContact C-N 3.33Å; G86-G88 PolarHBondContact O-N 3.36Å; G86-L89 PolarHBondContact O-N 2.96Å; G86-F90 WeakPolarHBondContact O-CB 3.45Å; G86-F90 PolarHBondContact O-N 2.92Å
87Y92.3Very high89.9Confident43 Ų4322.6 Ų22.617%0.16912%0.12CC..Hα-helixtrans-63.4-39.8177.5-171-87.6000112V31 P35 M59 I83 L89 F90 K91V31-Y87 HydrophobicContact CB-CD1 4.29Å; V31-Y87 HydrophobicContact CG1-CD1 3.37Å; V31-Y87 HydrophobicContact CG1-CD2 4.21Å; V31-Y87 HydrophobicContact CG1-CE1 3.33Å; V31-Y87 HydrophobicContact CG1-CE2 4.18Å; V31-Y87 HydrophobicContact CG1-CG 3.81Å; V31-Y87 WeakPolarHBondContact O-CD1 3.31Å; V31-Y87 VanDerWaalsContact O-CE1 3.23Å; V31-Y87 WeakPolarHBondContact O-CE1 3.48Å; P35-Y87 HydrophobicContact CG-CD1 4.02Å; P35-Y87 HydrophobicContact CG-CE1 4.03Å; M59-Y87 HydrophobicContact CE-CD2 3.83Å; M59-Y87 HydrophobicContact SD-CD2 4.3Å; I83-Y87 VanDerWaalsContact O-CB 3.27Å; I83-Y87 WeakPolarHBondContact O-CB 3.11Å; I83-Y87 PolarHBondContact O-N 2.86Å; Y87-L89 VanDerWaalsContact C-N 3.3Å; Y87-L89 PolarHBondContact O-N 3.27Å; Y87-F90 PolarHBondContact O-N 2.79Å; Y87-F90 VanDerWaalsContact O-N 3.11Å; Y87-K91 HydrophobicContact CD1-CB 3.85Å; Y87-K91 HydrophobicContact CD1-CG 4.47Å; Y87-K91 HydrophobicContact CE1-CB 3.46Å; Y87-K91 VanDerWaalsContact CE1-CB 3.46Å; Y87-K91 HydrophobicContact CE1-CD 4.31Å; Y87-K91 HydrophobicContact CE1-CG 3.59Å; Y87-K91 HydrophobicContact CE2-CB 4.27Å; Y87-K91 HydrophobicContact CE2-CD 4.39Å; Y87-K91 HydrophobicContact CE2-CG 4.46Å; Y87-K91 HydrophobicContact CG-CB 4.43Å; Y87-K91 WeakPolarHBondContact O-CB 3.36Å; Y87-K91 PolarHBondContact O-N 3.34Å; Y87-K91 WeakPolarHBondContact OH-CD 3.49Å; Y87-K91 WeakPolarHBondContact OH-CE 3.46Å; Y87-K91 WeakPolarHBondContact OH-CG 3.45Å
88G89.9Confident89.7Confident2 Ų223.4 Ų23.42%0.02113%0.125CC..Hα-helixtrans-58-41.3175.700000112.8T34 P35 G38 I84 C85 G86 S92T34-G88 VanDerWaalsContact OG1-CA 3.27Å; T34-G88 WeakPolarHBondContact OG1-CA 3.38Å; T34-G88 PolarHBondContact OG1-N 2.99Å; P35-G88 WeakPolarHBondContact CA-O 3.29Å; G38-G88 WeakPolarHBondContact CA-O 3.34Å; I84-G88 PolarHBondContact O-N 3.33Å; C85-G88 PolarHBondContact O-N 3.27Å; G86-G88 VanDerWaalsContact C-N 3.33Å; G86-G88 PolarHBondContact O-N 3.36Å; G88-S92 PolarHBondContact O-OG 3.18Å
89L90.4Very high89.3Confident19 Ų1921.7 Ų21.710%0.09912%0.12CC..Hα-helixtrans-77.5-24.6175.5-65.4175.4000113.4L41 L46 A51 A54 L58 C85 G86 Y87 N93L41-L89 HydrophobicContact CD2-CD2 3.97Å; L46-L89 HydrophobicContact CD1-CD2 4.33Å; A51-L89 CarbonylContact C-O 3.52Å; A54-L89 HydrophobicContact CB-CD1 4.26Å; L58-L89 HydrophobicContact CD1-CD1 4.05Å; C85-L89 PolarHBondContact O-N 3.44Å; G86-L89 PolarHBondContact O-N 2.96Å; Y87-L89 VanDerWaalsContact C-N 3.3Å; Y87-L89 PolarHBondContact O-N 3.27Å; L89-N93 WeakPolarHBondContact O-CB 3.49Å; L89-N93 PolarHBondContact O-ND2 2.72Å
90F91.6Very high88.9Confident51 Ų5124.7 Ų24.722%0.22413%0.134CC..Hα-helixtrans-86.3-52.4-176.6-174.5-92.8000112.8V52 A56 M59 G86 Y87 S92 N93 I94V52-F90 HydrophobicContact CG1-CD2 3.95Å; V52-F90 HydrophobicContact CG1-CE2 3.81Å; A56-F90 HydrophobicContact CB-CD2 4.02Å; A56-F90 HydrophobicContact CB-CE2 4.15Å; M59-F90 HydrophobicContact SD-CB 4.11Å; M59-F90 HydrophobicContact SD-CG 4.36Å; G86-F90 WeakPolarHBondContact O-CB 3.45Å; G86-F90 PolarHBondContact O-N 2.92Å; Y87-F90 PolarHBondContact O-N 2.79Å; Y87-F90 VanDerWaalsContact O-N 3.11Å; F90-S92 PolarHBondContact O-N 3.01Å; F90-N93 PolarHBondContact O-N 3.24Å; F90-I94 HydrophobicContact CD1-CG2 4.47Å; F90-I94 HydrophobicContact CE1-CB 4.47Å; F90-I94 HydrophobicContact CE1-CG2 4.25Å; F90-I94 HydrophobicContact CZ-CG1 4.42Å; F90-I94 WeakPolarHBondContact O-CB 3.47Å; F90-I94 WeakPolarHBondContact O-CG2 3.34Å; F90-I94 PolarHBondContact O-N 3.01Å
91K88.2Confident88.5Confident94 Ų9427.7 Ų27.741%0.40915%0.149SC..Hα-helixtrans-66.7-44.1-161.9-178.262.3173179.70114.3P35 Y87 I94P35-K91 HydrophobicContact CB-CB 4.5Å; P35-K91 HydrophobicContact CG-CB 4.21Å; Y87-K91 HydrophobicContact CD1-CB 3.85Å; Y87-K91 HydrophobicContact CD1-CG 4.47Å; Y87-K91 HydrophobicContact CE1-CB 3.46Å; Y87-K91 VanDerWaalsContact CE1-CB 3.46Å; Y87-K91 HydrophobicContact CE1-CD 4.31Å; Y87-K91 HydrophobicContact CE1-CG 3.59Å; Y87-K91 HydrophobicContact CE2-CB 4.27Å; Y87-K91 HydrophobicContact CE2-CD 4.39Å; Y87-K91 HydrophobicContact CE2-CG 4.46Å; Y87-K91 HydrophobicContact CG-CB 4.43Å; Y87-K91 WeakPolarHBondContact O-CB 3.36Å; Y87-K91 PolarHBondContact O-N 3.34Å; Y87-K91 WeakPolarHBondContact OH-CD 3.49Å; Y87-K91 WeakPolarHBondContact OH-CE 3.46Å; Y87-K91 WeakPolarHBondContact OH-CG 3.45Å; K91-I94 WeakPolarHBondContact O-CG2 3.28Å
92S86.3Confident88Confident27 Ų2730.8 Ų30.819%0.18916%0.161CC..Hα-helixtrans-72-46.1176.4480000110.7P35 G39 G88 F90 I94 S95 C96P35-S92 WeakPolarHBondContact O-CB 3.48Å; P35-S92 PolarHBondContact O-OG 3.44Å; G39-S92 PolarHBondContact N-OG 2.99Å; G88-S92 PolarHBondContact O-OG 3.18Å; F90-S92 PolarHBondContact O-N 3.01Å; S92-I94 PolarHBondContact O-N 3.22Å; S92-S95 PolarHBondContact O-N 2.88Å; S92-C96 PolarHBondContact O-N 3.45Å; S92-C96 VanDerWaalsContact O-N 3.17Å; S92-C96 PolarHBondContact O-SG 3.05Å
93N87.8Confident87.3Confident0 Ų036 Ų360%019%0.19CC..Hα-helixtrans-72.5-28.5-170.9-61.8-47000114.2G38 G39 A42 N48 A51 V52 L89 F90 S95 C96 L97G38-N93 PolarHBondContact O-ND2 2.96Å; G39-N93 WeakPolarHBondContact CA-OD1 3.36Å; A42-N93 VanDerWaalsContact CB-CG 3.45Å; A42-N93 WeakPolarHBondContact CB-OD1 3.41Å; N48-N93 PolarHBondContact OD1-OD1 3.39Å; N48-N93 VanDerWaalsContact OD1-OD1 3.11Å; A51-N93 HydrophobicContact CB-CB 4.06Å; A51-N93 WeakPolarHBondContact CB-ND2 3.32Å; V52-N93 HydrophobicContact CG2-CB 3.89Å; L89-N93 WeakPolarHBondContact O-CB 3.49Å; L89-N93 PolarHBondContact O-ND2 2.72Å; F90-N93 PolarHBondContact O-N 3.24Å; N93-S95 VanDerWaalsContact C-N 3.29Å; N93-S95 PolarHBondContact O-N 3.11Å; N93-C96 PolarHBondContact O-N 3.21Å; N93-L97 WeakPolarHBondContact O-CB 3.29Å; N93-L97 PolarHBondContact O-N 3.32Å
94I89.3Confident86.4Confident36 Ų3643.9 Ų43.919%0.18523%0.227CC..Hα-helixtrans-65.1-36.1174.3-168.363.9000111.6V52 F90 K91 S92 L98 F158V52-I94 HydrophobicContact CG1-CD1 3.98Å; V52-I94 HydrophobicContact CG2-CB 4.1Å; V52-I94 HydrophobicContact CG2-CD1 4.2Å; F90-I94 HydrophobicContact CD1-CG2 4.47Å; F90-I94 HydrophobicContact CE1-CB 4.47Å; F90-I94 HydrophobicContact CE1-CG2 4.25Å; F90-I94 HydrophobicContact CZ-CG1 4.42Å; F90-I94 WeakPolarHBondContact O-CB 3.47Å; F90-I94 WeakPolarHBondContact O-CG2 3.34Å; F90-I94 PolarHBondContact O-N 3.01Å; K91-I94 WeakPolarHBondContact O-CG2 3.28Å; S92-I94 PolarHBondContact O-N 3.22Å; I94-L98 PolarHBondContact O-N 3.42Å; I94-F158 HydrophobicContact CD1-CE2 4.32Å
95S85.6Confident85.5Confident43 Ų4351.7 Ų51.730%0.30127%0.268SS..Hα-helixtrans-73.8-40.6178.5-53.50000110.9S92 N93 L98 G99S92-S95 PolarHBondContact O-N 2.88Å; N93-S95 VanDerWaalsContact C-N 3.29Å; N93-S95 PolarHBondContact O-N 3.11Å; S95-L98 PolarHBondContact O-N 3.27Å; S95-G99 PolarHBondContact O-N 3.47Å
96C85.4Confident85Confident54 Ų5452.1 Ų52.137%0.36527%0.269SS..Hα-helixtrans-63.6-43173.1-63.60000111.7N48 S92 N93 L98 G99 E100N48-C96 WeakPolarHBondContact ND2-CB 3.47Å; S92-C96 PolarHBondContact O-N 3.45Å; S92-C96 VanDerWaalsContact O-N 3.17Å; S92-C96 PolarHBondContact O-SG 3.05Å; N93-C96 PolarHBondContact O-N 3.21Å; C96-L98 VanDerWaalsContact C-N 3.33Å; C96-L98 PolarHBondContact O-N 3.3Å; C96-G99 CarbonylContact O-C 3.6Å; C96-G99 WeakPolarHBondContact O-CA 3.48Å; C96-G99 PolarHBondContact O-N 3.29Å; C96-E100 PolarHBondContact O-N 3.07Å
97L85.9Confident84.4Confident2 Ų259.6 Ų59.61%0.0130%0.304CS..Hα-helixtrans-60.3-42.7176.9-175.267.7000111.7N48 R49 V52 N93 G99 E100 L101 F158 T168N48-L97 HydrophobicContact CB-CB 4.1Å; N48-L97 HydrophobicContact CB-CD1 4.18Å; R49-L97 HydrophobicContact CB-CD1 4.21Å; V52-L97 HydrophobicContact CG2-CD2 4.43Å; N93-L97 WeakPolarHBondContact O-CB 3.29Å; N93-L97 PolarHBondContact O-N 3.32Å; L97-G99 VanDerWaalsContact C-N 3.28Å; L97-G99 PolarHBondContact O-N 3.43Å; L97-E100 PolarHBondContact O-N 2.81Å; L97-L101 WeakPolarHBondContact O-CG 3.42Å; L97-L101 PolarHBondContact O-N 3.44Å; L97-F158 HydrophobicContact CD2-CE2 3.67Å; L97-F158 HydrophobicContact CD2-CZ 3.49Å; L97-F158 VanDerWaalsContact CD2-CZ 3.49Å; L97-T168 HydrophobicContact CD1-CG2 3.69Å
98L85.4Confident84Confident30 Ų3064.8 Ų64.816%0.15732%0.323CS..Hα-helixtrans-61.6-40.3173.8-177.763.9000111.2I94 S95 C96 E100 L101 Y102 F113 L116I94-L98 PolarHBondContact O-N 3.42Å; S95-L98 PolarHBondContact O-N 3.27Å; C96-L98 VanDerWaalsContact C-N 3.33Å; C96-L98 PolarHBondContact O-N 3.3Å; L98-E100 VanDerWaalsContact C-N 3.31Å; L98-E100 PolarHBondContact O-N 2.95Å; L98-L101 HydrophobicContact CD1-CD1 4.45Å; L98-L101 PolarHBondContact O-N 3.05Å; L98-Y102 HydrophobicContact CD1-CE2 3.77Å; L98-Y102 HydrophobicContact CG-CE2 4.29Å; L98-Y102 WeakPolarHBondContact O-CD2 3.41Å; L98-F113 HydrophobicContact CD2-CD1 3.97Å; L98-F113 HydrophobicContact CD2-CE1 4.14Å; L98-F113 HydrophobicContact CD2-CG 4.26Å; L98-L116 HydrophobicContact CD2-CB 3.84Å; L98-L116 HydrophobicContact CD2-CD2 3.67Å; L98-L116 HydrophobicContact CD2-CG 4.32Å
99G81.5Confident83.4Confident15 Ų1568.9 Ų68.916%0.15534%0.338CS..Hα-helixtrans-60.3-36.9174.700000113.5S95 C96 L97 L101 Y102S95-G99 PolarHBondContact O-N 3.47Å; C96-G99 CarbonylContact O-C 3.6Å; C96-G99 WeakPolarHBondContact O-CA 3.48Å; C96-G99 PolarHBondContact O-N 3.29Å; L97-G99 VanDerWaalsContact C-N 3.28Å; L97-G99 PolarHBondContact O-N 3.43Å; G99-L101 VanDerWaalsContact C-N 3.26Å; G99-L101 PolarHBondContact O-N 2.72Å; G99-Y102 PolarHBondContact O-N 3.04Å; G99-Y102 VanDerWaalsContact O-O 3.06Å
100E82.3Confident82.9Confident64 Ų6473.6 Ų73.630%0.29936%0.363SS..Hα-helixtrans-70.9-17.3177.3-71.7-177.3-171.200114N48 C96 L97 L98 Y102 T168 R169N48-E100 PolarHBondContact ND2-OE1 3.44Å; C96-E100 PolarHBondContact O-N 3.07Å; L97-E100 PolarHBondContact O-N 2.81Å; L98-E100 VanDerWaalsContact C-N 3.31Å; L98-E100 PolarHBondContact O-N 2.95Å; E100-Y102 VanDerWaalsContact C-N 3.33Å; E100-T168 HydrophobicContact CB-CG2 4.33Å; E100-T168 WeakPolarHBondContact OE2-CB 3.47Å; E100-R169 PolarHBondContact OE2-N 3.34Å
101L83.5Confident82.4Confident62 Ų6273.3 Ų73.333%0.32538%0.375SS..THydrogen-bonded Turntrans-81.7-14.2179.2-68.4169.9000113.4L97 L98 G99 F165 T168L97-L101 WeakPolarHBondContact O-CG 3.42Å; L97-L101 PolarHBondContact O-N 3.44Å; L98-L101 HydrophobicContact CD1-CD1 4.45Å; L98-L101 PolarHBondContact O-N 3.05Å; G99-L101 VanDerWaalsContact C-N 3.26Å; G99-L101 PolarHBondContact O-N 2.72Å; L101-F165 HydrophobicContact CD1-CD1 3.93Å; L101-F165 HydrophobicContact CD1-CE1 3.85Å; L101-F165 HydrophobicContact CD2-CD1 4.05Å; L101-T168 HydrophobicContact CD2-CG2 3.6Å; L101-T168 HydrophobicContact CG-CG2 4.17Å
102Y82.3Confident82.3Confident65 Ų6569.1 Ų69.126%0.25536%0.358SS..SBendtrans-115.9141178.1-64.2-80.4000110L98 G99 E100 R108 R109L98-Y102 HydrophobicContact CD1-CE2 3.77Å; L98-Y102 HydrophobicContact CG-CE2 4.29Å; L98-Y102 WeakPolarHBondContact O-CD2 3.41Å; G99-Y102 PolarHBondContact O-N 3.04Å; G99-Y102 VanDerWaalsContact O-O 3.06Å; E100-Y102 VanDerWaalsContact C-N 3.33Å; Y102-R108 HydrophobicContact CD1-CB 4.22Å; Y102-R108 HydrophobicContact CE1-CB 3.87Å; Y102-R109 HydrophobicContact CD1-CB 4.5Å; Y102-R109 HydrophobicContact CD2-CB 4.46Å; Y102-R109 HydrophobicContact CD2-CG 4.36Å; Y102-R109 HydrophobicContact CG-CB 4.06Å; Y102-R109 HydrophobicContact CG-CG 4.3Å
103D77.9Confident82.2Confident131 Ų13171 Ų7170%0.70136%0.363SS*.  trans-63.5149.8167.1-66.3-42000109.9N105 D106D103-N105 PolarHBondContact O-N 3.46Å; D103-D106 HydrophobicContact CB-CB 4.4Å; D103-D106 PolarHBondContact O-N 2.95Å
104E73.1Confident82Confident167 Ų16774.6 Ų74.678%0.7839%0.388SS*.THydrogen-bonded Turntrans-55.8-30.7-173.2-68.4-173.8163.200113.5R109E104-R109 PolarHBondContact O-NH1 3.27Å
105N74Confident81.9Confident164 Ų16479 Ų7988%0.87741%0.412SS*.THydrogen-bonded Turntrans-102.88-178.4-64.1-34.3000114D103 H107D103-N105 PolarHBondContact O-N 3.46Å; N105-H107 PolarHBondContact O-N 3.33Å
106D81.1Confident82Confident25 Ų2580.1 Ų80.113%0.13441%0.414CS..  trans-73.8117.5178.4-168.1-14.4000110.8D103 R108 R109D103-D106 HydrophobicContact CB-CB 4.4Å; D103-D106 PolarHBondContact O-N 2.95Å; D106-R108 PolarHBondContact O-N 3.32Å; D106-R108 WeakPolarHBondContact OD1-CB 3.37Å; D106-R108 PolarHBondContact OD1-N 3.21Å; D106-R108 IonicContact OD1-NE 3.19Å; D106-R108 PolarHBondContact OD1-NE 3.43Å; D106-R108 IonicContact OD1-NH2 3.73Å; D106-R108 IonicContact OD2-CZ 3.97Å; D106-R108 VanDerWaalsContact OD2-CZ 3.3Å; D106-R108 IonicContact OD2-NE 3.03Å; D106-R108 PolarHBondContact OD2-NE 3.06Å; D106-R108 IonicContact OD2-NH2 3.3Å; D106-R108 PolarHBondContact OD2-NH2 3.4Å; D106-R109 WeakPolarHBondContact O-CB 3.45Å; D106-R109 PolarHBondContact O-N 3.23Å
107H79.1Confident81.9Confident158 Ų15883.5 Ų83.573%0.73142%0.42SS*.THydrogen-bonded Turntrans-52.1-23.7173.765.7-68.5000114.5N105 R109N105-H107 PolarHBondContact O-N 3.33Å; H107-R109 VanDerWaalsContact C-N 3.29Å; H107-R109 PolarHBondContact O-N 3.46Å
108R83.6Confident82Confident151 Ų15185.1 Ų85.157%0.5743%0.433SS*.Hα-helixtrans-76.6-15.4178.8-63.2175.6-67.3179.41.9113.5Y102 D106 D110 G111 G112Y102-R108 HydrophobicContact CD1-CB 4.22Å; Y102-R108 HydrophobicContact CE1-CB 3.87Å; D106-R108 PolarHBondContact O-N 3.32Å; D106-R108 WeakPolarHBondContact OD1-CB 3.37Å; D106-R108 PolarHBondContact OD1-N 3.21Å; D106-R108 IonicContact OD1-NE 3.19Å; D106-R108 PolarHBondContact OD1-NE 3.43Å; D106-R108 IonicContact OD1-NH2 3.73Å; D106-R108 IonicContact OD2-CZ 3.97Å; D106-R108 VanDerWaalsContact OD2-CZ 3.3Å; D106-R108 IonicContact OD2-NE 3.03Å; D106-R108 PolarHBondContact OD2-NE 3.06Å; D106-R108 IonicContact OD2-NH2 3.3Å; D106-R108 PolarHBondContact OD2-NH2 3.4Å; R108-D110 PolarHBondContact O-N 2.9Å; R108-G111 PolarHBondContact O-N 3.34Å; R108-G112 PolarHBondContact O-N 3.32Å
109R78.1Confident82.2Confident88 Ų8886.3 Ų86.333%0.33245%0.447SS..Hα-helixtrans-57.4-46.9-178.2-174.9176.5175.8-163.30.9111.8Y102 E104 D106 H107 G111 G112 F113Y102-R109 HydrophobicContact CD1-CB 4.5Å; Y102-R109 HydrophobicContact CD2-CB 4.46Å; Y102-R109 HydrophobicContact CD2-CG 4.36Å; Y102-R109 HydrophobicContact CG-CB 4.06Å; Y102-R109 HydrophobicContact CG-CG 4.3Å; E104-R109 PolarHBondContact O-NH1 3.27Å; D106-R109 WeakPolarHBondContact O-CB 3.45Å; D106-R109 PolarHBondContact O-N 3.23Å; H107-R109 VanDerWaalsContact C-N 3.29Å; H107-R109 PolarHBondContact O-N 3.46Å; R109-G111 VanDerWaalsContact C-N 3.32Å; R109-G111 PolarHBondContact O-N 2.92Å; R109-G112 WeakPolarHBondContact O-CA 3.41Å; R109-G112 PolarHBondContact O-N 3Å; R109-G112 VanDerWaalsContact O-N 3.11Å; R109-F113 HydrophobicContact CG-CD2 3.95Å; R109-F113 HydrophobicContact CG-CE2 3.73Å; R109-F113 VanDerWaalsContact O-CD2 3.28Å; R109-F113 WeakPolarHBondContact O-CD2 3.46Å; R109-F113 PolarHBondContact O-N 3.03Å
110D78.1Confident82.6Confident119 Ų11987.8 Ų87.864%0.63646%0.463SS*.Hα-helixtrans-63.4-39.4179-68.7-14.9000111.8R108 G112 F113 S114R108-D110 PolarHBondContact O-N 2.9Å; D110-G112 VanDerWaalsContact C-N 3.33Å; D110-F113 PolarHBondContact O-N 3.17Å; D110-S114 WeakPolarHBondContact O-CB 3.07Å; D110-S114 PolarHBondContact O-N 2.85Å; D110-S114 PolarHBondContact O-OG 2.88Å
111G82.8Confident82.8Confident45 Ų4585.6 Ų85.646%0.46445%0.453SS..Hα-helixtrans-61.9-40.9172.900000112.2R108 R109 S114 L115R108-G111 PolarHBondContact O-N 3.34Å; R109-G111 VanDerWaalsContact C-N 3.32Å; R109-G111 PolarHBondContact O-N 2.92Å; G111-S114 PolarHBondContact O-N 3.48Å; G111-L115 WeakPolarHBondContact O-CB 3.27Å; G111-L115 PolarHBondContact O-N 2.88Å
112G85.3Confident83.3Confident6 Ų687.3 Ų87.36%0.06246%0.462CS..Hα-helixtrans-60.8-48.8174.800000113.1R108 R109 D110 S114 L115 L116R108-G112 PolarHBondContact O-N 3.32Å; R109-G112 WeakPolarHBondContact O-CA 3.41Å; R109-G112 PolarHBondContact O-N 3Å; R109-G112 VanDerWaalsContact O-N 3.11Å; D110-G112 VanDerWaalsContact C-N 3.33Å; G112-S114 VanDerWaalsContact C-N 3.33Å; G112-S114 PolarHBondContact O-N 3.45Å; G112-L115 PolarHBondContact O-N 3.47Å; G112-L116 PolarHBondContact O-N 3.33Å
113F84.1Confident83.8Confident67 Ų6785.9 Ų85.929%0.29447%0.467SS..Hα-helixtrans-64.8-36.8176.2-79.5-75.9000112.3L98 R109 D110 L116 Y117L98-F113 HydrophobicContact CD2-CD1 3.97Å; L98-F113 HydrophobicContact CD2-CE1 4.14Å; L98-F113 HydrophobicContact CD2-CG 4.26Å; R109-F113 HydrophobicContact CG-CD2 3.95Å; R109-F113 HydrophobicContact CG-CE2 3.73Å; R109-F113 VanDerWaalsContact O-CD2 3.28Å; R109-F113 WeakPolarHBondContact O-CD2 3.46Å; R109-F113 PolarHBondContact O-N 3.03Å; D110-F113 PolarHBondContact O-N 3.17Å; F113-L116 PolarHBondContact O-N 3.28Å; F113-Y117 PolarHBondContact O-N 3.21Å
114S84Confident84.4Confident75 Ų7582.3 Ų82.352%0.52445%0.452SS..Hα-helixtrans-63.4-41.8175.5-59.30000111.8D110 G111 G112 Y117 A118D110-S114 WeakPolarHBondContact O-CB 3.07Å; D110-S114 PolarHBondContact O-N 2.85Å; D110-S114 PolarHBondContact O-OG 2.88Å; G111-S114 PolarHBondContact O-N 3.48Å; G112-S114 VanDerWaalsContact C-N 3.33Å; G112-S114 PolarHBondContact O-N 3.45Å; S114-Y117 PolarHBondContact O-N 2.93Å; S114-A118 WeakPolarHBondContact O-CB 3.48Å; S114-A118 PolarHBondContact O-N 3.26Å
115L87.3Confident85.4Confident128 Ų12876 Ų7667%0.6742%0.424SS*.Hα-helixtrans-64.4-42.2175.3-17369.3000111.6G111 G112 Y117 A118 A119G111-L115 WeakPolarHBondContact O-CB 3.27Å; G111-L115 PolarHBondContact O-N 2.88Å; G112-L115 PolarHBondContact O-N 3.47Å; L115-Y117 VanDerWaalsContact C-N 3.32Å; L115-Y117 PolarHBondContact O-N 2.85Å; L115-A118 PolarHBondContact O-N 2.94Å; L115-A119 WeakPolarHBondContact O-CB 3.2Å; L115-A119 PolarHBondContact O-N 3.26Å
116L88.3Confident86.4Confident67 Ų6770.7 Ų70.735%0.35140%0.402SS..Hα-helixtrans-61.1-41.9175.6-179.265.2000111.4L98 G112 F113 A119 G120L98-L116 HydrophobicContact CD2-CB 3.84Å; L98-L116 HydrophobicContact CD2-CD2 3.67Å; L98-L116 HydrophobicContact CD2-CG 4.32Å; G112-L116 PolarHBondContact O-N 3.33Å; F113-L116 PolarHBondContact O-N 3.28Å; L116-A119 PolarHBondContact O-N 3.47Å; L116-G120 PolarHBondContact O-N 2.99Å
117Y83.3Confident86.9Confident125 Ų12571.9 Ų71.949%0.4942%0.415SS..Hα-helixtrans-65-44.9176.5-178.5-96.7000112.1F113 S114 L115 G120 N121 V292F113-Y117 PolarHBondContact O-N 3.21Å; S114-Y117 PolarHBondContact O-N 2.93Å; L115-Y117 VanDerWaalsContact C-N 3.32Å; L115-Y117 PolarHBondContact O-N 2.85Å; Y117-G120 PolarHBondContact O-N 3.26Å; Y117-N121 WeakPolarHBondContact CD1-ND2 3.32Å; Y117-N121 WeakPolarHBondContact CE1-ND2 3.43Å; Y117-N121 VanDerWaalsContact CZ-ND2 3.25Å; Y117-N121 PolarHBondContact O-N 3.45Å; Y117-N121 PolarHBondContact O-ND2 3.25Å; Y117-V292 WeakPolarHBondContact OH-CG1 3.49Å
118A86.3Confident87.6Confident35 Ų3564.9 Ų64.929%0.28938%0.384SS..Hα-helixtrans-60.9-45.6175.800000111.5S114 L115 G120 N121 I122S114-A118 WeakPolarHBondContact O-CB 3.48Å; S114-A118 PolarHBondContact O-N 3.26Å; L115-A118 PolarHBondContact O-N 2.94Å; A118-G120 VanDerWaalsContact C-N 3.31Å; A118-G120 PolarHBondContact O-N 3.49Å; A118-N121 PolarHBondContact O-N 2.92Å; A118-I122 WeakPolarHBondContact O-CG1 3.36Å; A118-I122 PolarHBondContact O-N 3.01Å
119A90.8Very high88Confident55 Ų5560.8 Ų60.846%0.45537%0.373SS..Hα-helixtrans-60.5-40.4175.900000112.1L115 L116 I122 G123L115-A119 WeakPolarHBondContact O-CB 3.2Å; L115-A119 PolarHBondContact O-N 3.26Å; L116-A119 PolarHBondContact O-N 3.47Å; A119-I122 PolarHBondContact O-N 3.47Å; A119-G123 PolarHBondContact O-N 3.33Å
120G88.7Confident88.7Confident47 Ų4758.6 Ų58.649%0.48537%0.374SS..Hα-helixtrans-60.3-43.8174.900000113L116 Y117 A118 G123 S124L116-G120 PolarHBondContact O-N 2.99Å; Y117-G120 PolarHBondContact O-N 3.26Å; A118-G120 VanDerWaalsContact C-N 3.31Å; A118-G120 PolarHBondContact O-N 3.49Å; G120-G123 PolarHBondContact O-N 3.33Å; G120-S124 PolarHBondContact O-N 3.26Å
121N88.1Confident89.4Confident18 Ų1853.4 Ų53.410%0.09635%0.347CS..Hα-helixtrans-68-43.1176.8-77.4-75.5000112.3Y117 A118 G123 S124 I125 M293Y117-N121 WeakPolarHBondContact CD1-ND2 3.32Å; Y117-N121 WeakPolarHBondContact CE1-ND2 3.43Å; Y117-N121 VanDerWaalsContact CZ-ND2 3.25Å; Y117-N121 PolarHBondContact O-N 3.45Å; Y117-N121 PolarHBondContact O-ND2 3.25Å; A118-N121 PolarHBondContact O-N 2.92Å; N121-G123 VanDerWaalsContact C-N 3.28Å; N121-G123 PolarHBondContact O-N 3.01Å; N121-S124 CarbonylContact O-C 3.57Å; N121-S124 WeakPolarHBondContact O-CA 3.49Å; N121-S124 WeakPolarHBondContact O-CB 3.19Å; N121-S124 PolarHBondContact O-N 3.36Å; N121-I125 WeakPolarHBondContact O-CG1 3.49Å; N121-I125 PolarHBondContact O-N 3.37Å; N121-M293 HydrophobicContact CB-CG 3.66Å; N121-M293 HydrophobicContact CB-SD 3.6Å
122I93Very high89.7Confident97 Ų9751.4 Ų51.450%0.49733%0.326SS..Hα-helixtrans-58-43.8174.2-67.2167.4000110.4A118 A119 S124 I125 A126 M293A118-I122 WeakPolarHBondContact O-CG1 3.36Å; A118-I122 PolarHBondContact O-N 3.01Å; A119-I122 PolarHBondContact O-N 3.47Å; I122-S124 VanDerWaalsContact C-N 3.31Å; I122-S124 PolarHBondContact O-N 3.11Å; I122-I125 PolarHBondContact O-N 2.85Å; I122-I125 VanDerWaalsContact O-N 3.12Å; I122-A126 WeakPolarHBondContact O-CB 3.47Å; I122-A126 PolarHBondContact O-N 2.93Å; I122-M293 HydrophobicContact CG1-CE 4Å; I122-M293 HydrophobicContact CG1-SD 4.26Å
123G92.5Very high90Very high36 Ų3653.2 Ų53.237%0.37133%0.334SS..Hα-helixtrans-60.3-39.5173.600000112.8A119 G120 N121 I125 A126 A127A119-G123 PolarHBondContact O-N 3.33Å; G120-G123 PolarHBondContact O-N 3.33Å; N121-G123 VanDerWaalsContact C-N 3.28Å; N121-G123 PolarHBondContact O-N 3.01Å; G123-I125 VanDerWaalsContact C-N 3.27Å; G123-I125 PolarHBondContact O-N 2.81Å; G123-A126 PolarHBondContact O-N 3.33Å; G123-A127 WeakPolarHBondContact O-CB 3.28Å; G123-A127 PolarHBondContact O-N 2.97Å
124S91.4Very high90.4Very high56 Ų5650.4 Ų50.439%0.39232%0.323SS..Hα-helixtrans-69.1-20.8175.3-167.50000113.8G120 N121 I122 P128G120-S124 PolarHBondContact O-N 3.26Å; N121-S124 CarbonylContact O-C 3.57Å; N121-S124 WeakPolarHBondContact O-CA 3.49Å; N121-S124 WeakPolarHBondContact O-CB 3.19Å; N121-S124 PolarHBondContact O-N 3.36Å; I122-S124 VanDerWaalsContact C-N 3.31Å; I122-S124 PolarHBondContact O-N 3.11Å; S124-P128 WeakPolarHBondContact O-CD 3.42Å; S124-P128 VanDerWaalsContact O-CG 3.22Å; S124-P128 WeakPolarHBondContact O-CG 3.48Å
125I93.9Very high90.6Very high35 Ų3547.3 Ų47.318%0.17930%0.302CS..Hα-helixtrans-82-49.2172-63.6169.7000109.8N121 I122 G123 I129 S286 A289 I290 M293N121-I125 WeakPolarHBondContact O-CG1 3.49Å; N121-I125 PolarHBondContact O-N 3.37Å; I122-I125 PolarHBondContact O-N 2.85Å; I122-I125 VanDerWaalsContact O-N 3.12Å; G123-I125 VanDerWaalsContact C-N 3.27Å; G123-I125 PolarHBondContact O-N 2.81Å; I125-I129 HydrophobicContact CG2-CD1 3.98Å; I125-I129 VanDerWaalsContact O-CD1 3.27Å; I125-I129 WeakPolarHBondContact O-CD1 3.49Å; I125-I129 VanDerWaalsContact O-CG1 3.32Å; I125-I129 WeakPolarHBondContact O-CG1 3.26Å; I125-S286 PolarHBondContact O-OG 3.3Å; I125-A289 HydrophobicContact CD1-CB 4.38Å; I125-A289 HydrophobicContact CG1-CB 3.53Å; I125-I290 HydrophobicContact CD1-CG1 3.68Å; I125-I290 HydrophobicContact CG1-CG1 3.88Å; I125-I290 HydrophobicContact CG2-CD1 4.25Å; I125-I290 HydrophobicContact CG2-CG1 4.08Å; I125-M293 HydrophobicContact CD1-SD 3.51Å; I125-M293 VanDerWaalsContact CD1-SD 3.51Å
126A93.9Very high90.5Very high51 Ų5144.6 Ų44.642%0.42129%0.286SS..Hα-helixtrans-70.6-39.7-173.800000112.8I122 G123 I129 A130I122-A126 WeakPolarHBondContact O-CB 3.47Å; I122-A126 PolarHBondContact O-N 2.93Å; G123-A126 PolarHBondContact O-N 3.33Å; A126-I129 PolarHBondContact O-N 2.9Å; A126-A130 WeakPolarHBondContact O-CB 3.33Å; A126-A130 PolarHBondContact O-N 3.47Å
127A93.3Very high90.5Very high50 Ų5048.8 Ų48.841%0.41330%0.297SS..Hα-helixtrans-65.2-47.3-173.600000113.5G123 I129 A130 C131G123-A127 WeakPolarHBondContact O-CB 3.28Å; G123-A127 PolarHBondContact O-N 2.97Å; A127-I129 VanDerWaalsContact C-N 3.31Å; A127-I129 PolarHBondContact O-N 3.33Å; A127-A130 PolarHBondContact O-N 2.96Å; A127-C131 VanDerWaalsContact O-CB 3.25Å; A127-C131 WeakPolarHBondContact O-CB 3.13Å; A127-C131 PolarHBondContact O-N 3.5Å; A127-C131 PolarHBondContact O-SG 3.27Å; A127-C131 VanDerWaalsContact O-SG 3.34Å
128P92.5Very high90.8Very high12 Ų1250.9 Ų50.98%0.07831%0.305CS..Hα-helixtrans-65.6-33.3176.2-17.830.7000113A3 S124 G132 A282 Q285A3-P128 HydrophobicContact CB-CB 3.9Å; A3-P128 HydrophobicContact CB-CG 4.29Å; S124-P128 WeakPolarHBondContact O-CD 3.42Å; S124-P128 VanDerWaalsContact O-CG 3.22Å; S124-P128 WeakPolarHBondContact O-CG 3.48Å; P128-G132 WeakPolarHBondContact O-CA 3.3Å; P128-G132 PolarHBondContact O-N 3.18Å; P128-A282 WeakPolarHBondContact CB-O 3.46Å; P128-Q285 HydrophobicContact CB-CB 4.18Å; P128-Q285 HydrophobicContact CG-CB 4.08Å
129I92.6Very high90.8Very high65 Ų6550.5 Ų50.533%0.33331%0.305SS..Hα-helixtrans-64.5-55.3174.6-64.1167.4000110.3I125 A126 A127 L133 L283I125-I129 HydrophobicContact CG2-CD1 3.98Å; I125-I129 VanDerWaalsContact O-CD1 3.27Å; I125-I129 WeakPolarHBondContact O-CD1 3.49Å; I125-I129 VanDerWaalsContact O-CG1 3.32Å; I125-I129 WeakPolarHBondContact O-CG1 3.26Å; A126-I129 PolarHBondContact O-N 2.9Å; A127-I129 VanDerWaalsContact C-N 3.31Å; A127-I129 PolarHBondContact O-N 3.33Å; I129-L133 HydrophobicContact CG2-CD1 3.92Å; I129-L133 WeakPolarHBondContact O-CB 3.46Å; I129-L133 VanDerWaalsContact O-CG 3.28Å; I129-L133 WeakPolarHBondContact O-CG 3.2Å; I129-L133 PolarHBondContact O-N 3.42Å; I129-L283 HydrophobicContact CB-CG 4.42Å; I129-L283 HydrophobicContact CG1-CG 4.04Å
130A93.1Very high90.6Very high42 Ų4250.1 Ų50.135%0.34729%0.291SS..Hα-helixtrans-65.7-50.6-175.800000111.9A126 A127 A134 L146A126-A130 WeakPolarHBondContact O-CB 3.33Å; A126-A130 PolarHBondContact O-N 3.47Å; A127-A130 PolarHBondContact O-N 2.96Å; A130-A134 WeakPolarHBondContact O-CB 3.11Å; A130-A134 PolarHBondContact O-N 2.62Å; A130-L146 HydrophobicContact CB-CD2 3.83Å
131C92.2Very high90.6Very high10 Ų1051.5 Ų51.57%0.06829%0.285CS..Hα-helixtrans-71.6-32.6-179.5-58.70000112L4 A127 A135 L146L4-C131 HydrophobicContact CD1-CB 3.68Å; A127-C131 VanDerWaalsContact O-CB 3.25Å; A127-C131 WeakPolarHBondContact O-CB 3.13Å; A127-C131 PolarHBondContact O-N 3.5Å; A127-C131 PolarHBondContact O-SG 3.27Å; A127-C131 VanDerWaalsContact O-SG 3.34Å; C131-A135 WeakPolarHBondContact O-CB 3.36Å; C131-A135 PolarHBondContact O-N 2.88Å; C131-L146 VanDerWaalsContact SG-CD2 3.56Å
132G89.8Confident90.6Very high2 Ų253.6 Ų53.62%0.02130%0.298CS..Hα-helixtrans-66.5-49.1177.400000112.6P128 A135 Q136P128-G132 WeakPolarHBondContact O-CA 3.3Å; P128-G132 PolarHBondContact O-N 3.18Å; G132-A135 PolarHBondContact O-N 3.36Å; G132-Q136 PolarHBondContact O-N 2.98Å
133L91.7Very high90.4Very high45 Ų4549 Ų4924%0.23627%0.274CS..Hα-helixtrans-64.5-42.2175.1-68.7171.5000111.5I129 A135 Q136 W137 P280 L283I129-L133 HydrophobicContact CG2-CD1 3.92Å; I129-L133 WeakPolarHBondContact O-CB 3.46Å; I129-L133 VanDerWaalsContact O-CG 3.28Å; I129-L133 WeakPolarHBondContact O-CG 3.2Å; I129-L133 PolarHBondContact O-N 3.42Å; L133-A135 PolarHBondContact O-N 3.43Å; L133-Q136 PolarHBondContact O-N 2.97Å; L133-W137 HydrophobicContact CD2-CH2 4.44Å; L133-W137 HydrophobicContact CD2-CZ2 3.98Å; L133-W137 PolarHBondContact O-N 3.47Å; L133-P280 HydrophobicContact CD2-CG 3.81Å; L133-P280 HydrophobicContact CG-CG 4.38Å; L133-L283 HydrophobicContact CG-CD1 4.43Å
134A91.7Very high90.2Very high8 Ų847.3 Ų47.37%0.06626%0.257CS..Hα-helixtrans-61.7-42.5176.600000112.2A130 Y138 G139 V142 L146A130-A134 WeakPolarHBondContact O-CB 3.11Å; A130-A134 PolarHBondContact O-N 2.62Å; A134-Y138 WeakPolarHBondContact O-CB 3.24Å; A134-Y138 PolarHBondContact O-N 3.14Å; A134-G139 PolarHBondContact O-N 3.36Å; A134-V142 HydrophobicContact CB-CG1 4.35Å; A134-L146 HydrophobicContact CB-CD1 4.1Å
135A87.4Confident90.2Very high9 Ų947 Ų477%0.07426%0.258CS..Hα-helixtrans-65-39177.500000112.4L4 C131 G132 L133 G139 W140L4-A135 HydrophobicContact CD2-CB 4.04Å; C131-A135 WeakPolarHBondContact O-CB 3.36Å; C131-A135 PolarHBondContact O-N 2.88Å; G132-A135 PolarHBondContact O-N 3.36Å; L133-A135 PolarHBondContact O-N 3.43Å; A135-G139 WeakPolarHBondContact CA-O 3.28Å; A135-G139 CarbonylContact O-C 3.35Å; A135-G139 WeakPolarHBondContact O-CA 3.5Å; A135-G139 PolarHBondContact O-N 2.9Å; A135-W140 HydrophobicContact CB-CE3 4.24Å; A135-W140 HydrophobicContact CB-CZ3 4.49Å
136Q86.6Confident90.1Very high72 Ų7248.8 Ų48.834%0.33627%0.268SS..Hα-helixtrans-71.1-42.2179.8-168.1-174.41800112.4G132 L133 E278 P280G132-Q136 PolarHBondContact O-N 2.98Å; L133-Q136 PolarHBondContact O-N 2.97Å; Q136-E278 PolarHBondContact NE2-O 2.99Å; Q136-E278 PolarHBondContact OE1-O 3.4Å; Q136-P280 HydrophobicContact CB-CG 4.33Å; Q136-P280 VanDerWaalsContact OE1-CD 3.29Å
137W88Confident90Very high155 Ų15547.4 Ų47.459%0.58726%0.256SS*.Hα-helixtrans-88.1-35.9-174-62.1-12.6000113.9L133L133-W137 HydrophobicContact CD2-CH2 4.44Å; L133-W137 HydrophobicContact CD2-CZ2 3.98Å; L133-W137 PolarHBondContact O-N 3.47Å
138Y88.7Confident89.9Confident169 Ų16945.1 Ų45.166%0.66324%0.237SC*.Hα-helixtrans-116.9-0.3-174-59.2-78.2000113.4A134A134-Y138 WeakPolarHBondContact O-CB 3.24Å; A134-Y138 PolarHBondContact O-N 3.14Å
