A0A087YRJ0_POEFO Loading...

Melanin-concentrating hormone receptor 1

AlphaFold DB , UniProt , Accession A0A087YRJ0, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 356 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
1M49.7Very low43.6Very low15 Ų1543.3 Ų43.37%0.07423%0.225CC..  089.60-120.5178.1-152.800106.1L86 Q89 W96 I106 T107 D110 C181M1-L86 HydrophobicContact CE-CB 4.37Å; M1-L86 HydrophobicContact CE-CD1 4.12Å; M1-L86 HydrophobicContact CG-CD1 4.02Å; M1-Q89 VanDerWaalsContact CE-OE1 3.24Å; M1-W96 HydrophobicContact CE-CE3 4.11Å; M1-W96 HydrophobicContact CE-CH2 3.89Å; M1-W96 HydrophobicContact CE-CZ3 3.37Å; M1-I106 HydrophobicContact CE-CG2 4.1Å; M1-T107 HydrophobicContact CB-CG2 4.1Å; M1-D110 PolarHBondContact N-OD2 3.34Å; M1-C181 HydrophobicContact SD-CB 3.78Å; M1-C181 PolarHBondContact SD-SG 2.93Å
2D50.8Low43.3Very low22 Ų2242.5 Ų42.512%0.11824%0.235CC..  trans-107.3152.9-148.8-50.2-34.4000112.1L4 N5 V6 Y259 Y280 I284D2-L4 PolarHBondContact O-N 3.35Å; D2-N5 WeakPolarHBondContact O-CB 3.42Å; D2-N5 PolarHBondContact O-N 3.45Å; D2-V6 PolarHBondContact O-N 3.05Å; D2-Y259 VanDerWaalsContact CG-OH 3.27Å; D2-Y259 PolarHBondContact OD1-OH 3.39Å; D2-Y259 WeakPolarHBondContact OD2-CE2 3.33Å; D2-Y259 PolarHBondContact OD2-OH 2.96Å; D2-Y280 VanDerWaalsContact CB-OH 3.28Å; D2-Y280 WeakPolarHBondContact CB-OH 3.34Å; D2-I284 WeakPolarHBondContact OD2-CD1 3.25Å
3F41.6Very low42.9Very low36 Ų3646.6 Ų46.616%0.15826%0.257CS..Hα-helixtrans-52.1-29.6-177.2-78.4-84.1000114.4V6 S7 L183 L185 L188 T192F3-V6 PolarHBondContact O-N 2.89Å; F3-S7 PolarHBondContact O-N 2.83Å; F3-S7 PolarHBondContact O-OG 3.02Å; F3-S7 VanDerWaalsContact O-OG 3.1Å; F3-L183 HydrophobicContact CE1-CB 4.4Å; F3-L183 WeakPolarHBondContact CE1-O 3.41Å; F3-L183 HydrophobicContact CE2-CB 3.81Å; F3-L183 HydrophobicContact CE2-CD2 3.59Å; F3-L183 HydrophobicContact CE2-CG 4.24Å; F3-L183 HydrophobicContact CZ-CB 3.67Å; F3-L183 HydrophobicContact CZ-CD2 3.85Å; F3-L183 HydrophobicContact CZ-CG 4.13Å; F3-L183 WeakPolarHBondContact CZ-O 3.36Å; F3-L185 HydrophobicContact CZ-CD1 4.23Å; F3-L185 HydrophobicContact CZ-CD2 4.17Å; F3-L188 HydrophobicContact CD1-CD1 4.24Å; F3-L188 HydrophobicContact CE1-CD1 3.74Å; F3-T192 HydrophobicContact CD2-CG2 4.4Å; F3-T192 HydrophobicContact CE2-CG2 4.37Å
4L45.3Very low42.3Very low10 Ų1052.5 Ų52.55%0.05229%0.287CS..Hα-helixtrans-75.7-26.6178-91.9160.5000113.6D2 V6 S7 Y8 H266 F276 Y280D2-L4 PolarHBondContact O-N 3.35Å; L4-V6 VanDerWaalsContact C-N 3.33Å; L4-S7 WeakPolarHBondContact CA-OG 3.44Å; L4-S7 PolarHBondContact O-OG 2.98Å; L4-Y8 WeakPolarHBondContact O-CB 3.47Å; L4-Y8 PolarHBondContact O-N 2.94Å; L4-H266 HydrophobicContact CD1-CB 4.09Å; L4-F276 HydrophobicContact CD1-CE1 3.89Å; L4-F276 HydrophobicContact CD1-CZ 4.4Å; L4-F276 HydrophobicContact CD2-CE1 4.13Å; L4-Y280 HydrophobicContact CB-CD1 3.77Å; L4-Y280 HydrophobicContact CB-CE1 3.37Å; L4-Y280 HydrophobicContact CB-CE2 4.26Å; L4-Y280 HydrophobicContact CB-CG 4.34Å; L4-Y280 HydrophobicContact CD1-CD1 4.09Å; L4-Y280 HydrophobicContact CD1-CD2 3.42Å; L4-Y280 VanDerWaalsContact CD1-CD2 3.42Å; L4-Y280 HydrophobicContact CD1-CE1 3.97Å; L4-Y280 HydrophobicContact CD1-CE2 3.27Å; L4-Y280 HydrophobicContact CD1-CG 3.81Å; L4-Y280 HydrophobicContact CG-CE1 4.31Å; L4-Y280 HydrophobicContact CG-CE2 4.38Å