139G87.7Confident89.9Confident27 Ų2746 Ų4628%0.27825%0.248SC..  trans89.5168179.500000114.3A134 A135 H141 V142 G143A134-G139 PolarHBondContact O-N 3.36Å; A135-G139 WeakPolarHBondContact CA-O 3.28Å; A135-G139 CarbonylContact O-C 3.35Å; A135-G139 WeakPolarHBondContact O-CA 3.5Å; A135-G139 PolarHBondContact O-N 2.9Å; G139-H141 VanDerWaalsContact C-N 3.31Å; G139-H141 PolarHBondContact O-N 3Å; G139-V142 PolarHBondContact O-N 3.32Å; G139-V142 VanDerWaalsContact O-N 3.16Å; G139-G143 PolarHBondContact O-N 2.89Å
140W86.2Confident89.9Confident47 Ų4745 Ų4518%0.17825%0.254CS..Hα-helixtrans-58.2-38-172.8-60.2101.5000114L4 L7 Y8 H11 A135 V142 G143 F144L4-W140 HydrophobicContact CB-CZ3 4.48Å; L4-W140 HydrophobicContact CD2-CZ3 4.05Å; L7-W140 HydrophobicContact CB-CH2 3.61Å; L7-W140 HydrophobicContact CB-CZ3 4.15Å; Y8-W140 HydrophobicContact CD2-CB 4.12Å; Y8-W140 HydrophobicContact CD2-CD2 4.06Å; Y8-W140 HydrophobicContact CD2-CE3 4.17Å; Y8-W140 HydrophobicContact CD2-CG 4.03Å; Y8-W140 HydrophobicContact CE2-CB 4.38Å; Y8-W140 HydrophobicContact CG-CE3 4.44Å; H11-W140 HydrophobicContact CB-CZ2 4.01Å; A135-W140 HydrophobicContact CB-CE3 4.24Å; A135-W140 HydrophobicContact CB-CZ3 4.49Å; W140-V142 VanDerWaalsContact C-N 3.3Å; W140-V142 PolarHBondContact O-N 2.8Å; W140-G143 PolarHBondContact O-N 3.33Å; W140-G143 VanDerWaalsContact O-N 3.17Å; W140-F144 HydrophobicContact CB-CD2 4.39Å; W140-F144 HydrophobicContact CB-CE2 4.2Å; W140-F144 HydrophobicContact CE3-CE2 4.39Å; W140-F144 WeakPolarHBondContact O-CD2 3.43Å; W140-F144 PolarHBondContact O-N 3.39Å
141H88.7Confident89.9Confident76 Ų7645 Ų4535%0.35225%0.247SC..Hα-helixtrans-52.8-48.7176.6-64.1-80.4000111.8G67 T70 G139 F144 A145G67-H141 PolarHBondContact O-ND1 3.11Å; T70-H141 HydrophobicContact CG2-CB 4.48Å; T70-H141 WeakPolarHBondContact CG2-CE1 3.44Å; T70-H141 WeakPolarHBondContact CG2-ND1 3.33Å; T70-H141 PolarHBondContact OG1-CE1 2.93Å; T70-H141 PolarHBondContact OG1-NE2 2.97Å; G139-H141 VanDerWaalsContact C-N 3.31Å; G139-H141 PolarHBondContact O-N 3Å; H141-F144 PolarHBondContact O-N 3Å; H141-A145 WeakPolarHBondContact O-CB 3.27Å; H141-A145 PolarHBondContact O-N 3.5Å
142V88.7Confident90Very high61 Ų6149.1 Ų49.137%0.3726%0.264SS..Hα-helixtrans-72.1-36.8-178.5-176.70000110.6A134 G139 W140 F144 A145 L146A134-V142 HydrophobicContact CB-CG1 4.35Å; G139-V142 PolarHBondContact O-N 3.32Å; G139-V142 VanDerWaalsContact O-N 3.16Å; W140-V142 VanDerWaalsContact C-N 3.3Å; W140-V142 PolarHBondContact O-N 2.8Å; V142-F144 PolarHBondContact O-N 3.42Å; V142-A145 PolarHBondContact O-N 3.05Å; V142-L146 WeakPolarHBondContact O-CB 3.38Å; V142-L146 PolarHBondContact O-N 3.18Å
143G88Confident90.2Very high0 Ų053.9 Ų53.90%029%0.288CS..Hα-helixtrans-58.4-45.8173.800000113.3G139 W140 A147G139-G143 PolarHBondContact O-N 2.89Å; W140-G143 PolarHBondContact O-N 3.33Å; W140-G143 VanDerWaalsContact O-N 3.17Å; G143-A147 PolarHBondContact O-N 3.03Å
144F89.4Confident90.2Very high1 Ų153.4 Ų53.40%0.00429%0.294CS..Hα-helixtrans-75.7-38.6176.8-66.7-56.5000113M1 L4 Y8 L66 W140 H141 V142 L146 A147 G148M1-F144 HydrophobicContact CE-CE1 4.24Å; M1-F144 HydrophobicContact SD-CD1 3.93Å; M1-F144 HydrophobicContact SD-CE1 3.85Å; L4-F144 HydrophobicContact CB-CE1 3.89Å; L4-F144 HydrophobicContact CB-CZ 4.19Å; L4-F144 HydrophobicContact CD1-CD1 4.32Å; L4-F144 HydrophobicContact CD1-CE1 4.16Å; Y8-F144 AromaticContact CD1-CE2 3.86Å; Y8-F144 HydrophobicContact CD1-CE2 3.86Å; Y8-F144 AromaticContact CD1-CZ 3.73Å; Y8-F144 HydrophobicContact CD1-CZ 3.73Å; Y8-F144 AromaticContact CD2-CE2 3.57Å; Y8-F144 HydrophobicContact CD2-CE2 3.57Å; Y8-F144 HydrophobicContact CD2-CZ 4.09Å; Y8-F144 HydrophobicContact CE1-CE2 4.08Å; Y8-F144 HydrophobicContact CE1-CZ 4.3Å; Y8-F144 AromaticContact CE2-CE2 3.85Å; Y8-F144 HydrophobicContact CE2-CE2 3.85Å; Y8-F144 AromaticContact CG-CE2 3.57Å; Y8-F144 HydrophobicContact CG-CE2 3.57Å; Y8-F144 AromaticContact CG-CZ 3.59Å; Y8-F144 HydrophobicContact CG-CZ 3.59Å; L66-F144 HydrophobicContact CD2-CB 4.23Å; L66-F144 HydrophobicContact CD2-CD1 3.39Å; L66-F144 HydrophobicContact CD2-CD2 3.9Å; L66-F144 HydrophobicContact CD2-CE1 3.56Å; L66-F144 HydrophobicContact CD2-CE2 4.05Å; L66-F144 HydrophobicContact CD2-CG 3.58Å; L66-F144 HydrophobicContact CD2-CZ 3.89Å; L66-F144 HydrophobicContact CG-CB 4.39Å; L66-F144 HydrophobicContact CG-CD1 4.27Å; L66-F144 HydrophobicContact CG-CD2 3.91Å; L66-F144 HydrophobicContact CG-CE2 4.21Å; L66-F144 HydrophobicContact CG-CG 3.94Å; W140-F144 HydrophobicContact CB-CD2 4.39Å; W140-F144 HydrophobicContact CB-CE2 4.2Å; W140-F144 HydrophobicContact CE3-CE2 4.39Å; W140-F144 WeakPolarHBondContact O-CD2 3.43Å; W140-F144 PolarHBondContact O-N 3.39Å; H141-F144 PolarHBondContact O-N 3Å; V142-F144 PolarHBondContact O-N 3.42Å; F144-L146 VanDerWaalsContact C-N 3.29Å; F144-L146 PolarHBondContact O-N 2.82Å; F144-A147 WeakPolarHBondContact O-CB 3.34Å; F144-A147 PolarHBondContact O-N 3.27Å; F144-G148 PolarHBondContact O-N 3.33Å
145A89.8Confident90.2Very high49 Ų4953.3 Ų53.341%0.40529%0.293SS..Hα-helixtrans-62.6-37175.200000111.6H141 V142 G148 G149H141-A145 WeakPolarHBondContact O-CB 3.27Å; H141-A145 PolarHBondContact O-N 3.5Å; V142-A145 PolarHBondContact O-N 3.05Å; A145-G148 PolarHBondContact O-N 2.88Å; A145-G149 PolarHBondContact O-N 2.95Å
146L92.1Very high90.5Very high74 Ų7456.8 Ų56.839%0.38731%0.309SS..Hα-helixtrans-65.1-40.1174.8-171.5143.6000111.5A130 C131 A134 V142 F144 G149 G150A130-L146 HydrophobicContact CB-CD2 3.83Å; C131-L146 VanDerWaalsContact SG-CD2 3.56Å; A134-L146 HydrophobicContact CB-CD1 4.1Å; V142-L146 WeakPolarHBondContact O-CB 3.38Å; V142-L146 PolarHBondContact O-N 3.18Å; F144-L146 VanDerWaalsContact C-N 3.29Å; F144-L146 PolarHBondContact O-N 2.82Å; L146-G149 PolarHBondContact O-N 3.35Å; L146-G150 PolarHBondContact O-N 3.34Å
147A91.8Very high90.8Very high22 Ų2258.9 Ų58.918%0.18232%0.322CS..Hα-helixtrans-62.8-42.4172.600000112G143 F144 G150 M151G143-A147 PolarHBondContact O-N 3.03Å; F144-A147 WeakPolarHBondContact O-CB 3.34Å; F144-A147 PolarHBondContact O-N 3.27Å; A147-G150 PolarHBondContact O-N 3.41Å; A147-M151 PolarHBondContact O-N 3.49Å; A147-M151 VanDerWaalsContact O-N 3.14Å
148G91.3Very high90.8Very high2 Ų253 Ų532%0.02130%0.3CS..Hα-helixtrans-63.1-44.1173.900000112.9H63 F144 A145 G150 M151 F152H63-G148 VanDerWaalsContact CB-CA 3.46Å; F144-G148 PolarHBondContact O-N 3.33Å; A145-G148 PolarHBondContact O-N 2.88Å; G148-G150 PolarHBondContact O-N 3.5Å; G148-M151 PolarHBondContact O-N 3.12Å; G148-F152 WeakPolarHBondContact O-CB 3.32Å; G148-F152 PolarHBondContact O-N 3.05Å
149G92.9Very high90.7Very high30 Ų3048.5 Ų48.531%0.30929%0.287SS..Hα-helixtrans-61.9-41.3175.900000112.4A145 L146 M151 F152 I153A145-G149 PolarHBondContact O-N 2.95Å; L146-G149 PolarHBondContact O-N 3.35Å; G149-M151 PolarHBondContact O-N 3.44Å; G149-F152 PolarHBondContact O-N 3.24Å; G149-I153 VanDerWaalsContact O-CG1 3.29Å; G149-I153 WeakPolarHBondContact O-CG1 3.39Å; G149-I153 PolarHBondContact O-N 3.43Å
150G92.6Very high90.7Very high43 Ų4352.2 Ų52.244%0.44331%0.309SS..Hα-helixtrans-60-45.2174.100000112.6L146 A147 G148 G154L146-G150 PolarHBondContact O-N 3.34Å; A147-G150 PolarHBondContact O-N 3.41Å; G148-G150 PolarHBondContact O-N 3.5Å; G150-G154 PolarHBondContact O-N 2.82Å
151M92.5Very high90.5Very high42 Ų4250.7 Ų50.721%0.20731%0.308CS..Hα-helixtrans-64.6-40.8174.5-17860.377.300111.9A56 M59 T60 A147 G148 G149 G154 L155A56-M151 HydrophobicContact CB-SD 4.05Å; M59-M151 HydrophobicContact CB-CE 4.14Å; M59-M151 HydrophobicContact CB-CG 4.15Å; M59-M151 HydrophobicContact CE-CE 3.4Å; M59-M151 HydrophobicContact SD-CE 3.57Å; M59-M151 VanDerWaalsContact SD-CE 3.57Å; T60-M151 WeakPolarHBondContact OG1-CG 3.33Å; A147-M151 PolarHBondContact O-N 3.49Å; A147-M151 VanDerWaalsContact O-N 3.14Å; G148-M151 PolarHBondContact O-N 3.12Å; G149-M151 PolarHBondContact O-N 3.44Å; M151-G154 PolarHBondContact O-N 3.17Å; M151-L155 PolarHBondContact O-N 3.44Å
152F94.1Very high89.7Confident97 Ų9750.3 Ų50.343%0.42531%0.306SS..Hα-helixtrans-63.4-45178.2-176.3-110.7000112.5T60 G148 G149 G154 L155 L156T60-F152 HydrophobicContact CG2-CB 3.82Å; T60-F152 HydrophobicContact CG2-CD2 4.09Å; T60-F152 HydrophobicContact CG2-CG 4.35Å; G148-F152 WeakPolarHBondContact O-CB 3.32Å; G148-F152 PolarHBondContact O-N 3.05Å; G149-F152 PolarHBondContact O-N 3.24Å; F152-G154 VanDerWaalsContact C-N 3.32Å; F152-G154 PolarHBondContact O-N 3.46Å; F152-L155 WeakPolarHBondContact O-CB 3.28Å; F152-L155 PolarHBondContact O-N 3.42Å; F152-L156 HydrophobicContact CD1-CD1 4.09Å; F152-L156 HydrophobicContact CD1-CG 4.44Å; F152-L156 HydrophobicContact CE1-CD1 3.63Å; F152-L156 HydrophobicContact CE1-CG 4.1Å; F152-L156 HydrophobicContact CZ-CD1 4.14Å; F152-L156 HydrophobicContact CZ-CD2 4.29Å; F152-L156 HydrophobicContact CZ-CG 4.22Å; F152-L156 WeakPolarHBondContact O-CG 3.32Å; F152-L156 PolarHBondContact O-N 2.88Å
153I94.1Very high88.7Confident102 Ų10257.7 Ų57.752%0.52333%0.327SS..Hα-helixtrans-62-43.1174.4-67.5166.3000110G149 L155 L156 I157G149-I153 VanDerWaalsContact O-CG1 3.29Å; G149-I153 WeakPolarHBondContact O-CG1 3.39Å; G149-I153 PolarHBondContact O-N 3.43Å; I153-L155 VanDerWaalsContact C-N 3.3Å; I153-L155 PolarHBondContact O-N 2.87Å; I153-L156 PolarHBondContact O-N 3.2Å; I153-L156 VanDerWaalsContact O-N 3.17Å; I153-I157 HydrophobicContact CG2-CD1 3.92Å; I153-I157 HydrophobicContact CG2-CG1 4.45Å; I153-I157 WeakPolarHBondContact O-CG1 3.5Å; I153-I157 PolarHBondContact O-N 2.89Å
154G92.7Very high87.9Confident36 Ų3664.6 Ų64.637%0.37136%0.359SS..Hα-helixtrans-57.5-42.2174.100000112.7G150 M151 F152 I157 F158G150-G154 PolarHBondContact O-N 2.82Å; M151-G154 PolarHBondContact O-N 3.17Å; F152-G154 VanDerWaalsContact C-N 3.32Å; F152-G154 PolarHBondContact O-N 3.46Å; G154-I157 PolarHBondContact O-N 3.11Å; G154-F158 WeakPolarHBondContact O-CB 3.29Å; G154-F158 PolarHBondContact O-N 2.95Å
155L91.9Very high86.9Confident6 Ų666.1 Ų66.13%0.03137%0.366CS..Hα-helixtrans-64-44.1174.1174.662.6000111.9I53 A56 L57 M151 F152 I153 I157 F158 L159I53-L155 HydrophobicContact CG2-CD1 4.26Å; A56-L155 HydrophobicContact CB-CB 4.29Å; A56-L155 HydrophobicContact CB-CD1 4.03Å; L57-L155 HydrophobicContact CD2-CD2 3.4Å; L57-L155 VanDerWaalsContact CD2-CD2 3.4Å; L57-L155 HydrophobicContact CG-CD2 3.65Å; M151-L155 PolarHBondContact O-N 3.44Å; F152-L155 WeakPolarHBondContact O-CB 3.28Å; F152-L155 PolarHBondContact O-N 3.42Å; I153-L155 VanDerWaalsContact C-N 3.3Å; I153-L155 PolarHBondContact O-N 2.87Å; L155-I157 PolarHBondContact O-N 3.44Å; L155-F158 WeakPolarHBondContact O-CB 3.31Å; L155-F158 PolarHBondContact O-N 3.49Å; L155-L159 HydrophobicContact CD1-CD1 4.06Å; L155-L159 HydrophobicContact CD1-CG 4.03Å; L155-L159 HydrophobicContact CG-CD1 3.99Å; L155-L159 HydrophobicContact CG-CG 4.38Å; L155-L159 WeakPolarHBondContact O-CB 3.45Å; L155-L159 VanDerWaalsContact O-CG 3.3Å; L155-L159 WeakPolarHBondContact O-CG 3.47Å; L155-L159 PolarHBondContact O-N 2.92Å
156L93.4Very high85.5Confident81 Ų8170.3 Ų70.342%0.42438%0.377SS..Hα-helixtrans-59.5-46176.6-74.7-178.5000111.6F152 I153 F158 L159 S160F152-L156 HydrophobicContact CD1-CD1 4.09Å; F152-L156 HydrophobicContact CD1-CG 4.44Å; F152-L156 HydrophobicContact CE1-CD1 3.63Å; F152-L156 HydrophobicContact CE1-CG 4.1Å; F152-L156 HydrophobicContact CZ-CD1 4.14Å; F152-L156 HydrophobicContact CZ-CD2 4.29Å; F152-L156 HydrophobicContact CZ-CG 4.22Å; F152-L156 WeakPolarHBondContact O-CG 3.32Å; F152-L156 PolarHBondContact O-N 2.88Å; I153-L156 PolarHBondContact O-N 3.2Å; I153-L156 VanDerWaalsContact O-N 3.17Å; L156-F158 VanDerWaalsContact C-N 3.3Å; L156-F158 PolarHBondContact O-N 2.66Å; L156-L159 PolarHBondContact O-N 2.93Å; L156-S160 WeakPolarHBondContact O-CB 3.46Å; L156-S160 PolarHBondContact O-N 2.95Å; L156-S160 PolarHBondContact O-OG 3.41Å; L156-S160 VanDerWaalsContact O-OG 3.11Å
157I91.6Very high83.9Confident116 Ų11671.7 Ų71.760%0.59539%0.393SS*.Hα-helixtrans-59.2-44.6176-66.6167000110.4I153 G154 L155 L159 S160 G161I153-I157 HydrophobicContact CG2-CD1 3.92Å; I153-I157 HydrophobicContact CG2-CG1 4.45Å; I153-I157 WeakPolarHBondContact O-CG1 3.5Å; I153-I157 PolarHBondContact O-N 2.89Å; G154-I157 PolarHBondContact O-N 3.11Å; L155-I157 PolarHBondContact O-N 3.44Å; I157-L159 VanDerWaalsContact C-N 3.35Å; I157-L159 PolarHBondContact O-N 2.94Å; I157-S160 PolarHBondContact O-N 3.26Å; I157-G161 PolarHBondContact O-N 3.06Å
158F88.6Confident82.4Confident31 Ų3171.1 Ų71.114%0.13639%0.388CS..Hα-helixtrans-61.7-41.1177.5-175.6-94.8000112.4R49 V52 I53 I94 L97 G154 L155 L156 G161 F165R49-F158 HydrophobicContact CG-CE1 4.4Å; R49-F158 HydrophobicContact CG-CZ 4.48Å; V52-F158 HydrophobicContact CB-CZ 4.38Å; V52-F158 HydrophobicContact CG1-CD1 4.49Å; V52-F158 HydrophobicContact CG1-CE1 4.04Å; V52-F158 HydrophobicContact CG1-CE2 4.12Å; V52-F158 HydrophobicContact CG1-CZ 3.84Å; I53-F158 HydrophobicContact CD1-CE1 4.11Å; I53-F158 HydrophobicContact CG1-CD1 3.97Å; I53-F158 HydrophobicContact CG1-CE1 3.67Å; I94-F158 HydrophobicContact CD1-CE2 4.32Å; L97-F158 HydrophobicContact CD2-CE2 3.67Å; L97-F158 HydrophobicContact CD2-CZ 3.49Å; L97-F158 VanDerWaalsContact CD2-CZ 3.49Å; G154-F158 WeakPolarHBondContact O-CB 3.29Å; G154-F158 PolarHBondContact O-N 2.95Å; L155-F158 WeakPolarHBondContact O-CB 3.31Å; L155-F158 PolarHBondContact O-N 3.49Å; L156-F158 VanDerWaalsContact C-N 3.3Å; L156-F158 PolarHBondContact O-N 2.66Å; F158-G161 PolarHBondContact O-N 3.43Å; F158-F165 HydrophobicContact CD2-CE2 4.16Å; F158-F165 HydrophobicContact CD2-CZ 4.19Å; F158-F165 HydrophobicContact CE2-CE1 4.42Å; F158-F165 HydrophobicContact CE2-CE2 4.03Å; F158-F165 AromaticContact CE2-CZ 3.98Å; F158-F165 HydrophobicContact CE2-CZ 3.98Å; F158-F165 HydrophobicContact CZ-CE2 4.46Å
159L87.5Confident80.8Confident75 Ų7578.1 Ų78.139%0.39341%0.413SS..Hα-helixtrans-69.4-41.6177.2-69.8173.4000112.4I53 L155 L156 I157 G161 H162I53-L159 HydrophobicContact CD1-CD2 3.81Å; I53-L159 HydrophobicContact CG1-CD2 4.12Å; I53-L159 HydrophobicContact CG2-CD2 4.47Å; L155-L159 HydrophobicContact CD1-CD1 4.06Å; L155-L159 HydrophobicContact CD1-CG 4.03Å; L155-L159 HydrophobicContact CG-CD1 3.99Å; L155-L159 HydrophobicContact CG-CG 4.38Å; L155-L159 WeakPolarHBondContact O-CB 3.45Å; L155-L159 VanDerWaalsContact O-CG 3.3Å; L155-L159 WeakPolarHBondContact O-CG 3.47Å; L155-L159 PolarHBondContact O-N 2.92Å; L156-L159 PolarHBondContact O-N 2.93Å; I157-L159 VanDerWaalsContact C-N 3.35Å; I157-L159 PolarHBondContact O-N 2.94Å; L159-G161 PolarHBondContact O-N 2.96Å; L159-H162 WeakPolarHBondContact O-CB 3.33Å; L159-H162 PolarHBondContact O-N 3.41Å; L159-H162 VanDerWaalsContact O-N 3.08Å
160S87.2Confident79.1Confident105 Ų10581.5 Ų81.573%0.73443%0.433SS*.Hα-helixtrans-61.6-32.2173.5-63.80000111.9L156 I157 H162L156-S160 WeakPolarHBondContact O-CB 3.46Å; L156-S160 PolarHBondContact O-N 2.95Å; L156-S160 PolarHBondContact O-OG 3.41Å; L156-S160 VanDerWaalsContact O-OG 3.11Å; I157-S160 PolarHBondContact O-N 3.26Å; S160-H162 PolarHBondContact O-N 2.91Å
161G80.9Confident77.5Confident15 Ų1582.4 Ų82.416%0.15543%0.426CS..G310 helixtrans-71.9-1.6174.500000115.3I157 F158 L159 R163 H164 F165I157-G161 PolarHBondContact O-N 3.06Å; F158-G161 PolarHBondContact O-N 3.43Å; L159-G161 PolarHBondContact O-N 2.96Å; G161-R163 PolarHBondContact O-N 3.02Å; G161-H164 PolarHBondContact O-N 3.37Å; G161-H164 PolarHBondContact O-ND1 3.23Å; G161-F165 VanDerWaalsContact O-CD2 3.32Å; G161-F165 WeakPolarHBondContact O-CD2 3.37Å; G161-F165 WeakPolarHBondContact O-CE2 3.38Å
162H72.6Confident76Confident69 Ų6983.7 Ų83.732%0.31943%0.433SS..G310 helixtrans-45-39.2-172.2174.521.7000114.3R49 L159 S160 H164 F165R49-H162 PolarHBondContact NH1-CE1 3.4Å; R49-H162 PolarHBondContact NH1-ND1 2.98Å; R49-H162 PolarHBondContact NH2-CD2 2.86Å; R49-H162 PolarHBondContact NH2-CE1 2.85Å; R49-H162 PolarHBondContact NH2-ND1 2.89Å; R49-H162 PolarHBondContact NH2-NE2 3.33Å; L159-H162 WeakPolarHBondContact O-CB 3.33Å; L159-H162 PolarHBondContact O-N 3.41Å; L159-H162 VanDerWaalsContact O-N 3.08Å; S160-H162 PolarHBondContact O-N 2.91Å; H162-H164 PolarHBondContact O-N 3.26Å; H162-H164 VanDerWaalsContact O-N 3.14Å; H162-F165 PolarHBondContact O-N 2.93Å
163R68.9Low74.3Confident215 Ų21586.4 Ų86.481%0.81145%0.445SS*.G310 helixtrans-55.7-32-178.7-64.7-174.8-178.7-174.90.6113.2G161 F165G161-R163 PolarHBondContact O-N 3.02Å; R163-F165 VanDerWaalsContact C-N 3.34Å
164H71.3Confident72.4Confident145 Ų14590 Ų9067%0.67146%0.457SS*.G310 helixtrans-78.7-16.4-179.7-56.295.6000113.5G161 H162G161-H164 PolarHBondContact O-N 3.37Å; G161-H164 PolarHBondContact O-ND1 3.23Å; H162-H164 PolarHBondContact O-N 3.26Å; H162-H164 VanDerWaalsContact O-N 3.14Å
165F66.7Low70.8Confident34 Ų3489.4 Ų89.415%0.14945%0.448CS..G310 helixtrans-103.68.5-174-51.3-65.7000113.2L101 F158 G161 H162 R163 S167 T168L101-F165 HydrophobicContact CD1-CD1 3.93Å; L101-F165 HydrophobicContact CD1-CE1 3.85Å; L101-F165 HydrophobicContact CD2-CD1 4.05Å; F158-F165 HydrophobicContact CD2-CE2 4.16Å; F158-F165 HydrophobicContact CD2-CZ 4.19Å; F158-F165 HydrophobicContact CE2-CE1 4.42Å; F158-F165 HydrophobicContact CE2-CE2 4.03Å; F158-F165 AromaticContact CE2-CZ 3.98Å; F158-F165 HydrophobicContact CE2-CZ 3.98Å; F158-F165 HydrophobicContact CZ-CE2 4.46Å; G161-F165 VanDerWaalsContact O-CD2 3.32Å; G161-F165 WeakPolarHBondContact O-CD2 3.37Å; G161-F165 WeakPolarHBondContact O-CE2 3.38Å; H162-F165 PolarHBondContact O-N 2.93Å; R163-F165 VanDerWaalsContact C-N 3.34Å; F165-S167 PolarHBondContact O-N 2.93Å; F165-T168 HydrophobicContact CB-CG2 4.47Å; F165-T168 WeakPolarHBondContact O-CB 3.5Å; F165-T168 PolarHBondContact O-N 2.99Å; F165-T168 VanDerWaalsContact O-N 3.17Å; F165-T168 PolarHBondContact O-OG1 3.14Å
166Q60.8Low69.2Low136 Ų13689.5 Ų89.564%0.63645%0.449SS*.THydrogen-bonded Turntrans-66.2-24.6-174-69.3-172.7-11.400113.9T168Q166-T168 VanDerWaalsContact C-N 3.3Å
167S59.4Low67.5Low103 Ų10390.4 Ų90.472%0.7246%0.458SS*.THydrogen-bonded Turntrans-76.2-13.7176.553.10000114.1F165F165-S167 PolarHBondContact O-N 2.93Å
168T59.8Low65.8Low11 Ų1187 Ų877%0.06745%0.445CS..SBendtrans-73.4156.5-175.661.90000111.9L97 E100 L101 F165 Q166 S170L97-T168 HydrophobicContact CD1-CG2 3.69Å; E100-T168 HydrophobicContact CB-CG2 4.33Å; E100-T168 WeakPolarHBondContact OE2-CB 3.47Å; L101-T168 HydrophobicContact CD2-CG2 3.6Å; L101-T168 HydrophobicContact CG-CG2 4.17Å; F165-T168 HydrophobicContact CB-CG2 4.47Å; F165-T168 WeakPolarHBondContact O-CB 3.5Å; F165-T168 PolarHBondContact O-N 2.99Å; F165-T168 VanDerWaalsContact O-N 3.17Å; F165-T168 PolarHBondContact O-OG1 3.14Å; Q166-T168 VanDerWaalsContact C-N 3.3Å; T168-S170 PolarHBondContact O-N 3.45Å
169R57.1Low64.1Low148 Ų14890.1 Ų90.156%0.55847%0.466SS*.  trans-59.5109.1-173.4-173.3174.7176.3-172.4-6.4110.1D43 E100D43-R169 PolarHBondContact O-NH2 2.9Å; E100-R169 PolarHBondContact OE2-N 3.34Å
170S58Low62.4Low102 Ų10293.4 Ų93.471%0.71348%0.477SS*.  trans-69.8151178.472.30000111.2T168 D172T168-S170 PolarHBondContact O-N 3.45Å; S170-D172 PolarHBondContact O-N 2.82Å
171M58.6Low60.7Low61 Ų6197.8 Ų97.830%0.348%0.483SS..  trans-49.1130.8178.9-173.5165.873.500111.6L46 T50 K173 L176L46-M171 WeakPolarHBondContact O-CB 3.21Å; L46-M171 VanDerWaalsContact O-CG 3.3Å; L46-M171 WeakPolarHBondContact O-CG 3.49Å; T50-M171 HydrophobicContact CG2-SD 4.04Å; M171-K173 VanDerWaalsContact C-N 3.3Å; M171-K173 PolarHBondContact O-N 3.49Å; M171-L176 HydrophobicContact CE-CD1 3.79Å; M171-L176 HydrophobicContact CG-CD1 3.18Å; M171-L176 HydrophobicContact SD-CD1 3.39Å; M171-L176 WeakPolarHBondContact SD-CD1 3.31Å
172D60.7Low59.7Low69 Ų69101.7 Ų101.737%0.36951%0.514SS..  trans-74.186-179.9-170.4-12.8000110S170 K174 A175 L176S170-D172 PolarHBondContact O-N 2.82Å; D172-K174 PolarHBondContact O-N 2.95Å; D172-K174 PolarHBondContact OD1-N 3.47Å; D172-A175 HydrophobicContact CB-CB 3.94Å; D172-A175 PolarHBondContact O-N 2.83Å; D172-A175 VanDerWaalsContact O-N 3.14Å; D172-A175 PolarHBondContact OD1-N 3.38Å; D172-L176 PolarHBondContact O-N 3.18Å; D172-L176 VanDerWaalsContact O-N 3.11Å
173K58.9Low59.3Low155 Ų155102.2 Ų102.267%0.67452%0.519SS*.Hα-helixtrans-56.6-32.3-178.6-66.2-176.4-177.9179.40112.1M171 T177M171-K173 VanDerWaalsContact C-N 3.3Å; M171-K173 PolarHBondContact O-N 3.49Å; K173-T177 WeakPolarHBondContact O-CG2 3.15Å; K173-T177 PolarHBondContact O-N 2.88Å; K173-T177 PolarHBondContact O-OG1 3.26Å
174K54.5Low59.2Low177 Ų17794.4 Ų94.477%0.7750%0.496SS*.Hα-helixtrans-73-39.6179.1-76-175.6178.4179.20111.5D172 L176 T177 S178D172-K174 PolarHBondContact O-N 2.95Å; D172-K174 PolarHBondContact OD1-N 3.47Å; K174-L176 VanDerWaalsContact C-N 3.34Å; K174-T177 PolarHBondContact O-OG1 3.36Å; K174-S178 PolarHBondContact O-N 3.03Å; K174-S178 VanDerWaalsContact O-N 3.14Å
175A59.3Low59Low23 Ų2388.4 Ų88.419%0.1947%0.469CS..Hα-helixtrans-65.5-37.9175.500000112.1L45 D172 S178L45-A175 HydrophobicContact CD2-CB 4.22Å; D172-A175 HydrophobicContact CB-CB 3.94Å; D172-A175 PolarHBondContact O-N 2.83Å; D172-A175 VanDerWaalsContact O-N 3.14Å; D172-A175 PolarHBondContact OD1-N 3.38Å; A175-S178 WeakPolarHBondContact O-CB 3.49Å; A175-S178 PolarHBondContact O-N 3.49Å; A175-S178 PolarHBondContact O-OG 3.04Å
176L56.8Low59.1Low8 Ų894.4 Ų94.44%0.04249%0.491CS..Hα-helixtrans-70.8-36.9-179.8-78.3161.4000114.6M171 D172 K174 S178 V185 W186 L189M171-L176 HydrophobicContact CE-CD1 3.79Å; M171-L176 HydrophobicContact CG-CD1 3.18Å; M171-L176 HydrophobicContact SD-CD1 3.39Å; M171-L176 WeakPolarHBondContact SD-CD1 3.31Å; D172-L176 PolarHBondContact O-N 3.18Å; D172-L176 VanDerWaalsContact O-N 3.11Å; K174-L176 VanDerWaalsContact C-N 3.34Å; L176-S178 VanDerWaalsContact C-N 3.31Å; L176-V185 PolarHBondContact O-N 3.45Å; L176-W186 HydrophobicContact CD2-CB 4.12Å; L176-W186 PolarHBondContact O-N 2.89Å; L176-W186 VanDerWaalsContact O-N 3.13Å; L176-L189 HydrophobicContact CD2-CD1 3.33Å
177T57.5Low59.2Low100 Ų10089.1 Ų89.161%0.61347%0.469SS*.Hα-helixtrans-83.2-11.1176.655.80000112.6K173 K174 V179K173-T177 WeakPolarHBondContact O-CG2 3.15Å; K173-T177 PolarHBondContact O-N 2.88Å; K173-T177 PolarHBondContact O-OG1 3.26Å; K174-T177 PolarHBondContact O-OG1 3.36Å; T177-V179 PolarHBondContact O-N 2.98Å
178S56.7Low59.7Low45 Ų4589.3 Ų89.332%0.31545%0.454SS..SBendtrans-59.7127.8171.878.20000109.7K174 A175 L176 V185K174-S178 PolarHBondContact O-N 3.03Å; K174-S178 VanDerWaalsContact O-N 3.14Å; A175-S178 WeakPolarHBondContact O-CB 3.49Å; A175-S178 PolarHBondContact O-N 3.49Å; A175-S178 PolarHBondContact O-OG 3.04Å; L176-S178 VanDerWaalsContact C-N 3.31Å; S178-V185 WeakPolarHBondContact O-CG2 3.23Å; S178-V185 PolarHBondContact O-N 3.18Å
179V52Low60.2Low97 Ų9790 Ų9059%0.58846%0.457SS*.EExtended strand (participates in β ladder)trans-86119.3177.5-179.70000107.4T177T177-V179 PolarHBondContact O-N 2.98Å
180K52.1Low60.9Low143 Ų14385.6 Ų85.662%0.62245%0.447SS*.EExtended strand (participates in β ladder)trans-124.3129.1170.3-77.5-168178.3-176.60108.6L183 V185K180-L183 PolarHBondContact N-O 3.24Å; K180-L183 VanDerWaalsContact N-O 3.13Å; K180-L183 VanDerWaalsContact O-O 3.05Å; K180-V185 HydrophobicContact CB-CG2 4.45Å
181F51.9Low61.5Low198 Ų19883.8 Ų83.887%0.86843%0.431SS*.THydrogen-bonded Turntrans49.666.3-176.6-87.8-90.3000112.1L183F181-L183 PolarHBondContact O-N 3.28Å
182A60.7Low62.2Low97 Ų9785.7 Ų85.780%0.80244%0.441SS*.THydrogen-bonded Turntrans66.8-18.9174.900000118.1
183L64.6Low62.9Low79 Ų7986 Ų8641%0.41444%0.442SS..EExtended strand (participates in β ladder)trans-120.3144.7-176.2-81.8176.2000111.9K180 F181 S187K180-L183 PolarHBondContact N-O 3.24Å; K180-L183 VanDerWaalsContact N-O 3.13Å; K180-L183 VanDerWaalsContact O-O 3.05Å; F181-L183 PolarHBondContact O-N 3.28Å; L183-S187 WeakPolarHBondContact CB-OG 3.12Å
184P65.6Low63.7Low51 Ų5182.6 Ų82.633%0.33144%0.437SS..EExtended strand (participates in β ladder)trans-62.7141.2172.124.1-30.4000109.8W186 S187 W188P184-W186 PolarHBondContact O-N 3.28Å; P184-S187 VanDerWaalsContact CD-OG 3.32Å; P184-S187 WeakPolarHBondContact CD-OG 3.3Å; P184-S187 WeakPolarHBondContact O-CB 3.42Å; P184-S187 PolarHBondContact O-N 2.83Å; P184-S187 PolarHBondContact O-OG 3.23Å; P184-W188 PolarHBondContact O-N 3.25Å
185V68Low64.9Low19 Ų1978.9 Ų78.912%0.11543%0.425CS..Hα-helixtrans-53.9-32.7-176.2170.70000112.4L45 L176 S178 K180 S187 W188 L189L45-V185 HydrophobicContact CD1-CG1 3.85Å; L45-V185 HydrophobicContact CD2-CG1 3.76Å; L45-V185 HydrophobicContact CG-CG1 4.41Å; L176-V185 PolarHBondContact O-N 3.45Å; S178-V185 WeakPolarHBondContact O-CG2 3.23Å; S178-V185 PolarHBondContact O-N 3.18Å; K180-V185 HydrophobicContact CB-CG2 4.45Å; V185-S187 VanDerWaalsContact C-N 3.34Å; V185-S187 PolarHBondContact O-N 2.8Å; V185-W188 WeakPolarHBondContact O-CB 3.44Å; V185-W188 PolarHBondContact O-N 2.87Å; V185-L189 HydrophobicContact CG1-CD1 4.42Å; V185-L189 HydrophobicContact CG1-CG 4.47Å; V185-L189 WeakPolarHBondContact O-CG 3.4Å; V185-L189 PolarHBondContact O-N 2.76Å
186W68.2Low65.9Low160 Ų16079 Ų7961%0.60643%0.426SS*.Hα-helixtrans-60.2-40.1173.5-172.173.9000113.6L176 P184 W188 L189 V190L176-W186 HydrophobicContact CD2-CB 4.12Å; L176-W186 PolarHBondContact O-N 2.89Å; L176-W186 VanDerWaalsContact O-N 3.13Å; P184-W186 PolarHBondContact O-N 3.28Å; W186-W188 VanDerWaalsContact C-N 3.35Å; W186-L189 WeakPolarHBondContact O-CB 3.43Å; W186-L189 PolarHBondContact O-N 2.97Å; W186-L189 VanDerWaalsContact O-N 3.17Å; W186-V190 HydrophobicContact CD2-CG2 4.18Å; W186-V190 HydrophobicContact CE3-CG2 4.3Å; W186-V190 HydrophobicContact CH2-CG2 4.1Å; W186-V190 HydrophobicContact CZ2-CG2 3.94Å; W186-V190 HydrophobicContact CZ3-CG2 4.27Å; W186-V190 WeakPolarHBondContact O-CG2 3.33Å; W186-V190 PolarHBondContact O-N 3.23Å
187S62.8Low66.9Low25 Ų2579.2 Ų79.218%0.17543%0.428CS..Hα-helixtrans-67.6-36175.564.20000112.1L183 P184 V185 L189 V190 V191L183-S187 WeakPolarHBondContact CB-OG 3.12Å; P184-S187 VanDerWaalsContact CD-OG 3.32Å; P184-S187 WeakPolarHBondContact CD-OG 3.3Å; P184-S187 WeakPolarHBondContact O-CB 3.42Å; P184-S187 PolarHBondContact O-N 2.83Å; P184-S187 PolarHBondContact O-OG 3.23Å; V185-S187 VanDerWaalsContact C-N 3.34Å; V185-S187 PolarHBondContact O-N 2.8Å; S187-L189 VanDerWaalsContact C-N 3.31Å; S187-L189 PolarHBondContact O-N 2.84Å; S187-V190 PolarHBondContact O-N 3.06Å; S187-V191 WeakPolarHBondContact O-CB 3.49Å; S187-V191 VanDerWaalsContact O-CG2 3.26Å; S187-V191 WeakPolarHBondContact O-CG2 3.39Å; S187-V191 PolarHBondContact O-N 3.39Å
188W71.1Confident68Low108 Ų10878.2 Ų78.241%0.40942%0.421SS..Hα-helixtrans-62.7-36.4170.1-91.2100.7000112.6P184 V185 W186 V191 M192P184-W188 PolarHBondContact O-N 3.25Å; V185-W188 WeakPolarHBondContact O-CB 3.44Å; V185-W188 PolarHBondContact O-N 2.87Å; W186-W188 VanDerWaalsContact C-N 3.35Å; W188-V191 PolarHBondContact O-N 3.43Å; W188-M192 HydrophobicContact CE3-CE 4.48Å; W188-M192 HydrophobicContact CZ3-CE 4.3Å; W188-M192 VanDerWaalsContact O-CB 3.32Å; W188-M192 WeakPolarHBondContact O-CB 3.31Å; W188-M192 WeakPolarHBondContact O-CG 3.43Å; W188-M192 PolarHBondContact O-N 3.22Å
189L69.2Low69.3Low25 Ų2580.8 Ų80.813%0.13143%0.427CS..Hα-helixtrans-66.1-41.4174-71.4170.6000111.7L41 L45 L46 L176 V185 W186 S187 M192 L193L41-L189 HydrophobicContact CD1-CD2 3.74Å; L41-L189 HydrophobicContact CD2-CD2 3.91Å; L41-L189 HydrophobicContact CG-CD2 4.07Å; L45-L189 HydrophobicContact CB-CD1 4.34Å; L45-L189 HydrophobicContact CD1-CD1 4.33Å; L45-L189 HydrophobicContact CD1-CD2 4.01Å; L45-L189 HydrophobicContact CD1-CG 4.46Å; L46-L189 HydrophobicContact CD2-CD1 3.91Å; L46-L189 HydrophobicContact CG-CD1 4.36Å; L176-L189 HydrophobicContact CD2-CD1 3.33Å; V185-L189 HydrophobicContact CG1-CD1 4.42Å; V185-L189 HydrophobicContact CG1-CG 4.47Å; V185-L189 WeakPolarHBondContact O-CG 3.4Å; V185-L189 PolarHBondContact O-N 2.76Å; W186-L189 WeakPolarHBondContact O-CB 3.43Å; W186-L189 PolarHBondContact O-N 2.97Å; W186-L189 VanDerWaalsContact O-N 3.17Å; S187-L189 VanDerWaalsContact C-N 3.31Å; S187-L189 PolarHBondContact O-N 2.84Å; L189-M192 PolarHBondContact O-N 3.13Å; L189-L193 WeakPolarHBondContact O-CB 3.45Å; L189-L193 PolarHBondContact O-N 3.24Å
190V71.6Confident70.7Confident56 Ų5677 Ų7734%0.33940%0.403SS..Hα-helixtrans-66.1-41.9175176.10000110.7W186 S187 L193 C194W186-V190 HydrophobicContact CD2-CG2 4.18Å; W186-V190 HydrophobicContact CE3-CG2 4.3Å; W186-V190 HydrophobicContact CH2-CG2 4.1Å; W186-V190 HydrophobicContact CZ2-CG2 3.94Å; W186-V190 HydrophobicContact CZ3-CG2 4.27Å; W186-V190 WeakPolarHBondContact O-CG2 3.33Å; W186-V190 PolarHBondContact O-N 3.23Å; S187-V190 PolarHBondContact O-N 3.06Å; V190-L193 WeakPolarHBondContact O-CB 3.46Å; V190-L193 PolarHBondContact O-N 2.91Å; V190-C194 PolarHBondContact O-N 2.84Å; V190-C194 PolarHBondContact O-SG 3.15Å; V190-C194 VanDerWaalsContact O-SG 3.38Å
191V70.3Confident72Confident63 Ų6370.6 Ų70.638%0.38238%0.375SS..Hα-helixtrans-61-47.1174.21710000110.3S187 W188 L193 C194 L195S187-V191 WeakPolarHBondContact O-CB 3.49Å; S187-V191 VanDerWaalsContact O-CG2 3.26Å; S187-V191 WeakPolarHBondContact O-CG2 3.39Å; S187-V191 PolarHBondContact O-N 3.39Å; W188-V191 PolarHBondContact O-N 3.43Å; V191-L193 VanDerWaalsContact C-N 3.3Å; V191-L193 PolarHBondContact O-N 3.34Å; V191-C194 PolarHBondContact O-N 3.21Å; V191-L195 WeakPolarHBondContact O-CB 3.24Å; V191-L195 PolarHBondContact O-N 3.34Å
192M74.3Confident73.5Confident101 Ų10165.1 Ų65.150%0.49836%0.355SS..Hα-helixtrans-63.6-34.9175.4-80-70.5168.900112.4W188 L189 C194 L195 A196W188-M192 HydrophobicContact CE3-CE 4.48Å; W188-M192 HydrophobicContact CZ3-CE 4.3Å; W188-M192 VanDerWaalsContact O-CB 3.32Å; W188-M192 WeakPolarHBondContact O-CB 3.31Å; W188-M192 WeakPolarHBondContact O-CG 3.43Å; W188-M192 PolarHBondContact O-N 3.22Å; L189-M192 PolarHBondContact O-N 3.13Å; M192-C194 VanDerWaalsContact C-N 3.31Å; M192-C194 PolarHBondContact O-N 3.37Å; M192-L195 PolarHBondContact O-N 3.2Å; M192-A196 WeakPolarHBondContact O-CA 3.45Å; M192-A196 WeakPolarHBondContact O-CB 3.21Å; M192-A196 PolarHBondContact O-N 3.44Å
193L75.4Confident74.5Confident76 Ų7660.8 Ų60.840%0.39832%0.318SS..Hα-helixtrans-65-35.5175.2-172.968.9000112L58 L189 V190 V191 P197L58-L193 HydrophobicContact CD1-CD1 3.52Å; L58-L193 HydrophobicContact CD2-CD1 3.88Å; L58-L193 HydrophobicContact CD2-CG 4.5Å; L58-L193 HydrophobicContact CG-CD1 4.14Å; L189-L193 WeakPolarHBondContact O-CB 3.45Å; L189-L193 PolarHBondContact O-N 3.24Å; V190-L193 WeakPolarHBondContact O-CB 3.46Å; V190-L193 PolarHBondContact O-N 2.91Å; V191-L193 VanDerWaalsContact C-N 3.3Å; V191-L193 PolarHBondContact O-N 3.34Å; L193-P197 WeakPolarHBondContact O-CD 3.36Å; L193-P197 VanDerWaalsContact O-CG 3.29Å; L193-P197 WeakPolarHBondContact O-CG 3.37Å
194C76.1Confident75.4Confident84 Ų8457.1 Ų57.157%0.56830%0.299SS*.Hα-helixtrans-81.1-34.9175.2-66.30000112.5V190 V191 M192V190-C194 PolarHBondContact O-N 2.84Å; V190-C194 PolarHBondContact O-SG 3.15Å; V190-C194 VanDerWaalsContact O-SG 3.38Å; V191-C194 PolarHBondContact O-N 3.21Å; M192-C194 VanDerWaalsContact C-N 3.31Å; M192-C194 PolarHBondContact O-N 3.37Å
195L79.2Confident76.1Confident98 Ų9859.4 Ų59.451%0.51331%0.305SS..Hα-helixtrans-87-27.9-173.3-156.1130.1000112.5V191 M192 V198 F199V191-L195 WeakPolarHBondContact O-CB 3.24Å; V191-L195 PolarHBondContact O-N 3.34Å; M192-L195 PolarHBondContact O-N 3.2Å; L195-V198 PolarHBondContact O-N 3.26Å; L195-F199 WeakPolarHBondContact O-CB 3.47Å; L195-F199 PolarHBondContact O-N 2.9Å
196A79.8Confident76.8Confident26 Ų2662 Ų6222%0.21532%0.318CS..Hα-helixtrans-63.3-44.4176.500000112.3M192 V198 F199 F200M192-A196 WeakPolarHBondContact O-CA 3.45Å; M192-A196 WeakPolarHBondContact O-CB 3.21Å; M192-A196 PolarHBondContact O-N 3.44Å; A196-V198 VanDerWaalsContact C-N 3.32Å; A196-V198 PolarHBondContact O-N 3.3Å; A196-F199 PolarHBondContact O-N 3.46Å; A196-F200 HydrophobicContact CB-CD2 4.44Å; A196-F200 HydrophobicContact CB-CE2 4.34Å; A196-F200 WeakPolarHBondContact O-CD2 3.37Å; A196-F200 PolarHBondContact O-N 3.39Å
197P77.7Confident77.4Confident13 Ų1357.9 Ų57.98%0.08431%0.308CS..Hα-helixtrans-55.5-46.9170.5-27.735.4000112.1L78 A81 I82 L193 F199 F200 T201L78-P197 HydrophobicContact CD1-CB 4.41Å; A81-P197 HydrophobicContact CB-CB 4.5Å; A81-P197 WeakPolarHBondContact CB-O 3.31Å; I82-P197 HydrophobicContact CG1-CB 4.06Å; I82-P197 HydrophobicContact CG1-CG 4.22Å; L193-P197 WeakPolarHBondContact O-CD 3.36Å; L193-P197 VanDerWaalsContact O-CG 3.29Å; L193-P197 WeakPolarHBondContact O-CG 3.37Å; P197-F199 VanDerWaalsContact C-N 3.33Å; P197-F199 PolarHBondContact O-N 2.88Å; P197-F200 PolarHBondContact O-N 2.95Å; P197-T201 VanDerWaalsContact O-CG2 3.31Å; P197-T201 WeakPolarHBondContact O-CG2 3.48Å; P197-T201 PolarHBondContact O-N 3.48Å; P197-T201 PolarHBondContact O-OG1 3.03Å
198V80.4Confident78.4Confident78 Ų7863.5 Ų63.547%0.47333%0.326SS..Hα-helixtrans-62.1-40.1178.2-179.10000111.9L195 A196 T201 L202L195-V198 PolarHBondContact O-N 3.26Å; A196-V198 VanDerWaalsContact C-N 3.32Å; A196-V198 PolarHBondContact O-N 3.3Å; V198-T201 WeakPolarHBondContact CA-OG1 3.47Å; V198-T201 PolarHBondContact O-OG1 3.22Å; V198-L202 HydrophobicContact CG1-CD1 4.22Å; V198-L202 VanDerWaalsContact O-CG 3.28Å; V198-L202 WeakPolarHBondContact O-CG 3.29Å; V198-L202 PolarHBondContact O-N 3.09Å; V198-L202 VanDerWaalsContact O-N 3.08Å
199F84.4Confident79Confident100 Ų10058.9 Ų58.944%0.43931%0.31SS..Hα-helixtrans-64-46.7175.9174.6-102000111.4L195 A196 P197 L202 L203L195-F199 WeakPolarHBondContact O-CB 3.47Å; L195-F199 PolarHBondContact O-N 2.9Å; A196-F199 PolarHBondContact O-N 3.46Å; P197-F199 VanDerWaalsContact C-N 3.33Å; P197-F199 PolarHBondContact O-N 2.88Å; F199-L202 PolarHBondContact O-N 3.27Å; F199-L203 HydrophobicContact CE1-CD1 3.65Å; F199-L203 HydrophobicContact CE2-CD1 4.39Å; F199-L203 HydrophobicContact CZ-CD1 3.56Å; F199-L203 WeakPolarHBondContact O-CB 3.42Å; F199-L203 PolarHBondContact O-N 2.95Å
200F82.2Confident79.8Confident17 Ų1758.6 Ų58.68%0.07531%0.313CS..Hα-helixtrans-70.5-31.9179-72.9-61.2000112.6L30 T34 A81 I84 C85 A196 P197 L203 L204L30-F200 HydrophobicContact CD1-CD1 4.06Å; L30-F200 HydrophobicContact CD1-CE1 4.49Å; L30-F200 HydrophobicContact CD2-CD1 4.39Å; L30-F200 HydrophobicContact CD2-CE1 4.04Å; T34-F200 HydrophobicContact CG2-CE1 4.18Å; T34-F200 HydrophobicContact CG2-CE2 4.15Å; T34-F200 HydrophobicContact CG2-CZ 3.53Å; A81-F200 HydrophobicContact CB-CB 3.6Å; I84-F200 HydrophobicContact CG2-CD1 4.2Å; I84-F200 HydrophobicContact CG2-CD2 4.22Å; I84-F200 HydrophobicContact CG2-CE1 4.13Å; I84-F200 HydrophobicContact CG2-CE2 4.14Å; I84-F200 HydrophobicContact CG2-CG 4.26Å; I84-F200 HydrophobicContact CG2-CZ 4.11Å; C85-F200 WeakPolarHBondContact SG-CD2 3.5Å; A196-F200 HydrophobicContact CB-CD2 4.44Å; A196-F200 HydrophobicContact CB-CE2 4.34Å; A196-F200 WeakPolarHBondContact O-CD2 3.37Å; A196-F200 PolarHBondContact O-N 3.39Å; P197-F200 PolarHBondContact O-N 2.95Å; F200-L203 PolarHBondContact O-N 3.15Å; F200-L204 WeakPolarHBondContact O-CB 3.36Å; F200-L204 VanDerWaalsContact O-CG 3.25Å; F200-L204 WeakPolarHBondContact O-CG 3.46Å; F200-L204 PolarHBondContact O-N 3.2Å
201T79.6Confident80.5Confident8 Ų863.9 Ų63.95%0.04933%0.328CS..Hα-helixtrans-62.3-49.4171.952.80000110.7L78 A81 P197 V198 L203 L204 E205L78-T201 VanDerWaalsContact CA-CG2 3.41Å; L78-T201 HydrophobicContact CB-CG2 4.11Å; L78-T201 HydrophobicContact CD1-CG2 4.01Å; A81-T201 HydrophobicContact CB-CG2 3.67Å; P197-T201 VanDerWaalsContact O-CG2 3.31Å; P197-T201 WeakPolarHBondContact O-CG2 3.48Å; P197-T201 PolarHBondContact O-N 3.48Å; P197-T201 PolarHBondContact O-OG1 3.03Å; V198-T201 WeakPolarHBondContact CA-OG1 3.47Å; V198-T201 PolarHBondContact O-OG1 3.22Å; T201-L203 VanDerWaalsContact C-N 3.27Å; T201-L203 PolarHBondContact O-N 3.43Å; T201-L204 PolarHBondContact O-N 3.31Å; T201-E205 VanDerWaalsContact O-CB 3.26Å; T201-E205 WeakPolarHBondContact O-CB 3.47Å; T201-E205 PolarHBondContact O-N 2.99Å
202L81.7Confident81.3Confident83 Ų8363 Ų6344%0.43532%0.321SS..Hα-helixtrans-63.1-35.4178.2-69.6172.4000112.2V198 F199 N206V198-L202 HydrophobicContact CG1-CD1 4.22Å; V198-L202 VanDerWaalsContact O-CG 3.28Å; V198-L202 WeakPolarHBondContact O-CG 3.29Å; V198-L202 PolarHBondContact O-N 3.09Å; V198-L202 VanDerWaalsContact O-N 3.08Å; F199-L202 PolarHBondContact O-N 3.27Å; L202-N206 VanDerWaalsContact O-CB 3.29Å; L202-N206 WeakPolarHBondContact O-CB 3.47Å; L202-N206 PolarHBondContact O-N 3.19Å; L202-N206 PolarHBondContact O-ND2 3.14Å; L202-N206 VanDerWaalsContact O-ND2 3.17Å
203L83.3Confident81.9Confident7 Ų758.6 Ų58.64%0.03730%0.3CS..Hα-helixtrans-73.1-32.3-179.7-174142.3000112.7L30 F199 F200 T201 W208 L212L30-L203 HydrophobicContact CD1-CD2 3.6Å; L30-L203 HydrophobicContact CD2-CD2 4.02Å; L30-L203 HydrophobicContact CG-CD2 4.38Å; F199-L203 HydrophobicContact CE1-CD1 3.65Å; F199-L203 HydrophobicContact CE2-CD1 4.39Å; F199-L203 HydrophobicContact CZ-CD1 3.56Å; F199-L203 WeakPolarHBondContact O-CB 3.42Å; F199-L203 PolarHBondContact O-N 2.95Å; F200-L203 PolarHBondContact O-N 3.15Å; T201-L203 VanDerWaalsContact C-N 3.27Å; T201-L203 PolarHBondContact O-N 3.43Å; L203-W208 HydrophobicContact CG-CB 4.24Å; L203-W208 PolarHBondContact O-N 2.91Å; L203-L212 HydrophobicContact CD1-CB 4.03Å; L203-L212 HydrophobicContact CD1-CD2 3.83Å; L203-L212 HydrophobicContact CD1-CG 4.39Å
204L82.3Confident82.6Confident1 Ų157.3 Ų57.31%0.00530%0.3CS..Hα-helixtrans-77.8-42.7172.8-70.6175.4000111.7L23 A26 L30 Y77 L80 I84 F200 T201 N206 D207L23-L204 HydrophobicContact CD1-CB 4.15Å; L23-L204 HydrophobicContact CD1-CD1 4.41Å; L23-L204 HydrophobicContact CD1-CD2 3.92Å; L23-L204 HydrophobicContact CD1-CG 4.38Å; A26-L204 HydrophobicContact CB-CD2 3.81Å; L30-L204 HydrophobicContact CD1-CD2 3.81Å; L30-L204 HydrophobicContact CD1-CG 4.36Å; Y77-L204 HydrophobicContact CD1-CB 3.81Å; Y77-L204 HydrophobicContact CD1-CD1 4.5Å; Y77-L204 HydrophobicContact CE1-CB 4.2Å; L80-L204 HydrophobicContact CB-CD1 3.92Å; L80-L204 HydrophobicContact CD1-CD1 4.43Å; I84-L204 HydrophobicContact CD1-CD1 4.06Å; F200-L204 WeakPolarHBondContact O-CB 3.36Å; F200-L204 VanDerWaalsContact O-CG 3.25Å; F200-L204 WeakPolarHBondContact O-CG 3.46Å; F200-L204 PolarHBondContact O-N 3.2Å; T201-L204 PolarHBondContact O-N 3.31Å; L204-N206 PolarHBondContact O-N 3.14Å; L204-D207 PolarHBondContact O-N 3.43Å
205E80.8Confident83.3Confident99 Ų9958 Ų5846%0.46330%0.297SS..Hα-helixtrans-65.5-37.6-179-173175.6-175.300112.3Y77 T201Y77-E205 HydrophobicContact CD2-CB 4.44Å; Y77-E205 HydrophobicContact CE2-CB 4.37Å; Y77-E205 HydrophobicContact CE2-CG 4.32Å; T201-E205 VanDerWaalsContact O-CB 3.26Å; T201-E205 WeakPolarHBondContact O-CB 3.47Å; T201-E205 PolarHBondContact O-N 2.99Å
206N83.1Confident83.7Confident73 Ų7354.8 Ų54.839%0.3928%0.281SS..THydrogen-bonded Turntrans-91.87.2178.8-64.9-39.7000114.1L202 L204 W208L202-N206 VanDerWaalsContact O-CB 3.29Å; L202-N206 WeakPolarHBondContact O-CB 3.47Å; L202-N206 PolarHBondContact O-N 3.19Å; L202-N206 PolarHBondContact O-ND2 3.14Å; L202-N206 VanDerWaalsContact O-ND2 3.17Å; L204-N206 PolarHBondContact O-N 3.14Å; N206-W208 HydrophobicContact CB-CD2 3.84Å; N206-W208 HydrophobicContact CB-CE3 4.49Å; N206-W208 HydrophobicContact CB-CG 3.94Å; N206-W208 HydrophobicContact CB-CZ2 4.2Å; N206-W208 PolarHBondContact O-N 3.5Å; N206-W208 VanDerWaalsContact O-N 3.12Å; N206-W208 PolarHBondContact O-NE1 2.94Å
207D80.8Confident84.2Confident75 Ų7555.4 Ų55.440%0.40128%0.283SS..THydrogen-bonded Turntrans53.729.3-175.6-74.8-40.9000114.8L204 S209L204-D207 PolarHBondContact O-N 3.43Å; D207-S209 PolarHBondContact O-N 3.41Å
208W84Confident84.9Confident142 Ų14260.6 Ų60.654%0.53831%0.31SS..THydrogen-bonded Turntrans-81.22.9-178-69.1-4.7000114.4L203 N206 G210 Y211 L212L203-W208 HydrophobicContact CG-CB 4.24Å; L203-W208 PolarHBondContact O-N 2.91Å; N206-W208 HydrophobicContact CB-CD2 3.84Å; N206-W208 HydrophobicContact CB-CE3 4.49Å; N206-W208 HydrophobicContact CB-CG 3.94Å; N206-W208 HydrophobicContact CB-CZ2 4.2Å; N206-W208 PolarHBondContact O-N 3.5Å; N206-W208 VanDerWaalsContact O-N 3.12Å; N206-W208 PolarHBondContact O-NE1 2.94Å; W208-G210 VanDerWaalsContact C-N 3.26Å; W208-G210 PolarHBondContact O-N 3.38Å; W208-Y211 HydrophobicContact CB-CD2 4.28Å; W208-Y211 HydrophobicContact CG-CD2 4.32Å; W208-Y211 PolarHBondContact O-N 2.87Å; W208-Y211 VanDerWaalsContact O-N 3.11Å; W208-L212 PolarHBondContact O-N 3.3Å
209S82.6Confident85.5Confident11 Ų1161 Ų618%0.07731%0.309CS..Hα-helixtrans-56.6-37.6179.367.80000113.3A26 D207 Y211 L212 L213A26-S209 VanDerWaalsContact CB-OG 3.24Å; A26-S209 WeakPolarHBondContact CB-OG 3.42Å; D207-S209 PolarHBondContact O-N 3.41Å; S209-Y211 PolarHBondContact O-N 2.93Å; S209-L212 PolarHBondContact O-N 3.2Å; S209-L213 WeakPolarHBondContact O-CB 3.46Å; S209-L213 PolarHBondContact O-N 2.9Å
210G85.2Confident85.7Confident19 Ų1956.8 Ų56.820%0.19629%0.292CS..Hα-helixtrans-62.4-40.1176.300000113W208 L213 A214W208-G210 VanDerWaalsContact C-N 3.26Å; W208-G210 PolarHBondContact O-N 3.38Å; G210-L213 PolarHBondContact O-N 3.48Å; G210-A214 WeakPolarHBondContact O-CB 3.39Å; G210-A214 PolarHBondContact O-N 3.32Å
211Y87.5Confident86.1Confident167 Ų16758.5 Ų58.566%0.65531%0.31SS*.Hα-helixtrans-68.1-43.5177.9-63.9-70.5000112W208 S209 L213 A214 I215W208-Y211 HydrophobicContact CB-CD2 4.28Å; W208-Y211 HydrophobicContact CG-CD2 4.32Å; W208-Y211 PolarHBondContact O-N 2.87Å; W208-Y211 VanDerWaalsContact O-N 3.11Å; S209-Y211 PolarHBondContact O-N 2.93Å; Y211-L213 VanDerWaalsContact C-N 3.31Å; Y211-L213 PolarHBondContact O-N 2.72Å; Y211-A214 WeakPolarHBondContact O-CB 3.33Å; Y211-A214 PolarHBondContact O-N 3.09Å; Y211-I215 WeakPolarHBondContact O-CG1 3.38Å; Y211-I215 PolarHBondContact O-N 2.87Å
212L85.9Confident86.8Confident44 Ų4462.8 Ų62.823%0.2333%0.329CS..Hα-helixtrans-60.2-46.2175.3-177.373.4000110.4L30 L203 W208 S209 A214 I215 V216L30-L212 HydrophobicContact CD2-CD2 3.71Å; L203-L212 HydrophobicContact CD1-CB 4.03Å; L203-L212 HydrophobicContact CD1-CD2 3.83Å; L203-L212 HydrophobicContact CD1-CG 4.39Å; W208-L212 PolarHBondContact O-N 3.3Å; S209-L212 PolarHBondContact O-N 3.2Å; L212-A214 VanDerWaalsContact C-N 3.32Å; L212-A214 PolarHBondContact O-N 2.94Å; L212-I215 PolarHBondContact O-N 2.83Å; L212-V216 WeakPolarHBondContact O-CG2 3.35Å; L212-V216 PolarHBondContact O-N 3.18Å
213L88.1Confident87.2Confident10 Ų1061.5 Ų61.55%0.05232%0.322CS..Hα-helixtrans-61.5-41.3178-175.265.5000111.5V33 S209 G210 Y211 I215 V216 C217 A392 V393 W396V33-L213 HydrophobicContact CG2-CD1 4.24Å; S209-L213 WeakPolarHBondContact O-CB 3.46Å; S209-L213 PolarHBondContact O-N 2.9Å; G210-L213 PolarHBondContact O-N 3.48Å; Y211-L213 VanDerWaalsContact C-N 3.31Å; Y211-L213 PolarHBondContact O-N 2.72Å; L213-I215 VanDerWaalsContact C-N 3.35Å; L213-I215 PolarHBondContact O-N 3.18Å; L213-V216 PolarHBondContact O-N 2.67Å; L213-C217 WeakPolarHBondContact O-CB 3.19Å; L213-C217 PolarHBondContact O-N 3.15Å; L213-C217 PolarHBondContact O-SG 3.44Å; L213-A392 HydrophobicContact CD1-CB 3.73Å; L213-V393 HydrophobicContact CD1-CG2 4.04Å; L213-V393 HydrophobicContact CD2-CG2 4.49Å; L213-V393 HydrophobicContact CG-CG2 4.39Å; L213-W396 HydrophobicContact CD2-CB 3.38Å; L213-W396 HydrophobicContact CD2-CD2 4.08Å; L213-W396 HydrophobicContact CD2-CE3 4.44Å; L213-W396 HydrophobicContact CD2-CG 3.62Å
214A90.1Very high87.4Confident49 Ų4962.5 Ų62.541%0.40533%0.327SS..Hα-helixtrans-59.5-44.7175.500000111.6G210 Y211 L212 C217 L218G210-A214 WeakPolarHBondContact O-CB 3.39Å; G210-A214 PolarHBondContact O-N 3.32Å; Y211-A214 WeakPolarHBondContact O-CB 3.33Å; Y211-A214 PolarHBondContact O-N 3.09Å; L212-A214 VanDerWaalsContact C-N 3.32Å; L212-A214 PolarHBondContact O-N 2.94Å; A214-C217 PolarHBondContact O-N 3.02Å; A214-L218 WeakPolarHBondContact O-CB 3.3Å; A214-L218 VanDerWaalsContact O-CG 3.29Å; A214-L218 WeakPolarHBondContact O-CG 3.28Å; A214-L218 PolarHBondContact O-N 3.18Å
215I90.8Very high87.9Confident97 Ų9764.8 Ų64.850%0.49735%0.346SS..Hα-helixtrans-60.9-47.6175.8-66.5165.9000110.7Y211 L212 L213 C217 L218 I219Y211-I215 WeakPolarHBondContact O-CG1 3.38Å; Y211-I215 PolarHBondContact O-N 2.87Å; L212-I215 PolarHBondContact O-N 2.83Å; L213-I215 VanDerWaalsContact C-N 3.35Å; L213-I215 PolarHBondContact O-N 3.18Å; I215-C217 VanDerWaalsContact C-N 3.32Å; I215-C217 PolarHBondContact O-N 3.34Å; I215-L218 PolarHBondContact O-N 3.47Å; I215-I219 HydrophobicContact CG2-CD1 4.06Å; I215-I219 WeakPolarHBondContact O-CG1 2.97Å; I215-I219 PolarHBondContact O-N 3.39Å
216V87.5Confident88.3Confident32 Ų3267.6 Ų67.619%0.19435%0.352CS..Hα-helixtrans-64.1-38.4-179.9179.90000111.2V33 L212 L213 I219 A220 L388V33-V216 HydrophobicContact CG1-CG2 4.3Å; L212-V216 WeakPolarHBondContact O-CG2 3.35Å; L212-V216 PolarHBondContact O-N 3.18Å; L213-V216 PolarHBondContact O-N 2.67Å; V216-I219 PolarHBondContact O-N 3.37Å; V216-A220 PolarHBondContact O-N 3.41Å; V216-L388 HydrophobicContact CG1-CD1 3.46Å; V216-L388 VanDerWaalsContact CG1-CD1 3.46Å; V216-L388 HydrophobicContact CG1-CD2 3.77Å; V216-L388 HydrophobicContact CG1-CG 4.25Å
217C90.4Very high88.4Confident38 Ų3865.4 Ų65.426%0.25734%0.34SS..Hα-helixtrans-65.7-40.7174.9-69.10000112.4L213 A214 I215 I219 A220 A221 V393L213-C217 WeakPolarHBondContact O-CB 3.19Å; L213-C217 PolarHBondContact O-N 3.15Å; L213-C217 PolarHBondContact O-SG 3.44Å; A214-C217 PolarHBondContact O-N 3.02Å; I215-C217 VanDerWaalsContact C-N 3.32Å; I215-C217 PolarHBondContact O-N 3.34Å; C217-I219 VanDerWaalsContact C-N 3.32Å; C217-I219 PolarHBondContact O-N 3.17Å; C217-A220 PolarHBondContact O-N 3.27Å; C217-A221 WeakPolarHBondContact O-CB 3.4Å; C217-A221 PolarHBondContact O-N 2.97Å; C217-V393 WeakPolarHBondContact SG-CG2 3.36Å
218L93Very high88.8Confident123 Ų12362.9 Ų62.964%0.64433%0.326SS*.Hα-helixtrans-61.9-41.2175.2-74.5172.3000111.4A214 I215 A221 Q222A214-L218 WeakPolarHBondContact O-CB 3.3Å; A214-L218 VanDerWaalsContact O-CG 3.29Å; A214-L218 WeakPolarHBondContact O-CG 3.28Å; A214-L218 PolarHBondContact O-N 3.18Å; I215-L218 PolarHBondContact O-N 3.47Å; L218-A221 PolarHBondContact O-N 2.97Å; L218-Q222 VanDerWaalsContact O-CB 3.32Å; L218-Q222 WeakPolarHBondContact O-CB 3.47Å; L218-Q222 PolarHBondContact O-N 3.44Å
219I91.4Very high89Confident86 Ų8662.4 Ų62.444%0.44133%0.333SS..Hα-helixtrans-62.9-46.5174.6-65.8166.4000110.4I215 V216 C217 A221 Q222 I223I215-I219 HydrophobicContact CG2-CD1 4.06Å; I215-I219 WeakPolarHBondContact O-CG1 2.97Å; I215-I219 PolarHBondContact O-N 3.39Å; V216-I219 PolarHBondContact O-N 3.37Å; C217-I219 VanDerWaalsContact C-N 3.32Å; C217-I219 PolarHBondContact O-N 3.17Å; I219-A221 PolarHBondContact O-N 3.38Å; I219-Q222 WeakPolarHBondContact O-CB 3.29Å; I219-Q222 PolarHBondContact O-N 2.92Å; I219-I223 HydrophobicContact CG2-CD1 3.99Å; I219-I223 VanDerWaalsContact O-CG1 3.29Å; I219-I223 WeakPolarHBondContact O-CG1 3.39Å; I219-I223 PolarHBondContact O-N 3.12Å
220A89Confident89.3Confident11 Ų1169.3 Ų69.39%0.09136%0.362CS..Hα-helixtrans-61.6-44177.800000112.3V216 C217 Q222 I223 I224 I385 L388V216-A220 PolarHBondContact O-N 3.41Å; C217-A220 PolarHBondContact O-N 3.27Å; A220-Q222 VanDerWaalsContact C-N 3.34Å; A220-Q222 PolarHBondContact O-N 3.4Å; A220-I223 PolarHBondContact O-N 3.4Å; A220-I224 PolarHBondContact O-N 3.43Å; A220-I385 HydrophobicContact CB-CD1 4.48Å; A220-I385 HydrophobicContact CB-CG1 4.16Å; A220-I385 HydrophobicContact CB-CG2 4.03Å; A220-L388 HydrophobicContact CB-CD2 3.63Å
221A91.8Very high89.3Confident54 Ų5472 Ų7245%0.44637%0.368SS..Hα-helixtrans-62.5-40.8175.400000111.6C217 L218 I219 I223 I224 A225C217-A221 WeakPolarHBondContact O-CB 3.4Å; C217-A221 PolarHBondContact O-N 2.97Å; L218-A221 PolarHBondContact O-N 2.97Å; I219-A221 PolarHBondContact O-N 3.38Å; A221-I223 VanDerWaalsContact C-N 3.34Å; A221-I223 PolarHBondContact O-N 3.13Å; A221-I224 PolarHBondContact O-N 2.76Å; A221-A225 WeakPolarHBondContact O-CB 3.27Å; A221-A225 PolarHBondContact O-N 3.41Å
222Q92.9Very high89Confident97 Ų9768 Ų6845%0.45336%0.363SS..Hα-helixtrans-63.5-39.4175.1-170.3-177.32800111.8L218 I219 A220 A225 R226L218-Q222 VanDerWaalsContact O-CB 3.32Å; L218-Q222 WeakPolarHBondContact O-CB 3.47Å; L218-Q222 PolarHBondContact O-N 3.44Å; I219-Q222 WeakPolarHBondContact O-CB 3.29Å; I219-Q222 PolarHBondContact O-N 2.92Å; A220-Q222 VanDerWaalsContact C-N 3.34Å; A220-Q222 PolarHBondContact O-N 3.4Å; Q222-A225 PolarHBondContact O-N 2.94Å; Q222-R226 WeakPolarHBondContact O-CB 3.32Å; Q222-R226 VanDerWaalsContact O-CG 3.28Å; Q222-R226 WeakPolarHBondContact O-CG 3Å; Q222-R226 PolarHBondContact O-N 3.13Å
223I90.2Very high89Confident57 Ų5774 Ų7429%0.29239%0.39SS..Hα-helixtrans-62.9-47.8175.5-68.4165.2000110.2I219 A220 A221 A225 R226 M227 V381 I385I219-I223 HydrophobicContact CG2-CD1 3.99Å; I219-I223 VanDerWaalsContact O-CG1 3.29Å; I219-I223 WeakPolarHBondContact O-CG1 3.39Å; I219-I223 PolarHBondContact O-N 3.12Å; A220-I223 PolarHBondContact O-N 3.4Å; A221-I223 VanDerWaalsContact C-N 3.34Å; A221-I223 PolarHBondContact O-N 3.13Å; I223-A225 PolarHBondContact O-N 3.48Å; I223-R226 PolarHBondContact O-N 3.32Å; I223-M227 HydrophobicContact CG2-CE 3.8Å; I223-M227 HydrophobicContact CG2-SD 4.1Å; I223-M227 VanDerWaalsContact O-CG 3.25Å; I223-M227 WeakPolarHBondContact O-CG 3.22Å; I223-M227 PolarHBondContact O-N 2.96Å; I223-V381 HydrophobicContact CG2-CG1 3.79Å; I223-I385 HydrophobicContact CB-CD1 4.24Å; I223-I385 HydrophobicContact CG2-CD1 3.95Å
224I89.1Confident88.7Confident27 Ų2777 Ų7714%0.13840%0.403CS..Hα-helixtrans-60.1-47.1176.5-70.1171.8000110.7A220 A221 R226 M227 M228 V242 M245 I385A220-I224 PolarHBondContact O-N 3.43Å; A221-I224 PolarHBondContact O-N 2.76Å; I224-R226 PolarHBondContact O-N 2.95Å; I224-M227 WeakPolarHBondContact O-CB 3.27Å; I224-M227 PolarHBondContact O-N 2.9Å; I224-M227 VanDerWaalsContact O-N 3.11Å; I224-M228 HydrophobicContact CG2-CG 4.33Å; I224-M228 HydrophobicContact CG2-SD 4.35Å; I224-M228 WeakPolarHBondContact O-CG 3.2Å; I224-M228 PolarHBondContact O-N 2.99Å; I224-V242 HydrophobicContact CD1-CG2 4.36Å; I224-V242 HydrophobicContact CG2-CG2 3.9Å; I224-M245 HydrophobicContact CD1-SD 4.45Å; I224-I385 HydrophobicContact CD1-CD1 4.24Å; I224-I385 HydrophobicContact CD1-CG2 3.74Å; I224-I385 HydrophobicContact CG1-CD1 3.83Å
225A90.9Very high88.5Confident49 Ų4981 Ų8141%0.40541%0.408SS..Hα-helixtrans-60.2-44.5179.700000111.9A221 Q222 I223 M227 M228 I229A221-A225 WeakPolarHBondContact O-CB 3.27Å; A221-A225 PolarHBondContact O-N 3.41Å; Q222-A225 PolarHBondContact O-N 2.94Å; I223-A225 PolarHBondContact O-N 3.48Å; A225-M227 VanDerWaalsContact C-N 3.31Å; A225-M227 PolarHBondContact O-N 3.4Å; A225-M228 PolarHBondContact O-N 3.42Å; A225-I229 WeakPolarHBondContact O-CG1 3.49Å; A225-I229 PolarHBondContact O-N 3.21Å; A225-I229 VanDerWaalsContact O-N 3.12Å
226R90.8Very high88.2Confident158 Ų15886.5 Ų86.560%0.59642%0.422SS*.Hα-helixtrans-61.2-40174.4-75.3176.8179.4175.51.5111.9Q222 I223 I224 I229 K230Q222-R226 WeakPolarHBondContact O-CB 3.32Å; Q222-R226 VanDerWaalsContact O-CG 3.28Å; Q222-R226 WeakPolarHBondContact O-CG 3Å; Q222-R226 PolarHBondContact O-N 3.13Å; I223-R226 PolarHBondContact O-N 3.32Å; I224-R226 PolarHBondContact O-N 2.95Å; R226-I229 PolarHBondContact O-N 2.97Å; R226-K230 VanDerWaalsContact O-CB 3.3Å; R226-K230 WeakPolarHBondContact O-CB 3.42Å; R226-K230 PolarHBondContact O-N 3.45Å
227M85.3Confident88Confident27 Ų2786.4 Ų86.413%0.13343%0.425CS..Hα-helixtrans-64.2-41.4175.4-72.6179169.700112.2I223 I224 A225 I229 K230 F231 L238 M378 V381 L382I223-M227 HydrophobicContact CG2-CE 3.8Å; I223-M227 HydrophobicContact CG2-SD 4.1Å; I223-M227 VanDerWaalsContact O-CG 3.25Å; I223-M227 WeakPolarHBondContact O-CG 3.22Å; I223-M227 PolarHBondContact O-N 2.96Å; I224-M227 WeakPolarHBondContact O-CB 3.27Å; I224-M227 PolarHBondContact O-N 2.9Å; I224-M227 VanDerWaalsContact O-N 3.11Å; A225-M227 VanDerWaalsContact C-N 3.31Å; A225-M227 PolarHBondContact O-N 3.4Å; M227-I229 VanDerWaalsContact C-N 3.27Å; M227-I229 PolarHBondContact O-N 3.39Å; M227-K230 PolarHBondContact O-N 3.46Å; M227-F231 PolarHBondContact O-N 3.08Å; M227-L238 HydrophobicContact CB-CD1 4.44Å; M227-M378 HydrophobicContact CB-CE 3.73Å; M227-M378 HydrophobicContact CE-CE 3.82Å; M227-M378 HydrophobicContact CG-CE 3.41Å; M227-M378 VanDerWaalsContact CG-CE 3.41Å; M227-M378 HydrophobicContact SD-CE 3.38Å; M227-M378 WeakPolarHBondContact SD-CE 3.44Å; M227-V381 HydrophobicContact CE-CB 3.83Å; M227-V381 HydrophobicContact CE-CG1 3.54Å; M227-V381 HydrophobicContact CE-CG2 4.23Å; M227-L382 HydrophobicContact SD-CD2 4.4Å
228M87.4Confident87.9Confident23 Ų2384.8 Ų84.811%0.11341%0.413CS..Hα-helixtrans-65.5-28.3177.8-72.1-168.1125.700113.9I224 A225 R235 L238 W239I224-M228 HydrophobicContact CG2-CG 4.33Å; I224-M228 HydrophobicContact CG2-SD 4.35Å; I224-M228 WeakPolarHBondContact O-CG 3.2Å; I224-M228 PolarHBondContact O-N 2.99Å; A225-M228 PolarHBondContact O-N 3.42Å; M228-R235 HydrophobicContact CE-CG 4.48Å; M228-L238 HydrophobicContact CE-CB 4.14Å; M228-L238 HydrophobicContact CG-CD1 4.22Å; M228-W239 HydrophobicContact CE-CB 4.33Å; M228-W239 VanDerWaalsContact CE-CD1 3.43Å; M228-W239 HydrophobicContact CE-CD2 3.49Å; M228-W239 VanDerWaalsContact CE-CD2 3.49Å; M228-W239 VanDerWaalsContact CE-CE2 3.4Å; M228-W239 HydrophobicContact CE-CE3 4.22Å; M228-W239 HydrophobicContact CE-CG 3.51Å; M228-W239 HydrophobicContact CE-CZ2 4.06Å; M228-W239 HydrophobicContact SD-CZ2 4.38Å
229I89.4Confident87.6Confident132 Ų13286.1 Ų86.168%0.67741%0.41SS*.Hα-helixtrans-80.9-44.4175.1-64.4166.7000110.3A225 R226 M227A225-I229 WeakPolarHBondContact O-CG1 3.49Å; A225-I229 PolarHBondContact O-N 3.21Å; A225-I229 VanDerWaalsContact O-N 3.12Å; R226-I229 PolarHBondContact O-N 2.97Å; M227-I229 VanDerWaalsContact C-N 3.27Å; M227-I229 PolarHBondContact O-N 3.39Å
230K88.4Confident87.3Confident156 Ų15686.4 Ų86.468%0.67841%0.409SS*.Hα-helixtrans-71.9-29.9-174.4-170.7172-178.6177.70113.7R226 M227 P232R226-K230 VanDerWaalsContact O-CB 3.3Å; R226-K230 WeakPolarHBondContact O-CB 3.42Å; R226-K230 PolarHBondContact O-N 3.45Å; M227-K230 PolarHBondContact O-N 3.46Å; K230-P232 WeakPolarHBondContact O-CD 3.21Å
231F84.9Confident87.2Confident75 Ų7586.2 Ų86.233%0.32941%0.407SS..  trans-124.674.7-175-58.7-74.4000111.8M227 E233 H234 M378M227-F231 PolarHBondContact O-N 3.08Å; F231-E233 VanDerWaalsContact C-N 3.27Å; F231-E233 PolarHBondContact O-N 3.26Å; F231-H234 HydrophobicContact CB-CB 4.45Å; F231-H234 PolarHBondContact O-N 3.34Å; F231-M378 HydrophobicContact CD2-CE 3.59Å; F231-M378 HydrophobicContact CD2-SD 3.82Å; F231-M378 HydrophobicContact CE2-CE 3.7Å; F231-M378 HydrophobicContact CE2-SD 3.83Å; F231-M378 HydrophobicContact CG-SD 4.34Å; F231-M378 HydrophobicContact CZ-SD 4.38Å
232P82.6Confident87.1Confident84 Ų8485.6 Ų85.655%0.54540%0.398SS..G310 helixtrans-61.3-34.7-178.224.3-33.5000112.9K230 H234 R235K230-P232 WeakPolarHBondContact O-CD 3.21Å; P232-H234 PolarHBondContact O-N 3.35Å; P232-R235 WeakPolarHBondContact O-CB 3.46Å; P232-R235 PolarHBondContact O-N 3.2Å; P232-R235 VanDerWaalsContact O-N 3.09Å
233E84.7Confident86.9Confident170 Ų17085 Ų8579%0.79440%0.397SS*.G310 helixtrans-55.7-32.4176.9-56-58.7152.500113.1F231F231-E233 VanDerWaalsContact C-N 3.27Å; F231-E233 PolarHBondContact O-N 3.26Å
234H82.7Confident86.8Confident73 Ų7382.5 Ų82.534%0.33838%0.384SS..G310 helixtrans-98.93.6-177-61.8-45.5000113.4F231 P232 R236 A237 L238F231-H234 HydrophobicContact CB-CB 4.45Å; F231-H234 PolarHBondContact O-N 3.34Å; P232-H234 PolarHBondContact O-N 3.35Å; H234-R236 VanDerWaalsContact C-N 3.34Å; H234-R236 PolarHBondContact O-N 2.88Å; H234-A237 PolarHBondContact O-N 3.27Å; H234-A237 VanDerWaalsContact O-N 3.15Å; H234-L238 HydrophobicContact CB-CD1 4.47Å; H234-L238 WeakPolarHBondContact O-CG 3.29Å; H234-L238 PolarHBondContact O-N 2.85Å
235R85.3Confident86.9Confident133 Ų13381.7 Ų81.750%0.50238%0.38SS..Hα-helixtrans-58.7-40.3-171.6-169.3-177.7-124.8-165.2-0.5113.5M228 P232 L238 W239M228-R235 HydrophobicContact CE-CG 4.48Å; P232-R235 WeakPolarHBondContact O-CB 3.46Å; P232-R235 PolarHBondContact O-N 3.2Å; P232-R235 VanDerWaalsContact O-N 3.09Å; R235-L238 PolarHBondContact O-N 2.87Å; R235-W239 PolarHBondContact O-N 3.11Å
236R84.8Confident86.9Confident212 Ų21285.5 Ų85.580%0.839%0.388SS*.Hα-helixtrans-65.3-44.2178-68-176.8-178.9175.81111.8H234 W239 Q240H234-R236 VanDerWaalsContact C-N 3.34Å; H234-R236 PolarHBondContact O-N 2.88Å; R236-W239 PolarHBondContact O-N 3.25Å; R236-Q240 WeakPolarHBondContact O-CG 3.25Å; R236-Q240 PolarHBondContact O-N 3.34Å; R236-Q240 VanDerWaalsContact O-N 3.13Å
237A84.2Confident86.9Confident30 Ų3078.5 Ų78.525%0.24836%0.363CS..Hα-helixtrans-66.8-40.3177.400000111.6H234 Q240 I241 L376H234-A237 PolarHBondContact O-N 3.27Å; H234-A237 VanDerWaalsContact O-N 3.15Å; A237-Q240 WeakPolarHBondContact O-CB 3.36Å; A237-Q240 PolarHBondContact O-N 2.83Å; A237-I241 WeakPolarHBondContact O-CG1 3.49Å; A237-I241 PolarHBondContact O-N 3.01Å; A237-L376 HydrophobicContact CB-CD1 4.49Å; A237-L376 HydrophobicContact CB-CD2 4.1Å
238L86.5Confident87.3Confident3 Ų377.2 Ų77.22%0.01636%0.356CS..Hα-helixtrans-61.9-43.6174.5-74.3172.7000111.8M227 M228 H234 R235 Q240 I241 V242 L376 L382M227-L238 HydrophobicContact CB-CD1 4.44Å; M228-L238 HydrophobicContact CE-CB 4.14Å; M228-L238 HydrophobicContact CG-CD1 4.22Å; H234-L238 HydrophobicContact CB-CD1 4.47Å; H234-L238 WeakPolarHBondContact O-CG 3.29Å; H234-L238 PolarHBondContact O-N 2.85Å; R235-L238 PolarHBondContact O-N 2.87Å; L238-Q240 VanDerWaalsContact C-N 3.3Å; L238-Q240 PolarHBondContact O-N 3.26Å; L238-I241 PolarHBondContact O-N 3.22Å; L238-V242 WeakPolarHBondContact O-CG2 3.28Å; L238-V242 PolarHBondContact O-N 3.44Å; L238-L376 HydrophobicContact CD2-CD1 3.96Å; L238-L376 HydrophobicContact CG-CD1 4.46Å; L238-L382 HydrophobicContact CD2-CD1 3.95Å; L238-L382 HydrophobicContact CD2-CD2 4.03Å
239W87.5Confident87.6Confident151 Ų15176.8 Ų76.857%0.57236%0.355SS*.Hα-helixtrans-59.4-41174.5-91.4120.5000112.6M228 R235 R236 V242 L243M228-W239 HydrophobicContact CE-CB 4.33Å; M228-W239 VanDerWaalsContact CE-CD1 3.43Å; M228-W239 HydrophobicContact CE-CD2 3.49Å; M228-W239 VanDerWaalsContact CE-CD2 3.49Å; M228-W239 VanDerWaalsContact CE-CE2 3.4Å; M228-W239 HydrophobicContact CE-CE3 4.22Å; M228-W239 HydrophobicContact CE-CG 3.51Å; M228-W239 HydrophobicContact CE-CZ2 4.06Å; M228-W239 HydrophobicContact SD-CZ2 4.38Å; R235-W239 PolarHBondContact O-N 3.11Å; R236-W239 PolarHBondContact O-N 3.25Å; W239-V242 HydrophobicContact CZ3-CG1 4.46Å; W239-V242 PolarHBondContact O-N 2.9Å; W239-L243 WeakPolarHBondContact O-CB 3.36Å; W239-L243 PolarHBondContact O-N 3.43Å