5N45.5Very low41.3Very low21 Ų2158.4 Ų58.411%0.11232%0.318CS..Hα-helixtrans-67.8-40.9171-127.320000109.4D2 Y8 F9 L90D2-N5 WeakPolarHBondContact O-CB 3.42Å; D2-N5 PolarHBondContact O-N 3.45Å; N5-Y8 WeakPolarHBondContact O-CB 3.33Å; N5-Y8 PolarHBondContact O-N 3.33Å; N5-F9 HydrophobicContact CB-CE2 4.49Å; N5-F9 WeakPolarHBondContact O-CD2 3.4Å; N5-F9 WeakPolarHBondContact O-CE2 3.16Å; N5-F9 PolarHBondContact O-N 3.09Å; N5-F9 VanDerWaalsContact O-N 3.12Å; N5-L90 WeakPolarHBondContact ND2-CD2 3.39Å
6V45.6Very low40.9Very low18 Ų1861.5 Ų61.511%0.10933%0.333CS..Hα-helixtrans-69.4-41.5178.7-177.50000112D2 F3 L4 F9 S10 M172 A182D2-V6 PolarHBondContact O-N 3.05Å; F3-V6 PolarHBondContact O-N 2.89Å; L4-V6 VanDerWaalsContact C-N 3.33Å; V6-F9 PolarHBondContact O-N 3.06Å; V6-S10 WeakPolarHBondContact O-CB 3.39Å; V6-S10 PolarHBondContact O-N 3.36Å; V6-M172 HydrophobicContact CG1-SD 3.61Å; V6-A182 HydrophobicContact CG1-CB 4.41Å; V6-A182 HydrophobicContact CG2-CB 3.73Å
7S39.3Very low40.4Very low36 Ų3665.7 Ų65.725%0.25236%0.362SS..Hα-helixtrans-74.9-25.6175.259.80000113.5F3 L4 S10 N11F3-S7 PolarHBondContact O-N 2.83Å; F3-S7 PolarHBondContact O-OG 3.02Å; F3-S7 VanDerWaalsContact O-OG 3.1Å; L4-S7 WeakPolarHBondContact CA-OG 3.44Å; L4-S7 PolarHBondContact O-OG 2.98Å; S7-S10 PolarHBondContact O-N 3.17Å; S7-N11 VanDerWaalsContact O-CB 3.28Å; S7-N11 WeakPolarHBondContact O-CB 3.11Å; S7-N11 PolarHBondContact O-N 3.37Å
8Y44.6Very low39.9Very low130 Ų13075.4 Ų75.451%0.5139%0.392SS..Hα-helixtrans-62-43.8167-179.1-94.7000111.5L4 N5 G12L4-Y8 WeakPolarHBondContact O-CB 3.47Å; L4-Y8 PolarHBondContact O-N 2.94Å; N5-Y8 WeakPolarHBondContact O-CB 3.33Å; N5-Y8 PolarHBondContact O-N 3.33Å; Y8-G12 PolarHBondContact O-N 3.4Å
9F46.3Very low39.5Very low30 Ų3075.5 Ų75.513%0.13241%0.405CS..Hα-helixtrans-69.4-41.3174.7-66.2-59.7000112.1N5 V6 N11 G12 L90 N93 G94N5-F9 HydrophobicContact CB-CE2 4.49Å; N5-F9 WeakPolarHBondContact O-CD2 3.4Å; N5-F9 WeakPolarHBondContact O-CE2 3.16Å; N5-F9 PolarHBondContact O-N 3.09Å; N5-F9 VanDerWaalsContact O-N 3.12Å; V6-F9 PolarHBondContact O-N 3.06Å; F9-N11 PolarHBondContact O-N 3.32Å; F9-G12 PolarHBondContact O-N 3.03Å; F9-L90 HydrophobicContact CE2-CD2 4.44Å; F9-L90 HydrophobicContact CZ-CD2 4.02Å; F9-N93 VanDerWaalsContact CD1-O 3.25Å; F9-N93 WeakPolarHBondContact CD1-O 3.32Å; F9-G94 VanDerWaalsContact CD2-CA 3.42Å; F9-G94 VanDerWaalsContact CE1-N 3.32Å
10S34.7Very low39.3Very low69 Ų6980 Ų8048%0.48342%0.423SS..Hα-helixtrans-70.8-28.9179.5-165.70000114.4V6 S7V6-S10 WeakPolarHBondContact O-CB 3.39Å; V6-S10 PolarHBondContact O-N 3.36Å; S7-S10 PolarHBondContact O-N 3.17Å
11N36.5Very low39.1Very low89 Ų8983.6 Ų83.648%0.47644%0.443SS..Hα-helixtrans-91.5-15.7175.1-80.1-20.1000113.2S7 F9 D13 L14S7-N11 VanDerWaalsContact O-CB 3.28Å; S7-N11 WeakPolarHBondContact O-CB 3.11Å; S7-N11 PolarHBondContact O-N 3.37Å; F9-N11 PolarHBondContact O-N 3.32Å; N11-D13 PolarHBondContact O-N 3.03Å; N11-L14 PolarHBondContact O-N 3.43Å
12G39.8Very low38.2Very low34 Ų3490.6 Ų90.635%0.35148%0.48SS..Hα-helixtrans-58.3-34.8172.500000112Y8 F9 L16Y8-G12 PolarHBondContact O-N 3.4Å; F9-G12 PolarHBondContact O-N 3.03Å; G12-L16 WeakPolarHBondContact O-CB 3.37Å
13D38.3Very low37.6Very low96 Ų9693 Ų9351%0.51350%0.504SS..THydrogen-bonded Turntrans-85.4-18.8-175.9-63.5-29.4000114.3N11N11-D13 PolarHBondContact O-N 3.03Å
14L33.6Very low37.5Very low129 Ų12996.5 Ų96.568%0.67553%0.53SS*.THydrogen-bonded Turntrans-84.3-10.4-176.2-98.9144.3000114.4N11N11-L14 PolarHBondContact O-N 3.43Å
15N28.2Very low37.2Very low141 Ų141104.5 Ų104.575%0.75457%0.567SS**SBendtrans-123.61.6175.2-82.4-30.7000114.1T17N15-T17 VanDerWaalsContact C-N 3.26Å; N15-T17 PolarHBondContact O-N 3.15Å
16L34.2Very low37.4Very low108 Ų108106 Ų10657%0.56558%0.579SS**THydrogen-bonded Turntrans-87.524.9-177.9-144.682.6000114.2G12G12-L16 WeakPolarHBondContact O-CB 3.37Å
17T32.7Very low38Very low133 Ų133107.9 Ų107.982%0.81660%0.601SS**THydrogen-bonded Turntrans-98.78168.844.20000112.8N15N15-T17 VanDerWaalsContact C-N 3.26Å; N15-T17 PolarHBondContact O-N 3.15Å
18R31.7Very low39.3Very low240 Ų240108.6 Ų108.691%0.90661%0.609SS**SBendtrans-137.28.9-177.2-137.5179-169.6139.13.6117.3
19A31.2Very low41.1Very low77 Ų77105.2 Ų105.264%0.63661%0.605SS**  trans-147.344.8178.700000112.4D21A19-D21 PolarHBondContact O-N 3.34Å
20E36.6Very low42.9Very low166 Ų166105 Ų10578%0.77660%0.604SS**  trans-73.299.3156.4-77.1177.4120.100106.9
21D34.7Very low45.4Very low156 Ų156102.1 Ų102.183%0.83459%0.585SS**SBendtrans179.6-7.8139.2-92.8-21.6000115.9A19A19-D21 PolarHBondContact O-N 3.34Å
22D31.5Very low48Very low161 Ų161102.1 Ų102.186%0.86159%0.587SS**SBendtrans-138.245.2-170.1-90.2-30.7000117.3
23A38.1Very low50.4Low74 Ų74104 Ų10461%0.61259%0.588SS**  trans-148.546.217400000119.8H25A23-H25 PolarHBondContact O-N 3.25Å
24P38.2Very low52.9Low109 Ų10999.5 Ų99.571%0.70856%0.564SS**THydrogen-bonded Turntrans-65.9-21172-14.328.6000113.6
25H39.7Very low55.7Low177 Ų17794.8 Ų94.882%0.81955%0.547SS*.THydrogen-bonded Turntrans-88-11.8-171.1-65.3-51.7000115.2A23A23-H25 PolarHBondContact O-N 3.25Å
26C50.3Low58.8Low54 Ų5492.6 Ų92.637%0.36553%0.534SS..THydrogen-bonded Turntrans-92.4-39.9-172.4-152.50000113.4A28 S29 Y278C26-A28 PolarHBondContact O-N 3.2Å; C26-S29 PolarHBondContact O-N 3.46Å; C26-S29 PolarHBondContact O-OG 2.91Å; C26-Y278 PolarHBondContact SG-OH 3.3Å
27G58.1Low61.6Low57 Ų5788.1 Ų88.159%0.58851%0.511SS*.THydrogen-bonded Turntrans-69-26.3-177.500000115P31G27-P31 WeakPolarHBondContact O-CD 3.3Å
28A67.4Low64.6Low50 Ų5082.4 Ų82.441%0.41348%0.476SS..THydrogen-bonded Turntrans-83-12.5-179.300000114.2C26 P31 V32C26-A28 PolarHBondContact O-N 3.2Å; A28-P31 WeakPolarHBondContact O-CD 3.47Å; A28-V32 WeakPolarHBondContact O-CG2 3.45Å; A28-V32 PolarHBondContact O-N 3.19Å
29S81.4Confident67.6Low59 Ų5977.2 Ų77.241%0.41346%0.46SS..Hα-helixtrans-65.7-46.4-171.8620000113.2C26 V32 I33C26-S29 PolarHBondContact O-N 3.46Å; C26-S29 PolarHBondContact O-OG 2.91Å; S29-V32 PolarHBondContact O-N 3.04Å; S29-I33 VanDerWaalsContact O-CG1 3.3Å; S29-I33 WeakPolarHBondContact O-CG1 3.5Å; S29-I33 PolarHBondContact O-N 3.3Å; S29-I33 VanDerWaalsContact O-N 3.07Å