240Q85.4Confident87.7Confident92 Ų9273.3 Ų73.343%0.4334%0.337SS..Hα-helixtrans-63-42.2175.4-70.7173.4-12.900111.8R236 A237 L238 L243 L244R236-Q240 WeakPolarHBondContact O-CG 3.25Å; R236-Q240 PolarHBondContact O-N 3.34Å; R236-Q240 VanDerWaalsContact O-N 3.13Å; A237-Q240 WeakPolarHBondContact O-CB 3.36Å; A237-Q240 PolarHBondContact O-N 2.83Å; L238-Q240 VanDerWaalsContact C-N 3.3Å; L238-Q240 PolarHBondContact O-N 3.26Å; Q240-L243 PolarHBondContact O-N 2.97Å; Q240-L244 VanDerWaalsContact O-CB 3.31Å; Q240-L244 WeakPolarHBondContact O-CB 3.17Å; Q240-L244 PolarHBondContact O-N 3.46Å
241I86.5Confident88Confident8 Ų865.9 Ų65.94%0.04131%0.305CS..Hα-helixtrans-65.8-41.8176.9-71.6168.7000111.4A237 L238 L243 L244 M245 I373 L376 L382A237-I241 WeakPolarHBondContact O-CG1 3.49Å; A237-I241 PolarHBondContact O-N 3.01Å; L238-I241 PolarHBondContact O-N 3.22Å; I241-L243 VanDerWaalsContact C-N 3.31Å; I241-L243 PolarHBondContact O-N 3.04Å; I241-L244 CarbonylContact O-C 3.49Å; I241-L244 WeakPolarHBondContact O-CB 3.36Å; I241-L244 PolarHBondContact O-N 3.4Å; I241-M245 HydrophobicContact CG2-CE 3.47Å; I241-M245 VanDerWaalsContact CG2-CE 3.47Å; I241-M245 HydrophobicContact CG2-CG 4.31Å; I241-M245 HydrophobicContact CG2-SD 3.89Å; I241-M245 WeakPolarHBondContact O-CB 3.35Å; I241-M245 VanDerWaalsContact O-CG 3.28Å; I241-M245 WeakPolarHBondContact O-CG 3.37Å; I241-M245 PolarHBondContact O-N 3.45Å; I241-I373 HydrophobicContact CG1-CG1 4.4Å; I241-I373 HydrophobicContact CG2-CD1 4.5Å; I241-I373 HydrophobicContact CG2-CG1 3.82Å; I241-L376 HydrophobicContact CD1-CD1 3.23Å; I241-L376 HydrophobicContact CD1-CG 3.88Å; I241-L382 HydrophobicContact CD1-CD1 4.15Å
242V89.8Confident88.5Confident41 Ų4163.2 Ų63.225%0.24829%0.293CS..Hα-helixtrans-62.2-41.5176.2170.20000110.7I224 L238 W239 M245 F246I224-V242 HydrophobicContact CD1-CG2 4.36Å; I224-V242 HydrophobicContact CG2-CG2 3.9Å; L238-V242 WeakPolarHBondContact O-CG2 3.28Å; L238-V242 PolarHBondContact O-N 3.44Å; W239-V242 HydrophobicContact CZ3-CG1 4.46Å; W239-V242 PolarHBondContact O-N 2.9Å; V242-M245 WeakPolarHBondContact O-CB 3.4Å; V242-M245 PolarHBondContact O-N 2.91Å; V242-F246 PolarHBondContact O-N 3.29Å
243L89Confident89.1Confident84 Ų8459.8 Ų59.844%0.4427%0.27SS..Hα-helixtrans-66.6-40.4176.4-156.6147.4000111.2W239 Q240 I241 F246 V247 W316W239-L243 WeakPolarHBondContact O-CB 3.36Å; W239-L243 PolarHBondContact O-N 3.43Å; Q240-L243 PolarHBondContact O-N 2.97Å; I241-L243 VanDerWaalsContact C-N 3.31Å; I241-L243 PolarHBondContact O-N 3.04Å; L243-F246 PolarHBondContact O-N 2.85Å; L243-V247 HydrophobicContact CD2-CG2 4.08Å; L243-V247 WeakPolarHBondContact O-CG2 3.42Å; L243-V247 PolarHBondContact O-N 3.24Å; L243-W316 HydrophobicContact CB-CH2 4.38Å; L243-W316 HydrophobicContact CD2-CH2 3.14Å; L243-W316 HydrophobicContact CD2-CZ2 3.89Å; L243-W316 HydrophobicContact CD2-CZ3 3.74Å; L243-W316 HydrophobicContact CG-CH2 4.31Å
244L87.6Confident89.6Confident4 Ų452.4 Ų52.42%0.02124%0.236CC..Hα-helixtrans-64-40.6174.5-165.277.2000112.4Q240 I241 V247 G248 V315 W316 F319 A369 Q372Q240-L244 VanDerWaalsContact O-CB 3.31Å; Q240-L244 WeakPolarHBondContact O-CB 3.17Å; Q240-L244 PolarHBondContact O-N 3.46Å; I241-L244 CarbonylContact O-C 3.49Å; I241-L244 WeakPolarHBondContact O-CB 3.36Å; I241-L244 PolarHBondContact O-N 3.4Å; L244-V247 PolarHBondContact O-N 2.93Å; L244-G248 PolarHBondContact O-N 3.37Å; L244-V315 HydrophobicContact CD1-CG1 4.31Å; L244-W316 HydrophobicContact CD1-CH2 4.35Å; L244-F319 HydrophobicContact CD1-CD2 3.73Å; L244-F319 HydrophobicContact CD1-CE1 4.38Å; L244-F319 HydrophobicContact CD1-CE2 3.54Å; L244-F319 HydrophobicContact CD1-CG 4.21Å; L244-F319 HydrophobicContact CD1-CZ 3.86Å; L244-F319 HydrophobicContact CG-CE2 4.06Å; L244-F319 HydrophobicContact CG-CZ 4.13Å; L244-A369 HydrophobicContact CD2-CB 3.92Å; L244-A369 HydrophobicContact CG-CB 4.26Å; L244-Q372 HydrophobicContact CD2-CB 3.98Å; L244-Q372 HydrophobicContact CD2-CG 4.21Å
245M91.2Very high90.1Very high11 Ų1149.6 Ų49.65%0.05423%0.225CC..Hα-helixtrans-59.2-47.8173-79.7165.1176.300110.3I224 I241 V242 G248 T249 I373 L382 I385 Y386I224-M245 HydrophobicContact CD1-SD 4.45Å; I241-M245 HydrophobicContact CG2-CE 3.47Å; I241-M245 VanDerWaalsContact CG2-CE 3.47Å; I241-M245 HydrophobicContact CG2-CG 4.31Å; I241-M245 HydrophobicContact CG2-SD 3.89Å; I241-M245 WeakPolarHBondContact O-CB 3.35Å; I241-M245 VanDerWaalsContact O-CG 3.28Å; I241-M245 WeakPolarHBondContact O-CG 3.37Å; I241-M245 PolarHBondContact O-N 3.45Å; V242-M245 WeakPolarHBondContact O-CB 3.4Å; V242-M245 PolarHBondContact O-N 2.91Å; M245-G248 PolarHBondContact O-N 2.94Å; M245-T249 WeakPolarHBondContact O-CB 3.33Å; M245-T249 PolarHBondContact O-N 3.4Å; M245-T249 PolarHBondContact O-OG1 2.87Å; M245-T249 VanDerWaalsContact O-OG1 3.11Å; M245-I373 HydrophobicContact CE-CD1 4.26Å; M245-L382 HydrophobicContact CE-CB 4.3Å; M245-L382 HydrophobicContact CE-CD2 4.36Å; M245-L382 WeakPolarHBondContact CE-O 3.46Å; M245-I385 HydrophobicContact CE-CB 4.49Å; M245-I385 HydrophobicContact SD-CG2 4.48Å; M245-Y386 HydrophobicContact CB-CD2 4.46Å; M245-Y386 HydrophobicContact CG-CD2 3.74Å
246F91.8Very high90.5Very high128 Ų12843.5 Ų43.556%0.56120%0.202SC*.Hα-helixtrans-60.3-49.7178.8176.8-101.2000112V242 L243 G248 T249 L250V242-F246 PolarHBondContact O-N 3.29Å; L243-F246 PolarHBondContact O-N 2.85Å; F246-G248 VanDerWaalsContact C-N 3.33Å; F246-G248 PolarHBondContact O-N 3.41Å; F246-T249 WeakPolarHBondContact O-CB 3.31Å; F246-T249 PolarHBondContact O-N 3Å; F246-L250 HydrophobicContact CD1-CD1 4.14Å; F246-L250 HydrophobicContact CE1-CD1 3.56Å; F246-L250 HydrophobicContact CE1-CG 4.29Å; F246-L250 HydrophobicContact CZ-CD1 3.93Å; F246-L250 HydrophobicContact CZ-CG 4.33Å; F246-L250 PolarHBondContact O-N 3.25Å
247V91Very high90.8Very high12 Ų1233.4 Ų33.47%0.07316%0.164CC..Hα-helixtrans-66.2-37.5178.5-176.30000111.3L243 L244 L250 F251 F319 L323 I436L243-V247 HydrophobicContact CD2-CG2 4.08Å; L243-V247 WeakPolarHBondContact O-CG2 3.42Å; L243-V247 PolarHBondContact O-N 3.24Å; L244-V247 PolarHBondContact O-N 2.93Å; V247-L250 WeakPolarHBondContact O-CB 3.42Å; V247-L250 PolarHBondContact O-N 2.92Å; V247-F251 PolarHBondContact O-N 3.44Å; V247-F319 HydrophobicContact CB-CD1 4.2Å; V247-F319 HydrophobicContact CB-CE1 3.81Å; V247-F319 HydrophobicContact CG1-CD1 3.55Å; V247-F319 HydrophobicContact CG1-CE1 3.52Å; V247-L323 HydrophobicContact CG1-CD1 3.61Å; V247-I436 HydrophobicContact CG1-CD1 3.81Å; V247-I436 HydrophobicContact CG2-CD1 4.43Å
248G92.3Very high91Very high0 Ų032.3 Ų32.30%016%0.156CC..Hα-helixtrans-63.3-40174.200000112.3L244 M245 F246 F251 W252L244-G248 PolarHBondContact O-N 3.37Å; M245-G248 PolarHBondContact O-N 2.94Å; F246-G248 VanDerWaalsContact C-N 3.33Å; F246-G248 PolarHBondContact O-N 3.41Å; G248-F251 PolarHBondContact O-N 3.12Å; G248-W252 PolarHBondContact O-N 3.16Å
249T93.7Very high91Very high13 Ų1332.1 Ų32.18%0.0816%0.155CC..Hα-helixtrans-61.4-45.5172.2-67.40000110.8M245 F246 F251 W252 V253 A389 V393 A394 L397M245-T249 WeakPolarHBondContact O-CB 3.33Å; M245-T249 PolarHBondContact O-N 3.4Å; M245-T249 PolarHBondContact O-OG1 2.87Å; M245-T249 VanDerWaalsContact O-OG1 3.11Å; F246-T249 WeakPolarHBondContact O-CB 3.31Å; F246-T249 PolarHBondContact O-N 3Å; T249-F251 VanDerWaalsContact C-N 3.34Å; T249-F251 PolarHBondContact O-N 3.37Å; T249-W252 CarbonylContact O-C 3.58Å; T249-W252 PolarHBondContact O-N 2.99Å; T249-W252 VanDerWaalsContact O-N 3.14Å; T249-V253 HydrophobicContact CG2-CG2 4.34Å; T249-V253 VanDerWaalsContact O-CG2 3.31Å; T249-V253 WeakPolarHBondContact O-CG2 3.45Å; T249-V253 PolarHBondContact O-N 2.63Å; T249-A389 WeakPolarHBondContact CG2-O 3.24Å; T249-A389 WeakPolarHBondContact OG1-CB 3.28Å; T249-A389 PolarHBondContact OG1-O 3.43Å; T249-V393 HydrophobicContact CG2-CG1 4.4Å; T249-A394 HydrophobicContact CG2-CB 4.2Å; T249-L397 HydrophobicContact CG2-CD1 4.29Å
250L92.7Very high91.1Very high59 Ų5925 Ų2531%0.30913%0.129SC..Hα-helixtrans-58.7-44.8176.3-70176.2000112.2F246 V247 W252 V253 L254F246-L250 HydrophobicContact CD1-CD1 4.14Å; F246-L250 HydrophobicContact CE1-CD1 3.56Å; F246-L250 HydrophobicContact CE1-CG 4.29Å; F246-L250 HydrophobicContact CZ-CD1 3.93Å; F246-L250 HydrophobicContact CZ-CG 4.33Å; F246-L250 PolarHBondContact O-N 3.25Å; V247-L250 WeakPolarHBondContact O-CB 3.42Å; V247-L250 PolarHBondContact O-N 2.92Å; L250-W252 VanDerWaalsContact C-N 3.31Å; L250-W252 PolarHBondContact O-N 3.03Å; L250-V253 WeakPolarHBondContact O-CB 3.27Å; L250-V253 PolarHBondContact O-N 3.03Å; L250-L254 WeakPolarHBondContact O-CG 3.26Å; L250-L254 PolarHBondContact O-N 3.39Å
251F94.8Very high91.4Very high0 Ų020.7 Ų20.70%011%0.108CC..Hα-helixtrans-56.7-46.8174.1172.4-93.1000111.6V247 G248 T249 L254 A255 L323 M326 A361 E362 I365V247-F251 PolarHBondContact O-N 3.44Å; G248-F251 PolarHBondContact O-N 3.12Å; T249-F251 VanDerWaalsContact C-N 3.34Å; T249-F251 PolarHBondContact O-N 3.37Å; F251-L254 WeakPolarHBondContact O-CB 3.42Å; F251-L254 PolarHBondContact O-N 3.14Å; F251-A255 HydrophobicContact CE1-CB 4.08Å; F251-A255 HydrophobicContact CZ-CB 4.36Å; F251-A255 WeakPolarHBondContact O-CB 3.49Å; F251-A255 PolarHBondContact O-N 2.8Å; F251-L323 HydrophobicContact CB-CD2 4.03Å; F251-L323 HydrophobicContact CD2-CD2 4.17Å; F251-M326 HydrophobicContact CD2-CB 4.23Å; F251-M326 HydrophobicContact CD2-CE 3.94Å; F251-M326 HydrophobicContact CD2-CG 4.3Å; F251-M326 HydrophobicContact CE1-CE 4.33Å; F251-M326 HydrophobicContact CE2-CB 4Å; F251-M326 HydrophobicContact CE2-CE 3.22Å; F251-M326 HydrophobicContact CE2-CG 4.23Å; F251-M326 HydrophobicContact CZ-CE 3.44Å; F251-M326 VanDerWaalsContact CZ-CE 3.44Å; F251-A361 HydrophobicContact CE2-CB 3.64Å; F251-A361 HydrophobicContact CZ-CB 4.04Å; F251-E362 HydrophobicContact CE1-CB 4.33Å; F251-E362 HydrophobicContact CE1-CG 4.38Å; F251-E362 VanDerWaalsContact CZ-CA 3.47Å; F251-E362 HydrophobicContact CZ-CB 4.11Å; F251-I365 HydrophobicContact CB-CG1 4.47Å; F251-I365 HydrophobicContact CB-CG2 4.19Å; F251-I365 HydrophobicContact CD1-CB 4.1Å; F251-I365 HydrophobicContact CD1-CG1 4.02Å; F251-I365 HydrophobicContact CD1-CG2 3.78Å; F251-I365 HydrophobicContact CD2-CD1 4.24Å; F251-I365 HydrophobicContact CD2-CG1 3.69Å; F251-I365 HydrophobicContact CE1-CB 4.29Å; F251-I365 HydrophobicContact CE1-CG1 4.2Å; F251-I365 HydrophobicContact CE1-CG2 4.41Å; F251-I365 HydrophobicContact CE2-CG1 3.86Å; F251-I365 HydrophobicContact CG-CB 4.29Å; F251-I365 HydrophobicContact CG-CD1 4.38Å; F251-I365 HydrophobicContact CG-CG1 3.77Å; F251-I365 HydrophobicContact CG-CG2 3.97Å; F251-I365 HydrophobicContact CZ-CG1 4.14Å
252W94.5Very high91.7Very high20 Ų2020.3 Ų20.38%0.07611%0.106CC..Hα-helixtrans-69.6-33.2-179.9-84.3105.4000112.7G248 T249 L250 L254 A255 Q256 E362 D366 T390 A394G248-W252 PolarHBondContact O-N 3.16Å; T249-W252 CarbonylContact O-C 3.58Å; T249-W252 PolarHBondContact O-N 2.99Å; T249-W252 VanDerWaalsContact O-N 3.14Å; L250-W252 VanDerWaalsContact C-N 3.31Å; L250-W252 PolarHBondContact O-N 3.03Å; W252-L254 PolarHBondContact O-N 3.28Å; W252-A255 HydrophobicContact CE3-CB 3.94Å; W252-A255 HydrophobicContact CZ3-CB 4.29Å; W252-A255 PolarHBondContact O-N 3.3Å; W252-Q256 HydrophobicContact CE3-CG 4.27Å; W252-Q256 VanDerWaalsContact CZ3-NE2 3.34Å; W252-Q256 VanDerWaalsContact O-CB 3.31Å; W252-Q256 WeakPolarHBondContact O-CB 3.12Å; W252-Q256 WeakPolarHBondContact O-CG 3.46Å; W252-Q256 PolarHBondContact O-N 3.04Å; W252-E362 HydrophobicContact CH2-CG 4.02Å; W252-E362 HydrophobicContact CZ2-CG 4Å; W252-D366 WeakPolarHBondContact CZ2-OD2 3.47Å; W252-D366 PolarHBondContact NE1-OD1 3.39Å; W252-D366 PolarHBondContact NE1-OD2 3.24Å; W252-T390 VanDerWaalsContact CB-O 3.3Å; W252-T390 WeakPolarHBondContact CB-O 3.37Å; W252-A394 HydrophobicContact CB-CB 3.57Å
253V95.4Very high91.8Very high12 Ų1218.3 Ų18.37%0.0739%0.094CC..Hα-helixtrans-55.6-41.6172169.20000110.8T249 L250 Q257 A394 L397 A398 V401T249-V253 HydrophobicContact CG2-CG2 4.34Å; T249-V253 VanDerWaalsContact O-CG2 3.31Å; T249-V253 WeakPolarHBondContact O-CG2 3.45Å; T249-V253 PolarHBondContact O-N 2.63Å; L250-V253 WeakPolarHBondContact O-CB 3.27Å; L250-V253 PolarHBondContact O-N 3.03Å; V253-Q257 PolarHBondContact O-NE2 2.88Å; V253-Q257 VanDerWaalsContact O-NE2 3.12Å; V253-A394 HydrophobicContact CG2-CB 4.06Å; V253-L397 HydrophobicContact CG1-CB 4.37Å; V253-L397 HydrophobicContact CG2-CB 3.57Å; V253-L397 HydrophobicContact CG2-CD1 4.02Å; V253-L397 HydrophobicContact CG2-CG 4.47Å; V253-A398 HydrophobicContact CG1-CB 4.47Å; V253-A398 WeakPolarHBondContact O-CB 3.13Å; V253-V401 HydrophobicContact CG1-CG2 4.17Å
254L94.8Very high91.8Very high15 Ų1514.3 Ų14.38%0.0797%0.073CC..Hα-helixtrans-72.1-47.2177.2-65.4169.7000111.8L250 F251 W252 Q256 Q257 M326 F330 M425 T429L250-L254 WeakPolarHBondContact O-CG 3.26Å; L250-L254 PolarHBondContact O-N 3.39Å; F251-L254 WeakPolarHBondContact O-CB 3.42Å; F251-L254 PolarHBondContact O-N 3.14Å; W252-L254 PolarHBondContact O-N 3.28Å; L254-Q256 VanDerWaalsContact C-N 3.3Å; L254-Q256 PolarHBondContact O-N 3.32Å; L254-Q257 VanDerWaalsContact O-CB 3.24Å; L254-Q257 WeakPolarHBondContact O-CB 3.5Å; L254-Q257 VanDerWaalsContact O-CG 3.28Å; L254-Q257 WeakPolarHBondContact O-CG 3.44Å; L254-Q257 PolarHBondContact O-N 2.87Å; L254-M326 HydrophobicContact CB-CG 4.08Å; L254-M326 HydrophobicContact CB-SD 4.16Å; L254-M326 HydrophobicContact CD1-CG 4.09Å; L254-F330 HydrophobicContact CB-CE2 3.73Å; L254-F330 HydrophobicContact CB-CZ 4.25Å; L254-F330 HydrophobicContact CD2-CE2 4.01Å; L254-F330 HydrophobicContact CD2-CZ 4.2Å; L254-F330 HydrophobicContact CG-CE2 4.41Å; L254-F330 WeakPolarHBondContact O-CZ 3.3Å; L254-M425 HydrophobicContact CD2-CB 3.89Å; L254-M425 HydrophobicContact CD2-CG 4.02Å; L254-M425 HydrophobicContact CD2-SD 3.57Å; L254-M425 VanDerWaalsContact CD2-SD 3.57Å; L254-T429 HydrophobicContact CD1-CG2 3.97Å; L254-T429 WeakPolarHBondContact CD1-OG1 3.26Å
255A94.2Very high92Very high13 Ų1314.1 Ų14.111%0.1077%0.072CC..Hα-helixtrans-64.7-33.1179.100000112.9R2 F251 W252 Q257 G258 M326R2-A255 PolarHBondContact NH2-O 2.91Å; F251-A255 HydrophobicContact CE1-CB 4.08Å; F251-A255 HydrophobicContact CZ-CB 4.36Å; F251-A255 WeakPolarHBondContact O-CB 3.49Å; F251-A255 PolarHBondContact O-N 2.8Å; W252-A255 HydrophobicContact CE3-CB 3.94Å; W252-A255 HydrophobicContact CZ3-CB 4.29Å; W252-A255 PolarHBondContact O-N 3.3Å; A255-Q257 PolarHBondContact O-N 3.03Å; A255-G258 PolarHBondContact O-N 3.21Å; A255-M326 HydrophobicContact CB-CE 3.74Å
256Q92.1Very high92.1Very high5 Ų513.7 Ų13.72%0.0237%0.07CC..Hα-helixtrans-70.7-18.2179-67.7-55.3-15.200112.8W252 L254 G258 G259 N395 A398W252-Q256 HydrophobicContact CE3-CG 4.27Å; W252-Q256 VanDerWaalsContact CZ3-NE2 3.34Å; W252-Q256 VanDerWaalsContact O-CB 3.31Å; W252-Q256 WeakPolarHBondContact O-CB 3.12Å; W252-Q256 WeakPolarHBondContact O-CG 3.46Å; W252-Q256 PolarHBondContact O-N 3.04Å; L254-Q256 VanDerWaalsContact C-N 3.3Å; L254-Q256 PolarHBondContact O-N 3.32Å; Q256-G258 PolarHBondContact O-N 3.32Å; Q256-G259 PolarHBondContact O-N 2.68Å; Q256-N395 VanDerWaalsContact CD-OD1 3.32Å; Q256-N395 WeakPolarHBondContact CG-OD1 3.35Å; Q256-N395 PolarHBondContact OE1-OD1 3.44Å; Q256-A398 HydrophobicContact CB-CB 3.68Å
257Q91.6Very high92Very high0 Ų08.6 Ų8.60%05%0.049CC..G310 helixtrans-55.5-26.3171.5-60.5-54.2-47.400112.7V253 L254 A255 G259 S260 T261 I262 F330 A398 F421V253-Q257 PolarHBondContact O-NE2 2.88Å; V253-Q257 VanDerWaalsContact O-NE2 3.12Å; L254-Q257 VanDerWaalsContact O-CB 3.24Å; L254-Q257 WeakPolarHBondContact O-CB 3.5Å; L254-Q257 VanDerWaalsContact O-CG 3.28Å; L254-Q257 WeakPolarHBondContact O-CG 3.44Å; L254-Q257 PolarHBondContact O-N 2.87Å; A255-Q257 PolarHBondContact O-N 3.03Å; Q257-G259 PolarHBondContact O-N 3.28Å; Q257-S260 CarbonylContact O-C 3.6Å; Q257-S260 PolarHBondContact O-N 3.29Å; Q257-T261 PolarHBondContact O-N 2.98Å; Q257-T261 PolarHBondContact OE1-OG1 3.31Å; Q257-I262 HydrophobicContact CB-CD1 3.98Å; Q257-I262 HydrophobicContact CB-CG1 4.17Å; Q257-I262 WeakPolarHBondContact O-CB 3.47Å; Q257-I262 PolarHBondContact O-N 3.45Å; Q257-F330 HydrophobicContact CB-CZ 4.09Å; Q257-F330 HydrophobicContact CG-CE1 4.5Å; Q257-F330 HydrophobicContact CG-CZ 4.01Å; Q257-A398 VanDerWaalsContact NE2-CA 3.28Å; Q257-A398 PolarHBondContact NE2-O 2.97Å; Q257-F421 HydrophobicContact CG-CE1 4.38Å; Q257-F421 HydrophobicContact CG-CZ 4.19Å
258G89.5Confident91.8Very high7 Ų710.8 Ų10.87%0.0726%0.056CC..G310 helixtrans-50.7-39.2172.600000112.5A255 Q256 Q285A255-G258 PolarHBondContact O-N 3.21Å; Q256-G258 PolarHBondContact O-N 3.32Å; G258-Q285 PolarHBondContact O-NE2 3.05Å
259G86.5Confident91.7Very high0 Ų011.5 Ų11.50%06%0.059CC..G310 helixtrans-88.5-6.7-178.600000114.7I6 F24 Q256 Q257I6-G259 WeakPolarHBondContact CG2-O 3.41Å; F24-G259 VanDerWaalsContact CZ-O 3.26Å; F24-G259 WeakPolarHBondContact CZ-O 3.37Å; Q256-G259 PolarHBondContact O-N 2.68Å; Q257-G259 PolarHBondContact O-N 3.28Å
260S89.6Confident91.5Very high2 Ų211.3 Ų11.31%0.0146%0.058CC..THydrogen-bonded Turntrans-122.1-101.1-177.255.40000111.4Q257 I262 S263 L264Q257-S260 CarbonylContact O-C 3.6Å; Q257-S260 PolarHBondContact O-N 3.29Å; S260-I262 VanDerWaalsContact C-N 3.35Å; S260-I262 PolarHBondContact O-N 3.35Å; S260-S263 WeakPolarHBondContact O-CB 3.35Å; S260-S263 PolarHBondContact O-N 3.02Å; S260-L264 PolarHBondContact O-N 3.32Å
261T91.4Very high91.4Very high0 Ų011.4 Ų11.40%06%0.058CC..Hα-helixtrans-54.1-46.2-175-64.60000112.8Q257 S263 L264 F265 A402 T405 Y418 F421 F422Q257-T261 PolarHBondContact O-N 2.98Å; Q257-T261 PolarHBondContact OE1-OG1 3.31Å; T261-S263 VanDerWaalsContact C-N 3.33Å; T261-S263 PolarHBondContact O-N 3.03Å; T261-L264 PolarHBondContact O-N 3.19Å; T261-F265 WeakPolarHBondContact O-CB 3.37Å; T261-F265 PolarHBondContact O-N 2.93Å; T261-A402 WeakPolarHBondContact OG1-CA 2.93Å; T261-A402 WeakPolarHBondContact OG1-CB 3.03Å; T261-T405 HydrophobicContact CG2-CG2 3.62Å; T261-T405 WeakPolarHBondContact CG2-OG1 3.44Å; T261-T405 PolarHBondContact OG1-OG1 3.03Å; T261-Y418 HydrophobicContact CG2-CD1 3.64Å; T261-Y418 HydrophobicContact CG2-CE1 3.48Å; T261-Y418 VanDerWaalsContact CG2-CE1 3.48Å; T261-Y418 WeakPolarHBondContact O-CE1 3.18Å; T261-F421 HydrophobicContact CG2-CD1 3.84Å; T261-F421 HydrophobicContact CG2-CE1 3.72Å; T261-F421 HydrophobicContact CG2-CZ 4.44Å; T261-F422 HydrophobicContact CG2-CE1 3.96Å; T261-F422 HydrophobicContact CG2-CZ 4.29Å
262I93.1Very high91.2Very high0 Ų013.3 Ų13.30%07%0.066CC..Hα-helixtrans-65-40.7-179.6-67.6176.4000110.3Q257 S260 L264 F265 I266 F330 L333 M351 L355 M358 F422Q257-I262 HydrophobicContact CB-CD1 3.98Å; Q257-I262 HydrophobicContact CB-CG1 4.17Å; Q257-I262 WeakPolarHBondContact O-CB 3.47Å; Q257-I262 PolarHBondContact O-N 3.45Å; S260-I262 VanDerWaalsContact C-N 3.35Å; S260-I262 PolarHBondContact O-N 3.35Å; I262-L264 VanDerWaalsContact C-N 3.33Å; I262-L264 PolarHBondContact O-N 3.5Å; I262-F265 PolarHBondContact O-N 2.95Å; I262-I266 HydrophobicContact CG2-CD1 3.76Å; I262-I266 HydrophobicContact CG2-CG1 4.37Å; I262-I266 WeakPolarHBondContact O-CG1 3.25Å; I262-I266 PolarHBondContact O-N 3.07Å; I262-F330 HydrophobicContact CD1-CE1 4.43Å; I262-F330 HydrophobicContact CD1-CZ 4.43Å; I262-L333 HydrophobicContact CD1-CD1 3.56Å; I262-L333 HydrophobicContact CG1-CD1 3.96Å; I262-M351 HydrophobicContact CG2-SD 4.31Å; I262-L355 HydrophobicContact CD1-CD2 4.47Å; I262-L355 HydrophobicContact CG2-CD2 3.69Å; I262-M358 HydrophobicContact CD1-CE 3.71Å; I262-M358 HydrophobicContact CD1-SD 4.03Å; I262-F422 HydrophobicContact CG1-CE1 3.84Å; I262-F422 HydrophobicContact CG1-CZ 4.23Å
263S91.9Very high90.7Very high0 Ų018.9 Ų18.90%09%0.092CC..Hα-helixtrans-62.9-40.3177.8-166.20000111.7S260 T261 D267 T281S260-S263 WeakPolarHBondContact O-CB 3.35Å; S260-S263 PolarHBondContact O-N 3.02Å; T261-S263 VanDerWaalsContact C-N 3.33Å; T261-S263 PolarHBondContact O-N 3.03Å; S263-D267 VanDerWaalsContact O-CB 3.31Å; S263-D267 WeakPolarHBondContact O-CB 3.3Å; S263-D267 PolarHBondContact O-N 3.2Å; S263-D267 VanDerWaalsContact O-N 3.07Å; S263-T281 WeakPolarHBondContact O-CG2 3.34Å
264L89Confident90Very high0 Ų019.4 Ų19.40%010%0.098CC..Hα-helixtrans-69.8-38176.2-67.5177.8000112.4I6 T10 D17 I21 S260 T261 I262 D267 R268I6-L264 HydrophobicContact CD1-CD1 3.85Å; I6-L264 HydrophobicContact CD1-CD2 4.3Å; I6-L264 HydrophobicContact CD1-CG 3.9Å; I6-L264 HydrophobicContact CG1-CD1 4.46Å; I6-L264 HydrophobicContact CG1-CD2 4.19Å; I6-L264 HydrophobicContact CG1-CG 4.33Å; T10-L264 HydrophobicContact CG2-CD2 3.92Å; D17-L264 HydrophobicContact CB-CD1 4.49Å; I21-L264 HydrophobicContact CD1-CD1 4.27Å; I21-L264 HydrophobicContact CG1-CD1 4.42Å; S260-L264 PolarHBondContact O-N 3.32Å; T261-L264 PolarHBondContact O-N 3.19Å; I262-L264 VanDerWaalsContact C-N 3.33Å; I262-L264 PolarHBondContact O-N 3.5Å; L264-D267 PolarHBondContact O-N 3.24Å; L264-R268 WeakPolarHBondContact O-CB 3.06Å; L264-R268 VanDerWaalsContact O-CG 3.32Å; L264-R268 WeakPolarHBondContact O-CG 3.27Å; L264-R268 PolarHBondContact O-N 3.19Å; L264-R268 VanDerWaalsContact O-N 3.09Å
265F91.5Very high89.1Confident0 Ų028.8 Ų28.80%014%0.139CC..Hα-helixtrans-62.9-46.2175.3179.4-99.5000111.8T261 I262 D267 R268 F269 V270 A337 A346 M351 Y418 F422T261-F265 WeakPolarHBondContact O-CB 3.37Å; T261-F265 PolarHBondContact O-N 2.93Å; I262-F265 PolarHBondContact O-N 2.95Å; F265-D267 PolarHBondContact O-N 3.49Å; F265-R268 PolarHBondContact O-N 3.01Å; F265-F269 HydrophobicContact CD2-CB 4.14Å; F265-F269 AromaticContact CD2-CD2 3.61Å; F265-F269 HydrophobicContact CD2-CD2 3.61Å; F265-F269 HydrophobicContact CD2-CG 4.29Å; F265-F269 HydrophobicContact CE2-CB 3.77Å; F265-F269 AromaticContact CE2-CD2 3.89Å; F265-F269 HydrophobicContact CE2-CD2 3.89Å; F265-F269 HydrophobicContact CE2-CG 4.16Å; F265-F269 HydrophobicContact CG-CD2 4.48Å; F265-F269 HydrophobicContact CZ-CB 4.14Å; F265-F269 PolarHBondContact O-N 2.88Å; F265-V270 HydrophobicContact CD1-CG2 4.09Å; F265-V270 HydrophobicContact CE1-CG2 3.83Å; F265-A337 HydrophobicContact CE2-CB 3.83Å; F265-A337 HydrophobicContact CZ-CB 3.72Å; F265-A346 HydrophobicContact CE1-CB 4.01Å; F265-A346 HydrophobicContact CZ-CB 3.9Å; F265-M351 HydrophobicContact CD1-CE 3.39Å; F265-M351 HydrophobicContact CE1-CE 3.38Å; F265-Y418 HydrophobicContact CB-CD1 3.75Å; F265-Y418 HydrophobicContact CB-CE1 3.79Å; F265-Y418 HydrophobicContact CB-CG 4.29Å; F265-Y418 AromaticContact CD2-CD1 3.88Å; F265-Y418 HydrophobicContact CD2-CD1 3.88Å; F265-Y418 AromaticContact CD2-CD2 3.94Å; F265-Y418 HydrophobicContact CD2-CD2 3.94Å; F265-Y418 AromaticContact CD2-CG 3.55Å; F265-Y418 HydrophobicContact CD2-CG 3.55Å; F265-Y418 HydrophobicContact CE2-CG 4.38Å; F265-Y418 HydrophobicContact CG-CD1 4.18Å; F265-Y418 HydrophobicContact CG-CG 4.3Å; F265-F422 HydrophobicContact CB-CE2 4.33Å; F265-F422 HydrophobicContact CB-CZ 4.02Å; F265-F422 AromaticContact CD1-CE2 3.93Å; F265-F422 HydrophobicContact CD1-CE2 3.93Å; F265-F422 HydrophobicContact CD1-CZ 4.29Å; F265-F422 HydrophobicContact CD2-CE2 4.06Å; F265-F422 HydrophobicContact CE1-CE2 4.29Å; F265-F422 HydrophobicContact CE2-CE2 4.41Å; F265-F422 AromaticContact CG-CE2 3.81Å; F265-F422 HydrophobicContact CG-CE2 3.81Å; F265-F422 HydrophobicContact CG-CZ 4.01Å
266I92.3Very high88.3Confident1 Ų135.8 Ų35.81%0.00518%0.175CC..Hα-helixtrans-59.3-41.5175.6-66.7168.4000110.7I262 R268 V270 T281 F284 M351 L355I262-I266 HydrophobicContact CG2-CD1 3.76Å; I262-I266 HydrophobicContact CG2-CG1 4.37Å; I262-I266 WeakPolarHBondContact O-CG1 3.25Å; I262-I266 PolarHBondContact O-N 3.07Å; I266-R268 VanDerWaalsContact C-N 3.32Å; I266-R268 PolarHBondContact O-N 3.22Å; I266-V270 HydrophobicContact CB-CG2 4.38Å; I266-V270 HydrophobicContact CG1-CG2 4.27Å; I266-V270 HydrophobicContact CG2-CB 4.45Å; I266-V270 WeakPolarHBondContact O-CB 3.23Å; I266-T281 HydrophobicContact CB-CG2 3.78Å; I266-T281 HydrophobicContact CG2-CG2 3.59Å; I266-F284 HydrophobicContact CD1-CB 3.81Å; I266-F284 HydrophobicContact CD1-CD1 3.87Å; I266-F284 HydrophobicContact CD1-CG 3.87Å; I266-F284 HydrophobicContact CG2-CD1 4.23Å; I266-F284 HydrophobicContact CG2-CD2 3.69Å; I266-F284 HydrophobicContact CG2-CE1 4.21Å; I266-F284 HydrophobicContact CG2-CE2 3.66Å; I266-F284 HydrophobicContact CG2-CG 3.97Å; I266-F284 HydrophobicContact CG2-CZ 3.91Å; I266-M351 HydrophobicContact CD1-CG 3.74Å; I266-M351 HydrophobicContact CD1-SD 3.65Å; I266-M351 HydrophobicContact CG1-CE 3.98Å; I266-M351 HydrophobicContact CG1-CG 3.66Å; I266-M351 HydrophobicContact CG1-SD 3.53Å; I266-M351 VanDerWaalsContact CG1-SD 3.53Å; I266-L355 HydrophobicContact CD1-CD1 4.04Å
267D89.6Confident87.9Confident21 Ų2140.3 Ų40.311%0.11220%0.198CC..Hα-helixtrans-67.5-33.5-176.6-171.970.9000113.4L7 H11 S263 L264 F265 R272 T281L7-D267 HydrophobicContact CD2-CB 3.84Å; H11-D267 IonicContact CD2-OD2 3.67Å; H11-D267 IonicContact CE1-OD2 2.65Å; H11-D267 IonicContact NE2-OD1 3.2Å; H11-D267 IonicContact NE2-OD2 3.55Å; H11-D267 PolarHBondContact NE2-OD2 3.42Å; S263-D267 VanDerWaalsContact O-CB 3.31Å; S263-D267 WeakPolarHBondContact O-CB 3.3Å; S263-D267 PolarHBondContact O-N 3.2Å; S263-D267 VanDerWaalsContact O-N 3.07Å; L264-D267 PolarHBondContact O-N 3.24Å; F265-D267 PolarHBondContact O-N 3.49Å; D267-R272 PolarHBondContact O-NH1 2.69Å; D267-R272 PolarHBondContact O-NH2 2.95Å; D267-R272 IonicContact OD1-CZ 3.55Å; D267-R272 IonicContact OD1-NH1 3.26Å; D267-R272 PolarHBondContact OD1-NH1 3.11Å; D267-T281 HydrophobicContact CB-CG2 4.05Å; D267-T281 PolarHBondContact OD1-OG1 3.12Å
268R87.8Confident87.7Confident59 Ų5944.3 Ų44.322%0.22322%0.217CC..Hα-helixtrans-101-36.3-170.6-67.4173.2-179.2178.63114.8D17 L264 F265 I266 I410D17-R268 VanDerWaalsContact CG-NH2 3.3Å; D17-R268 IonicContact OD1-CZ 2.69Å; D17-R268 IonicContact OD1-NH1 2.71Å; D17-R268 IonicContact OD1-NH2 3.8Å; D17-R268 PolarHBondContact OD1-NH2 3.11Å; D17-R268 IonicContact OD2-CZ 3.77Å; D17-R268 IonicContact OD2-NH1 2.67Å; D17-R268 PolarHBondContact OD2-NH1 3.13Å; D17-R268 IonicContact OD2-NH2 3.52Å; D17-R268 PolarHBondContact OD2-NH2 2.94Å; L264-R268 WeakPolarHBondContact O-CB 3.06Å; L264-R268 VanDerWaalsContact O-CG 3.32Å; L264-R268 WeakPolarHBondContact O-CG 3.27Å; L264-R268 PolarHBondContact O-N 3.19Å; L264-R268 VanDerWaalsContact O-N 3.09Å; F265-R268 PolarHBondContact O-N 3.01Å; I266-R268 VanDerWaalsContact C-N 3.32Å; I266-R268 PolarHBondContact O-N 3.22Å; R268-I410 HydrophobicContact CG-CD1 4.32Å
269F89.7Confident87.7Confident14 Ų1445.4 Ų45.46%0.06122%0.222CC..Hα-helixtrans-122.3-13.3-165.6-58.1-64.5000113.9F265 Q345 A346 I410 A414 I415 Y418F265-F269 HydrophobicContact CD2-CB 4.14Å; F265-F269 AromaticContact CD2-CD2 3.61Å; F265-F269 HydrophobicContact CD2-CD2 3.61Å; F265-F269 HydrophobicContact CD2-CG 4.29Å; F265-F269 HydrophobicContact CE2-CB 3.77Å; F265-F269 AromaticContact CE2-CD2 3.89Å; F265-F269 HydrophobicContact CE2-CD2 3.89Å; F265-F269 HydrophobicContact CE2-CG 4.16Å; F265-F269 HydrophobicContact CG-CD2 4.48Å; F265-F269 HydrophobicContact CZ-CB 4.14Å; F265-F269 PolarHBondContact O-N 2.88Å; F269-Q345 CarbonylContact O-C 3.56Å; F269-Q345 WeakPolarHBondContact O-CA 3.32Å; F269-A346 PolarHBondContact O-N 2.71Å; F269-I410 HydrophobicContact CE1-CG2 3.8Å; F269-I410 HydrophobicContact CZ-CG2 3.73Å; F269-A414 HydrophobicContact CE2-CB 4.38Å; F269-A414 HydrophobicContact CZ-CB 3.81Å; F269-I415 HydrophobicContact CD1-CD1 3.62Å; F269-I415 HydrophobicContact CD1-CG1 3.39Å; F269-I415 HydrophobicContact CD2-CG1 4.34Å; F269-I415 HydrophobicContact CE1-CD1 3.82Å; F269-I415 HydrophobicContact CE1-CG1 3.32Å; F269-I415 HydrophobicContact CE2-CG1 4.29Å; F269-I415 HydrophobicContact CG-CD1 4.39Å; F269-I415 HydrophobicContact CG-CG1 3.92Å; F269-I415 HydrophobicContact CZ-CG1 3.8Å; F269-Y418 HydrophobicContact CD2-CD2 4.17Å; F269-Y418 HydrophobicContact CD2-CE2 4.31Å; F269-Y418 AromaticContact CE2-CD2 3.72Å; F269-Y418 HydrophobicContact CE2-CD2 3.72Å; F269-Y418 AromaticContact CE2-CE2 3.63Å; F269-Y418 HydrophobicContact CE2-CE2 3.63Å
270V90.3Very high87.9Confident9 Ų946.1 Ų46.16%0.05523%0.226CC..EExtended strand (participates in β ladder)trans-88135177.8176.70000109.9F265 I266 R272 A346 M348 M351F265-V270 HydrophobicContact CD1-CG2 4.09Å; F265-V270 HydrophobicContact CE1-CG2 3.83Å; I266-V270 HydrophobicContact CB-CG2 4.38Å; I266-V270 HydrophobicContact CG1-CG2 4.27Å; I266-V270 HydrophobicContact CG2-CB 4.45Å; I266-V270 WeakPolarHBondContact O-CB 3.23Å; V270-R272 HydrophobicContact CG1-CG 4.48Å; V270-R272 PolarHBondContact O-N 3.16Å; V270-R272 VanDerWaalsContact O-N 3.13Å; V270-A346 HydrophobicContact CB-CB 4.36Å; V270-A346 HydrophobicContact CG2-CB 3.72Å; V270-M348 HydrophobicContact CG1-CB 4.12Å; V270-M351 HydrophobicContact CG2-CE 3.8Å