30L83.7Confident70.6Confident25 Ų2577.3 Ų77.313%0.13145%0.45CS..Hα-helixtrans-68.4-46.5-177.7-172.571.1000113V32 I33 F34 L90 S285L30-V32 VanDerWaalsContact C-N 3.29Å; L30-V32 PolarHBondContact O-N 3.36Å; L30-I33 PolarHBondContact O-N 3.27Å; L30-F34 HydrophobicContact CD1-CD1 4.21Å; L30-F34 HydrophobicContact CD1-CE1 3.54Å; L30-F34 HydrophobicContact CD1-CZ 3.78Å; L30-F34 HydrophobicContact CD2-CZ 4.27Å; L30-F34 HydrophobicContact CG-CD1 4.49Å; L30-F34 HydrophobicContact CG-CE1 4.04Å; L30-F34 HydrophobicContact CG-CE2 4.33Å; L30-F34 HydrophobicContact CG-CZ 3.95Å; L30-F34 PolarHBondContact O-N 3.46Å; L30-L90 HydrophobicContact CD2-CD1 4.1Å; L30-L90 HydrophobicContact CD2-CD2 4.22Å; L30-L90 HydrophobicContact CG-CD1 4.27Å; L30-S285 VanDerWaalsContact CD1-OG 3.28Å; L30-S285 WeakPolarHBondContact CD1-OG 3Å
31P87.4Confident73.4Confident10 Ų1069.4 Ų69.47%0.06541%0.413CS..Hα-helixtrans-54.6-40.8171.3-28.535.5000113.8G27 A28 F34 G35 I87 L90 L91G27-P31 WeakPolarHBondContact O-CD 3.3Å; A28-P31 WeakPolarHBondContact O-CD 3.47Å; P31-F34 PolarHBondContact O-N 3.34Å; P31-G35 PolarHBondContact O-N 3.29Å; P31-I87 HydrophobicContact CB-CG2 4.21Å; P31-L90 HydrophobicContact CG-CB 3.97Å; P31-L91 HydrophobicContact CB-CD2 3.81Å; P31-L91 HydrophobicContact CB-CG 4.05Å; P31-L91 HydrophobicContact CG-CD2 3.85Å; P31-L91 HydrophobicContact CG-CG 4.18Å
32V90.5Very high76.2Confident88 Ų8865.4 Ų65.453%0.53339%0.391SS..Hα-helixtrans-65.3-45178.1170.30000111A28 S29 L30 F34 G35 I36A28-V32 WeakPolarHBondContact O-CG2 3.45Å; A28-V32 PolarHBondContact O-N 3.19Å; S29-V32 PolarHBondContact O-N 3.04Å; L30-V32 VanDerWaalsContact C-N 3.29Å; L30-V32 PolarHBondContact O-N 3.36Å; V32-F34 VanDerWaalsContact C-N 3.35Å; V32-F34 PolarHBondContact O-N 3.05Å; V32-G35 PolarHBondContact O-N 2.86Å; V32-I36 HydrophobicContact CG1-CD1 4.06Å; V32-I36 WeakPolarHBondContact O-CG1 3.34Å; V32-I36 PolarHBondContact O-N 3.28Å
33I90.6Very high79.2Confident73 Ų7361.2 Ų61.237%0.37437%0.368SS..Hα-helixtrans-59.2-47.6176.2-68.6164.9000110.3S29 L30 G35 I36 I37S29-I33 VanDerWaalsContact O-CG1 3.3Å; S29-I33 WeakPolarHBondContact O-CG1 3.5Å; S29-I33 PolarHBondContact O-N 3.3Å; S29-I33 VanDerWaalsContact O-N 3.07Å; L30-I33 PolarHBondContact O-N 3.27Å; I33-G35 VanDerWaalsContact C-N 3.31Å; I33-G35 PolarHBondContact O-N 3.3Å; I33-I36 PolarHBondContact O-N 3.14Å; I33-I37 HydrophobicContact CG2-CD1 3.81Å; I33-I37 HydrophobicContact CG2-CG1 4.48Å; I33-I37 VanDerWaalsContact O-CG1 3.31Å; I33-I37 WeakPolarHBondContact O-CG1 3.47Å; I33-I37 PolarHBondContact O-N 2.97Å
34F90.6Very high81.8Confident2 Ų258.2 Ų58.21%0.00934%0.344CS..Hα-helixtrans-64.4-36.4178.5-73.69.7000112L30 P31 V32 I37 C38 L86 I87 L90 I284 S285 Y288L30-F34 HydrophobicContact CD1-CD1 4.21Å; L30-F34 HydrophobicContact CD1-CE1 3.54Å; L30-F34 HydrophobicContact CD1-CZ 3.78Å; L30-F34 HydrophobicContact CD2-CZ 4.27Å; L30-F34 HydrophobicContact CG-CD1 4.49Å; L30-F34 HydrophobicContact CG-CE1 4.04Å; L30-F34 HydrophobicContact CG-CE2 4.33Å; L30-F34 HydrophobicContact CG-CZ 3.95Å; L30-F34 PolarHBondContact O-N 3.46Å; P31-F34 PolarHBondContact O-N 3.34Å; V32-F34 VanDerWaalsContact C-N 3.35Å; V32-F34 PolarHBondContact O-N 3.05Å; F34-I37 HydrophobicContact CD1-CD1 4.49Å; F34-I37 PolarHBondContact O-N 3.4Å; F34-C38 WeakPolarHBondContact O-CB 3.39Å; F34-C38 PolarHBondContact O-N 3.3Å; F34-L86 HydrophobicContact CD2-CD2 4.12Å; F34-L86 HydrophobicContact CD2-CG 4.44Å; F34-L86 HydrophobicContact CE2-CD2 3.76Å; F34-L86 HydrophobicContact CE2-CG 4.29Å; F34-I87 HydrophobicContact CB-CD1 3.89Å; F34-I87 HydrophobicContact CB-CG1 3.7Å; F34-I87 HydrophobicContact CD2-CG1 4.44Å; F34-L90 HydrophobicContact CD2-CD1 3.65Å; F34-L90 HydrophobicContact CE2-CD1 3.61Å; F34-I284 HydrophobicContact CZ-CG2 4.1Å; F34-S285 WeakPolarHBondContact CE1-OG 3.4Å; F34-Y288 HydrophobicContact CD1-CD2 4.07Å; F34-Y288 HydrophobicContact CD2-CD2 4.14Å; F34-Y288 HydrophobicContact CD2-CE2 4.18Å; F34-Y288 AromaticContact CE1-CD2 3.61Å; F34-Y288 HydrophobicContact CE1-CD2 3.61Å; F34-Y288 HydrophobicContact CE1-CE2 4.24Å; F34-Y288 AromaticContact CE2-CD2 3.69Å; F34-Y288 HydrophobicContact CE2-CD2 3.69Å; F34-Y288 AromaticContact CE2-CE2 3.51Å; F34-Y288 HydrophobicContact CE2-CE2 3.51Å; F34-Y288 HydrophobicContact CG-CD2 4.32Å; F34-Y288 AromaticContact CZ-CD2 3.4Å; F34-Y288 HydrophobicContact CZ-CD2 3.4Å; F34-Y288 VanDerWaalsContact CZ-CD2 3.4Å; F34-Y288 AromaticContact CZ-CE2 3.55Å; F34-Y288 HydrophobicContact CZ-CE2 3.55Å
35G92.6Very high84.5Confident30 Ų3053 Ų5331%0.30931%0.31SS..Hα-helixtrans-61.8-44.2173.800000112.8P31 V32 I33 C38 F39P31-G35 PolarHBondContact O-N 3.29Å; V32-G35 PolarHBondContact O-N 2.86Å; I33-G35 VanDerWaalsContact C-N 3.31Å; I33-G35 PolarHBondContact O-N 3.3Å; G35-C38 PolarHBondContact O-N 3.3Å; G35-F39 WeakPolarHBondContact O-CB 3.29Å; G35-F39 PolarHBondContact O-N 2.8Å
36I93.7Very high87.1Confident95 Ų9547.4 Ų47.449%0.48729%0.29SS..Hα-helixtrans-64.3-46.3176.4-66.5166.8000110.8V32 I33 F39 L40V32-I36 HydrophobicContact CG1-CD1 4.06Å; V32-I36 WeakPolarHBondContact O-CG1 3.34Å; V32-I36 PolarHBondContact O-N 3.28Å; I33-I36 PolarHBondContact O-N 3.14Å; I36-F39 PolarHBondContact O-N 2.91Å; I36-L40 HydrophobicContact CG2-CD1 3.79Å; I36-L40 HydrophobicContact CG2-CG 4.3Å; I36-L40 WeakPolarHBondContact O-CB 3.32Å; I36-L40 WeakPolarHBondContact O-CG 3.47Å; I36-L40 PolarHBondContact O-N 3.35Å
37I93.7Very high89.1Confident15 Ų1547.6 Ų47.68%0.07729%0.287CS..Hα-helixtrans-56.8-51.6174.9-70.6170.4000109.5I33 F34 F39 L40 G41 L80 M83 Y288 A289 C292I33-I37 HydrophobicContact CG2-CD1 3.81Å; I33-I37 HydrophobicContact CG2-CG1 4.48Å; I33-I37 VanDerWaalsContact O-CG1 3.31Å; I33-I37 WeakPolarHBondContact O-CG1 3.47Å; I33-I37 PolarHBondContact O-N 2.97Å; F34-I37 HydrophobicContact CD1-CD1 4.49Å; F34-I37 PolarHBondContact O-N 3.4Å; I37-F39 VanDerWaalsContact C-N 3.35Å; I37-F39 PolarHBondContact O-N 3.43Å; I37-L40 PolarHBondContact O-N 3.18Å; I37-G41 PolarHBondContact O-N 3.19Å; I37-L80 HydrophobicContact CG2-CD2 4.47Å; I37-M83 HydrophobicContact CG2-SD 4.17Å; I37-Y288 WeakPolarHBondContact CG2-O 3.35Å; I37-A289 HydrophobicContact CD1-CB 4.13Å; I37-A289 HydrophobicContact CG1-CB 4.47Å; I37-C292 VanDerWaalsContact CG2-SG 3.51Å; I37-C292 PolarHBondContact O-SG 3.37Å