271N89.1Confident88Confident61 Ų6146.2 Ų46.233%0.32623%0.227SC..EExtended strand (participates in β ladder)trans-71.4106.5168.2-173.2-14.3000109.7Q273 Q345 A346 M348N271-Q273 WeakPolarHBondContact OD1-CB 3.19Å; N271-Q273 PolarHBondContact OD1-N 3.25Å; N271-Q345 HydrophobicContact CB-CB 4.2Å; N271-Q345 PolarHBondContact ND2-OE1 3.02Å; N271-Q345 VanDerWaalsContact ND2-OE1 3.15Å; N271-A346 PolarHBondContact N-O 3.19Å; N271-M348 WeakPolarHBondContact O-CB 3.43Å
272R90.5Very high88Confident40 Ų4046.3 Ų46.315%0.15123%0.228CC..  trans-92.810.4-177.7-61.3172.7-60-168.9-5.7113.6D267 V270 A274 E278 V279 T281 F284D267-R272 PolarHBondContact O-NH1 2.69Å; D267-R272 PolarHBondContact O-NH2 2.95Å; D267-R272 IonicContact OD1-CZ 3.55Å; D267-R272 IonicContact OD1-NH1 3.26Å; D267-R272 PolarHBondContact OD1-NH1 3.11Å; V270-R272 HydrophobicContact CG1-CG 4.48Å; V270-R272 PolarHBondContact O-N 3.16Å; V270-R272 VanDerWaalsContact O-N 3.13Å; R272-A274 PolarHBondContact O-N 2.79Å; R272-E278 HydrophobicContact CB-CG 4.09Å; R272-E278 IonicContact CZ-OE1 3.79Å; R272-E278 VanDerWaalsContact CZ-OE1 3.26Å; R272-E278 IonicContact NE-OE1 2.63Å; R272-E278 PolarHBondContact NE-OE1 3.47Å; R272-E278 IonicContact NH2-OE1 2.77Å; R272-E278 PolarHBondContact NH2-OE1 3.38Å; R272-V279 WeakPolarHBondContact CB-O 3.48Å; R272-V279 PolarHBondContact O-N 2.87Å; R272-T281 PolarHBondContact NH1-OG1 3.36Å; R272-F284 HydrophobicContact CG-CE2 4.4Å
273Q85.3Confident87.9Confident137 Ų13748.1 Ų48.164%0.6424%0.237SC*.EExtended strand (participates in β ladder)trans-78.9121.6179.8-65.2-164.9-12.600111.6N271N271-Q273 WeakPolarHBondContact OD1-CB 3.19Å; N271-Q273 PolarHBondContact OD1-N 3.25Å
274A79.7Confident88Confident24 Ų2448.4 Ų48.420%0.19824%0.238CC..EExtended strand (participates in β ladder)trans-126.6118.3172.500000109.3R272 N276 I277 V279 M348R272-A274 PolarHBondContact O-N 2.79Å; A274-N276 PolarHBondContact O-N 3.44Å; A274-N276 VanDerWaalsContact O-N 3.14Å; A274-I277 PolarHBondContact N-O 3.22Å; A274-I277 PolarHBondContact O-N 3.33Å; A274-I277 VanDerWaalsContact O-O 3.08Å; A274-V279 HydrophobicContact CB-CG2 3.64Å; A274-M348 HydrophobicContact CB-CE 4.04Å
275F76.5Confident88.1Confident211 Ų21149.4 Ų49.493%0.92524%0.243SC*.THydrogen-bonded Turntrans48.642.3177.5-57.9-83.6000114I277F275-I277 VanDerWaalsContact C-N 3.29Å; F275-I277 PolarHBondContact O-N 2.8Å
276N77.7Confident88.2Confident161 Ų16149.6 Ų49.686%0.86124%0.244SC*.THydrogen-bonded Turntrans70.84.7-174.7-61.5-10.2000117A274A274-N276 PolarHBondContact O-N 3.44Å; A274-N276 VanDerWaalsContact O-N 3.14Å
277I83.6Confident88.3Confident99 Ų9950.6 Ų50.651%0.50825%0.25SS..EExtended strand (participates in β ladder)trans-107.9129.3173.2-57.1174.4000108.2A274 F275 V279A274-I277 PolarHBondContact N-O 3.22Å; A274-I277 PolarHBondContact O-N 3.33Å; A274-I277 VanDerWaalsContact O-O 3.08Å; F275-I277 VanDerWaalsContact C-N 3.29Å; F275-I277 PolarHBondContact O-N 2.8Å; I277-V279 PolarHBondContact O-N 3.08Å
278E86.3Confident88.3Confident85 Ų8551.6 Ų51.640%0.39726%0.256SS..EExtended strand (participates in β ladder)trans-75.5116.9171.2-177.5177.1-162.100109.4Q136 R272 P280Q136-E278 PolarHBondContact NE2-O 2.99Å; Q136-E278 PolarHBondContact OE1-O 3.4Å; R272-E278 HydrophobicContact CB-CG 4.09Å; R272-E278 IonicContact CZ-OE1 3.79Å; R272-E278 VanDerWaalsContact CZ-OE1 3.26Å; R272-E278 IonicContact NE-OE1 2.63Å; R272-E278 PolarHBondContact NE-OE1 3.47Å; R272-E278 IonicContact NH2-OE1 2.77Å; R272-E278 PolarHBondContact NH2-OE1 3.38Å; E278-P280 WeakPolarHBondContact O-CD 3.44Å
279V90.4Very high88.5Confident30 Ų3048.9 Ų48.918%0.18225%0.246CC..PPolyproline II helixtrans-72.7120.6178.7179.70000109.2R272 A274 I277 T281 L283 F284 M348R272-V279 WeakPolarHBondContact CB-O 3.48Å; R272-V279 PolarHBondContact O-N 2.87Å; A274-V279 HydrophobicContact CB-CG2 3.64Å; I277-V279 PolarHBondContact O-N 3.08Å; V279-T281 PolarHBondContact O-N 3.17Å; V279-L283 HydrophobicContact CG1-CB 4.15Å; V279-L283 HydrophobicContact CG1-CD2 4.02Å; V279-F284 HydrophobicContact CG1-CE2 4.14Å; V279-M348 HydrophobicContact CB-SD 4.46Å; V279-M348 HydrophobicContact CG2-SD 4.17Å
280P91.2Very high88.7Confident14 Ų1451.7 Ų51.79%0.09126%0.261CS..PPolyproline II helixtrans-61.2139.2178.1-6.28000111.9L133 Q136 E278 A282 L283L133-P280 HydrophobicContact CD2-CG 3.81Å; L133-P280 HydrophobicContact CG-CG 4.38Å; Q136-P280 HydrophobicContact CB-CG 4.33Å; Q136-P280 VanDerWaalsContact OE1-CD 3.29Å; E278-P280 WeakPolarHBondContact O-CD 3.44Å; P280-A282 PolarHBondContact O-N 3.1Å; P280-A282 VanDerWaalsContact O-N 3.08Å; P280-L283 HydrophobicContact CB-CD1 3.81Å; P280-L283 HydrophobicContact CG-CD1 3.51Å; P280-L283 WeakPolarHBondContact O-CB 3.42Å; P280-L283 PolarHBondContact O-N 3.27Å
281T91.1Very high88.9Confident4 Ų451.4 Ų51.43%0.02526%0.26CS..G310 helixtrans-53.1-34.2177-480000112.5L7 S263 I266 D267 R272 V279 L283 F284L7-T281 HydrophobicContact CD1-CG2 4.21Å; L7-T281 HydrophobicContact CD2-CG2 4.25Å; S263-T281 WeakPolarHBondContact O-CG2 3.34Å; I266-T281 HydrophobicContact CB-CG2 3.78Å; I266-T281 HydrophobicContact CG2-CG2 3.59Å; D267-T281 HydrophobicContact CB-CG2 4.05Å; D267-T281 PolarHBondContact OD1-OG1 3.12Å; R272-T281 PolarHBondContact NH1-OG1 3.36Å; V279-T281 PolarHBondContact O-N 3.17Å; T281-L283 PolarHBondContact O-N 3.27Å; T281-F284 WeakPolarHBondContact O-CB 3.45Å; T281-F284 PolarHBondContact O-N 2.99Å; T281-F284 VanDerWaalsContact O-N 3.1Å
282A91.1Very high88.9Confident3 Ų348.7 Ų48.73%0.02525%0.245CC..G310 helixtrans-56.4-33177.600000113.2A3 L4 P128 P280 F284 Q285A3-A282 HydrophobicContact CB-CB 3.93Å; L4-A282 HydrophobicContact CD2-CB 4.03Å; P128-A282 WeakPolarHBondContact CB-O 3.46Å; P280-A282 PolarHBondContact O-N 3.1Å; P280-A282 VanDerWaalsContact O-N 3.08Å; A282-F284 PolarHBondContact O-N 3.41Å; A282-Q285 WeakPolarHBondContact O-CB 3.34Å; A282-Q285 PolarHBondContact O-N 3.46Å; A282-Q285 VanDerWaalsContact O-N 3.12Å
283L92.3Very high88.9Confident37 Ų3749.8 Ų49.819%0.19425%0.253CS..G310 helixtrans-65.7-25.2-179.2-84.362.2000112.4I129 L133 V279 P280 T281 Q285 S286I129-L283 HydrophobicContact CB-CG 4.42Å; I129-L283 HydrophobicContact CG1-CG 4.04Å; L133-L283 HydrophobicContact CG-CD1 4.43Å; V279-L283 HydrophobicContact CG1-CB 4.15Å; V279-L283 HydrophobicContact CG1-CD2 4.02Å; P280-L283 HydrophobicContact CB-CD1 3.81Å; P280-L283 HydrophobicContact CG-CD1 3.51Å; P280-L283 WeakPolarHBondContact O-CB 3.42Å; P280-L283 PolarHBondContact O-N 3.27Å; T281-L283 PolarHBondContact O-N 3.27Å; L283-Q285 PolarHBondContact O-N 3.39Å; L283-S286 VanDerWaalsContact O-CB 3.27Å; L283-S286 WeakPolarHBondContact O-CB 3.27Å; L283-S286 PolarHBondContact O-N 2.81Å
284F93.1Very high89.2Confident6 Ų647.8 Ų47.83%0.02625%0.246CC..Hα-helixtrans-65.1-24.1176.6-72.6-103.3000112.1I266 R272 V279 T281 A282 S286 V287 M348 M351 I352 L355I266-F284 HydrophobicContact CD1-CB 3.81Å; I266-F284 HydrophobicContact CD1-CD1 3.87Å; I266-F284 HydrophobicContact CD1-CG 3.87Å; I266-F284 HydrophobicContact CG2-CD1 4.23Å; I266-F284 HydrophobicContact CG2-CD2 3.69Å; I266-F284 HydrophobicContact CG2-CE1 4.21Å; I266-F284 HydrophobicContact CG2-CE2 3.66Å; I266-F284 HydrophobicContact CG2-CG 3.97Å; I266-F284 HydrophobicContact CG2-CZ 3.91Å; R272-F284 HydrophobicContact CG-CE2 4.4Å; V279-F284 HydrophobicContact CG1-CE2 4.14Å; T281-F284 WeakPolarHBondContact O-CB 3.45Å; T281-F284 PolarHBondContact O-N 2.99Å; T281-F284 VanDerWaalsContact O-N 3.1Å; A282-F284 PolarHBondContact O-N 3.41Å; F284-S286 PolarHBondContact O-N 2.93Å; F284-V287 VanDerWaalsContact O-CB 3.28Å; F284-V287 WeakPolarHBondContact O-CB 3.35Å; F284-V287 PolarHBondContact O-N 3.46Å; F284-M348 HydrophobicContact CE1-CG 3.94Å; F284-M348 HydrophobicContact CZ-CB 4.45Å; F284-M348 HydrophobicContact CZ-CG 3.67Å; F284-M348 HydrophobicContact CZ-SD 4.07Å; F284-M351 HydrophobicContact CD1-CG 3.82Å; F284-M351 HydrophobicContact CE1-CB 4.16Å; F284-M351 HydrophobicContact CE1-CG 3.73Å; F284-I352 HydrophobicContact CD1-CG1 4.19Å; F284-I352 HydrophobicContact CE1-CG1 3.92Å; F284-L355 HydrophobicContact CB-CD1 3.83Å; F284-L355 HydrophobicContact CD1-CD1 3.86Å; F284-L355 HydrophobicContact CG-CD1 4.36Å
285Q90.6Very high89.6Confident22 Ų2246.7 Ų46.710%0.10324%0.237CC..Hα-helixtrans-65.1-28.8171.8-63-60.8-45.600112.4A3 P128 G258 A282 L283 V287 N288A3-Q285 HydrophobicContact CB-CB 4.14Å; A3-Q285 HydrophobicContact CB-CG 3.64Å; P128-Q285 HydrophobicContact CB-CB 4.18Å; P128-Q285 HydrophobicContact CG-CB 4.08Å; G258-Q285 PolarHBondContact O-NE2 3.05Å; A282-Q285 WeakPolarHBondContact O-CB 3.34Å; A282-Q285 PolarHBondContact O-N 3.46Å; A282-Q285 VanDerWaalsContact O-N 3.12Å; L283-Q285 PolarHBondContact O-N 3.39Å; Q285-V287 PolarHBondContact O-N 2.89Å; Q285-N288 PolarHBondContact O-N 3.35Å
286S93.6Very high90.1Very high3 Ų338 Ų382%0.02121%0.207CC..Hα-helixtrans-69.2-25176.8-580000112I125 L283 F284 N288 A289 I290I125-S286 PolarHBondContact O-OG 3.3Å; L283-S286 VanDerWaalsContact O-CB 3.27Å; L283-S286 WeakPolarHBondContact O-CB 3.27Å; L283-S286 PolarHBondContact O-N 2.81Å; F284-S286 PolarHBondContact O-N 2.93Å; S286-N288 VanDerWaalsContact C-N 3.28Å; S286-N288 PolarHBondContact O-N 3.35Å; S286-A289 PolarHBondContact O-N 3.34Å; S286-I290 VanDerWaalsContact O-CG1 3.27Å; S286-I290 WeakPolarHBondContact O-CG1 3.39Å; S286-I290 PolarHBondContact O-N 2.89Å
287V94Very high90.5Very high22 Ų2235.1 Ų35.113%0.13320%0.195CC..Hα-helixtrans-58.8-42175.5179.50000110.7F284 Q285 I290 A291 I352 L355 A356F284-V287 VanDerWaalsContact O-CB 3.28Å; F284-V287 WeakPolarHBondContact O-CB 3.35Å; F284-V287 PolarHBondContact O-N 3.46Å; Q285-V287 PolarHBondContact O-N 2.89Å; V287-I290 PolarHBondContact O-N 2.96Å; V287-A291 VanDerWaalsContact O-CB 3.28Å; V287-A291 WeakPolarHBondContact O-CB 3.46Å; V287-A291 PolarHBondContact O-N 3.48Å; V287-I352 HydrophobicContact CG1-CG2 4.06Å; V287-I352 HydrophobicContact CG2-CG1 4.31Å; V287-I352 HydrophobicContact CG2-CG2 4.31Å; V287-L355 HydrophobicContact CB-CB 4.28Å; V287-L355 HydrophobicContact CG1-CB 3.86Å; V287-A356 HydrophobicContact CG1-CB 4.15Å
288N89.9Confident90.6Very high42 Ų4233.8 Ų33.823%0.22519%0.191CC..Hα-helixtrans-59.2-51.6177.5-171.469.9000111.1Q285 S286 I290 A291 V292 G359 E362Q285-N288 PolarHBondContact O-N 3.35Å; S286-N288 VanDerWaalsContact C-N 3.28Å; S286-N288 PolarHBondContact O-N 3.35Å; N288-I290 PolarHBondContact O-N 3.44Å; N288-A291 PolarHBondContact O-N 3.28Å; N288-V292 VanDerWaalsContact O-CG2 3.3Å; N288-V292 WeakPolarHBondContact O-CG2 3.23Å; N288-V292 PolarHBondContact O-N 2.86Å; N288-G359 WeakPolarHBondContact OD1-CA 3.18Å; N288-G359 PolarHBondContact OD1-N 2.86Å; N288-E362 PolarHBondContact ND2-OE2 2.92Å; N288-E362 VanDerWaalsContact ND2-OE2 3.12Å
289A92Very high90.4Very high2 Ų232.6 Ų32.62%0.01719%0.187CC..Hα-helixtrans-65-38.4-178.400000112.6I125 S286 M293I125-A289 HydrophobicContact CD1-CB 4.38Å; I125-A289 HydrophobicContact CG1-CB 3.53Å; S286-A289 PolarHBondContact O-N 3.34Å; A289-M293 WeakPolarHBondContact O-CG 3.14Å; A289-M293 PolarHBondContact O-N 3.27Å
290I94.5Very high89.9Confident74 Ų7434.8 Ų34.838%0.37921%0.208SC..Hα-helixtrans-61.2-47.7172.9-68.5165.6000110.2I125 S286 V287 N288 M293 L294I125-I290 HydrophobicContact CD1-CG1 3.68Å; I125-I290 HydrophobicContact CG1-CG1 3.88Å; I125-I290 HydrophobicContact CG2-CD1 4.25Å; I125-I290 HydrophobicContact CG2-CG1 4.08Å; S286-I290 VanDerWaalsContact O-CG1 3.27Å; S286-I290 WeakPolarHBondContact O-CG1 3.39Å; S286-I290 PolarHBondContact O-N 2.89Å; V287-I290 PolarHBondContact O-N 2.96Å; N288-I290 PolarHBondContact O-N 3.44Å; I290-M293 PolarHBondContact O-N 2.87Å; I290-L294 HydrophobicContact CG2-CD1 3.8Å; I290-L294 HydrophobicContact CG2-CG 4.27Å; I290-L294 WeakPolarHBondContact O-CB 3.41Å; I290-L294 WeakPolarHBondContact O-CG 3.38Å; I290-L294 PolarHBondContact O-N 2.99Å
291A93.6Very high89.3Confident3 Ų344.8 Ų44.83%0.02524%0.244CC..Hα-helixtrans-63.1-43.6-179.400000111.9V287 N288 M293 L294 A295 A356 F360V287-A291 VanDerWaalsContact O-CB 3.28Å; V287-A291 WeakPolarHBondContact O-CB 3.46Å; V287-A291 PolarHBondContact O-N 3.48Å; N288-A291 PolarHBondContact O-N 3.28Å; A291-M293 VanDerWaalsContact C-N 3.34Å; A291-M293 PolarHBondContact O-N 3.5Å; A291-L294 PolarHBondContact O-N 3.14Å; A291-A295 WeakPolarHBondContact O-CB 3.13Å; A291-A295 PolarHBondContact O-N 2.93Å; A291-A356 HydrophobicContact CB-CB 4.12Å; A291-A356 WeakPolarHBondContact CB-O 3.22Å; A291-F360 HydrophobicContact CB-CD2 4.18Å; A291-F360 HydrophobicContact CB-CE2 4.17Å
292V90.6Very high88.6Confident3 Ų349.6 Ų49.62%0.01827%0.269CS..Hα-helixtrans-58.7-44.9174.6171.80000111.2Y117 N288 A295 G296 G359 E362Y117-V292 WeakPolarHBondContact OH-CG1 3.49Å; N288-V292 VanDerWaalsContact O-CG2 3.3Å; N288-V292 WeakPolarHBondContact O-CG2 3.23Å; N288-V292 PolarHBondContact O-N 2.86Å; V292-A295 WeakPolarHBondContact O-CB 3.32Å; V292-A295 PolarHBondContact O-N 3.48Å; V292-G296 PolarHBondContact O-N 3.17Å; V292-G359 VanDerWaalsContact CG2-O 3.26Å; V292-G359 WeakPolarHBondContact CG2-O 3.31Å; V292-E362 HydrophobicContact CG2-CB 4.1Å
293M89.9Confident87.6Confident63 Ų6352.7 Ų52.731%0.3130%0.295SS..Hα-helixtrans-65.2-45.4178.2-74.1-175.767.300112.3N121 I122 I125 A289 I290 A291 A295 G296 V297N121-M293 HydrophobicContact CB-CG 3.66Å; N121-M293 HydrophobicContact CB-SD 3.6Å; I122-M293 HydrophobicContact CG1-CE 4Å; I122-M293 HydrophobicContact CG1-SD 4.26Å; I125-M293 HydrophobicContact CD1-SD 3.51Å; I125-M293 VanDerWaalsContact CD1-SD 3.51Å; A289-M293 WeakPolarHBondContact O-CG 3.14Å; A289-M293 PolarHBondContact O-N 3.27Å; I290-M293 PolarHBondContact O-N 2.87Å; A291-M293 VanDerWaalsContact C-N 3.34Å; A291-M293 PolarHBondContact O-N 3.5Å; M293-A295 VanDerWaalsContact C-N 3.34Å; M293-G296 WeakPolarHBondContact O-CA 3.38Å; M293-G296 PolarHBondContact O-N 2.88Å; M293-G296 VanDerWaalsContact O-N 3.14Å; M293-V297 WeakPolarHBondContact O-CG2 3.44Å; M293-V297 PolarHBondContact O-N 3.39Å
294L91.3Very high85.5Confident95 Ų9556 Ų5650%0.49732%0.321SS..Hα-helixtrans-62.5-42.6176.6-71.4175000111.4I290 A291 G296 V297 V298 F360I290-L294 HydrophobicContact CG2-CD1 3.8Å; I290-L294 HydrophobicContact CG2-CG 4.27Å; I290-L294 WeakPolarHBondContact O-CB 3.41Å; I290-L294 WeakPolarHBondContact O-CG 3.38Å; I290-L294 PolarHBondContact O-N 2.99Å; A291-L294 PolarHBondContact O-N 3.14Å; L294-G296 VanDerWaalsContact C-N 3.26Å; L294-G296 PolarHBondContact O-N 3.48Å; L294-V297 PolarHBondContact O-N 2.87Å; L294-V298 WeakPolarHBondContact O-CB 3.39Å; L294-V298 VanDerWaalsContact O-CG2 3.29Å; L294-V298 WeakPolarHBondContact O-CG2 3.41Å; L294-V298 PolarHBondContact O-N 3.21Å; L294-F360 HydrophobicContact CB-CZ 4.21Å
295A88.4Confident83.4Confident2 Ų261 Ų612%0.01735%0.354CS..Hα-helixtrans-56.2-43.5172.600000111.2A291 V292 M293 V298 L299 F360 L363A291-A295 WeakPolarHBondContact O-CB 3.13Å; A291-A295 PolarHBondContact O-N 2.93Å; V292-A295 WeakPolarHBondContact O-CB 3.32Å; V292-A295 PolarHBondContact O-N 3.48Å; M293-A295 VanDerWaalsContact C-N 3.34Å; A295-V298 PolarHBondContact O-N 3.11Å; A295-L299 WeakPolarHBondContact O-CB 3.42Å; A295-L299 WeakPolarHBondContact O-CG 3.25Å; A295-L299 PolarHBondContact O-N 3.11Å; A295-F360 VanDerWaalsContact CA-CE1 3.49Å; A295-F360 HydrophobicContact CB-CD1 3.23Å; A295-F360 HydrophobicContact CB-CE1 3.6Å; A295-F360 HydrophobicContact CB-CG 4.11Å; A295-L363 HydrophobicContact CB-CB 4.33Å; A295-L363 HydrophobicContact CB-CD2 3.53Å; A295-L363 WeakPolarHBondContact O-CD2 3.49Å
296G86.7Confident81Confident28 Ų2869 Ų6929%0.28939%0.392SS..Hα-helixtrans-58.3-49.1177.200000112.2V292 M293 L294 L299 A300 L363V292-G296 PolarHBondContact O-N 3.17Å; M293-G296 WeakPolarHBondContact O-CA 3.38Å; M293-G296 PolarHBondContact O-N 2.88Å; M293-G296 VanDerWaalsContact O-N 3.14Å; L294-G296 VanDerWaalsContact C-N 3.26Å; L294-G296 PolarHBondContact O-N 3.48Å; G296-L299 PolarHBondContact O-N 3.42Å; G296-A300 WeakPolarHBondContact O-CB 3.4Å; G296-A300 PolarHBondContact O-N 3.47Å; G296-L363 VanDerWaalsContact N-CD2 3.3Å
297V86.9Confident78.7Confident101 Ų10172.9 Ų72.961%0.61242%0.419SS*.Hα-helixtrans-63-45.8177.8175.40000111.1M293 L294 A300 W301M293-V297 WeakPolarHBondContact O-CG2 3.44Å; M293-V297 PolarHBondContact O-N 3.39Å; L294-V297 PolarHBondContact O-N 2.87Å; V297-A300 PolarHBondContact O-N 3.21Å; V297-W301 PolarHBondContact O-N 3.08Å
298V86.2Confident76.2Confident71 Ų7184.5 Ų84.543%0.4346%0.46SS..Hα-helixtrans-62.6-44.5179.2170.10000111.1L294 A295 W301 L302L294-V298 WeakPolarHBondContact O-CB 3.39Å; L294-V298 VanDerWaalsContact O-CG2 3.29Å; L294-V298 WeakPolarHBondContact O-CG2 3.41Å; L294-V298 PolarHBondContact O-N 3.21Å; A295-V298 PolarHBondContact O-N 3.11Å; V298-W301 PolarHBondContact O-N 3.48Å; V298-L302 HydrophobicContact CG1-CD1 3.62Å; V298-L302 HydrophobicContact CG1-CG 4.39Å; V298-L302 WeakPolarHBondContact O-CB 3.42Å; V298-L302 WeakPolarHBondContact O-CG 3.35Å; V298-L302 PolarHBondContact O-N 3.37Å
299L81.7Confident74.4Confident59 Ų5984.3 Ų84.331%0.30947%0.469SS..Hα-helixtrans-66.5-37.2176.4-76.3-166.5000112.6A295 G296 W301 L302 A303 L363 F364A295-L299 WeakPolarHBondContact O-CB 3.42Å; A295-L299 WeakPolarHBondContact O-CG 3.25Å; A295-L299 PolarHBondContact O-N 3.11Å; G296-L299 PolarHBondContact O-N 3.42Å; L299-W301 VanDerWaalsContact C-N 3.28Å; L299-W301 PolarHBondContact O-N 3.42Å; L299-L302 PolarHBondContact O-N 3.04Å; L299-A303 WeakPolarHBondContact O-CB 3.33Å; L299-A303 PolarHBondContact O-N 3.39Å; L299-L363 HydrophobicContact CB-CD2 4.23Å; L299-L363 HydrophobicContact CD1-CD2 3.29Å; L299-L363 HydrophobicContact CD1-CG 3.69Å; L299-L363 HydrophobicContact CG-CD2 3.8Å; L299-F364 HydrophobicContact CD1-CD1 4.42Å; L299-F364 HydrophobicContact CD1-CE1 3.85Å; L299-F364 HydrophobicContact CD1-CZ 3.95Å; L299-F364 HydrophobicContact CD2-CE1 3.86Å; L299-F364 HydrophobicContact CD2-CZ 3.81Å; L299-F364 HydrophobicContact CG-CE1 4.42Å; L299-F364 HydrophobicContact CG-CZ 4.23Å
300A80Confident72.8Confident76 Ų7690.1 Ų90.163%0.62850%0.499SS*.Hα-helixtrans-63.5-36.8175.300000111.6G296 V297G296-A300 WeakPolarHBondContact O-CB 3.4Å; G296-A300 PolarHBondContact O-N 3.47Å; V297-A300 PolarHBondContact O-N 3.21Å
301W77Confident71.6Confident224 Ų22488.8 Ų88.885%0.84850%0.496SS*.Hα-helixtrans-74.6-37.6177.5-164.766.9000113V297 V298 L299V297-W301 PolarHBondContact O-N 3.08Å; V298-W301 PolarHBondContact O-N 3.48Å; L299-W301 VanDerWaalsContact C-N 3.28Å; L299-W301 PolarHBondContact O-N 3.42Å
302L76.9Confident70.6Confident105 Ų10591.3 Ų91.355%0.5551%0.512SS..Hα-helixtrans-79.3-15.9177.7-71.5169.3000113.7V298 L299 S304V298-L302 HydrophobicContact CG1-CD1 3.62Å; V298-L302 HydrophobicContact CG1-CG 4.39Å; V298-L302 WeakPolarHBondContact O-CB 3.42Å; V298-L302 WeakPolarHBondContact O-CG 3.35Å; V298-L302 PolarHBondContact O-N 3.37Å; L299-L302 PolarHBondContact O-N 3.04Å; L302-S304 VanDerWaalsContact C-N 3.31Å; L302-S304 PolarHBondContact O-N 3.06Å
303A70.1Confident69.8Low69 Ų6992.9 Ų92.957%0.5752%0.52SS*.  trans-66.489.4-179.600000110.5L299L299-A303 WeakPolarHBondContact O-CB 3.33Å; L299-A303 PolarHBondContact O-N 3.39Å
304S49.7Very low69.4Low105 Ų10594.5 Ų94.573%0.73452%0.523SS*.  trans-69.5126.4164.8-61.90000108.7L302L302-S304 VanDerWaalsContact C-N 3.31Å; L302-S304 PolarHBondContact O-N 3.06Å
305P48.8Very low69Low111 Ų11190.7 Ų90.772%0.72150%0.503SS*.SBendtrans-61.6142.9167.626.7-30.1000107.6
306E39.7Very low68.9Low190 Ų19092.6 Ų92.689%0.88851%0.51SS*.  trans80.499.5174.3-52.6174.3142.500116.4
307S44.4Very low69Low85 Ų8594.9 Ų94.959%0.59452%0.515SS*.  trans-145.5112149-175.60000109.8G309 R314S307-G309 PolarHBondContact O-N 3.22Å; S307-R314 PolarHBondContact O-NH1 3.27Å; S307-R314 PolarHBondContact O-NH2 2.96Å; S307-R314 PolarHBondContact OG-NH2 3.41Å
308R42.8Very low69Low266 Ų26694.7 Ų94.7100%1.00451%0.506SS*.  trans-74.653.9177.5-75.1176.5167.3157.1-3.8112.4
309G51.6Low69.1Low39 Ų3991.3 Ų91.340%0.40249%0.486SS..  trans-95.6161.2177.300000112.8S307 S311S307-G309 PolarHBondContact O-N 3.22Å; G309-S311 PolarHBondContact O-N 3.38Å; G309-S311 VanDerWaalsContact O-N 3.07Å
310N57.8Low69.6Low123 Ų12388.8 Ų88.866%0.65847%0.473SS*.  trans-57.8112.5178.1-153.6-2.4000110.4T312 L313 R314N310-T312 PolarHBondContact O-N 3.47Å; N310-T312 VanDerWaalsContact O-N 3.12Å; N310-L313 PolarHBondContact O-N 3.33Å; N310-R314 PolarHBondContact O-N 2.89Å
311S68.8Low70.2Confident46 Ų4689.8 Ų89.832%0.32246%0.464SS..Hα-helixtrans-61.5-28.5-165-178.50000113.2G309 V315 R375G309-S311 PolarHBondContact O-N 3.38Å; G309-S311 VanDerWaalsContact O-N 3.07Å; S311-V315 WeakPolarHBondContact O-CG2 3.49Å; S311-R375 PolarHBondContact OG-NH1 2.91Å
312T72.6Confident70.9Confident57 Ų5779.1 Ų79.135%0.3542%0.423SS..Hα-helixtrans-78.2-46.7-177.1510000112.4N310 R314 V315 W316N310-T312 PolarHBondContact O-N 3.47Å; N310-T312 VanDerWaalsContact O-N 3.12Å; T312-R314 VanDerWaalsContact C-N 3.27Å; T312-R314 PolarHBondContact O-N 3.47Å; T312-V315 WeakPolarHBondContact O-CB 3.3Å; T312-V315 PolarHBondContact O-N 2.86Å; T312-V315 VanDerWaalsContact O-N 3.09Å; T312-W316 VanDerWaalsContact O-CD1 3.29Å; T312-W316 PolarHBondContact O-N 2.93Å; T312-W316 VanDerWaalsContact O-N 3.16Å
313L74.8Confident71.8Confident36 Ų3674.2 Ų74.219%0.18840%0.398CS..Hα-helixtrans-58.7-41.6178.2179.462.1000111.2N310 V315 W316 L317 A440N310-L313 PolarHBondContact O-N 3.33Å; L313-V315 VanDerWaalsContact C-N 3.3Å; L313-V315 PolarHBondContact O-N 2.99Å; L313-W316 PolarHBondContact O-N 3.31Å; L313-L317 HydrophobicContact CD1-CD1 4.22Å; L313-L317 HydrophobicContact CD1-CG 4.26Å; L313-L317 HydrophobicContact CG-CD1 3.93Å; L313-L317 HydrophobicContact CG-CG 4.4Å; L313-L317 WeakPolarHBondContact O-CB 3.5Å; L313-L317 VanDerWaalsContact O-CG 3.32Å; L313-L317 WeakPolarHBondContact O-CG 3.49Å; L313-L317 PolarHBondContact O-N 2.63Å; L313-A440 HydrophobicContact CD1-CB 3.84Å
314R81.7Confident73Confident97 Ų9774 Ų7437%0.36639%0.387SS..Hα-helixtrans-60.6-39.6176.8-176.3-178.7-63.7169.90.6112.4S307 N310 T312 K318S307-R314 PolarHBondContact O-NH1 3.27Å; S307-R314 PolarHBondContact O-NH2 2.96Å; S307-R314 PolarHBondContact OG-NH2 3.41Å; N310-R314 PolarHBondContact O-N 2.89Å; T312-R314 VanDerWaalsContact C-N 3.27Å; T312-R314 PolarHBondContact O-N 3.47Å; R314-K318 WeakPolarHBondContact O-CG 3.38Å; R314-K318 PolarHBondContact O-N 3.23Å
315V83.4Confident75.2Confident14 Ų1470.3 Ų70.39%0.08536%0.358CS..Hα-helixtrans-63-49.5178.4166.60000110L244 S311 T312 L313 L317 K318 F319 V368 Q372L244-V315 HydrophobicContact CD1-CG1 4.31Å; S311-V315 WeakPolarHBondContact O-CG2 3.49Å; T312-V315 WeakPolarHBondContact O-CB 3.3Å; T312-V315 PolarHBondContact O-N 2.86Å; T312-V315 VanDerWaalsContact O-N 3.09Å; L313-V315 VanDerWaalsContact C-N 3.3Å; L313-V315 PolarHBondContact O-N 2.99Å; V315-L317 PolarHBondContact O-N 2.83Å; V315-K318 PolarHBondContact O-N 2.86Å; V315-F319 PolarHBondContact O-N 2.93Å; V315-V368 HydrophobicContact CB-CG1 4.35Å; V315-V368 HydrophobicContact CG1-CG1 3.77Å; V315-V368 HydrophobicContact CG2-CG1 4.37Å; V315-Q372 HydrophobicContact CG1-CG 3.91Å; V315-Q372 HydrophobicContact CG2-CG 4.08Å; V315-Q372 VanDerWaalsContact CG2-NE2 3.31Å
316W86.4Confident77.4Confident42 Ų4265.1 Ų65.116%0.15932%0.324CS..Hα-helixtrans-63.5-39.5178.7-73.8110000113.1L243 L244 T312 L313 F319 A320 I436 A440L243-W316 HydrophobicContact CB-CH2 4.38Å; L243-W316 HydrophobicContact CD2-CH2 3.14Å; L243-W316 HydrophobicContact CD2-CZ2 3.89Å; L243-W316 HydrophobicContact CD2-CZ3 3.74Å; L243-W316 HydrophobicContact CG-CH2 4.31Å; L244-W316 HydrophobicContact CD1-CH2 4.35Å; T312-W316 VanDerWaalsContact O-CD1 3.29Å; T312-W316 PolarHBondContact O-N 2.93Å; T312-W316 VanDerWaalsContact O-N 3.16Å; L313-W316 PolarHBondContact O-N 3.31Å; W316-F319 PolarHBondContact O-N 2.92Å; W316-A320 WeakPolarHBondContact O-CB 3.5Å; W316-A320 PolarHBondContact O-N 3.16Å; W316-I436 HydrophobicContact CB-CG2 4.44Å; W316-I436 HydrophobicContact CE3-CG2 3.74Å; W316-A440 HydrophobicContact CB-CB 4.16Å
317L87.4Confident80.1Confident76 Ų7656 Ų5640%0.39828%0.282SS..Hα-helixtrans-65.7-39.1175.9-71.6172.8000112.4L313 V315 A320 F321L313-L317 HydrophobicContact CD1-CD1 4.22Å; L313-L317 HydrophobicContact CD1-CG 4.26Å; L313-L317 HydrophobicContact CG-CD1 3.93Å; L313-L317 HydrophobicContact CG-CG 4.4Å; L313-L317 WeakPolarHBondContact O-CB 3.5Å; L313-L317 VanDerWaalsContact O-CG 3.32Å; L313-L317 WeakPolarHBondContact O-CG 3.49Å; L313-L317 PolarHBondContact O-N 2.63Å; V315-L317 PolarHBondContact O-N 2.83Å; L317-A320 PolarHBondContact O-N 3.47Å; L317-F321 WeakPolarHBondContact O-CB 3.37Å; L317-F321 PolarHBondContact O-N 3.24Å
318K87.8Confident82.6Confident98 Ų9854.5 Ų54.543%0.42627%0.271SS..Hα-helixtrans-62.9-44.3173.1-75.1-177.8175.8-162.40111.4R314 V315 F321 G322 V368R314-K318 WeakPolarHBondContact O-CG 3.38Å; R314-K318 PolarHBondContact O-N 3.23Å; V315-K318 PolarHBondContact O-N 2.86Å; K318-F321 PolarHBondContact O-N 3.49Å; K318-G322 PolarHBondContact O-N 3.47Å; K318-V368 HydrophobicContact CB-CG2 4.26Å; K318-V368 HydrophobicContact CD-CG2 3.95Å
319F88.3Confident85.2Confident0 Ų041.9 Ų41.90%022%0.223CC..Hα-helixtrans-62.7-44.7177.4-127.2-99.5000112.1L244 V247 V315 W316 F321 G322 L323 I365 V368 A369L244-F319 HydrophobicContact CD1-CD2 3.73Å; L244-F319 HydrophobicContact CD1-CE1 4.38Å; L244-F319 HydrophobicContact CD1-CE2 3.54Å; L244-F319 HydrophobicContact CD1-CG 4.21Å; L244-F319 HydrophobicContact CD1-CZ 3.86Å; L244-F319 HydrophobicContact CG-CE2 4.06Å; L244-F319 HydrophobicContact CG-CZ 4.13Å; V247-F319 HydrophobicContact CB-CD1 4.2Å; V247-F319 HydrophobicContact CB-CE1 3.81Å; V247-F319 HydrophobicContact CG1-CD1 3.55Å; V247-F319 HydrophobicContact CG1-CE1 3.52Å; V315-F319 PolarHBondContact O-N 2.93Å; W316-F319 PolarHBondContact O-N 2.92Å; F319-F321 VanDerWaalsContact C-N 3.31Å; F319-F321 PolarHBondContact O-N 3.13Å; F319-G322 PolarHBondContact O-N 2.78Å; F319-L323 PolarHBondContact O-N 3.33Å; F319-I365 HydrophobicContact CB-CD1 4.44Å; F319-I365 HydrophobicContact CD1-CD1 3.62Å; F319-I365 HydrophobicContact CD2-CD1 4Å; F319-I365 HydrophobicContact CE1-CD1 3.79Å; F319-I365 HydrophobicContact CE1-CG2 4.07Å; F319-I365 HydrophobicContact CE2-CB 4.37Å; F319-I365 HydrophobicContact CE2-CD1 4.16Å; F319-I365 HydrophobicContact CE2-CG2 3.93Å; F319-I365 WeakPolarHBondContact CE2-O 3.36Å; F319-I365 HydrophobicContact CG-CD1 3.76Å; F319-I365 HydrophobicContact CZ-CB 4.4Å; F319-I365 HydrophobicContact CZ-CD1 4.09Å; F319-I365 HydrophobicContact CZ-CG2 3.55Å; F319-V368 HydrophobicContact CD2-CG1 4.26Å; F319-A369 HydrophobicContact CE2-CB 4.15Å
320A91.6Very high87.3Confident6 Ų640 Ų405%0.0520%0.204CC..Hα-helixtrans-61.3-39.5175.500000111.8W316 L317 L323 L324 V433 I436 V437W316-A320 WeakPolarHBondContact O-CB 3.5Å; W316-A320 PolarHBondContact O-N 3.16Å; L317-A320 PolarHBondContact O-N 3.47Å; A320-L323 PolarHBondContact O-N 2.97Å; A320-L324 WeakPolarHBondContact O-CB 3.37Å; A320-L324 PolarHBondContact O-N 3.32Å; A320-V433 HydrophobicContact CB-CG1 4.43Å; A320-I436 HydrophobicContact CB-CG2 4.02Å; A320-V437 HydrophobicContact CB-CG2 4.08Å
321F92Very high89.1Confident96 Ų9637 Ų3742%0.42119%0.187SC..Hα-helixtrans-65.5-42.4175.4-174.6-106.3000112.3L317 K318 F319 L324 L325 F364L317-F321 WeakPolarHBondContact O-CB 3.37Å; L317-F321 PolarHBondContact O-N 3.24Å; K318-F321 PolarHBondContact O-N 3.49Å; F319-F321 VanDerWaalsContact C-N 3.31Å; F319-F321 PolarHBondContact O-N 3.13Å; F321-L324 HydrophobicContact CD2-CD2 4.49Å; F321-L324 WeakPolarHBondContact O-CB 3.46Å; F321-L324 PolarHBondContact O-N 3.38Å; F321-L325 HydrophobicContact CD1-CD1 4.08Å; F321-L325 HydrophobicContact CE1-CD1 3.6Å; F321-L325 HydrophobicContact CE1-CG 4.14Å; F321-L325 HydrophobicContact CZ-CD1 4.07Å; F321-L325 HydrophobicContact CZ-CD2 4.26Å; F321-L325 HydrophobicContact CZ-CG 4.21Å; F321-L325 WeakPolarHBondContact O-CG 3.44Å; F321-L325 PolarHBondContact O-N 3.3Å; F321-F364 AromaticContact CD1-CD1 3.94Å; F321-F364 HydrophobicContact CD1-CD1 3.94Å; F321-F364 HydrophobicContact CD1-CD2 4.03Å; F321-F364 AromaticContact CD1-CE1 3.81Å; F321-F364 HydrophobicContact CD1-CE1 3.81Å; F321-F364 AromaticContact CD1-CE2 3.91Å; F321-F364 HydrophobicContact CD1-CE2 3.91Å; F321-F364 HydrophobicContact CD1-CG 4.04Å; F321-F364 AromaticContact CD1-CZ 3.8Å; F321-F364 HydrophobicContact CD1-CZ 3.8Å; F321-F364 HydrophobicContact CE1-CD2 4.27Å; F321-F364 AromaticContact CE1-CE1 3.99Å; F321-F364 HydrophobicContact CE1-CE1 3.99Å; F321-F364 AromaticContact CE1-CE2 3.71Å; F321-F364 HydrophobicContact CE1-CE2 3.71Å; F321-F364 AromaticContact CE1-CZ 3.55Å; F321-F364 HydrophobicContact CE1-CZ 3.55Å
322G93Very high90.4Very high0 Ų037.5 Ų37.50%019%0.186CC..Hα-helixtrans-58.5-49.5172.500000111.9K318 F319 L324 L325 M326 A361K318-G322 PolarHBondContact O-N 3.47Å; F319-G322 PolarHBondContact O-N 2.78Å; G322-L324 VanDerWaalsContact C-N 3.31Å; G322-L324 PolarHBondContact O-N 2.9Å; G322-L325 PolarHBondContact O-N 3.06Å; G322-M326 PolarHBondContact O-N 3.34Å; G322-A361 WeakPolarHBondContact O-CB 3.34Å