38C94.6Very high90.7Very high12 Ų1245 Ų458%0.08126%0.259CS..Hα-helixtrans-54.2-50.6179.4-173.50000111.7F34 G35 G41 I42 M83F34-C38 WeakPolarHBondContact O-CB 3.39Å; F34-C38 PolarHBondContact O-N 3.3Å; G35-C38 PolarHBondContact O-N 3.3Å; C38-G41 PolarHBondContact O-N 2.84Å; C38-I42 WeakPolarHBondContact O-CB 3.41Å; C38-I42 VanDerWaalsContact O-CG1 3.23Å; C38-I42 WeakPolarHBondContact O-CG1 3.36Å; C38-I42 PolarHBondContact O-N 2.87Å; C38-M83 HydrophobicContact CB-CB 4.34Å
39F94.8Very high91.9Very high132 Ų13244.1 Ų44.158%0.57925%0.247SC*.Hα-helixtrans-62.3-51.7-179.6179.4-103000113.2G35 I36 I37 G41 I42 I43G35-F39 WeakPolarHBondContact O-CB 3.29Å; G35-F39 PolarHBondContact O-N 2.8Å; I36-F39 PolarHBondContact O-N 2.91Å; I37-F39 VanDerWaalsContact C-N 3.35Å; I37-F39 PolarHBondContact O-N 3.43Å; F39-G41 VanDerWaalsContact C-N 3.34Å; F39-G41 PolarHBondContact O-N 3.26Å; F39-I42 PolarHBondContact O-N 3.45Å; F39-I43 HydrophobicContact CD1-CD1 4Å; F39-I43 HydrophobicContact CD2-CD1 4.13Å; F39-I43 HydrophobicContact CE1-CD1 3.47Å; F39-I43 VanDerWaalsContact CE1-CD1 3.47Å; F39-I43 HydrophobicContact CE2-CD1 3.62Å; F39-I43 HydrophobicContact CG-CD1 4.32Å; F39-I43 HydrophobicContact CZ-CD1 3.26Å; F39-I43 WeakPolarHBondContact O-CG1 3.45Å; F39-I43 PolarHBondContact O-N 3.12Å
40L94.4Very high92.3Very high79 Ų7947.2 Ų47.241%0.41425%0.251SS..Hα-helixtrans-64.6-40.4-179.5-68.4178.1000111.7I36 I37 G44I36-L40 HydrophobicContact CG2-CD1 3.79Å; I36-L40 HydrophobicContact CG2-CG 4.3Å; I36-L40 WeakPolarHBondContact O-CB 3.32Å; I36-L40 WeakPolarHBondContact O-CG 3.47Å; I36-L40 PolarHBondContact O-N 3.35Å; I37-L40 PolarHBondContact O-N 3.18Å; L40-G44 PolarHBondContact O-N 3.24Å
41G94.5Very high92.5Very high0 Ų046.3 Ų46.30%025%0.246CC..Hα-helixtrans-62.4-45.6178.200000112.2I37 C38 F39 G44 N45 C292I37-G41 PolarHBondContact O-N 3.19Å; C38-G41 PolarHBondContact O-N 2.84Å; F39-G41 VanDerWaalsContact C-N 3.34Å; F39-G41 PolarHBondContact O-N 3.26Å; G41-G44 PolarHBondContact O-N 2.85Å; G41-N45 WeakPolarHBondContact O-CB 3.42Å; G41-N45 PolarHBondContact O-N 3.27Å; G41-N45 PolarHBondContact O-ND2 3.12Å; G41-C292 VanDerWaalsContact CA-SG 3.53Å; G41-C292 PolarHBondContact N-SG 3.12Å; G41-C292 VanDerWaalsContact N-SG 3.44Å
42I95.1Very high92.5Very high71 Ų7146 Ų4636%0.36424%0.244SC..Hα-helixtrans-62.4-50.4179.4-71.8167.7000109.8C38 F39 G44 C46 L77 L80C38-I42 WeakPolarHBondContact O-CB 3.41Å; C38-I42 VanDerWaalsContact O-CG1 3.23Å; C38-I42 WeakPolarHBondContact O-CG1 3.36Å; C38-I42 PolarHBondContact O-N 2.87Å; F39-I42 PolarHBondContact O-N 3.45Å; I42-G44 PolarHBondContact O-N 3.45Å; I42-C46 VanDerWaalsContact O-CB 3.23Å; I42-C46 WeakPolarHBondContact O-CB 3.33Å; I42-C46 PolarHBondContact O-N 2.9Å; I42-C46 PolarHBondContact O-SG 3.26Å; I42-L77 HydrophobicContact CB-CD2 4.46Å; I42-L77 HydrophobicContact CG1-CD2 4.37Å; I42-L80 HydrophobicContact CG1-CB 4.11Å; I42-L80 HydrophobicContact CG1-CD1 4.27Å