323L94.4Very high91.5Very high3 Ų334.8 Ų34.82%0.01617%0.169CC..Hα-helixtrans-62.8-35.2176.5-72.1171000113.1V247 F251 F319 A320 M326 A327 I365 T429 V433 I436V247-L323 HydrophobicContact CG1-CD1 3.61Å; F251-L323 HydrophobicContact CB-CD2 4.03Å; F251-L323 HydrophobicContact CD2-CD2 4.17Å; F319-L323 PolarHBondContact O-N 3.33Å; A320-L323 PolarHBondContact O-N 2.97Å; L323-M326 WeakPolarHBondContact O-CB 3.48Å; L323-M326 PolarHBondContact O-N 3.04Å; L323-A327 WeakPolarHBondContact O-CB 3.48Å; L323-A327 PolarHBondContact O-N 2.87Å; L323-I365 HydrophobicContact CG-CD1 4.45Å; L323-T429 HydrophobicContact CB-CG2 4.15Å; L323-T429 HydrophobicContact CD2-CG2 4.1Å; L323-T429 WeakPolarHBondContact O-CG2 3.29Å; L323-V433 HydrophobicContact CB-CG2 3.42Å; L323-V433 VanDerWaalsContact CB-CG2 3.42Å; L323-I436 HydrophobicContact CD1-CD1 3.41Å; L323-I436 VanDerWaalsContact CD1-CD1 3.41Å
324L95.7Very high92.5Very high65 Ų6533.5 Ų33.534%0.3416%0.163SC..Hα-helixtrans-61.7-47.4174.5-174.582.2000110.9A320 F321 G322 M326 A327 C328 L430 V433A320-L324 WeakPolarHBondContact O-CB 3.37Å; A320-L324 PolarHBondContact O-N 3.32Å; F321-L324 HydrophobicContact CD2-CD2 4.49Å; F321-L324 WeakPolarHBondContact O-CB 3.46Å; F321-L324 PolarHBondContact O-N 3.38Å; G322-L324 VanDerWaalsContact C-N 3.31Å; G322-L324 PolarHBondContact O-N 2.9Å; L324-M326 VanDerWaalsContact C-N 3.31Å; L324-M326 PolarHBondContact O-N 3.29Å; L324-A327 WeakPolarHBondContact O-CB 3.24Å; L324-A327 PolarHBondContact O-N 3.41Å; L324-C328 PolarHBondContact O-N 3.45Å; L324-C328 PolarHBondContact O-SG 3.41Å; L324-C328 VanDerWaalsContact O-SG 3.34Å; L324-L430 HydrophobicContact CD1-CD2 3.91Å; L324-V433 HydrophobicContact CB-CG2 4.41Å; L324-V433 HydrophobicContact CD1-CG1 4.32Å
325L95.5Very high93.1Very high27 Ų2735 Ų3514%0.14117%0.173CC..Hα-helixtrans-60.8-41.5176.5-70.9177.9000111.8F321 G322 C328 G329 L357 F360 A361 F364F321-L325 HydrophobicContact CD1-CD1 4.08Å; F321-L325 HydrophobicContact CE1-CD1 3.6Å; F321-L325 HydrophobicContact CE1-CG 4.14Å; F321-L325 HydrophobicContact CZ-CD1 4.07Å; F321-L325 HydrophobicContact CZ-CD2 4.26Å; F321-L325 HydrophobicContact CZ-CG 4.21Å; F321-L325 WeakPolarHBondContact O-CG 3.44Å; F321-L325 PolarHBondContact O-N 3.3Å; G322-L325 PolarHBondContact O-N 3.06Å; L325-C328 PolarHBondContact O-N 3.26Å; L325-G329 PolarHBondContact O-N 2.81Å; L325-L357 HydrophobicContact CD2-CD2 4.35Å; L325-F360 HydrophobicContact CD1-CB 4.14Å; L325-A361 HydrophobicContact CB-CB 3.74Å; L325-F364 HydrophobicContact CD1-CD2 4.06Å; L325-F364 HydrophobicContact CD1-CE2 3.86Å
326M95.6Very high93.5Very high1 Ų134.3 Ų34.31%0.00517%0.169CC..Hα-helixtrans-59.7-46.1173.8-178.257.370.800111.3F251 L254 A255 G322 L323 L324 G329 F330 M358 A361 T429F251-M326 HydrophobicContact CD2-CB 4.23Å; F251-M326 HydrophobicContact CD2-CE 3.94Å; F251-M326 HydrophobicContact CD2-CG 4.3Å; F251-M326 HydrophobicContact CE1-CE 4.33Å; F251-M326 HydrophobicContact CE2-CB 4Å; F251-M326 HydrophobicContact CE2-CE 3.22Å; F251-M326 HydrophobicContact CE2-CG 4.23Å; F251-M326 HydrophobicContact CZ-CE 3.44Å; F251-M326 VanDerWaalsContact CZ-CE 3.44Å; L254-M326 HydrophobicContact CB-CG 4.08Å; L254-M326 HydrophobicContact CB-SD 4.16Å; L254-M326 HydrophobicContact CD1-CG 4.09Å; A255-M326 HydrophobicContact CB-CE 3.74Å; G322-M326 PolarHBondContact O-N 3.34Å; L323-M326 WeakPolarHBondContact O-CB 3.48Å; L323-M326 PolarHBondContact O-N 3.04Å; L324-M326 VanDerWaalsContact C-N 3.31Å; L324-M326 PolarHBondContact O-N 3.29Å; M326-G329 WeakPolarHBondContact O-CA 3.47Å; M326-G329 PolarHBondContact O-N 3.45Å; M326-F330 HydrophobicContact CG-CD2 4.19Å; M326-F330 HydrophobicContact CG-CE2 4.25Å; M326-F330 WeakPolarHBondContact O-CD2 3.2Å; M326-F330 PolarHBondContact O-N 3.06Å; M326-F330 HydrophobicContact SD-CD2 3.87Å; M326-F330 HydrophobicContact SD-CE2 3.6Å; M326-F330 VanDerWaalsContact SD-CE2 3.6Å; M326-M358 HydrophobicContact CE-CB 4.02Å; M326-M358 HydrophobicContact CE-CE 4.27Å; M326-M358 HydrophobicContact CE-CG 4.33Å; M326-M358 HydrophobicContact SD-CB 4.05Å; M326-M358 HydrophobicContact SD-CE 3.59Å; M326-M358 VanDerWaalsContact SD-CE 3.59Å; M326-M358 HydrophobicContact SD-CG 3.68Å; M326-M358 HydrophobicContact SD-SD 4.39Å; M326-A361 HydrophobicContact CB-CB 4.17Å; M326-A361 HydrophobicContact CE-CB 4.43Å; M326-T429 HydrophobicContact CB-CG2 4.47Å; M326-T429 HydrophobicContact CG-CG2 4.5Å
327A96.6Very high93.8Very high0 Ų032.3 Ų32.30%016%0.161CC..Hα-helixtrans-63.8-42.3178.300000112.5L323 L324 G329 F330 M331 T429 L430L323-A327 WeakPolarHBondContact O-CB 3.48Å; L323-A327 PolarHBondContact O-N 2.87Å; L324-A327 WeakPolarHBondContact O-CB 3.24Å; L324-A327 PolarHBondContact O-N 3.41Å; A327-G329 VanDerWaalsContact C-N 3.3Å; A327-G329 PolarHBondContact O-N 2.9Å; A327-F330 PolarHBondContact O-N 3.06Å; A327-M331 WeakPolarHBondContact O-CB 3.26Å; A327-M331 VanDerWaalsContact O-CG 3.27Å; A327-M331 WeakPolarHBondContact O-CG 3.29Å; A327-M331 PolarHBondContact O-N 3.21Å; A327-T429 HydrophobicContact CB-CG2 3.78Å; A327-L430 HydrophobicContact CB-CD2 3.96Å; A327-L430 HydrophobicContact CB-CG 3.79Å
328C96.6Very high93.9Very high53 Ų5336.8 Ų36.836%0.35817%0.173SC..Hα-helixtrans-60.9-40.1173-69.80000111.6L324 L325 M331 L332 L357L324-C328 PolarHBondContact O-N 3.45Å; L324-C328 PolarHBondContact O-SG 3.41Å; L324-C328 VanDerWaalsContact O-SG 3.34Å; L325-C328 PolarHBondContact O-N 3.26Å; C328-M331 PolarHBondContact O-N 2.97Å; C328-L332 WeakPolarHBondContact O-CG 3.48Å; C328-L332 PolarHBondContact O-N 2.78Å; C328-L357 HydrophobicContact CB-CD1 4.04Å
329G96.8Very high93.9Very high0 Ų035.9 Ų35.90%017%0.17CC..Hα-helixtrans-55.6-55.4172.500000111.7L325 M326 A327 M331 L332 L333L325-G329 PolarHBondContact O-N 2.81Å; M326-G329 WeakPolarHBondContact O-CA 3.47Å; M326-G329 PolarHBondContact O-N 3.45Å; A327-G329 VanDerWaalsContact C-N 3.3Å; A327-G329 PolarHBondContact O-N 2.9Å; G329-M331 VanDerWaalsContact C-N 3.31Å; G329-M331 PolarHBondContact O-N 3.45Å; G329-L332 WeakPolarHBondContact O-CB 3.11Å; G329-L332 PolarHBondContact O-N 3.31Å; G329-L332 VanDerWaalsContact O-N 3.15Å; G329-L333 WeakPolarHBondContact O-CG 3.08Å; G329-L333 PolarHBondContact O-N 2.84Å
330F96.4Very high93.9Very high0 Ų035.9 Ų35.90%017%0.17CC..Hα-helixtrans-59.9-36.9176.8-88.2-78000113.7L254 Q257 I262 M326 A327 L333 A334 M358 F421 F422 M425L254-F330 HydrophobicContact CB-CE2 3.73Å; L254-F330 HydrophobicContact CB-CZ 4.25Å; L254-F330 HydrophobicContact CD2-CE2 4.01Å; L254-F330 HydrophobicContact CD2-CZ 4.2Å; L254-F330 HydrophobicContact CG-CE2 4.41Å; L254-F330 WeakPolarHBondContact O-CZ 3.3Å; Q257-F330 HydrophobicContact CB-CZ 4.09Å; Q257-F330 HydrophobicContact CG-CE1 4.5Å; Q257-F330 HydrophobicContact CG-CZ 4.01Å; I262-F330 HydrophobicContact CD1-CE1 4.43Å; I262-F330 HydrophobicContact CD1-CZ 4.43Å; M326-F330 HydrophobicContact CG-CD2 4.19Å; M326-F330 HydrophobicContact CG-CE2 4.25Å; M326-F330 WeakPolarHBondContact O-CD2 3.2Å; M326-F330 PolarHBondContact O-N 3.06Å; M326-F330 HydrophobicContact SD-CD2 3.87Å; M326-F330 HydrophobicContact SD-CE2 3.6Å; M326-F330 VanDerWaalsContact SD-CE2 3.6Å; A327-F330 PolarHBondContact O-N 3.06Å; F330-L333 PolarHBondContact O-N 3.04Å; F330-A334 WeakPolarHBondContact O-CB 3.33Å; F330-A334 PolarHBondContact O-N 2.91Å; F330-M358 HydrophobicContact CD2-CE 4.32Å; F330-M358 HydrophobicContact CE2-CE 3.63Å; F330-M358 HydrophobicContact CZ-CE 3.92Å; F330-F421 HydrophobicContact CE1-CE1 4.37Å; F330-F422 HydrophobicContact CD1-CB 4.4Å; F330-F422 AromaticContact CD1-CD1 3.9Å; F330-F422 HydrophobicContact CD1-CD1 3.9Å; F330-F422 AromaticContact CE1-CD1 3.99Å; F330-F422 HydrophobicContact CE1-CD1 3.99Å; F330-M425 HydrophobicContact CD1-CB 3.65Å; F330-M425 HydrophobicContact CD1-CG 4.37Å; F330-M425 HydrophobicContact CD2-CB 4.45Å; F330-M425 HydrophobicContact CE1-CB 3.87Å; F330-M425 HydrophobicContact CE1-CG 4.14Å; F330-M425 HydrophobicContact CG-CB 3.96Å; F330-M425 HydrophobicContact CZ-CB 4.37Å
331M96.4Very high93.5Very high61 Ų6138.4 Ų38.430%0.319%0.19SC..Hα-helixtrans-66.1-37176.1-74.8-71.7170.200112.6A327 C328 G329 A334 F335 E427 L430A327-M331 WeakPolarHBondContact O-CB 3.26Å; A327-M331 VanDerWaalsContact O-CG 3.27Å; A327-M331 WeakPolarHBondContact O-CG 3.29Å; A327-M331 PolarHBondContact O-N 3.21Å; C328-M331 PolarHBondContact O-N 2.97Å; G329-M331 VanDerWaalsContact C-N 3.31Å; G329-M331 PolarHBondContact O-N 3.45Å; M331-A334 PolarHBondContact O-N 3.17Å; M331-F335 WeakPolarHBondContact O-CB 3.43Å; M331-F335 PolarHBondContact O-N 3.2Å; M331-E427 HydrophobicContact CE-CB 4.34Å; M331-E427 HydrophobicContact CE-CG 3.57Å; M331-L430 HydrophobicContact CE-CD1 4.13Å
332L95.8Very high93Very high56 Ų5637.5 Ų37.529%0.29320%0.201SC..Hα-helixtrans-65.1-40.2171.4-72.8179.7000111.5C328 G329 A334 F335 D336 V350 L357C328-L332 WeakPolarHBondContact O-CG 3.48Å; C328-L332 PolarHBondContact O-N 2.78Å; G329-L332 WeakPolarHBondContact O-CB 3.11Å; G329-L332 PolarHBondContact O-N 3.31Å; G329-L332 VanDerWaalsContact O-N 3.15Å; L332-A334 VanDerWaalsContact C-N 3.35Å; L332-F335 WeakPolarHBondContact O-CB 3.23Å; L332-F335 PolarHBondContact O-N 2.77Å; L332-D336 WeakPolarHBondContact O-CB 3.25Å; L332-D336 PolarHBondContact O-N 3.42Å; L332-V350 HydrophobicContact CB-CG1 4.44Å; L332-L357 HydrophobicContact CD1-CD1 3.58Å
333L95.5Very high92.4Very high0 Ų042.9 Ų42.90%023%0.23CC..Hα-helixtrans-64.7-39.1174.8-58.8-175.4000112I262 G329 F330 F335 D336 A337 M351 M358 F422I262-L333 HydrophobicContact CD1-CD1 3.56Å; I262-L333 HydrophobicContact CG1-CD1 3.96Å; G329-L333 WeakPolarHBondContact O-CG 3.08Å; G329-L333 PolarHBondContact O-N 2.84Å; F330-L333 PolarHBondContact O-N 3.04Å; L333-F335 VanDerWaalsContact C-N 3.35Å; L333-D336 PolarHBondContact O-N 2.63Å; L333-A337 WeakPolarHBondContact O-CB 3.36Å; L333-A337 PolarHBondContact O-N 2.92Å; L333-M351 HydrophobicContact CD2-CE 3.67Å; L333-M351 HydrophobicContact CD2-SD 3.34Å; L333-M351 WeakPolarHBondContact CD2-SD 3.44Å; L333-M358 HydrophobicContact CD1-SD 4Å; L333-F422 HydrophobicContact CB-CB 4.31Å; L333-F422 HydrophobicContact CB-CD1 4.39Å; L333-F422 HydrophobicContact CB-CD2 3.83Å; L333-F422 HydrophobicContact CB-CE2 4.22Å; L333-F422 HydrophobicContact CB-CG 3.94Å
334A94.9Very high91.5Very high9 Ų945.1 Ų45.17%0.07425%0.253CS..Hα-helixtrans-65.2-39.917500000111.8F330 M331 L332 R338 F422F330-A334 WeakPolarHBondContact O-CB 3.33Å; F330-A334 PolarHBondContact O-N 2.91Å; M331-A334 PolarHBondContact O-N 3.17Å; L332-A334 VanDerWaalsContact C-N 3.35Å; A334-R338 WeakPolarHBondContact O-CB 3.45Å; A334-R338 PolarHBondContact O-N 3.38Å; A334-F422 HydrophobicContact CB-CB 3.71Å
335F94.6Very high91Very high128 Ų12847 Ų4756%0.56126%0.26SS*.Hα-helixtrans-61.8-44.3173.4175.2-96.5000111.3M331 L332 L333 R338 H339 V350M331-F335 WeakPolarHBondContact O-CB 3.43Å; M331-F335 PolarHBondContact O-N 3.2Å; L332-F335 WeakPolarHBondContact O-CB 3.23Å; L332-F335 PolarHBondContact O-N 2.77Å; L333-F335 VanDerWaalsContact C-N 3.35Å; F335-R338 WeakPolarHBondContact O-CB 3.4Å; F335-R338 PolarHBondContact O-N 2.92Å; F335-H339 PolarHBondContact O-N 2.87Å; F335-V350 HydrophobicContact CD1-CG1 4.32Å
336D93.1Very high90.6Very high0 Ų045.8 Ų45.80%025%0.254CS..Hα-helixtrans-66.7-40.6178.4-156.626.9000112.3L332 L333 R338 H339 A340 A346 S347 V350L332-D336 WeakPolarHBondContact O-CB 3.25Å; L332-D336 PolarHBondContact O-N 3.42Å; L333-D336 PolarHBondContact O-N 2.63Å; D336-R338 VanDerWaalsContact C-N 3.32Å; D336-R338 PolarHBondContact O-N 3.3Å; D336-H339 WeakPolarHBondContact O-CB 3.26Å; D336-H339 PolarHBondContact O-N 3.46Å; D336-H339 VanDerWaalsContact O-N 3.16Å; D336-A340 PolarHBondContact O-N 3.02Å; D336-A346 WeakPolarHBondContact OD2-CB 3.4Å; D336-S347 PolarHBondContact OD1-N 3.39Å; D336-S347 VanDerWaalsContact OD2-O 3.09Å; D336-V350 HydrophobicContact CB-CB 4.17Å; D336-V350 HydrophobicContact CB-CG1 3.72Å
337A91.3Very high90.4Very high0 Ų048 Ų480%027%0.27CS..Hα-helixtrans-63.1-37.8173.500000112.4F265 L333 H339 A340 A341 I415 Q419 F422F265-A337 HydrophobicContact CE2-CB 3.83Å; F265-A337 HydrophobicContact CZ-CB 3.72Å; L333-A337 WeakPolarHBondContact O-CB 3.36Å; L333-A337 PolarHBondContact O-N 2.92Å; A337-H339 VanDerWaalsContact C-N 3.34Å; A337-A340 PolarHBondContact O-N 3.32Å; A337-A341 PolarHBondContact O-N 3.32Å; A337-I415 VanDerWaalsContact O-CG2 3.23Å; A337-I415 WeakPolarHBondContact O-CG2 3.41Å; A337-Q419 HydrophobicContact CB-CB 3.92Å; A337-Q419 HydrophobicContact CB-CG 4.45Å; A337-F422 HydrophobicContact CB-CD2 4.09Å; A337-F422 HydrophobicContact CB-CE2 4.42Å
338R90.8Very high90.2Very high169 Ų16950.2 Ų50.264%0.63828%0.281SS*.Hα-helixtrans-65.4-39173-177.4-179.6174.7179.7-1111.7A334 F335 D336 A341 A342 Q419A334-R338 WeakPolarHBondContact O-CB 3.45Å; A334-R338 PolarHBondContact O-N 3.38Å; F335-R338 WeakPolarHBondContact O-CB 3.4Å; F335-R338 PolarHBondContact O-N 2.92Å; D336-R338 VanDerWaalsContact C-N 3.32Å; D336-R338 PolarHBondContact O-N 3.3Å; R338-A341 PolarHBondContact O-N 3.45Å; R338-A342 PolarHBondContact O-N 3.07Å; R338-Q419 HydrophobicContact CB-CG 4.23Å
339H87.5Confident90Very high80 Ų8050 Ų5037%0.3729%0.287SS..Hα-helixtrans-64.6-42.5175.1-168.759000111.1F335 D336 A337 A341 A342 D343F335-H339 PolarHBondContact O-N 2.87Å; D336-H339 WeakPolarHBondContact O-CB 3.26Å; D336-H339 PolarHBondContact O-N 3.46Å; D336-H339 VanDerWaalsContact O-N 3.16Å; A337-H339 VanDerWaalsContact C-N 3.34Å; H339-A341 VanDerWaalsContact C-N 3.28Å; H339-A341 PolarHBondContact O-N 3.49Å; H339-A342 PolarHBondContact O-N 2.9Å; H339-D343 IonicContact CE1-OD2 3.34Å; H339-D343 PolarHBondContact CE1-OD2 3.13Å; H339-D343 IonicContact CG-OD2 2.94Å; H339-D343 IonicContact ND1-OD2 2.75Å; H339-D343 PolarHBondContact ND1-OD2 2.82Å; H339-D343 IonicContact NE2-OD2 3.34Å; H339-D343 PolarHBondContact O-N 2.93Å
340A87.5Confident89.9Confident0 Ų051.4 Ų51.40%030%0.296CS..Hα-helixtrans-59.4-36.5173.400000113.3D336 A337 A342 G344 A346 I415D336-A340 PolarHBondContact O-N 3.02Å; A337-A340 PolarHBondContact O-N 3.32Å; A340-A342 PolarHBondContact O-N 3.35Å; A340-G344 CarbonylContact O-C 3.29Å; A340-G344 VanDerWaalsContact O-C 3.29Å; A340-G344 WeakPolarHBondContact O-CA 3.28Å; A340-G344 PolarHBondContact O-N 3.08Å; A340-A346 HydrophobicContact CB-CB 3.8Å; A340-I415 HydrophobicContact CB-CG2 4.11Å
341A83.1Confident89.8Confident58 Ų5851.4 Ų51.448%0.47930%0.296SS..Hα-helixtrans-66.8-27.2176.200000112.8A337 R338 H339 I415A337-A341 PolarHBondContact O-N 3.32Å; R338-A341 PolarHBondContact O-N 3.45Å; H339-A341 VanDerWaalsContact C-N 3.28Å; H339-A341 PolarHBondContact O-N 3.49Å; A341-I415 HydrophobicContact CB-CG2 3.81Å
342A82Confident89.7Confident78 Ų7851.6 Ų51.665%0.64530%0.297SS*.Hα-helixtrans-88.8-48-179.800000112.5R338 H339 A340R338-A342 PolarHBondContact O-N 3.07Å; H339-A342 PolarHBondContact O-N 2.9Å; A340-A342 PolarHBondContact O-N 3.35Å
343D79.8Confident89.7Confident113 Ų11351.2 Ų51.260%0.60430%0.299SS*.Hα-helixtrans-102.2-0.4-171.9-63.3-51.5000113.2H339 Q345H339-D343 IonicContact CE1-OD2 3.34Å; H339-D343 PolarHBondContact CE1-OD2 3.13Å; H339-D343 IonicContact CG-OD2 2.94Å; H339-D343 IonicContact ND1-OD2 2.75Å; H339-D343 PolarHBondContact ND1-OD2 2.82Å; H339-D343 IonicContact NE2-OD2 3.34Å; H339-D343 PolarHBondContact O-N 2.93Å; D343-Q345 VanDerWaalsContact C-N 3.27Å; D343-Q345 PolarHBondContact O-N 2.78Å
344G77.1Confident89.8Confident49 Ų4951.2 Ų51.251%0.50530%0.299SS..SBendtrans85.6-19.6179.600000114.7A340A340-G344 CarbonylContact O-C 3.29Å; A340-G344 VanDerWaalsContact O-C 3.29Å; A340-G344 WeakPolarHBondContact O-CA 3.28Å; A340-G344 PolarHBondContact O-N 3.08Å
345Q83.8Confident89.8Confident105 Ų10551.5 Ų51.549%0.49130%0.299SS..SBendtrans-141.5143.2179.2-65.1-175.9-22.900112.4F269 N271 D343F269-Q345 CarbonylContact O-C 3.56Å; F269-Q345 WeakPolarHBondContact O-CA 3.32Å; N271-Q345 HydrophobicContact CB-CB 4.2Å; N271-Q345 PolarHBondContact ND2-OE1 3.02Å; N271-Q345 VanDerWaalsContact ND2-OE1 3.15Å; D343-Q345 VanDerWaalsContact C-N 3.27Å; D343-Q345 PolarHBondContact O-N 2.78Å
346A87.8Confident89.8Confident2 Ų246.4 Ų46.42%0.01728%0.281CS..EExtended strand (participates in β ladder)trans-81.4155.7172.100000111.5F265 F269 V270 N271 D336 A340F265-A346 HydrophobicContact CE1-CB 4.01Å; F265-A346 HydrophobicContact CZ-CB 3.9Å; F269-A346 PolarHBondContact O-N 2.71Å; V270-A346 HydrophobicContact CB-CB 4.36Å; V270-A346 HydrophobicContact CG2-CB 3.72Å; N271-A346 PolarHBondContact N-O 3.19Å; D336-A346 WeakPolarHBondContact OD2-CB 3.4Å; A340-A346 HydrophobicContact CB-CB 3.8Å
347S91.3Very high89.9Confident48 Ų4848.8 Ų48.834%0.33629%0.293SS..EExtended strand (participates in β ladder)trans-87.6122.8-178.6176.80000111.8D336 G349 V350 M351D336-S347 PolarHBondContact OD1-N 3.39Å; D336-S347 VanDerWaalsContact OD2-O 3.09Å; S347-G349 PolarHBondContact O-N 3.09Å; S347-G349 PolarHBondContact OG-N 2.96Å; S347-V350 PolarHBondContact O-N 2.76Å; S347-M351 PolarHBondContact O-N 3.47Å; S347-M351 VanDerWaalsContact O-N 3.08Å
348M91.9Very high90.1Very high46 Ų4649.1 Ų49.123%0.22730%0.295CS..Hα-helixtrans-54.8-36.3173174173.872.500112.8V270 N271 A274 V279 F284 M351 I352V270-M348 HydrophobicContact CG1-CB 4.12Å; N271-M348 WeakPolarHBondContact O-CB 3.43Å; A274-M348 HydrophobicContact CB-CE 4.04Å; V279-M348 HydrophobicContact CB-SD 4.46Å; V279-M348 HydrophobicContact CG2-SD 4.17Å; F284-M348 HydrophobicContact CE1-CG 3.94Å; F284-M348 HydrophobicContact CZ-CB 4.45Å; F284-M348 HydrophobicContact CZ-CG 3.67Å; F284-M348 HydrophobicContact CZ-SD 4.07Å; M348-M351 PolarHBondContact O-N 3.32Å; M348-I352 HydrophobicContact CG-CD1 3.7Å; M348-I352 HydrophobicContact CG-CG1 4.32Å; M348-I352 VanDerWaalsContact O-CG1 3.23Å; M348-I352 WeakPolarHBondContact O-CG1 3.22Å; M348-I352 PolarHBondContact O-N 3.24Å; M348-I352 HydrophobicContact SD-CD1 4.43Å
349G92.5Very high90.2Very high47 Ų4741.1 Ų41.149%0.48527%0.265SS..Hα-helixtrans-66.7-40.8-179.400000112.9S347 I352 S353S347-G349 PolarHBondContact O-N 3.09Å; S347-G349 PolarHBondContact OG-N 2.96Å; G349-I352 PolarHBondContact O-N 2.84Å; G349-S353 PolarHBondContact O-N 2.93Å
350V94.5Very high90.4Very high31 Ų3140.1 Ų40.119%0.18826%0.26CS..Hα-helixtrans-68.3-43.4177.7-178.20000109.8L332 F335 D336 S347 I352 S353 G354L332-V350 HydrophobicContact CB-CG1 4.44Å; F335-V350 HydrophobicContact CD1-CG1 4.32Å; D336-V350 HydrophobicContact CB-CB 4.17Å; D336-V350 HydrophobicContact CB-CG1 3.72Å; S347-V350 PolarHBondContact O-N 2.76Å; V350-I352 PolarHBondContact O-N 3.14Å; V350-S353 WeakPolarHBondContact CA-OG 3.44Å; V350-S353 PolarHBondContact O-N 3.49Å; V350-S353 VanDerWaalsContact O-N 3.15Å; V350-S353 PolarHBondContact O-OG 2.85Å; V350-G354 PolarHBondContact O-N 3.16Å
351M94.5Very high90.7Very high0 Ų040.1 Ų40.10%026%0.26CS..Hα-helixtrans-54.8-51.3173.6-175.258.653.800112.4I262 F265 I266 V270 F284 L333 S347 M348 S353 G354 L355I262-M351 HydrophobicContact CG2-SD 4.31Å; F265-M351 HydrophobicContact CD1-CE 3.39Å; F265-M351 HydrophobicContact CE1-CE 3.38Å; I266-M351 HydrophobicContact CD1-CG 3.74Å; I266-M351 HydrophobicContact CD1-SD 3.65Å; I266-M351 HydrophobicContact CG1-CE 3.98Å; I266-M351 HydrophobicContact CG1-CG 3.66Å; I266-M351 HydrophobicContact CG1-SD 3.53Å; I266-M351 VanDerWaalsContact CG1-SD 3.53Å; V270-M351 HydrophobicContact CG2-CE 3.8Å; F284-M351 HydrophobicContact CD1-CG 3.82Å; F284-M351 HydrophobicContact CE1-CB 4.16Å; F284-M351 HydrophobicContact CE1-CG 3.73Å; L333-M351 HydrophobicContact CD2-CE 3.67Å; L333-M351 HydrophobicContact CD2-SD 3.34Å; L333-M351 WeakPolarHBondContact CD2-SD 3.44Å; S347-M351 PolarHBondContact O-N 3.47Å; S347-M351 VanDerWaalsContact O-N 3.08Å; M348-M351 PolarHBondContact O-N 3.32Å; M351-S353 VanDerWaalsContact C-N 3.28Å; M351-S353 PolarHBondContact O-N 2.91Å; M351-G354 PolarHBondContact O-N 3.36Å; M351-L355 HydrophobicContact CG-CD1 4.17Å; M351-L355 VanDerWaalsContact O-CG 3.29Å; M351-L355 WeakPolarHBondContact O-CG 3.32Å; M351-L355 PolarHBondContact O-N 2.9Å; M351-L355 HydrophobicContact SD-CD1 4.35Å; M351-L355 HydrophobicContact SD-CG 4.28Å
352I95.5Very high91.1Very high65 Ų6538.8 Ų38.833%0.33324%0.243SC..Hα-helixtrans-58.7-42177.6-69.2167.3000110.8F284 V287 M348 G349 V350 L355 A356F284-I352 HydrophobicContact CD1-CG1 4.19Å; F284-I352 HydrophobicContact CE1-CG1 3.92Å; V287-I352 HydrophobicContact CG1-CG2 4.06Å; V287-I352 HydrophobicContact CG2-CG1 4.31Å; V287-I352 HydrophobicContact CG2-CG2 4.31Å; M348-I352 HydrophobicContact CG-CD1 3.7Å; M348-I352 HydrophobicContact CG-CG1 4.32Å; M348-I352 VanDerWaalsContact O-CG1 3.23Å; M348-I352 WeakPolarHBondContact O-CG1 3.22Å; M348-I352 PolarHBondContact O-N 3.24Å; M348-I352 HydrophobicContact SD-CD1 4.43Å; G349-I352 PolarHBondContact O-N 2.84Å; V350-I352 PolarHBondContact O-N 3.14Å; I352-L355 PolarHBondContact O-N 3.48Å; I352-A356 VanDerWaalsContact O-CB 3.24Å; I352-A356 WeakPolarHBondContact O-CB 3.42Å; I352-A356 PolarHBondContact O-N 3.4Å
353S95.6Very high91.3Very high48 Ų4836.4 Ų36.434%0.33622%0.22SC..Hα-helixtrans-64.8-40.8178.474.30000112.7G349 V350 M351 A356 L357G349-S353 PolarHBondContact O-N 2.93Å; V350-S353 WeakPolarHBondContact CA-OG 3.44Å; V350-S353 PolarHBondContact O-N 3.49Å; V350-S353 VanDerWaalsContact O-N 3.15Å; V350-S353 PolarHBondContact O-OG 2.85Å; M351-S353 VanDerWaalsContact C-N 3.28Å; M351-S353 PolarHBondContact O-N 2.91Å; S353-A356 PolarHBondContact O-N 3.47Å; S353-L357 WeakPolarHBondContact O-CG 3.32Å; S353-L357 PolarHBondContact O-N 3.01Å
354G96.1Very high91.8Very high0 Ų032.5 Ų32.50%020%0.197CC..Hα-helixtrans-63.7-48.9175.900000111.9V350 M351 A356 L357 M358V350-G354 PolarHBondContact O-N 3.16Å; M351-G354 PolarHBondContact O-N 3.36Å; G354-A356 VanDerWaalsContact C-N 3.31Å; G354-A356 PolarHBondContact O-N 2.98Å; G354-L357 PolarHBondContact O-N 3.47Å; G354-M358 VanDerWaalsContact O-CG 3.31Å; G354-M358 WeakPolarHBondContact O-CG 3.5Å; G354-M358 PolarHBondContact O-N 2.8Å
355L95.6Very high92.3Very high14 Ų1430.1 Ų30.17%0.07317%0.173CC..Hα-helixtrans-62.3-38.1176.4-64177.3000112.5I262 I266 F284 V287 M351 I352 M358 G359I262-L355 HydrophobicContact CD1-CD2 4.47Å; I262-L355 HydrophobicContact CG2-CD2 3.69Å; I266-L355 HydrophobicContact CD1-CD1 4.04Å; F284-L355 HydrophobicContact CB-CD1 3.83Å; F284-L355 HydrophobicContact CD1-CD1 3.86Å; F284-L355 HydrophobicContact CG-CD1 4.36Å; V287-L355 HydrophobicContact CB-CB 4.28Å; V287-L355 HydrophobicContact CG1-CB 3.86Å; M351-L355 HydrophobicContact CG-CD1 4.17Å; M351-L355 VanDerWaalsContact O-CG 3.29Å; M351-L355 WeakPolarHBondContact O-CG 3.32Å; M351-L355 PolarHBondContact O-N 2.9Å; M351-L355 HydrophobicContact SD-CD1 4.35Å; M351-L355 HydrophobicContact SD-CG 4.28Å; I352-L355 PolarHBondContact O-N 3.48Å; L355-M358 HydrophobicContact CD2-SD 4.33Å; L355-M358 PolarHBondContact O-N 3.46Å; L355-G359 PolarHBondContact O-N 2.94Å
356A95.5Very high92.4Very high21 Ų2126.8 Ų26.817%0.17416%0.159CC..Hα-helixtrans-62.5-48.5176.300000110.6V287 A291 I352 S353 G354 M358 G359 F360V287-A356 HydrophobicContact CG1-CB 4.15Å; A291-A356 HydrophobicContact CB-CB 4.12Å; A291-A356 WeakPolarHBondContact CB-O 3.22Å; I352-A356 VanDerWaalsContact O-CB 3.24Å; I352-A356 WeakPolarHBondContact O-CB 3.42Å; I352-A356 PolarHBondContact O-N 3.4Å; S353-A356 PolarHBondContact O-N 3.47Å; G354-A356 VanDerWaalsContact C-N 3.31Å; G354-A356 PolarHBondContact O-N 2.98Å; A356-M358 VanDerWaalsContact C-N 3.28Å; A356-M358 PolarHBondContact O-N 2.96Å; A356-G359 WeakPolarHBondContact O-CA 3.16Å; A356-G359 PolarHBondContact O-N 3.26Å; A356-F360 WeakPolarHBondContact O-CD2 3.39Å; A356-F360 PolarHBondContact O-N 3.19Å
357L95.2Very high92.2Very high50 Ų5030 Ų3026%0.26218%0.179SC..Hα-helixtrans-56.9-41.4175.8-74.2-174.7000112.6L325 C328 L332 S353 G354 G359 F360 A361L325-L357 HydrophobicContact CD2-CD2 4.35Å; C328-L357 HydrophobicContact CB-CD1 4.04Å; L332-L357 HydrophobicContact CD1-CD1 3.58Å; S353-L357 WeakPolarHBondContact O-CG 3.32Å; S353-L357 PolarHBondContact O-N 3.01Å; G354-L357 PolarHBondContact O-N 3.47Å; L357-G359 VanDerWaalsContact C-N 3.34Å; L357-G359 PolarHBondContact O-N 3.44Å; L357-F360 PolarHBondContact O-N 3.34Å; L357-A361 PolarHBondContact O-N 2.89Å; L357-A361 VanDerWaalsContact O-N 3.07Å
358M94.1Very high91.8Very high8 Ų828.5 Ų28.54%0.03917%0.168CC..Hα-helixtrans-62.8-39.9175.1-64.5172.569.800111.8I262 M326 F330 L333 G354 L355 A356 A361 E362I262-M358 HydrophobicContact CD1-CE 3.71Å; I262-M358 HydrophobicContact CD1-SD 4.03Å; M326-M358 HydrophobicContact CE-CB 4.02Å; M326-M358 HydrophobicContact CE-CE 4.27Å; M326-M358 HydrophobicContact CE-CG 4.33Å; M326-M358 HydrophobicContact SD-CB 4.05Å; M326-M358 HydrophobicContact SD-CE 3.59Å; M326-M358 VanDerWaalsContact SD-CE 3.59Å; M326-M358 HydrophobicContact SD-CG 3.68Å; M326-M358 HydrophobicContact SD-SD 4.39Å; F330-M358 HydrophobicContact CD2-CE 4.32Å; F330-M358 HydrophobicContact CE2-CE 3.63Å; F330-M358 HydrophobicContact CZ-CE 3.92Å; L333-M358 HydrophobicContact CD1-SD 4Å; G354-M358 VanDerWaalsContact O-CG 3.31Å; G354-M358 WeakPolarHBondContact O-CG 3.5Å; G354-M358 PolarHBondContact O-N 2.8Å; L355-M358 HydrophobicContact CD2-SD 4.33Å; L355-M358 PolarHBondContact O-N 3.46Å; A356-M358 VanDerWaalsContact C-N 3.28Å; A356-M358 PolarHBondContact O-N 2.96Å; M358-A361 VanDerWaalsContact O-CB 3.28Å; M358-A361 WeakPolarHBondContact O-CB 3.49Å; M358-A361 PolarHBondContact O-N 3.49Å; M358-E362 PolarHBondContact O-N 3.14Å
359G93Very high91.6Very high0 Ų026.3 Ų26.30%016%0.157CC..Hα-helixtrans-67.2-39.7174.300000113.2N288 V292 L355 A356 L357 A361 E362N288-G359 WeakPolarHBondContact OD1-CA 3.18Å; N288-G359 PolarHBondContact OD1-N 2.86Å; V292-G359 VanDerWaalsContact CG2-O 3.26Å; V292-G359 WeakPolarHBondContact CG2-O 3.31Å; L355-G359 PolarHBondContact O-N 2.94Å; A356-G359 WeakPolarHBondContact O-CA 3.16Å; A356-G359 PolarHBondContact O-N 3.26Å; L357-G359 VanDerWaalsContact C-N 3.34Å; L357-G359 PolarHBondContact O-N 3.44Å; G359-A361 PolarHBondContact O-N 2.78Å; G359-E362 WeakPolarHBondContact O-CB 3.46Å; G359-E362 PolarHBondContact O-N 2.85Å
360F92.5Very high91.1Very high60 Ų6027.2 Ų27.226%0.26315%0.15SC..Hα-helixtrans-59-36.1172.5-81.7-80.3000111.8A291 L294 A295 L325 A356 L357 E362 F364A291-F360 HydrophobicContact CB-CD2 4.18Å; A291-F360 HydrophobicContact CB-CE2 4.17Å; L294-F360 HydrophobicContact CB-CZ 4.21Å; A295-F360 VanDerWaalsContact CA-CE1 3.49Å; A295-F360 HydrophobicContact CB-CD1 3.23Å; A295-F360 HydrophobicContact CB-CE1 3.6Å; A295-F360 HydrophobicContact CB-CG 4.11Å; L325-F360 HydrophobicContact CD1-CB 4.14Å; A356-F360 WeakPolarHBondContact O-CD2 3.39Å; A356-F360 PolarHBondContact O-N 3.19Å; L357-F360 PolarHBondContact O-N 3.34Å; F360-E362 VanDerWaalsContact C-N 3.33Å; F360-E362 PolarHBondContact O-N 3.38Å; F360-F364 VanDerWaalsContact O-CD2 3.23Å; F360-F364 WeakPolarHBondContact O-CD2 3.33Å; F360-F364 WeakPolarHBondContact O-CE2 3.44Å
361A93.9Very high90.5Very high0 Ų027.7 Ų27.70%016%0.158CC..Hα-helixtrans-63.3-36.5-179.900000113.4F251 G322 L325 M326 L357 M358 G359 L363 F364F251-A361 HydrophobicContact CE2-CB 3.64Å; F251-A361 HydrophobicContact CZ-CB 4.04Å; G322-A361 WeakPolarHBondContact O-CB 3.34Å; L325-A361 HydrophobicContact CB-CB 3.74Å; M326-A361 HydrophobicContact CB-CB 4.17Å; M326-A361 HydrophobicContact CE-CB 4.43Å; L357-A361 PolarHBondContact O-N 2.89Å; L357-A361 VanDerWaalsContact O-N 3.07Å; M358-A361 VanDerWaalsContact O-CB 3.28Å; M358-A361 WeakPolarHBondContact O-CB 3.49Å; M358-A361 PolarHBondContact O-N 3.49Å; G359-A361 PolarHBondContact O-N 2.78Å; A361-L363 PolarHBondContact O-N 2.86Å; A361-F364 PolarHBondContact O-N 3.01Å; A361-F364 VanDerWaalsContact O-N 3.11Å
362E91.1Very high89.9Confident29 Ų2929.4 Ų29.414%0.13617%0.166CC..Hα-helixtrans-54.9-39.5-176.5-168.9-178.8145.400112.2F251 W252 N288 V292 M358 G359 F360 F364 I365 D366F251-E362 HydrophobicContact CE1-CB 4.33Å; F251-E362 HydrophobicContact CE1-CG 4.38Å; F251-E362 VanDerWaalsContact CZ-CA 3.47Å; F251-E362 HydrophobicContact CZ-CB 4.11Å; W252-E362 HydrophobicContact CH2-CG 4.02Å; W252-E362 HydrophobicContact CZ2-CG 4Å; N288-E362 PolarHBondContact ND2-OE2 2.92Å; N288-E362 VanDerWaalsContact ND2-OE2 3.12Å; V292-E362 HydrophobicContact CG2-CB 4.1Å; M358-E362 PolarHBondContact O-N 3.14Å; G359-E362 WeakPolarHBondContact O-CB 3.46Å; G359-E362 PolarHBondContact O-N 2.85Å; F360-E362 VanDerWaalsContact C-N 3.33Å; F360-E362 PolarHBondContact O-N 3.38Å; E362-F364 PolarHBondContact O-N 3.03Å; E362-I365 PolarHBondContact O-N 2.88Å; E362-D366 PolarHBondContact O-N 3.16Å
363L87.1Confident89.2Confident29 Ų2926.4 Ų26.415%0.15215%0.15CC..THydrogen-bonded Turntrans-66.7-23.3-176.8-170.264.8000113.9A295 G296 L299 A361 P367A295-L363 HydrophobicContact CB-CB 4.33Å; A295-L363 HydrophobicContact CB-CD2 3.53Å; A295-L363 WeakPolarHBondContact O-CD2 3.49Å; G296-L363 VanDerWaalsContact N-CD2 3.3Å; L299-L363 HydrophobicContact CB-CD2 4.23Å; L299-L363 HydrophobicContact CD1-CD2 3.29Å; L299-L363 HydrophobicContact CD1-CG 3.69Å; L299-L363 HydrophobicContact CG-CD2 3.8Å; A361-L363 PolarHBondContact O-N 2.86Å; L363-P367 HydrophobicContact CD1-CG 4.23Å; L363-P367 WeakPolarHBondContact O-CD 3.46Å