43I94.5Very high92.4Very high74 Ų7446.3 Ų46.338%0.37924%0.242SC..Hα-helixtrans-60.5-50.2-179.5-68.7174.4000110.4F39 C46 I47F39-I43 HydrophobicContact CD1-CD1 4Å; F39-I43 HydrophobicContact CD2-CD1 4.13Å; F39-I43 HydrophobicContact CE1-CD1 3.47Å; F39-I43 VanDerWaalsContact CE1-CD1 3.47Å; F39-I43 HydrophobicContact CE2-CD1 3.62Å; F39-I43 HydrophobicContact CG-CD1 4.32Å; F39-I43 HydrophobicContact CZ-CD1 3.26Å; F39-I43 WeakPolarHBondContact O-CG1 3.45Å; F39-I43 PolarHBondContact O-N 3.12Å; I43-C46 PolarHBondContact O-N 3.33Å; I43-I47 HydrophobicContact CG2-CD1 3.79Å; I43-I47 VanDerWaalsContact O-CG1 3.27Å; I43-I47 WeakPolarHBondContact O-CG1 3.37Å; I43-I47 PolarHBondContact O-N 2.93Å
44G92.6Very high92.1Very high11 Ų1145.4 Ų45.411%0.11324%0.236CC..Hα-helixtrans-60.8-48.9-177.100000112.5L40 G41 I42 I47 V48L40-G44 PolarHBondContact O-N 3.24Å; G41-G44 PolarHBondContact O-N 2.85Å; I42-G44 PolarHBondContact O-N 3.45Å; G44-I47 WeakPolarHBondContact O-CB 3.26Å; G44-I47 PolarHBondContact O-N 3.25Å; G44-V48 WeakPolarHBondContact O-CG2 3.36Å; G44-V48 PolarHBondContact O-N 2.87Å; G44-V48 VanDerWaalsContact O-N 3.12Å
45N94.8Very high91.7Very high0 Ų046.3 Ų46.30%024%0.24CC..Hα-helixtrans-70.7-35.9-179-74.1-66.5000112.5G41 I47 V48 I49 S73 L77 S291G41-N45 WeakPolarHBondContact O-CB 3.42Å; G41-N45 PolarHBondContact O-N 3.27Å; G41-N45 PolarHBondContact O-ND2 3.12Å; N45-I47 VanDerWaalsContact C-N 3.31Å; N45-I47 PolarHBondContact O-N 3.07Å; N45-V48 PolarHBondContact O-N 2.67Å; N45-V48 VanDerWaalsContact O-N 3.17Å; N45-I49 WeakPolarHBondContact O-CG1 3.34Å; N45-I49 PolarHBondContact O-N 3.44Å; N45-S73 WeakPolarHBondContact OD1-CB 3.24Å; N45-S73 PolarHBondContact OD1-OG 3Å; N45-S73 VanDerWaalsContact OD1-OG 3.07Å; N45-L77 HydrophobicContact CB-CD1 4.47Å; N45-L77 HydrophobicContact CB-CD2 3.84Å; N45-L77 HydrophobicContact CB-CG 3.84Å; N45-S291 PolarHBondContact ND2-O 2.64Å
46C94.4Very high91Very high59 Ų5947.7 Ų47.740%0.39924%0.242SC..Hα-helixtrans-58.6-42.7171.2-72.80000112I42 I43 V48 I49 Y50I42-C46 VanDerWaalsContact O-CB 3.23Å; I42-C46 WeakPolarHBondContact O-CB 3.33Å; I42-C46 PolarHBondContact O-N 2.9Å; I42-C46 PolarHBondContact O-SG 3.26Å; I43-C46 PolarHBondContact O-N 3.33Å; C46-V48 VanDerWaalsContact C-N 3.32Å; C46-V48 PolarHBondContact O-N 2.89Å; C46-I49 PolarHBondContact O-N 3.31Å; C46-Y50 WeakPolarHBondContact O-CB 3.38Å; C46-Y50 PolarHBondContact O-N 2.91Å
47I91.6Very high90.1Very high58 Ų5852 Ų5230%0.29726%0.258SS..Hα-helixtrans-61.4-41.1176.1-73.5167.4000111.4I43 G44 N45 T51 F309I43-I47 HydrophobicContact CG2-CD1 3.79Å; I43-I47 VanDerWaalsContact O-CG1 3.27Å; I43-I47 WeakPolarHBondContact O-CG1 3.37Å; I43-I47 PolarHBondContact O-N 2.93Å; G44-I47 WeakPolarHBondContact O-CB 3.26Å; G44-I47 PolarHBondContact O-N 3.25Å; N45-I47 VanDerWaalsContact C-N 3.31Å; N45-I47 PolarHBondContact O-N 3.07Å; I47-T51 WeakPolarHBondContact O-CB 3.42Å; I47-T51 PolarHBondContact O-N 3.37Å; I47-T51 PolarHBondContact O-OG1 3.43Å; I47-F309 HydrophobicContact CG2-CD2 3.64Å; I47-F309 HydrophobicContact CG2-CE2 3.39Å