364F88.3Confident88.4Confident30 Ų3027.7 Ų27.713%0.13216%0.157CC..THydrogen-bonded Turntrans-88.9-9.9179.8-64.3-82.2000113.5L299 F321 L325 F360 A361 E362 V368L299-F364 HydrophobicContact CD1-CD1 4.42Å; L299-F364 HydrophobicContact CD1-CE1 3.85Å; L299-F364 HydrophobicContact CD1-CZ 3.95Å; L299-F364 HydrophobicContact CD2-CE1 3.86Å; L299-F364 HydrophobicContact CD2-CZ 3.81Å; L299-F364 HydrophobicContact CG-CE1 4.42Å; L299-F364 HydrophobicContact CG-CZ 4.23Å; F321-F364 AromaticContact CD1-CD1 3.94Å; F321-F364 HydrophobicContact CD1-CD1 3.94Å; F321-F364 HydrophobicContact CD1-CD2 4.03Å; F321-F364 AromaticContact CD1-CE1 3.81Å; F321-F364 HydrophobicContact CD1-CE1 3.81Å; F321-F364 AromaticContact CD1-CE2 3.91Å; F321-F364 HydrophobicContact CD1-CE2 3.91Å; F321-F364 HydrophobicContact CD1-CG 4.04Å; F321-F364 AromaticContact CD1-CZ 3.8Å; F321-F364 HydrophobicContact CD1-CZ 3.8Å; F321-F364 HydrophobicContact CE1-CD2 4.27Å; F321-F364 AromaticContact CE1-CE1 3.99Å; F321-F364 HydrophobicContact CE1-CE1 3.99Å; F321-F364 AromaticContact CE1-CE2 3.71Å; F321-F364 HydrophobicContact CE1-CE2 3.71Å; F321-F364 AromaticContact CE1-CZ 3.55Å; F321-F364 HydrophobicContact CE1-CZ 3.55Å; L325-F364 HydrophobicContact CD1-CD2 4.06Å; L325-F364 HydrophobicContact CD1-CE2 3.86Å; F360-F364 VanDerWaalsContact O-CD2 3.23Å; F360-F364 WeakPolarHBondContact O-CD2 3.33Å; F360-F364 WeakPolarHBondContact O-CE2 3.44Å; A361-F364 PolarHBondContact O-N 3.01Å; A361-F364 VanDerWaalsContact O-N 3.11Å; E362-F364 PolarHBondContact O-N 3.03Å; F364-V368 WeakPolarHBondContact O-CB 3.32Å; F364-V368 WeakPolarHBondContact O-CG2 3.44Å
365I89.5Confident87.5Confident0 Ų035.3 Ų35.30%019%0.185CC..THydrogen-bonded Turntrans-101.9-63.9-174.2-60.3-63.7000109.7F251 F319 L323 E362 V368 A369F251-I365 HydrophobicContact CB-CG1 4.47Å; F251-I365 HydrophobicContact CB-CG2 4.19Å; F251-I365 HydrophobicContact CD1-CB 4.1Å; F251-I365 HydrophobicContact CD1-CG1 4.02Å; F251-I365 HydrophobicContact CD1-CG2 3.78Å; F251-I365 HydrophobicContact CD2-CD1 4.24Å; F251-I365 HydrophobicContact CD2-CG1 3.69Å; F251-I365 HydrophobicContact CE1-CB 4.29Å; F251-I365 HydrophobicContact CE1-CG1 4.2Å; F251-I365 HydrophobicContact CE1-CG2 4.41Å; F251-I365 HydrophobicContact CE2-CG1 3.86Å; F251-I365 HydrophobicContact CG-CB 4.29Å; F251-I365 HydrophobicContact CG-CD1 4.38Å; F251-I365 HydrophobicContact CG-CG1 3.77Å; F251-I365 HydrophobicContact CG-CG2 3.97Å; F251-I365 HydrophobicContact CZ-CG1 4.14Å; F319-I365 HydrophobicContact CB-CD1 4.44Å; F319-I365 HydrophobicContact CD1-CD1 3.62Å; F319-I365 HydrophobicContact CD2-CD1 4Å; F319-I365 HydrophobicContact CE1-CD1 3.79Å; F319-I365 HydrophobicContact CE1-CG2 4.07Å; F319-I365 HydrophobicContact CE2-CB 4.37Å; F319-I365 HydrophobicContact CE2-CD1 4.16Å; F319-I365 HydrophobicContact CE2-CG2 3.93Å; F319-I365 WeakPolarHBondContact CE2-O 3.36Å; F319-I365 HydrophobicContact CG-CD1 3.76Å; F319-I365 HydrophobicContact CZ-CB 4.4Å; F319-I365 HydrophobicContact CZ-CD1 4.09Å; F319-I365 HydrophobicContact CZ-CG2 3.55Å; L323-I365 HydrophobicContact CG-CD1 4.45Å; E362-I365 PolarHBondContact O-N 2.88Å; I365-V368 PolarHBondContact O-N 3.4Å; I365-A369 WeakPolarHBondContact O-CB 3.29Å; I365-A369 PolarHBondContact O-N 3.27Å
366D85.3Confident86.5Confident34 Ų3435.8 Ų35.818%0.18219%0.188CC..Hα-helixtrans-69-52.4-166.4-97.79.3000114.6W252 E362 V368 A369 I370 Y386W252-D366 WeakPolarHBondContact CZ2-OD2 3.47Å; W252-D366 PolarHBondContact NE1-OD1 3.39Å; W252-D366 PolarHBondContact NE1-OD2 3.24Å; E362-D366 PolarHBondContact O-N 3.16Å; D366-V368 PolarHBondContact O-N 3.31Å; D366-A369 PolarHBondContact O-N 3.4Å; D366-A369 VanDerWaalsContact O-N 3.15Å; D366-I370 WeakPolarHBondContact O-CG1 3.4Å; D366-I370 PolarHBondContact O-N 3.12Å; D366-Y386 PolarHBondContact OD1-OH 3.05Å
367P82.6Confident85.3Confident69 Ų6944.6 Ų44.645%0.44822%0.222SC..Hα-helixtrans-59.1-35.9177-23.533.4000112L363 A371L363-P367 HydrophobicContact CD1-CG 4.23Å; L363-P367 WeakPolarHBondContact O-CD 3.46Å; P367-A371 WeakPolarHBondContact O-CB 3.45Å; P367-A371 PolarHBondContact O-N 2.76Å
368V84.4Confident84.2Confident17 Ų1743.9 Ų43.910%0.10322%0.218CC..Hα-helixtrans-68.2-42.4179.1177.50000110.7V315 K318 F319 F364 I365 D366 Q372V315-V368 HydrophobicContact CB-CG1 4.35Å; V315-V368 HydrophobicContact CG1-CG1 3.77Å; V315-V368 HydrophobicContact CG2-CG1 4.37Å; K318-V368 HydrophobicContact CB-CG2 4.26Å; K318-V368 HydrophobicContact CD-CG2 3.95Å; F319-V368 HydrophobicContact CD2-CG1 4.26Å; F364-V368 WeakPolarHBondContact O-CB 3.32Å; F364-V368 WeakPolarHBondContact O-CG2 3.44Å; I365-V368 PolarHBondContact O-N 3.4Å; D366-V368 PolarHBondContact O-N 3.31Å; V368-Q372 PolarHBondContact O-N 3.26Å
369A85.9Confident83.3Confident0 Ų045.5 Ų45.50%023%0.23CC..Hα-helixtrans-64.5-50.917800000112.2L244 F319 I365 D366 A371 Q372 I373 Y386L244-A369 HydrophobicContact CD2-CB 3.92Å; L244-A369 HydrophobicContact CG-CB 4.26Å; F319-A369 HydrophobicContact CE2-CB 4.15Å; I365-A369 WeakPolarHBondContact O-CB 3.29Å; I365-A369 PolarHBondContact O-N 3.27Å; D366-A369 PolarHBondContact O-N 3.4Å; D366-A369 VanDerWaalsContact O-N 3.15Å; A369-A371 VanDerWaalsContact C-N 3.29Å; A369-A371 PolarHBondContact O-N 3.26Å; A369-Q372 PolarHBondContact O-N 3.26Å; A369-Q372 VanDerWaalsContact O-N 3.12Å; A369-I373 WeakPolarHBondContact O-CG1 3.36Å; A369-I373 PolarHBondContact O-N 2.91Å; A369-I373 VanDerWaalsContact O-N 3.11Å; A369-Y386 HydrophobicContact CB-CD2 4.41Å; A369-Y386 HydrophobicContact CB-CE1 4.31Å; A369-Y386 HydrophobicContact CB-CE2 3.52Å; A369-Y386 VanDerWaalsContact CB-CZ 3.46Å; A369-Y386 VanDerWaalsContact CB-OH 3.31Å; A369-Y386 WeakPolarHBondContact CB-OH 3.18Å
370I82.9Confident82.4Confident66 Ų6648.1 Ų48.134%0.33826%0.257SS..Hα-helixtrans-60.4-42.1179.1-64.7171.5000110.2D366 Q372 I373 T374 Y386D366-I370 WeakPolarHBondContact O-CG1 3.4Å; D366-I370 PolarHBondContact O-N 3.12Å; I370-Q372 VanDerWaalsContact C-N 3.26Å; I370-Q372 PolarHBondContact O-N 3.44Å; I370-I373 PolarHBondContact O-N 3.43Å; I370-I373 VanDerWaalsContact O-N 3.13Å; I370-T374 HydrophobicContact CG2-CG2 3.98Å; I370-T374 WeakPolarHBondContact O-CG2 3.46Å; I370-T374 PolarHBondContact O-N 2.96Å; I370-T374 PolarHBondContact O-OG1 3.12Å; I370-T374 VanDerWaalsContact O-OG1 3.07Å; I370-Y386 HydrophobicContact CG1-CD1 4.45Å; I370-Y386 HydrophobicContact CG1-CE1 4.24Å
371A81.6Confident82Confident42 Ų4248.6 Ų48.635%0.34727%0.265SS..Hα-helixtrans-63-26.4178.400000114.3P367 A369 T374 R375P367-A371 WeakPolarHBondContact O-CB 3.45Å; P367-A371 PolarHBondContact O-N 2.76Å; A369-A371 VanDerWaalsContact C-N 3.29Å; A369-A371 PolarHBondContact O-N 3.26Å; A371-T374 PolarHBondContact O-OG1 3.34Å; A371-R375 WeakPolarHBondContact O-CG 3.42Å
372Q81.4Confident81.5Confident36 Ų3648.7 Ų48.717%0.16827%0.265CS..Hα-helixtrans-79.6-39.4172.1-67.3-46.2-63.400111.9L244 V315 V368 A369 I370 R375L244-Q372 HydrophobicContact CD2-CB 3.98Å; L244-Q372 HydrophobicContact CD2-CG 4.21Å; V315-Q372 HydrophobicContact CG1-CG 3.91Å; V315-Q372 HydrophobicContact CG2-CG 4.08Å; V315-Q372 VanDerWaalsContact CG2-NE2 3.31Å; V368-Q372 PolarHBondContact O-N 3.26Å; A369-Q372 PolarHBondContact O-N 3.26Å; A369-Q372 VanDerWaalsContact O-N 3.12Å; I370-Q372 VanDerWaalsContact C-N 3.26Å; I370-Q372 PolarHBondContact O-N 3.44Å; Q372-R375 PolarHBondContact O-N 3.07Å
373I81.7Confident81.1Confident1 Ų148.8 Ų48.81%0.00527%0.268CS..Hα-helixtrans-65-41.4-179.7-67.2163.6000111.1I241 M245 A369 I370 R375 L376 L382 T383 Y386I241-I373 HydrophobicContact CG1-CG1 4.4Å; I241-I373 HydrophobicContact CG2-CD1 4.5Å; I241-I373 HydrophobicContact CG2-CG1 3.82Å; M245-I373 HydrophobicContact CE-CD1 4.26Å; A369-I373 WeakPolarHBondContact O-CG1 3.36Å; A369-I373 PolarHBondContact O-N 2.91Å; A369-I373 VanDerWaalsContact O-N 3.11Å; I370-I373 PolarHBondContact O-N 3.43Å; I370-I373 VanDerWaalsContact O-N 3.13Å; I373-R375 PolarHBondContact O-N 2.91Å; I373-L376 PolarHBondContact O-N 3.32Å; I373-L382 HydrophobicContact CG2-CB 3.44Å; I373-L382 VanDerWaalsContact CG2-CB 3.44Å; I373-T383 WeakPolarHBondContact CG2-OG1 3.28Å; I373-Y386 HydrophobicContact CD1-CD1 4.31Å; I373-Y386 HydrophobicContact CD1-CD2 3.68Å; I373-Y386 HydrophobicContact CD1-CE2 4.49Å; I373-Y386 HydrophobicContact CD1-CG 3.59Å
374T78.3Confident81.1Confident76 Ų7648.7 Ų48.747%0.46627%0.274SS..THydrogen-bonded Turntrans-71.3-13.5-176.955.20000114.3I370 A371 L376I370-T374 HydrophobicContact CG2-CG2 3.98Å; I370-T374 WeakPolarHBondContact O-CG2 3.46Å; I370-T374 PolarHBondContact O-N 2.96Å; I370-T374 PolarHBondContact O-OG1 3.12Å; I370-T374 VanDerWaalsContact O-OG1 3.07Å; A371-T374 PolarHBondContact O-OG1 3.34Å; T374-L376 PolarHBondContact O-N 2.72Å
375R76.8Confident81.1Confident159 Ų15948 Ų4860%0.627%0.272SS*.THydrogen-bonded Turntrans-71.2-18.6173.6-72.2172.3177.1-165.2-6.5113.3S311 A371 Q372 I373S311-R375 PolarHBondContact OG-NH1 2.91Å; A371-R375 WeakPolarHBondContact O-CG 3.42Å; Q372-R375 PolarHBondContact O-N 3.07Å; I373-R375 PolarHBondContact O-N 2.91Å
376L76.1Confident81.2Confident25 Ų2548.1 Ų48.113%0.13127%0.272CS..SBendtrans-88.4145175.7-62.7-171.2000111A237 L238 I241 I373 T374 M378 S379 L382A237-L376 HydrophobicContact CB-CD1 4.49Å; A237-L376 HydrophobicContact CB-CD2 4.1Å; L238-L376 HydrophobicContact CD2-CD1 3.96Å; L238-L376 HydrophobicContact CG-CD1 4.46Å; I241-L376 HydrophobicContact CD1-CD1 3.23Å; I241-L376 HydrophobicContact CD1-CG 3.88Å; I373-L376 PolarHBondContact O-N 3.32Å; T374-L376 PolarHBondContact O-N 2.72Å; L376-M378 PolarHBondContact O-N 2.96Å; L376-S379 WeakPolarHBondContact O-CB 3.46Å; L376-S379 PolarHBondContact O-N 2.93Å; L376-S379 VanDerWaalsContact O-N 3.11Å; L376-L382 HydrophobicContact CB-CD1 4.28Å; L376-L382 HydrophobicContact CD1-CD1 3.72Å
377K70.5Confident81.4Confident205 Ų20550.8 Ų50.889%0.89129%0.285SS*.THydrogen-bonded Turntrans-56.6-23.9175.6-70.4-174.7177.1-178.80113.3S379K377-S379 VanDerWaalsContact C-N 3.3Å; K377-S379 PolarHBondContact O-N 2.82Å
378M71.6Confident81.8Confident36 Ų3647.9 Ų47.918%0.17727%0.265CS..THydrogen-bonded Turntrans-95.530-179-62.2140.367.200112.4M227 F231 L376 G380 V381 L382M227-M378 HydrophobicContact CB-CE 3.73Å; M227-M378 HydrophobicContact CE-CE 3.82Å; M227-M378 HydrophobicContact CG-CE 3.41Å; M227-M378 VanDerWaalsContact CG-CE 3.41Å; M227-M378 HydrophobicContact SD-CE 3.38Å; M227-M378 WeakPolarHBondContact SD-CE 3.44Å; F231-M378 HydrophobicContact CD2-CE 3.59Å; F231-M378 HydrophobicContact CD2-SD 3.82Å; F231-M378 HydrophobicContact CE2-CE 3.7Å; F231-M378 HydrophobicContact CE2-SD 3.83Å; F231-M378 HydrophobicContact CG-SD 4.34Å; F231-M378 HydrophobicContact CZ-SD 4.38Å; L376-M378 PolarHBondContact O-N 2.96Å; M378-G380 PolarHBondContact O-N 3.3Å; M378-V381 PolarHBondContact O-N 3.35Å; M378-L382 HydrophobicContact CB-CD1 4.44Å; M378-L382 WeakPolarHBondContact O-CG 3.21Å; M378-L382 PolarHBondContact O-N 3.33Å
379S74Confident82.2Confident41 Ų4148 Ų4829%0.28727%0.268SS..Hα-helixtrans-54.6-46.5-172.457.40000113.2L376 K377 V381 L382 T383L376-S379 WeakPolarHBondContact O-CB 3.46Å; L376-S379 PolarHBondContact O-N 2.93Å; L376-S379 VanDerWaalsContact O-N 3.11Å; K377-S379 VanDerWaalsContact C-N 3.3Å; K377-S379 PolarHBondContact O-N 2.82Å; S379-V381 PolarHBondContact O-N 2.93Å; S379-L382 PolarHBondContact O-N 2.94Å; S379-T383 WeakPolarHBondContact O-CB 3.44Å; S379-T383 PolarHBondContact O-N 3.25Å; S379-T383 PolarHBondContact O-OG1 2.88Å
380G74.1Confident82.5Confident56 Ų5648.4 Ų48.458%0.57727%0.271SS*.Hα-helixtrans-58.8-47-175.500000114M378 G384M378-G380 PolarHBondContact O-N 3.3Å; G380-G384 PolarHBondContact O-N 3.02Å
381V84.4Confident82.9Confident70 Ų7045.4 Ų45.442%0.42426%0.255SS..Hα-helixtrans-68.8-42.4179.6-179.60000110.9I223 M227 M378 S379 G384 I385I223-V381 HydrophobicContact CG2-CG1 3.79Å; M227-V381 HydrophobicContact CE-CB 3.83Å; M227-V381 HydrophobicContact CE-CG1 3.54Å; M227-V381 HydrophobicContact CE-CG2 4.23Å; M378-V381 PolarHBondContact O-N 3.35Å; S379-V381 PolarHBondContact O-N 2.93Å; V381-G384 PolarHBondContact O-N 3.41Å; V381-I385 HydrophobicContact CG1-CD1 4.03Å; V381-I385 WeakPolarHBondContact O-CG1 3.19Å; V381-I385 PolarHBondContact O-N 3.41Å
382L84.6Confident83.4Confident2 Ų243.4 Ų43.41%0.0124%0.239CC..Hα-helixtrans-66.9-38.7179.1-68.6173.4000111.9M227 L238 I241 M245 I373 L376 M378 S379 G384 I385 Y386M227-L382 HydrophobicContact SD-CD2 4.4Å; L238-L382 HydrophobicContact CD2-CD1 3.95Å; L238-L382 HydrophobicContact CD2-CD2 4.03Å; I241-L382 HydrophobicContact CD1-CD1 4.15Å; M245-L382 HydrophobicContact CE-CB 4.3Å; M245-L382 HydrophobicContact CE-CD2 4.36Å; M245-L382 WeakPolarHBondContact CE-O 3.46Å; I373-L382 HydrophobicContact CG2-CB 3.44Å; I373-L382 VanDerWaalsContact CG2-CB 3.44Å; L376-L382 HydrophobicContact CB-CD1 4.28Å; L376-L382 HydrophobicContact CD1-CD1 3.72Å; M378-L382 HydrophobicContact CB-CD1 4.44Å; M378-L382 WeakPolarHBondContact O-CG 3.21Å; M378-L382 PolarHBondContact O-N 3.33Å; S379-L382 PolarHBondContact O-N 2.94Å; L382-G384 VanDerWaalsContact C-N 3.33Å; L382-I385 PolarHBondContact O-N 3.28Å; L382-Y386 WeakPolarHBondContact O-CB 3.46Å; L382-Y386 PolarHBondContact O-N 3.4Å
383T83Confident84Confident30 Ų3043 Ų4318%0.18424%0.239CC..Hα-helixtrans-64-40.6173.7-600000110.6I373 S379 I385 Y386 M387I373-T383 WeakPolarHBondContact CG2-OG1 3.28Å; S379-T383 WeakPolarHBondContact O-CB 3.44Å; S379-T383 PolarHBondContact O-N 3.25Å; S379-T383 PolarHBondContact O-OG1 2.88Å; T383-I385 PolarHBondContact O-N 2.82Å; T383-Y386 PolarHBondContact O-N 3.35Å; T383-M387 HydrophobicContact CG2-SD 4.44Å; T383-M387 WeakPolarHBondContact O-CG 3.41Å; T383-M387 PolarHBondContact O-N 3.37Å
384G85.9Confident84.6Confident28 Ų2843 Ų4329%0.28924%0.239SC..Hα-helixtrans-60.8-43.4174.200000112.9G380 V381 L382 M387 L388G380-G384 PolarHBondContact O-N 3.02Å; V381-G384 PolarHBondContact O-N 3.41Å; L382-G384 VanDerWaalsContact C-N 3.33Å; G384-M387 PolarHBondContact O-N 2.79Å; G384-L388 PolarHBondContact O-N 2.91Å
385I89.5Confident85.4Confident15 Ų1539.5 Ų39.58%0.07722%0.217CC..Hα-helixtrans-70.1-36.3176.6-62.6170.6000111.4A220 I223 I224 M245 V381 L382 T383 L388 A389A220-I385 HydrophobicContact CB-CD1 4.48Å; A220-I385 HydrophobicContact CB-CG1 4.16Å; A220-I385 HydrophobicContact CB-CG2 4.03Å; I223-I385 HydrophobicContact CB-CD1 4.24Å; I223-I385 HydrophobicContact CG2-CD1 3.95Å; I224-I385 HydrophobicContact CD1-CD1 4.24Å; I224-I385 HydrophobicContact CD1-CG2 3.74Å; I224-I385 HydrophobicContact CG1-CD1 3.83Å; M245-I385 HydrophobicContact CE-CB 4.49Å; M245-I385 HydrophobicContact SD-CG2 4.48Å; V381-I385 HydrophobicContact CG1-CD1 4.03Å; V381-I385 WeakPolarHBondContact O-CG1 3.19Å; V381-I385 PolarHBondContact O-N 3.41Å; L382-I385 PolarHBondContact O-N 3.28Å; T383-I385 PolarHBondContact O-N 2.82Å; I385-L388 WeakPolarHBondContact O-CB 3.39Å; I385-L388 PolarHBondContact O-N 3.25Å; I385-A389 WeakPolarHBondContact O-CB 3.35Å; I385-A389 PolarHBondContact O-N 2.94Å
386Y90.9Very high86.2Confident3 Ų336.2 Ų36.21%0.01221%0.205CC..Hα-helixtrans-59.5-51.3172.9176.4-97.7000110.6M245 D366 A369 I370 I373 L382 T383 L388 A389 T390M245-Y386 HydrophobicContact CB-CD2 4.46Å; M245-Y386 HydrophobicContact CG-CD2 3.74Å; D366-Y386 PolarHBondContact OD1-OH 3.05Å; A369-Y386 HydrophobicContact CB-CD2 4.41Å; A369-Y386 HydrophobicContact CB-CE1 4.31Å; A369-Y386 HydrophobicContact CB-CE2 3.52Å; A369-Y386 VanDerWaalsContact CB-CZ 3.46Å; A369-Y386 VanDerWaalsContact CB-OH 3.31Å; A369-Y386 WeakPolarHBondContact CB-OH 3.18Å; I370-Y386 HydrophobicContact CG1-CD1 4.45Å; I370-Y386 HydrophobicContact CG1-CE1 4.24Å; I373-Y386 HydrophobicContact CD1-CD1 4.31Å; I373-Y386 HydrophobicContact CD1-CD2 3.68Å; I373-Y386 HydrophobicContact CD1-CE2 4.49Å; I373-Y386 HydrophobicContact CD1-CG 3.59Å; L382-Y386 WeakPolarHBondContact O-CB 3.46Å; L382-Y386 PolarHBondContact O-N 3.4Å; T383-Y386 PolarHBondContact O-N 3.35Å; Y386-L388 VanDerWaalsContact C-N 3.28Å; Y386-L388 PolarHBondContact O-N 2.95Å; Y386-A389 PolarHBondContact O-N 3.42Å; Y386-T390 HydrophobicContact CD1-CG2 4.35Å; Y386-T390 HydrophobicContact CD2-CG2 3.87Å; Y386-T390 HydrophobicContact CE1-CG2 3.95Å; Y386-T390 HydrophobicContact CE2-CG2 3.42Å; Y386-T390 VanDerWaalsContact CE2-CG2 3.42Å; Y386-T390 HydrophobicContact CG-CG2 4.3Å; Y386-T390 VanDerWaalsContact CZ-CG2 3.45Å; Y386-T390 PolarHBondContact O-N 3.42Å; Y386-T390 PolarHBondContact O-OG1 3.48Å
387M88.8Confident87Confident90 Ų9037.8 Ų37.844%0.44321%0.213SC..Hα-helixtrans-62-34.2178-69.7-176.775.400112.9T383 G384 G391T383-M387 HydrophobicContact CG2-SD 4.44Å; T383-M387 WeakPolarHBondContact O-CG 3.41Å; T383-M387 PolarHBondContact O-N 3.37Å; G384-M387 PolarHBondContact O-N 2.79Å; M387-G391 VanDerWaalsContact O-CA 3.23Å; M387-G391 WeakPolarHBondContact O-CA 3.11Å; M387-G391 PolarHBondContact O-N 3.19Å
388L91.7Very high88.1Confident8 Ų828.1 Ų28.14%0.04217%0.171CC..Iπ-helixtrans-62.7-47.1171.4-179.479.1000111V33 I36 V216 A220 G384 I385 Y386 A392 V393V33-L388 HydrophobicContact CG2-CD1 4.01Å; I36-L388 HydrophobicContact CD1-CB 4.35Å; I36-L388 HydrophobicContact CD1-CD1 4.06Å; V216-L388 HydrophobicContact CG1-CD1 3.46Å; V216-L388 VanDerWaalsContact CG1-CD1 3.46Å; V216-L388 HydrophobicContact CG1-CD2 3.77Å; V216-L388 HydrophobicContact CG1-CG 4.25Å; A220-L388 HydrophobicContact CB-CD2 3.63Å; G384-L388 PolarHBondContact O-N 2.91Å; I385-L388 WeakPolarHBondContact O-CB 3.39Å; I385-L388 PolarHBondContact O-N 3.25Å; Y386-L388 VanDerWaalsContact C-N 3.28Å; Y386-L388 PolarHBondContact O-N 2.95Å; L388-A392 HydrophobicContact CD1-CB 4.1Å; L388-A392 WeakPolarHBondContact O-CA 3.29Å; L388-A392 WeakPolarHBondContact O-CB 3.46Å; L388-A392 PolarHBondContact O-N 3.21Å; L388-V393 PolarHBondContact O-N 3.38Å
389A92.5Very high89.1Confident19 Ų1926.5 Ų26.516%0.15716%0.164CC..Iπ-helixtrans-70.5-43-177.400000112.6T249 I385 Y386 V393 A394T249-A389 WeakPolarHBondContact CG2-O 3.24Å; T249-A389 WeakPolarHBondContact OG1-CB 3.28Å; T249-A389 PolarHBondContact OG1-O 3.43Å; I385-A389 WeakPolarHBondContact O-CB 3.35Å; I385-A389 PolarHBondContact O-N 2.94Å; Y386-A389 PolarHBondContact O-N 3.42Å; A389-V393 WeakPolarHBondContact O-CB 3.19Å; A389-A394 PolarHBondContact O-N 2.78Å
390T92.3Very high89.9Confident9 Ų927.2 Ų27.26%0.05517%0.167CC..Iπ-helixtrans-87.8-22.3-177.461.20000113.6W252 Y386 A394W252-T390 VanDerWaalsContact CB-O 3.3Å; W252-T390 WeakPolarHBondContact CB-O 3.37Å; Y386-T390 HydrophobicContact CD1-CG2 4.35Å; Y386-T390 HydrophobicContact CD2-CG2 3.87Å; Y386-T390 HydrophobicContact CE1-CG2 3.95Å; Y386-T390 HydrophobicContact CE2-CG2 3.42Å; Y386-T390 VanDerWaalsContact CE2-CG2 3.42Å; Y386-T390 HydrophobicContact CG-CG2 4.3Å; Y386-T390 VanDerWaalsContact CZ-CG2 3.45Å; Y386-T390 PolarHBondContact O-N 3.42Å; Y386-T390 PolarHBondContact O-OG1 3.48Å; T390-A394 WeakPolarHBondContact O-CB 3.4Å
391G91.1Very high90.7Very high2 Ų225.8 Ų25.82%0.02115%0.147CC..Iπ-helixtrans-93.1-69.8174.900000111.6Y32 M387 N395Y32-G391 VanDerWaalsContact CG-CA 3.45Å; M387-G391 VanDerWaalsContact O-CA 3.23Å; M387-G391 WeakPolarHBondContact O-CA 3.11Å; M387-G391 PolarHBondContact O-N 3.19Å; G391-N395 WeakPolarHBondContact O-CB 3.09Å; G391-N395 PolarHBondContact O-N 2.96Å; G391-N395 PolarHBondContact O-ND2 3.41Å
392A92.4Very high90.9Very high0 Ų022.5 Ų22.50%013%0.127CC..Iπ-helixtrans-73.3-54.3-170.600000112.6S29 V33 L213 L388 A394 N395 W396S29-A392 WeakPolarHBondContact CB-O 3.36Å; S29-A392 WeakPolarHBondContact O-CB 3.38Å; S29-A392 PolarHBondContact OG-O 2.84Å; V33-A392 HydrophobicContact CG2-CB 3.49Å; V33-A392 VanDerWaalsContact CG2-CB 3.49Å; L213-A392 HydrophobicContact CD1-CB 3.73Å; L388-A392 HydrophobicContact CD1-CB 4.1Å; L388-A392 WeakPolarHBondContact O-CA 3.29Å; L388-A392 WeakPolarHBondContact O-CB 3.46Å; L388-A392 PolarHBondContact O-N 3.21Å; A392-A394 VanDerWaalsContact C-N 3.33Å; A392-A394 PolarHBondContact O-N 3.44Å; A392-N395 PolarHBondContact O-N 3.3Å; A392-W396 PolarHBondContact O-N 3.32Å; A392-W396 VanDerWaalsContact O-N 3.16Å
393V94Very high91Very high28 Ų2825.6 Ų25.617%0.1714%0.141CC..Iπ-helixtrans-64.6-41.2-177.8-178.70000111.4L213 C217 T249 L388 A389 N395 W396 L397L213-V393 HydrophobicContact CD1-CG2 4.04Å; L213-V393 HydrophobicContact CD2-CG2 4.49Å; L213-V393 HydrophobicContact CG-CG2 4.39Å; C217-V393 WeakPolarHBondContact SG-CG2 3.36Å; T249-V393 HydrophobicContact CG2-CG1 4.4Å; L388-V393 PolarHBondContact O-N 3.38Å; A389-V393 WeakPolarHBondContact O-CB 3.19Å; V393-N395 PolarHBondContact O-N 2.88Å; V393-W396 PolarHBondContact O-N 3.09Å; V393-L397 HydrophobicContact CG1-CD1 3.82Å; V393-L397 HydrophobicContact CG1-CG 4.19Å; V393-L397 WeakPolarHBondContact O-CB 3.25Å; V393-L397 WeakPolarHBondContact O-CG 3.44Å; V393-L397 PolarHBondContact O-N 3.42Å
394A95.1Very high91Very high0 Ų029.6 Ų29.60%016%0.158CC..Hα-helixtrans-62.3-40.3177.800000112.9T249 W252 V253 A389 T390 A392 A398T249-A394 HydrophobicContact CG2-CB 4.2Å; W252-A394 HydrophobicContact CB-CB 3.57Å; V253-A394 HydrophobicContact CG2-CB 4.06Å; A389-A394 PolarHBondContact O-N 2.78Å; T390-A394 WeakPolarHBondContact O-CB 3.4Å; A392-A394 VanDerWaalsContact C-N 3.33Å; A392-A394 PolarHBondContact O-N 3.44Å; A394-A398 WeakPolarHBondContact O-CB 3.36Å; A394-A398 PolarHBondContact O-N 2.9Å
395N93.5Very high90.7Very high3 Ų328.3 Ų28.32%0.01614%0.144CC..Hα-helixtrans-67.4-40.8177.7-87-77.2000112.3S25 A28 Y32 Q256 G391 A392 V393 A398 G399S25-N395 VanDerWaalsContact CB-O 3.27Å; S25-N395 WeakPolarHBondContact CB-O 3.11Å; A28-N395 HydrophobicContact CB-CB 3.87Å; A28-N395 VanDerWaalsContact CB-OD1 3.3Å; A28-N395 WeakPolarHBondContact CB-OD1 3.42Å; Y32-N395 WeakPolarHBondContact CE2-ND2 3.44Å; Q256-N395 VanDerWaalsContact CD-OD1 3.32Å; Q256-N395 WeakPolarHBondContact CG-OD1 3.35Å; Q256-N395 PolarHBondContact OE1-OD1 3.44Å; G391-N395 WeakPolarHBondContact O-CB 3.09Å; G391-N395 PolarHBondContact O-N 2.96Å; G391-N395 PolarHBondContact O-ND2 3.41Å; A392-N395 PolarHBondContact O-N 3.3Å; V393-N395 PolarHBondContact O-N 2.88Å; N395-A398 WeakPolarHBondContact O-CB 3.32Å; N395-A398 PolarHBondContact O-N 3.46Å; N395-G399 PolarHBondContact O-N 3.27Å
396W93.5Very high89.9Confident91 Ų9128.7 Ų28.735%0.34515%0.147SC..Hα-helixtrans-65-48.4176.5-178.580000111.6S29 L213 A392 V393 A398 G399 V400S29-W396 WeakPolarHBondContact OG-CA 3.21Å; S29-W396 WeakPolarHBondContact OG-CB 3.4Å; S29-W396 PolarHBondContact OG-N 3.07Å; L213-W396 HydrophobicContact CD2-CB 3.38Å; L213-W396 HydrophobicContact CD2-CD2 4.08Å; L213-W396 HydrophobicContact CD2-CE3 4.44Å; L213-W396 HydrophobicContact CD2-CG 3.62Å; A392-W396 PolarHBondContact O-N 3.32Å; A392-W396 VanDerWaalsContact O-N 3.16Å; V393-W396 PolarHBondContact O-N 3.09Å; W396-A398 VanDerWaalsContact C-N 3.28Å; W396-A398 PolarHBondContact O-N 3.46Å; W396-G399 WeakPolarHBondContact O-CA 3.18Å; W396-G399 PolarHBondContact O-N 3.2Å; W396-V400 HydrophobicContact CD2-CG2 4.24Å; W396-V400 HydrophobicContact CE3-CG2 4.3Å; W396-V400 HydrophobicContact CH2-CG2 3.99Å; W396-V400 HydrophobicContact CZ2-CG2 3.91Å; W396-V400 HydrophobicContact CZ3-CG2 4.18Å; W396-V400 PolarHBondContact O-N 3.37Å
397L93.5Very high89.2Confident57 Ų5732.3 Ų32.330%0.29816%0.164SC..Hα-helixtrans-61.1-37.8174.7-75.5176.6000111.8T249 V253 V393 G399 V400 V401T249-L397 HydrophobicContact CG2-CD1 4.29Å; V253-L397 HydrophobicContact CG1-CB 4.37Å; V253-L397 HydrophobicContact CG2-CB 3.57Å; V253-L397 HydrophobicContact CG2-CD1 4.02Å; V253-L397 HydrophobicContact CG2-CG 4.47Å; V393-L397 HydrophobicContact CG1-CD1 3.82Å; V393-L397 HydrophobicContact CG1-CG 4.19Å; V393-L397 WeakPolarHBondContact O-CB 3.25Å; V393-L397 WeakPolarHBondContact O-CG 3.44Å; V393-L397 PolarHBondContact O-N 3.42Å; L397-G399 VanDerWaalsContact C-N 3.26Å; L397-G399 PolarHBondContact O-N 2.93Å; L397-V400 PolarHBondContact O-N 3.3Å; L397-V401 WeakPolarHBondContact O-CB 3.27Å; L397-V401 VanDerWaalsContact O-CG2 3.25Å; L397-V401 WeakPolarHBondContact O-CG2 3.09Å; L397-V401 PolarHBondContact O-N 3.23Å
398A93.8Very high88.1Confident2 Ų233.4 Ų33.42%0.01718%0.181CC..Hα-helixtrans-61.1-36.8174.300000111.8V253 Q256 Q257 A394 N395 W396 A402V253-A398 HydrophobicContact CG1-CB 4.47Å; V253-A398 WeakPolarHBondContact O-CB 3.13Å; Q256-A398 HydrophobicContact CB-CB 3.68Å; Q257-A398 VanDerWaalsContact NE2-CA 3.28Å; Q257-A398 PolarHBondContact NE2-O 2.97Å; A394-A398 WeakPolarHBondContact O-CB 3.36Å; A394-A398 PolarHBondContact O-N 2.9Å; N395-A398 WeakPolarHBondContact O-CB 3.32Å; N395-A398 PolarHBondContact O-N 3.46Å; W396-A398 VanDerWaalsContact C-N 3.28Å; W396-A398 PolarHBondContact O-N 3.46Å; A398-A402 WeakPolarHBondContact O-CB 3.47Å; A398-A402 PolarHBondContact O-N 2.96Å
399G92.1Very high87Confident2 Ų239.5 Ų39.52%0.02121%0.209CC..Hα-helixtrans-63.3-49.7171.600000112.7I21 N395 W396 L397 V401 A402 Q403I21-G399 VanDerWaalsContact CG2-O 3.3Å; I21-G399 WeakPolarHBondContact CG2-O 3.16Å; N395-G399 PolarHBondContact O-N 3.27Å; W396-G399 WeakPolarHBondContact O-CA 3.18Å; W396-G399 PolarHBondContact O-N 3.2Å; L397-G399 VanDerWaalsContact C-N 3.26Å; L397-G399 PolarHBondContact O-N 2.93Å; G399-V401 VanDerWaalsContact C-N 3.29Å; G399-V401 PolarHBondContact O-N 2.88Å; G399-A402 PolarHBondContact O-N 3.36Å; G399-A402 VanDerWaalsContact O-N 3.16Å; G399-Q403 WeakPolarHBondContact O-CG 3.38Å; G399-Q403 PolarHBondContact O-N 3.31Å
400V91.2Very high85.9Confident56 Ų5643.9 Ų43.934%0.33923%0.228SC..Hα-helixtrans-59.4-41.2177.51750000111.7W396 L397W396-V400 HydrophobicContact CD2-CG2 4.24Å; W396-V400 HydrophobicContact CE3-CG2 4.3Å; W396-V400 HydrophobicContact CH2-CG2 3.99Å; W396-V400 HydrophobicContact CZ2-CG2 3.91Å; W396-V400 HydrophobicContact CZ3-CG2 4.18Å; W396-V400 PolarHBondContact O-N 3.37Å; L397-V400 PolarHBondContact O-N 3.3Å
401V91.3Very high85Confident27 Ų2745.1 Ų45.116%0.16424%0.238CC..Hα-helixtrans-69.4-41.5176.71700000110.5V253 L397 G399 Q403 Q404 F421 M425V253-V401 HydrophobicContact CG1-CG2 4.17Å; L397-V401 WeakPolarHBondContact O-CB 3.27Å; L397-V401 VanDerWaalsContact O-CG2 3.25Å; L397-V401 WeakPolarHBondContact O-CG2 3.09Å; L397-V401 PolarHBondContact O-N 3.23Å; G399-V401 VanDerWaalsContact C-N 3.29Å; G399-V401 PolarHBondContact O-N 2.88Å; V401-Q403 VanDerWaalsContact C-N 3.34Å; V401-Q403 PolarHBondContact O-N 3.34Å; V401-Q404 WeakPolarHBondContact O-CB 3.26Å; V401-Q404 WeakPolarHBondContact O-CG 3.1Å; V401-Q404 PolarHBondContact O-N 2.83Å; V401-F421 HydrophobicContact CG1-CE2 3.45Å; V401-F421 VanDerWaalsContact CG1-CE2 3.45Å; V401-F421 HydrophobicContact CG1-CZ 3.71Å; V401-F421 WeakPolarHBondContact O-CE2 3.33Å; V401-M425 HydrophobicContact CG1-CE 4.23Å; V401-M425 HydrophobicContact CG1-SD 3.9Å
402A88.5Confident84.2Confident0 Ų047.7 Ų47.70%026%0.264CS..Hα-helixtrans-63.7-3517800000113I21 T261 A398 G399 Q404 T405I21-A402 HydrophobicContact CD1-CB 4.14Å; I21-A402 HydrophobicContact CG2-CB 3.64Å; T261-A402 WeakPolarHBondContact OG1-CA 2.93Å; T261-A402 WeakPolarHBondContact OG1-CB 3.03Å; A398-A402 WeakPolarHBondContact O-CB 3.47Å; A398-A402 PolarHBondContact O-N 2.96Å; G399-A402 PolarHBondContact O-N 3.36Å; G399-A402 VanDerWaalsContact O-N 3.16Å; A402-Q404 PolarHBondContact O-N 3.23Å; A402-Q404 VanDerWaalsContact O-N 3.08Å; A402-T405 WeakPolarHBondContact O-CB 3.32Å; A402-T405 PolarHBondContact O-N 3.15Å; A402-T405 PolarHBondContact O-OG1 3.48Å
403Q86.7Confident83.6Confident67 Ų6753.8 Ų53.831%0.31329%0.294SS..G310 helixtrans-59.5-19.9176.5-75.7171.5-16.400113.6N18 I21 G399 V401 T405 T406N18-Q403 PolarHBondContact O-NE2 2.71Å; I21-Q403 HydrophobicContact CB-CG 4.38Å; I21-Q403 HydrophobicContact CG2-CG 3.89Å; G399-Q403 WeakPolarHBondContact O-CG 3.38Å; G399-Q403 PolarHBondContact O-N 3.31Å; V401-Q403 VanDerWaalsContact C-N 3.34Å; V401-Q403 PolarHBondContact O-N 3.34Å; Q403-T405 PolarHBondContact O-N 2.69Å; Q403-T406 WeakPolarHBondContact O-CB 3.49Å; Q403-T406 PolarHBondContact O-N 3.38Å; Q403-T406 PolarHBondContact O-OG1 2.67Å
404Q82Confident83.1Confident115 Ų11552.6 Ų52.654%0.53729%0.287SS..G310 helixtrans-69.5-12.9173.4-58-178.47.700113.3V401 A402V401-Q404 WeakPolarHBondContact O-CB 3.26Å; V401-Q404 WeakPolarHBondContact O-CG 3.1Å; V401-Q404 PolarHBondContact O-N 2.83Å; A402-Q404 PolarHBondContact O-N 3.23Å; A402-Q404 VanDerWaalsContact O-N 3.08Å
405T79.6Confident82.7Confident1 Ų153.2 Ų53.21%0.00629%0.291CS..G310 helixtrans-95.1-5.7176.462.80000113.7T261 A402 Q403 E407 F421T261-T405 HydrophobicContact CG2-CG2 3.62Å; T261-T405 WeakPolarHBondContact CG2-OG1 3.44Å; T261-T405 PolarHBondContact OG1-OG1 3.03Å; A402-T405 WeakPolarHBondContact O-CB 3.32Å; A402-T405 PolarHBondContact O-N 3.15Å; A402-T405 PolarHBondContact O-OG1 3.48Å; Q403-T405 PolarHBondContact O-N 2.69Å; T405-E407 PolarHBondContact O-N 3.44Å; T405-F421 HydrophobicContact CG2-CB 3.43Å; T405-F421 VanDerWaalsContact CG2-CB 3.43Å; T405-F421 HydrophobicContact CG2-CD1 3.64Å; T405-F421 HydrophobicContact CG2-CD2 3.37Å; T405-F421 HydrophobicContact CG2-CE1 4.22Å; T405-F421 HydrophobicContact CG2-CE2 3.95Å; T405-F421 HydrophobicContact CG2-CG 3.18Å; T405-F421 HydrophobicContact CG2-CZ 4.35Å
406T73.9Confident82.4Confident22 Ų2255 Ų5514%0.13531%0.306CS..  trans-72.2119.3-178.6-55.20000110.6D17 N18 Q403D17-T406 HydrophobicContact CB-CG2 3.64Å; N18-T406 HydrophobicContact CB-CG2 4.27Å; N18-T406 VanDerWaalsContact ND2-CG2 3.28Å; N18-T406 WeakPolarHBondContact ND2-CG2 3.22Å; N18-T406 WeakPolarHBondContact OD1-CB 3.49Å; N18-T406 WeakPolarHBondContact OD1-CG2 3.27Å; N18-T406 PolarHBondContact OD1-OG1 3.4Å; Q403-T406 WeakPolarHBondContact O-CB 3.49Å; Q403-T406 PolarHBondContact O-N 3.38Å; Q403-T406 PolarHBondContact O-OG1 2.67Å
407E75.5Confident82.2Confident80 Ų8051.3 Ų51.337%0.37430%0.295SS..  trans-120.7142.1172.1-73.6-69.7176.400108.8T405 Q409 A414 A417T405-E407 PolarHBondContact O-N 3.44Å; E407-Q409 PolarHBondContact O-N 2.88Å; E407-A414 HydrophobicContact CB-CB 4.16Å; E407-A414 HydrophobicContact CG-CB 4.47Å; E407-A417 HydrophobicContact CG-CB 3.9Å
408S65.6Low82.1Confident112 Ų11248.7 Ų48.778%0.78328%0.281SS*.SBendtrans-68.6-18.6-174.460.20000113.9
409Q68.7Low81.9Confident136 Ų13651.7 Ų51.764%0.63629%0.294SS*.SBendtrans-135.2132.3179.3-66-165.6-2900111.8E407 S411E407-Q409 PolarHBondContact O-N 2.88Å; Q409-S411 VanDerWaalsContact C-N 3.33Å; Q409-S411 PolarHBondContact O-N 3.16Å; Q409-S411 PolarHBondContact O-OG 3.34Å
410I69.6Low81.9Confident111 Ų11160 Ų6057%0.56933%0.325SS*.  trans-69.291.3171.2-54.4176000107.9R268 F269R268-I410 HydrophobicContact CG-CD1 4.32Å; F269-I410 HydrophobicContact CE1-CG2 3.8Å; F269-I410 HydrophobicContact CZ-CG2 3.73Å
411S73.3Confident82Confident36 Ų3657.6 Ų57.625%0.25231%0.31SS..SBendtrans-140.2178.6-175.866.30000110.5Q409 M413 A414 I415Q409-S411 VanDerWaalsContact C-N 3.33Å; Q409-S411 PolarHBondContact O-N 3.16Å; Q409-S411 PolarHBondContact O-OG 3.34Å; S411-M413 PolarHBondContact O-N 3.39Å; S411-M413 VanDerWaalsContact O-N 3.11Å; S411-M413 PolarHBondContact OG-N 2.89Å; S411-A414 WeakPolarHBondContact O-CB 3.21Å; S411-A414 PolarHBondContact O-N 2.94Å; S411-I415 PolarHBondContact O-N 3.48Å
412G74.7Confident82.2Confident56 Ų5656.3 Ų56.358%0.57730%0.302SS*.Hα-helixtrans-56-26172.800000113.5I415 A416G412-I415 PolarHBondContact O-N 3.05Å; G412-A416 PolarHBondContact O-N 3.49Å; G412-A416 VanDerWaalsContact O-N 3.12Å
413M80.4Confident82.4Confident127 Ų12757.7 Ų57.763%0.62631%0.312SS*.Hα-helixtrans-66.2-38.6172.8-66.7-176.4-76.800112S411 A416 A417S411-M413 PolarHBondContact O-N 3.39Å; S411-M413 VanDerWaalsContact O-N 3.11Å; S411-M413 PolarHBondContact OG-N 2.89Å; M413-A416 PolarHBondContact O-N 2.83Å; M413-A417 PolarHBondContact O-N 3.42Å
414A83.5Confident82.8Confident3 Ų357 Ų573%0.02531%0.309CS..Hα-helixtrans-62.5-45.4175.700000111F269 E407 S411 A416 A417 Y418F269-A414 HydrophobicContact CE2-CB 4.38Å; F269-A414 HydrophobicContact CZ-CB 3.81Å; E407-A414 HydrophobicContact CB-CB 4.16Å; E407-A414 HydrophobicContact CG-CB 4.47Å; S411-A414 WeakPolarHBondContact O-CB 3.21Å; S411-A414 PolarHBondContact O-N 2.94Å; A414-A416 VanDerWaalsContact C-N 3.29Å; A414-A416 PolarHBondContact O-N 3.45Å; A414-A417 WeakPolarHBondContact O-CB 3.22Å; A414-A417 PolarHBondContact O-N 2.96Å; A414-Y418 WeakPolarHBondContact O-CD2 3.34Å; A414-Y418 PolarHBondContact O-N 3.01Å
415I86.2Confident83.3Confident14 Ų1451.9 Ų51.97%0.07229%0.285CS..Hα-helixtrans-58.6-43.3176.1-56.5177.6000110.9F269 A337 A340 A341 S411 G412 A417 Y418 Q419F269-I415 HydrophobicContact CD1-CD1 3.62Å; F269-I415 HydrophobicContact CD1-CG1 3.39Å; F269-I415 HydrophobicContact CD2-CG1 4.34Å; F269-I415 HydrophobicContact CE1-CD1 3.82Å; F269-I415 HydrophobicContact CE1-CG1 3.32Å; F269-I415 HydrophobicContact CE2-CG1 4.29Å; F269-I415 HydrophobicContact CG-CD1 4.39Å; F269-I415 HydrophobicContact CG-CG1 3.92Å; F269-I415 HydrophobicContact CZ-CG1 3.8Å; A337-I415 VanDerWaalsContact O-CG2 3.23Å; A337-I415 WeakPolarHBondContact O-CG2 3.41Å; A340-I415 HydrophobicContact CB-CG2 4.11Å; A341-I415 HydrophobicContact CB-CG2 3.81Å; S411-I415 PolarHBondContact O-N 3.48Å; G412-I415 PolarHBondContact O-N 3.05Å; I415-A417 VanDerWaalsContact C-N 3.31Å; I415-A417 PolarHBondContact O-N 2.87Å; I415-Y418 PolarHBondContact O-N 3.32Å; I415-Q419 WeakPolarHBondContact O-CB 3.44Å; I415-Q419 PolarHBondContact O-N 3.46Å
416A87.5Confident84Confident41 Ų4151.9 Ų51.934%0.33929%0.285SS..Hα-helixtrans-64-34.9176.700000112.7G412 M413 A414 Q419 R420G412-A416 PolarHBondContact O-N 3.49Å; G412-A416 VanDerWaalsContact O-N 3.12Å; M413-A416 PolarHBondContact O-N 2.83Å; A414-A416 VanDerWaalsContact C-N 3.29Å; A414-A416 PolarHBondContact O-N 3.45Å; A416-Q419 PolarHBondContact O-N 3.48Å; A416-R420 WeakPolarHBondContact O-CB 3.34Å; A416-R420 PolarHBondContact O-N 2.83Å
417A88.5Confident84.9Confident13 Ų1356.1 Ų56.111%0.10730%0.303CS..Hα-helixtrans-64.3-47.5173.700000111.3E407 M413 A414 I415 Q419 R420 F421E407-A417 HydrophobicContact CG-CB 3.9Å; M413-A417 PolarHBondContact O-N 3.42Å; A414-A417 WeakPolarHBondContact O-CB 3.22Å; A414-A417 PolarHBondContact O-N 2.96Å; I415-A417 VanDerWaalsContact C-N 3.31Å; I415-A417 PolarHBondContact O-N 2.87Å; A417-Q419 PolarHBondContact O-N 2.94Å; A417-R420 PolarHBondContact O-N 3.39Å; A417-F421 VanDerWaalsContact O-CB 3.26Å; A417-F421 WeakPolarHBondContact O-CB 3.29Å; A417-F421 PolarHBondContact O-N 3.17Å
418Y90.6Very high85.8Confident2 Ų259.5 Ų59.51%0.00831%0.313CS..Hα-helixtrans-60.5-43.7173.8-76-77.6000112.1T261 F265 F269 A414 I415 F421 F422T261-Y418 HydrophobicContact CG2-CD1 3.64Å; T261-Y418 HydrophobicContact CG2-CE1 3.48Å; T261-Y418 VanDerWaalsContact CG2-CE1 3.48Å; T261-Y418 WeakPolarHBondContact O-CE1 3.18Å; F265-Y418 HydrophobicContact CB-CD1 3.75Å; F265-Y418 HydrophobicContact CB-CE1 3.79Å; F265-Y418 HydrophobicContact CB-CG 4.29Å; F265-Y418 AromaticContact CD2-CD1 3.88Å; F265-Y418 HydrophobicContact CD2-CD1 3.88Å; F265-Y418 AromaticContact CD2-CD2 3.94Å; F265-Y418 HydrophobicContact CD2-CD2 3.94Å; F265-Y418 AromaticContact CD2-CG 3.55Å; F265-Y418 HydrophobicContact CD2-CG 3.55Å; F265-Y418 HydrophobicContact CE2-CG 4.38Å; F265-Y418 HydrophobicContact CG-CD1 4.18Å; F265-Y418 HydrophobicContact CG-CG 4.3Å; F269-Y418 HydrophobicContact CD2-CD2 4.17Å; F269-Y418 HydrophobicContact CD2-CE2 4.31Å; F269-Y418 AromaticContact CE2-CD2 3.72Å; F269-Y418 HydrophobicContact CE2-CD2 3.72Å; F269-Y418 AromaticContact CE2-CE2 3.63Å; F269-Y418 HydrophobicContact CE2-CE2 3.63Å; A414-Y418 WeakPolarHBondContact O-CD2 3.34Å; A414-Y418 PolarHBondContact O-N 3.01Å; I415-Y418 PolarHBondContact O-N 3.32Å; Y418-F421 PolarHBondContact O-N 3.11Å; Y418-F422 HydrophobicContact CD1-CE2 4.32Å; Y418-F422 AromaticContact CD1-CZ 3.97Å; Y418-F422 HydrophobicContact CD1-CZ 3.97Å; Y418-F422 WeakPolarHBondContact O-CB 3.1Å; Y418-F422 WeakPolarHBondContact O-CD2 3.22Å; Y418-F422 VanDerWaalsContact O-CG 3.24Å; Y418-F422 WeakPolarHBondContact O-CG 3.21Å; Y418-F422 PolarHBondContact O-N 3.39Å
419Q91.4Very high87.1Confident64 Ų6454.4 Ų54.430%0.29928%0.277SS..Hα-helixtrans-59.4-50.9176.9-176-158.7-25.100111.3A337 R338 I415 A416 A417 F421 F422 S423A337-Q419 HydrophobicContact CB-CB 3.92Å; A337-Q419 HydrophobicContact CB-CG 4.45Å; R338-Q419 HydrophobicContact CB-CG 4.23Å; I415-Q419 WeakPolarHBondContact O-CB 3.44Å; I415-Q419 PolarHBondContact O-N 3.46Å; A416-Q419 PolarHBondContact O-N 3.48Å; A417-Q419 PolarHBondContact O-N 2.94Å; Q419-F421 VanDerWaalsContact C-N 3.29Å; Q419-F421 PolarHBondContact O-N 3.22Å; Q419-F422 PolarHBondContact O-N 3.32Å; Q419-S423 WeakPolarHBondContact O-CB 3.5Å; Q419-S423 PolarHBondContact O-N 3.21Å; Q419-S423 PolarHBondContact O-OG 3.48Å
420R91.9Very high88.3Confident176 Ų17651.2 Ų51.266%0.66426%0.264SS*.Hα-helixtrans-60.7-41.8178.8178.9-179.7-77.9131.4-4.7110.9A416 A417 S423 Q424A416-R420 WeakPolarHBondContact O-CB 3.34Å; A416-R420 PolarHBondContact O-N 2.83Å; A417-R420 PolarHBondContact O-N 3.39Å; R420-S423 PolarHBondContact O-OG 3.33Å; R420-S423 VanDerWaalsContact O-OG 3.04Å; R420-Q424 WeakPolarHBondContact O-CB 3.2Å; R420-Q424 PolarHBondContact O-N 3.48Å
421F92.5Very high89.4Confident6 Ų648.4 Ų48.43%0.02626%0.257CS..Hα-helixtrans-62.6-51.7178176.1-97.2000112Q257 T261 F330 V401 T405 A417 Y418 Q419 S423 Q424 M425Q257-F421 HydrophobicContact CG-CE1 4.38Å; Q257-F421 HydrophobicContact CG-CZ 4.19Å; T261-F421 HydrophobicContact CG2-CD1 3.84Å; T261-F421 HydrophobicContact CG2-CE1 3.72Å; T261-F421 HydrophobicContact CG2-CZ 4.44Å; F330-F421 HydrophobicContact CE1-CE1 4.37Å; V401-F421 HydrophobicContact CG1-CE2 3.45Å; V401-F421 VanDerWaalsContact CG1-CE2 3.45Å; V401-F421 HydrophobicContact CG1-CZ 3.71Å; V401-F421 WeakPolarHBondContact O-CE2 3.33Å; T405-F421 HydrophobicContact CG2-CB 3.43Å; T405-F421 VanDerWaalsContact CG2-CB 3.43Å; T405-F421 HydrophobicContact CG2-CD1 3.64Å; T405-F421 HydrophobicContact CG2-CD2 3.37Å; T405-F421 HydrophobicContact CG2-CE1 4.22Å; T405-F421 HydrophobicContact CG2-CE2 3.95Å; T405-F421 HydrophobicContact CG2-CG 3.18Å; T405-F421 HydrophobicContact CG2-CZ 4.35Å; A417-F421 VanDerWaalsContact O-CB 3.26Å; A417-F421 WeakPolarHBondContact O-CB 3.29Å; A417-F421 PolarHBondContact O-N 3.17Å; Y418-F421 PolarHBondContact O-N 3.11Å; Q419-F421 VanDerWaalsContact C-N 3.29Å; Q419-F421 PolarHBondContact O-N 3.22Å; F421-S423 VanDerWaalsContact C-N 3.32Å; F421-S423 PolarHBondContact O-N 3.01Å; F421-Q424 PolarHBondContact O-N 3.05Å; F421-M425 HydrophobicContact CD1-CG 4.28Å; F421-M425 HydrophobicContact CD2-CG 4.38Å; F421-M425 HydrophobicContact CE1-CG 3.9Å; F421-M425 HydrophobicContact CE2-CE 4.3Å; F421-M425 HydrophobicContact CE2-CG 4.04Å; F421-M425 HydrophobicContact CE2-SD 4.3Å; F421-M425 HydrophobicContact CZ-CG 3.78Å; F421-M425 HydrophobicContact CZ-SD 4.3Å; F421-M425 WeakPolarHBondContact O-CB 3.46Å; F421-M425 VanDerWaalsContact O-CG 3.31Å; F421-M425 WeakPolarHBondContact O-CG 3.35Å; F421-M425 PolarHBondContact O-N 3.35Å
422F94.6Very high90.3Very high0 Ų048.7 Ų48.70%026%0.259CS..Hα-helixtrans-63.1-39.5179.9-63.3-34.5000111.9T261 I262 F265 F330 L333 A334 A337 Y418 Q419 G426T261-F422 HydrophobicContact CG2-CE1 3.96Å; T261-F422 HydrophobicContact CG2-CZ 4.29Å; I262-F422 HydrophobicContact CG1-CE1 3.84Å; I262-F422 HydrophobicContact CG1-CZ 4.23Å; F265-F422 HydrophobicContact CB-CE2 4.33Å; F265-F422 HydrophobicContact CB-CZ 4.02Å; F265-F422 AromaticContact CD1-CE2 3.93Å; F265-F422 HydrophobicContact CD1-CE2 3.93Å; F265-F422 HydrophobicContact CD1-CZ 4.29Å; F265-F422 HydrophobicContact CD2-CE2 4.06Å; F265-F422 HydrophobicContact CE1-CE2 4.29Å; F265-F422 HydrophobicContact CE2-CE2 4.41Å; F265-F422 AromaticContact CG-CE2 3.81Å; F265-F422 HydrophobicContact CG-CE2 3.81Å; F265-F422 HydrophobicContact CG-CZ 4.01Å; F330-F422 HydrophobicContact CD1-CB 4.4Å; F330-F422 AromaticContact CD1-CD1 3.9Å; F330-F422 HydrophobicContact CD1-CD1 3.9Å; F330-F422 AromaticContact CE1-CD1 3.99Å; F330-F422 HydrophobicContact CE1-CD1 3.99Å; L333-F422 HydrophobicContact CB-CB 4.31Å; L333-F422 HydrophobicContact CB-CD1 4.39Å; L333-F422 HydrophobicContact CB-CD2 3.83Å; L333-F422 HydrophobicContact CB-CE2 4.22Å; L333-F422 HydrophobicContact CB-CG 3.94Å; A334-F422 HydrophobicContact CB-CB 3.71Å; A337-F422 HydrophobicContact CB-CD2 4.09Å; A337-F422 HydrophobicContact CB-CE2 4.42Å; Y418-F422 HydrophobicContact CD1-CE2 4.32Å; Y418-F422 AromaticContact CD1-CZ 3.97Å; Y418-F422 HydrophobicContact CD1-CZ 3.97Å; Y418-F422 WeakPolarHBondContact O-CB 3.1Å; Y418-F422 WeakPolarHBondContact O-CD2 3.22Å; Y418-F422 VanDerWaalsContact O-CG 3.24Å; Y418-F422 WeakPolarHBondContact O-CG 3.21Å; Y418-F422 PolarHBondContact O-N 3.39Å; Q419-F422 PolarHBondContact O-N 3.32Å; F422-G426 PolarHBondContact O-N 3.21Å
423S94.7Very high91.1Very high29 Ų2946.8 Ų46.820%0.20324%0.236CC..Hα-helixtrans-64.8-46.6176.276.90000111.1Q419 R420 F421 M425 G426 E427Q419-S423 WeakPolarHBondContact O-CB 3.5Å; Q419-S423 PolarHBondContact O-N 3.21Å; Q419-S423 PolarHBondContact O-OG 3.48Å; R420-S423 PolarHBondContact O-OG 3.33Å; R420-S423 VanDerWaalsContact O-OG 3.04Å; F421-S423 VanDerWaalsContact C-N 3.32Å; F421-S423 PolarHBondContact O-N 3.01Å; S423-M425 PolarHBondContact O-N 3.2Å; S423-G426 PolarHBondContact O-N 3.48Å; S423-E427 WeakPolarHBondContact O-CB 3.47Å; S423-E427 VanDerWaalsContact O-CG 3.28Å; S423-E427 WeakPolarHBondContact O-CG 3.28Å; S423-E427 PolarHBondContact O-N 3.08Å
424Q93.9Very high91.6Very high54 Ų5443.3 Ų43.325%0.25223%0.227SC..Hα-helixtrans-61.6-44.1179.1-174.317611.300111.9R420 F421 G426 E427 W428R420-Q424 WeakPolarHBondContact O-CB 3.2Å; R420-Q424 PolarHBondContact O-N 3.48Å; F421-Q424 PolarHBondContact O-N 3.05Å; Q424-G426 VanDerWaalsContact C-N 3.35Å; Q424-G426 PolarHBondContact O-N 2.85Å; Q424-E427 PolarHBondContact O-N 3.4Å; Q424-W428 HydrophobicContact CG-CD2 4.12Å; Q424-W428 HydrophobicContact CG-CG 4.36Å; Q424-W428 HydrophobicContact CG-CZ2 4.11Å; Q424-W428 VanDerWaalsContact O-CB 3.29Å; Q424-W428 WeakPolarHBondContact O-CB 3.29Å; Q424-W428 VanDerWaalsContact O-CD1 3.27Å; Q424-W428 PolarHBondContact O-N 2.65Å
425M92.9Very high91.9Very high7 Ų747.9 Ų47.93%0.03425%0.25CS..Hα-helixtrans-61.4-43.7175-70.1-54.6103.100111.3L254 F330 V401 F421 S423 W428 T429L254-M425 HydrophobicContact CD2-CB 3.89Å; L254-M425 HydrophobicContact CD2-CG 4.02Å; L254-M425 HydrophobicContact CD2-SD 3.57Å; L254-M425 VanDerWaalsContact CD2-SD 3.57Å; F330-M425 HydrophobicContact CD1-CB 3.65Å; F330-M425 HydrophobicContact CD1-CG 4.37Å; F330-M425 HydrophobicContact CD2-CB 4.45Å; F330-M425 HydrophobicContact CE1-CB 3.87Å; F330-M425 HydrophobicContact CE1-CG 4.14Å; F330-M425 HydrophobicContact CG-CB 3.96Å; F330-M425 HydrophobicContact CZ-CB 4.37Å; V401-M425 HydrophobicContact CG1-CE 4.23Å; V401-M425 HydrophobicContact CG1-SD 3.9Å; F421-M425 HydrophobicContact CD1-CG 4.28Å; F421-M425 HydrophobicContact CD2-CG 4.38Å; F421-M425 HydrophobicContact CE1-CG 3.9Å; F421-M425 HydrophobicContact CE2-CE 4.3Å; F421-M425 HydrophobicContact CE2-CG 4.04Å; F421-M425 HydrophobicContact CE2-SD 4.3Å; F421-M425 HydrophobicContact CZ-CG 3.78Å; F421-M425 HydrophobicContact CZ-SD 4.3Å; F421-M425 WeakPolarHBondContact O-CB 3.46Å; F421-M425 VanDerWaalsContact O-CG 3.31Å; F421-M425 WeakPolarHBondContact O-CG 3.35Å; F421-M425 PolarHBondContact O-N 3.35Å; S423-M425 PolarHBondContact O-N 3.2Å; M425-W428 HydrophobicContact CE-CE3 4.07Å; M425-W428 HydrophobicContact CE-CZ3 4.33Å; M425-T429 VanDerWaalsContact O-CB 3.32Å; M425-T429 WeakPolarHBondContact O-CB 3.39Å; M425-T429 PolarHBondContact O-N 2.63Å; M425-T429 PolarHBondContact O-OG1 2.79Å
426G93.2Very high92Very high0 Ų047.9 Ų47.90%025%0.25CS..Hα-helixtrans-61.5-47175.200000112.9F422 S423 Q424 T429 L430F422-G426 PolarHBondContact O-N 3.21Å; S423-G426 PolarHBondContact O-N 3.48Å; Q424-G426 VanDerWaalsContact C-N 3.35Å; Q424-G426 PolarHBondContact O-N 2.85Å; G426-T429 PolarHBondContact O-N 2.89Å; G426-L430 WeakPolarHBondContact O-CG 3.28Å; G426-L430 PolarHBondContact O-N 2.91Å
427E94.4Very high91.9Very high111 Ų11148.1 Ų48.152%0.51925%0.247SC..Hα-helixtrans-64.7-45.3-179.7-72.5170.8-162.200111.9M331 S423 Q424 T429 L430 A431M331-E427 HydrophobicContact CE-CB 4.34Å; M331-E427 HydrophobicContact CE-CG 3.57Å; S423-E427 WeakPolarHBondContact O-CB 3.47Å; S423-E427 VanDerWaalsContact O-CG 3.28Å; S423-E427 WeakPolarHBondContact O-CG 3.28Å; S423-E427 PolarHBondContact O-N 3.08Å; Q424-E427 PolarHBondContact O-N 3.4Å; E427-T429 VanDerWaalsContact C-N 3.3Å; E427-T429 PolarHBondContact O-N 3.23Å; E427-L430 PolarHBondContact O-N 2.79Å; E427-A431 WeakPolarHBondContact O-CB 3.45Å; E427-A431 PolarHBondContact O-N 2.89Å
428W92.9Very high91.9Very high151 Ų15152.1 Ų52.157%0.57227%0.27SS*.Hα-helixtrans-64-38.9177.6-73.716.2000111.3Q424 M425 A431 C432Q424-W428 HydrophobicContact CG-CD2 4.12Å; Q424-W428 HydrophobicContact CG-CG 4.36Å; Q424-W428 HydrophobicContact CG-CZ2 4.11Å; Q424-W428 VanDerWaalsContact O-CB 3.29Å; Q424-W428 WeakPolarHBondContact O-CB 3.29Å; Q424-W428 VanDerWaalsContact O-CD1 3.27Å; Q424-W428 PolarHBondContact O-N 2.65Å; M425-W428 HydrophobicContact CE-CE3 4.07Å; M425-W428 HydrophobicContact CE-CZ3 4.33Å; W428-A431 PolarHBondContact O-N 3.38Å; W428-C432 PolarHBondContact O-N 3.48Å; W428-C432 PolarHBondContact O-SG 3.2Å; W428-C432 VanDerWaalsContact O-SG 3.37Å
429T93.1Very high91.5Very high5 Ų556.6 Ų56.63%0.03129%0.294CS..Hα-helixtrans-66.7-41.7176.1-51.20000111L254 L323 M326 A327 M425 G426 E427 A431 C432 V433L254-T429 HydrophobicContact CD1-CG2 3.97Å; L254-T429 WeakPolarHBondContact CD1-OG1 3.26Å; L323-T429 HydrophobicContact CB-CG2 4.15Å; L323-T429 HydrophobicContact CD2-CG2 4.1Å; L323-T429 WeakPolarHBondContact O-CG2 3.29Å; M326-T429 HydrophobicContact CB-CG2 4.47Å; M326-T429 HydrophobicContact CG-CG2 4.5Å; A327-T429 HydrophobicContact CB-CG2 3.78Å; M425-T429 VanDerWaalsContact O-CB 3.32Å; M425-T429 WeakPolarHBondContact O-CB 3.39Å; M425-T429 PolarHBondContact O-N 2.63Å; M425-T429 PolarHBondContact O-OG1 2.79Å; G426-T429 PolarHBondContact O-N 2.89Å; E427-T429 VanDerWaalsContact C-N 3.3Å; E427-T429 PolarHBondContact O-N 3.23Å; T429-A431 VanDerWaalsContact C-N 3.35Å; T429-A431 PolarHBondContact O-N 3.28Å; T429-C432 WeakPolarHBondContact O-CB 3.38Å; T429-C432 PolarHBondContact O-N 3.47Å; T429-V433 WeakPolarHBondContact O-CG2 3.15Å; T429-V433 PolarHBondContact O-N 3.3Å
430L93.8Very high90.8Very high70 Ų7053.7 Ų53.737%0.36628%0.281SS..Hα-helixtrans-61.7-40.8172.9-76.3170.9000112.2L324 A327 M331 G426 E427 V433 A434L324-L430 HydrophobicContact CD1-CD2 3.91Å; A327-L430 HydrophobicContact CB-CD2 3.96Å; A327-L430 HydrophobicContact CB-CG 3.79Å; M331-L430 HydrophobicContact CE-CD1 4.13Å; G426-L430 WeakPolarHBondContact O-CG 3.28Å; G426-L430 PolarHBondContact O-N 2.91Å; E427-L430 PolarHBondContact O-N 2.79Å; L430-V433 WeakPolarHBondContact O-CB 3.23Å; L430-V433 PolarHBondContact O-N 3.32Å; L430-A434 PolarHBondContact O-N 2.96Å
431A93.2Very high90.2Very high51 Ų5149.7 Ų49.742%0.42127%0.268SS..Hα-helixtrans-61.7-43.8175.100000111.3E427 W428 T429 V433 A434 I435E427-A431 WeakPolarHBondContact O-CB 3.45Å; E427-A431 PolarHBondContact O-N 2.89Å; W428-A431 PolarHBondContact O-N 3.38Å; T429-A431 VanDerWaalsContact C-N 3.35Å; T429-A431 PolarHBondContact O-N 3.28Å; A431-V433 VanDerWaalsContact C-N 3.35Å; A431-V433 PolarHBondContact O-N 3.14Å; A431-A434 PolarHBondContact O-N 2.84Å; A431-I435 VanDerWaalsContact O-CG1 3.29Å; A431-I435 WeakPolarHBondContact O-CG1 3.31Å; A431-I435 PolarHBondContact O-N 3.29Å
432C91.5Very high89.4Confident43 Ų4351.1 Ų51.129%0.29128%0.281SS..Hα-helixtrans-59.4-43.3173.1-74.40000112.2W428 T429 I435 I436W428-C432 PolarHBondContact O-N 3.48Å; W428-C432 PolarHBondContact O-SG 3.2Å; W428-C432 VanDerWaalsContact O-SG 3.37Å; T429-C432 WeakPolarHBondContact O-CB 3.38Å; T429-C432 PolarHBondContact O-N 3.47Å; C432-I435 PolarHBondContact O-N 3.19Å; C432-I436 VanDerWaalsContact O-CG1 3.26Å; C432-I436 WeakPolarHBondContact O-CG1 3.43Å; C432-I436 PolarHBondContact O-N 3.1Å
433V91.8Very high88.1Confident16 Ų1654.2 Ų54.210%0.09730%0.3CS..Hα-helixtrans-59.5-47.91751720000110.8A320 L323 L324 T429 L430 A431 I435 I436 V437A320-V433 HydrophobicContact CB-CG1 4.43Å; L323-V433 HydrophobicContact CB-CG2 3.42Å; L323-V433 VanDerWaalsContact CB-CG2 3.42Å; L324-V433 HydrophobicContact CB-CG2 4.41Å; L324-V433 HydrophobicContact CD1-CG1 4.32Å; T429-V433 WeakPolarHBondContact O-CG2 3.15Å; T429-V433 PolarHBondContact O-N 3.3Å; L430-V433 WeakPolarHBondContact O-CB 3.23Å; L430-V433 PolarHBondContact O-N 3.32Å; A431-V433 VanDerWaalsContact C-N 3.35Å; A431-V433 PolarHBondContact O-N 3.14Å; V433-I435 VanDerWaalsContact C-N 3.34Å; V433-I435 PolarHBondContact O-N 3.37Å; V433-I436 PolarHBondContact O-N 3.39Å; V433-V437 HydrophobicContact CG1-CG2 4.27Å; V433-V437 WeakPolarHBondContact O-CB 3.34Å; V433-V437 VanDerWaalsContact O-CG2 3.29Å; V433-V437 WeakPolarHBondContact O-CG2 3.26Å; V433-V437 PolarHBondContact O-N 2.83Å
434A91.9Very high86.7Confident54 Ų5460.3 Ų60.345%0.44632%0.319SS..Hα-helixtrans-59.2-45.1178.900000111.5L430 A431 V437 V438L430-A434 PolarHBondContact O-N 2.96Å; A431-A434 PolarHBondContact O-N 2.84Å; A434-V437 PolarHBondContact O-N 3.07Å; A434-V438 WeakPolarHBondContact O-CB 3.26Å; A434-V438 VanDerWaalsContact O-CG2 3.25Å; A434-V438 WeakPolarHBondContact O-CG2 3.39Å; A434-V438 PolarHBondContact O-N 2.78Å
435I89.5Confident84.9Confident99 Ų9965.4 Ų65.451%0.50834%0.34SS..Hα-helixtrans-60.5-47.6176.2-67.6164.7000110.8A431 C432 V433 V437 V438 L439A431-I435 VanDerWaalsContact O-CG1 3.29Å; A431-I435 WeakPolarHBondContact O-CG1 3.31Å; A431-I435 PolarHBondContact O-N 3.29Å; C432-I435 PolarHBondContact O-N 3.19Å; V433-I435 VanDerWaalsContact C-N 3.34Å; V433-I435 PolarHBondContact O-N 3.37Å; I435-V437 VanDerWaalsContact C-N 3.35Å; I435-V437 PolarHBondContact O-N 3.31Å; I435-V438 PolarHBondContact O-N 3.43Å; I435-L439 HydrophobicContact CG2-CD1 3.75Å; I435-L439 HydrophobicContact CG2-CG 4.31Å; I435-L439 WeakPolarHBondContact O-CB 3.24Å; I435-L439 VanDerWaalsContact O-CG 3.26Å; I435-L439 WeakPolarHBondContact O-CG 3.13Å; I435-L439 PolarHBondContact O-N 3.33Å
436I87.2Confident82.8Confident13 Ų1371.4 Ų71.47%0.06737%0.372CS..Hα-helixtrans-61.6-44.3180-70.4164.9000110.9V247 W316 A320 L323 C432 V433 L439 A440V247-I436 HydrophobicContact CG1-CD1 3.81Å; V247-I436 HydrophobicContact CG2-CD1 4.43Å; W316-I436 HydrophobicContact CB-CG2 4.44Å; W316-I436 HydrophobicContact CE3-CG2 3.74Å; A320-I436 HydrophobicContact CB-CG2 4.02Å; L323-I436 HydrophobicContact CD1-CD1 3.41Å; L323-I436 VanDerWaalsContact CD1-CD1 3.41Å; C432-I436 VanDerWaalsContact O-CG1 3.26Å; C432-I436 WeakPolarHBondContact O-CG1 3.43Å; C432-I436 PolarHBondContact O-N 3.1Å; V433-I436 PolarHBondContact O-N 3.39Å; I436-L439 PolarHBondContact O-N 3.23Å; I436-A440 WeakPolarHBondContact O-CB 3.33Å; I436-A440 PolarHBondContact O-N 3.37Å
437V87.2Confident80.7Confident47 Ų4779.2 Ų79.229%0.28541%0.406SS..Hα-helixtrans-63.5-47.7178.8171.70000110.3A320 V433 A434 I435 L439 A440 F441A320-V437 HydrophobicContact CB-CG2 4.08Å; V433-V437 HydrophobicContact CG1-CG2 4.27Å; V433-V437 WeakPolarHBondContact O-CB 3.34Å; V433-V437 VanDerWaalsContact O-CG2 3.29Å; V433-V437 WeakPolarHBondContact O-CG2 3.26Å; V433-V437 PolarHBondContact O-N 2.83Å; A434-V437 PolarHBondContact O-N 3.07Å; I435-V437 VanDerWaalsContact C-N 3.35Å; I435-V437 PolarHBondContact O-N 3.31Å; V437-L439 PolarHBondContact O-N 3.42Å; V437-A440 PolarHBondContact O-N 2.97Å; V437-F441 HydrophobicContact CG1-CD2 3.7Å; V437-F441 HydrophobicContact CG1-CE2 3.77Å; V437-F441 VanDerWaalsContact O-CD2 3.27Å; V437-F441 WeakPolarHBondContact O-CD2 3.43Å; V437-F441 PolarHBondContact O-N 3.28Å
438V86.7Confident78.1Confident97 Ų9777.4 Ų77.459%0.58841%0.406SS*.Hα-helixtrans-59.3-46.1177.5170.50000111.1A434 I435 A440 F441 A442A434-V438 WeakPolarHBondContact O-CB 3.26Å; A434-V438 VanDerWaalsContact O-CG2 3.25Å; A434-V438 WeakPolarHBondContact O-CG2 3.39Å; A434-V438 PolarHBondContact O-N 2.78Å; I435-V438 PolarHBondContact O-N 3.43Å; V438-A440 PolarHBondContact O-N 3.49Å; V438-F441 PolarHBondContact O-N 3.39Å; V438-A442 VanDerWaalsContact O-CB 3.24Å; V438-A442 WeakPolarHBondContact O-CB 3.4Å; V438-A442 PolarHBondContact O-N 3.17Å
439L82.3Confident75.2Confident96 Ų9675.7 Ų75.750%0.50341%0.412SS..Hα-helixtrans-64.6-39.4177.3-70.3173.6000112.2I435 I436 V437 F441 A442 T443I435-L439 HydrophobicContact CG2-CD1 3.75Å; I435-L439 HydrophobicContact CG2-CG 4.31Å; I435-L439 WeakPolarHBondContact O-CB 3.24Å; I435-L439 VanDerWaalsContact O-CG 3.26Å; I435-L439 WeakPolarHBondContact O-CG 3.13Å; I435-L439 PolarHBondContact O-N 3.33Å; I436-L439 PolarHBondContact O-N 3.23Å; V437-L439 PolarHBondContact O-N 3.42Å; L439-F441 VanDerWaalsContact C-N 3.35Å; L439-F441 PolarHBondContact O-N 3.26Å; L439-A442 PolarHBondContact O-N 2.78Å; L439-T443 WeakPolarHBondContact O-CG2 3.11Å; L439-T443 PolarHBondContact O-N 2.92Å; L439-T443 PolarHBondContact O-OG1 3.16Å
440A77.7Confident72.5Confident3 Ų380.6 Ų80.63%0.02544%0.444CS..Hα-helixtrans-65.1-37.7177.300000112.1L313 W316 I436 V437 V438 T443 R444L313-A440 HydrophobicContact CD1-CB 3.84Å; W316-A440 HydrophobicContact CB-CB 4.16Å; I436-A440 WeakPolarHBondContact O-CB 3.33Å; I436-A440 PolarHBondContact O-N 3.37Å; V437-A440 PolarHBondContact O-N 2.97Å; V438-A440 PolarHBondContact O-N 3.49Å; A440-T443 PolarHBondContact O-OG1 3.33Å; A440-R444 PolarHBondContact O-N 3.01Å
441F78.4Confident69.8Low92 Ų9284 Ų8440%0.40447%0.468SS..Hα-helixtrans-75.6-40.6173.4-83.2-78.7000112.4V437 V438 L439 T443 R444 F445V437-F441 HydrophobicContact CG1-CD2 3.7Å; V437-F441 HydrophobicContact CG1-CE2 3.77Å; V437-F441 VanDerWaalsContact O-CD2 3.27Å; V437-F441 WeakPolarHBondContact O-CD2 3.43Å; V437-F441 PolarHBondContact O-N 3.28Å; V438-F441 PolarHBondContact O-N 3.39Å; L439-F441 VanDerWaalsContact C-N 3.35Å; L439-F441 PolarHBondContact O-N 3.26Å; F441-T443 VanDerWaalsContact C-N 3.32Å; F441-T443 PolarHBondContact O-N 3.07Å; F441-R444 WeakPolarHBondContact O-CA 3.15Å; F441-R444 VanDerWaalsContact O-CB 3.27Å; F441-R444 WeakPolarHBondContact O-CB 3.12Å; F441-R444 PolarHBondContact O-N 3.34Å; F441-F445 WeakPolarHBondContact O-CD2 3.42Å; F441-F445 PolarHBondContact O-N 3.44Å; F441-F445 VanDerWaalsContact O-N 3.11Å
442A76.2Confident67Low36 Ų3688.1 Ų88.130%0.29848%0.483SS..Hα-helixtrans-61.1-41.4178.500000111.8V438 L439 R444 F445 L446V438-A442 VanDerWaalsContact O-CB 3.24Å; V438-A442 WeakPolarHBondContact O-CB 3.4Å; V438-A442 PolarHBondContact O-N 3.17Å; L439-A442 PolarHBondContact O-N 2.78Å; A442-R444 VanDerWaalsContact C-N 3.28Å; A442-R444 PolarHBondContact O-N 3.13Å; A442-F445 PolarHBondContact O-N 3.33Å; A442-L446 WeakPolarHBondContact O-CB 3.3Å; A442-L446 PolarHBondContact O-N 3.4Å
443T68.2Low64.2Low64 Ų6494.8 Ų94.839%0.39351%0.512SS..Hα-helixtrans-62.6-35173.550.90000112.1L439 A440 F441 F447L439-T443 WeakPolarHBondContact O-CG2 3.11Å; L439-T443 PolarHBondContact O-N 2.92Å; L439-T443 PolarHBondContact O-OG1 3.16Å; A440-T443 PolarHBondContact O-OG1 3.33Å; F441-T443 VanDerWaalsContact C-N 3.32Å; F441-T443 PolarHBondContact O-N 3.07Å; T443-F447 HydrophobicContact CG2-CE2 4.2Å; T443-F447 WeakPolarHBondContact O-CB 3.15Å; T443-F447 WeakPolarHBondContact O-CD2 3.3Å; T443-F447 PolarHBondContact O-N 3.2Å
444R63.9Low61.5Low158 Ų158102.5 Ų102.560%0.59655%0.551SS**Hα-helixtrans-61.9-44.1173.3-171.1-177.3178.5-178.9-1.2112A440 F441 A442 S448A440-R444 PolarHBondContact O-N 3.01Å; F441-R444 WeakPolarHBondContact O-CA 3.15Å; F441-R444 VanDerWaalsContact O-CB 3.27Å; F441-R444 WeakPolarHBondContact O-CB 3.12Å; F441-R444 PolarHBondContact O-N 3.34Å; A442-R444 VanDerWaalsContact C-N 3.28Å; A442-R444 PolarHBondContact O-N 3.13Å; R444-S448 VanDerWaalsContact O-CB 3.25Å; R444-S448 WeakPolarHBondContact O-CB 3.01Å; R444-S448 PolarHBondContact O-N 2.86Å; R444-S448 VanDerWaalsContact O-N 3.13Å; R444-S448 PolarHBondContact O-OG 3.15Å; R444-S448 VanDerWaalsContact O-OG 3.13Å
445F56.7Low58.8Low160 Ų160108.6 Ų108.670%0.70257%0.57SS**Hα-helixtrans-71.2-40.7179.2-80.4-77.2000113.1F441 A442 S448F441-F445 WeakPolarHBondContact O-CD2 3.42Å; F441-F445 PolarHBondContact O-N 3.44Å; F441-F445 VanDerWaalsContact O-N 3.11Å; A442-F445 PolarHBondContact O-N 3.33Å; F445-S448 PolarHBondContact O-OG 3.47Å
446L48.3Very low56.3Low134 Ų134113.3 Ų113.370%0.70259%0.59SS**Hα-helixtrans-71.3-33-179.6-86.7152.9000113A442A442-L446 WeakPolarHBondContact O-CB 3.3Å; A442-L446 PolarHBondContact O-N 3.4Å
447F50.6Low53.9Low163 Ų163117.8 Ų117.872%0.71562%0.622SS**Hα-helixtrans-98.20.4-179.8-64.8-64.9000114.1T443 T449T443-F447 HydrophobicContact CG2-CE2 4.2Å; T443-F447 WeakPolarHBondContact O-CB 3.15Å; T443-F447 WeakPolarHBondContact O-CD2 3.3Å; T443-F447 PolarHBondContact O-N 3.2Å; F447-T449 PolarHBondContact O-N 2.97Å
448S40.2Very low51.4Low73 Ų73123 Ų12351%0.5165%0.648SS.*  trans-87.456.8166.466.70000110.8R444 F445 P450R444-S448 VanDerWaalsContact O-CB 3.25Å; R444-S448 WeakPolarHBondContact O-CB 3.01Å; R444-S448 PolarHBondContact O-N 2.86Å; R444-S448 VanDerWaalsContact O-N 3.13Å; R444-S448 PolarHBondContact O-OG 3.15Å; R444-S448 VanDerWaalsContact O-OG 3.13Å; F445-S448 PolarHBondContact O-OG 3.47Å; S448-P450 WeakPolarHBondContact O-CD 3.36Å
449T31.8Very low49.2Very low115 Ų115129.8 Ų129.871%0.70668%0.681SS**  trans-75.4119.6158.321.40000107.5F447 T451F447-T449 PolarHBondContact O-N 2.97Å; T449-T451 PolarHBondContact O-N 2.78Å
450P36.7Very low47.6Very low108 Ų108131.5 Ų131.570%0.70169%0.69SS**  trans-65.1119.9-179.726.1-31.3000108.6S448 N452S448-P450 WeakPolarHBondContact O-CD 3.36Å; P450-N452 PolarHBondContact O-N 3.01Å
451T36.8Very low46Very low141 Ų141138.2 Ų138.287%0.86573%0.725SS**  trans-66.877.2164.742.80000108.8T449T449-T451 PolarHBondContact O-N 2.78Å
452N33.7Very low44.2Very low139 Ų139140.8 Ų140.874%0.74374%0.743SS**  trans-143.4125164.3-82.9-19.8000105.7P450P450-N452 PolarHBondContact O-N 3.01Å
453M32.3Very low42.3Very low183 Ų183146.9 Ų146.990%0.90177%0.77SS**  trans128.250.6171.2-62.9-104.7-67.600113.1
454I36.4Very low40.7Very low177 Ų177152.1 Ų152.191%0.90879%0.793SS**  trans-145.661141.9-45.4177.9000107.7
455Q35.1Very low39.2Very low183 Ų183151.7 Ų151.786%0.85581%0.806SS**  trans-114.3144.9149.3-92176.9-52.100105
456E36.5Very low37.9Very low198 Ų198151.1 Ų151.193%0.92581%0.814SS**  trans92.574.1-177.2-55-178.1173.400115.7
457S35.9Very low37.1Very low107 Ų107152.5 Ų152.575%0.74882%0.822SS**  trans-15658.7145.1166.70000107.2
458N34.5Very low36Very low155 Ų155151.6 Ų151.683%0.82983%0.831SS**  trans-14679.2165.5-91.6-13.8000105.6
459D42.1Very low35.6Very low240 Ų240158.7 Ų158.7100%1.28386%0.86SS**  trans-174.90148.1-81.6-21.2000105.6

Retrieved 459 of 459 residues in 92.5 ms (Link to these results)

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