48V91.6Very high89.1Confident1 Ų155.9 Ų55.91%0.00628%0.284CS..Hα-helixtrans-62.8-50.7178.21750000110.9G44 N45 C46 Y50 T51 I52 I69 S73 P295 Y298 F305G44-V48 WeakPolarHBondContact O-CG2 3.36Å; G44-V48 PolarHBondContact O-N 2.87Å; G44-V48 VanDerWaalsContact O-N 3.12Å; N45-V48 PolarHBondContact O-N 2.67Å; N45-V48 VanDerWaalsContact O-N 3.17Å; C46-V48 VanDerWaalsContact C-N 3.32Å; C46-V48 PolarHBondContact O-N 2.89Å; V48-Y50 PolarHBondContact O-N 3.36Å; V48-T51 PolarHBondContact O-N 2.86Å; V48-I52 HydrophobicContact CG1-CD1 3.93Å; V48-I52 WeakPolarHBondContact O-CG1 3.22Å; V48-I52 PolarHBondContact O-N 3.36Å; V48-I69 HydrophobicContact CG1-CG2 3.67Å; V48-S73 VanDerWaalsContact CG1-OG 3.27Å; V48-S73 WeakPolarHBondContact CG1-OG 3.38Å; V48-P295 HydrophobicContact CG2-CB 4.06Å; V48-P295 HydrophobicContact CG2-CG 4.15Å; V48-Y298 HydrophobicContact CG1-CD2 3.98Å; V48-Y298 HydrophobicContact CG1-CE2 4.09Å; V48-Y298 HydrophobicContact CG2-CD2 3.71Å; V48-Y298 HydrophobicContact CG2-CE2 4.24Å; V48-F305 HydrophobicContact CB-CE2 4.27Å; V48-F305 HydrophobicContact CB-CZ 4.13Å; V48-F305 HydrophobicContact CG1-CE2 3.96Å; V48-F305 HydrophobicContact CG1-CZ 4.29Å; V48-F305 HydrophobicContact CG2-CE2 4.23Å; V48-F305 HydrophobicContact CG2-CZ 3.72Å
49I92.5Very high87.7Confident32 Ų3266.6 Ų66.616%0.16432%0.323CS..Hα-helixtrans-57.3-51.3176.8-66.5174000110.1N45 C46 T51 I52 L53 L70 I74 L77N45-I49 WeakPolarHBondContact O-CG1 3.34Å; N45-I49 PolarHBondContact O-N 3.44Å; C46-I49 PolarHBondContact O-N 3.31Å; I49-T51 VanDerWaalsContact C-N 3.31Å; I49-T51 PolarHBondContact O-N 2.75Å; I49-I52 PolarHBondContact O-N 3.35Å; I49-L53 HydrophobicContact CG2-CD1 3.64Å; I49-L53 HydrophobicContact CG2-CG 4.1Å; I49-L53 WeakPolarHBondContact O-CB 3.16Å; I49-L53 VanDerWaalsContact O-CG 3.3Å; I49-L53 WeakPolarHBondContact O-CG 3.36Å; I49-L53 PolarHBondContact O-N 3.08Å; I49-L70 HydrophobicContact CB-CD1 4.3Å; I49-L70 HydrophobicContact CG1-CD1 4.04Å; I49-L70 HydrophobicContact CG2-CD1 4.09Å; I49-I74 HydrophobicContact CD1-CG1 4.11Å; I49-L77 HydrophobicContact CD1-CD1 3.42Å; I49-L77 VanDerWaalsContact CD1-CD1 3.42Å; I49-L77 HydrophobicContact CD1-CG 4.49Å
50Y90.7Very high86.6Confident125 Ų12562.2 Ų62.249%0.4931%0.311SS..Hα-helixtrans-57-43.1178.8173.4-107000112.5C46 V48 I52 L53 K54 A312C46-Y50 WeakPolarHBondContact O-CB 3.38Å; C46-Y50 PolarHBondContact O-N 2.91Å; V48-Y50 PolarHBondContact O-N 3.36Å; Y50-I52 PolarHBondContact O-N 3.32Å; Y50-L53 PolarHBondContact O-N 3Å; Y50-K54 HydrophobicContact CE1-CD 4.15Å; Y50-K54 VanDerWaalsContact O-CB 3.24Å; Y50-K54 WeakPolarHBondContact O-CB 3.49Å; Y50-K54 PolarHBondContact O-N 3.21Å; Y50-K54 PolarHBondContact OH-NZ 2.97Å; Y50-A312 HydrophobicContact CE1-CB 4.08Å
51T87.4Confident85.8Confident5 Ų567.7 Ų67.73%0.03133%0.332CS..Hα-helixtrans-63.3-41.5179.8-61.20000111.7I47 V48 I49 K55 F305 H308 F309I47-T51 WeakPolarHBondContact O-CB 3.42Å; I47-T51 PolarHBondContact O-N 3.37Å; I47-T51 PolarHBondContact O-OG1 3.43Å; V48-T51 PolarHBondContact O-N 2.86Å; I49-T51 VanDerWaalsContact C-N 3.31Å; I49-T51 PolarHBondContact O-N 2.75Å; T51-K55 WeakPolarHBondContact O-CB 3.25Å; T51-K55 PolarHBondContact O-N 3.47Å; T51-F305 HydrophobicContact CG2-CD2 4.1Å; T51-F305 HydrophobicContact CG2-CE2 3.73Å; T51-F305 HydrophobicContact CG2-CZ 4.09Å; T51-H308 HydrophobicContact CG2-CB 3.79Å; T51-F309 HydrophobicContact CG2-CB 4.25Å
52I88.1Confident85.1Confident4 Ų470.4 Ų70.42%0.02134%0.344CS..Hα-helixtrans-71-45.9178.7-66.5170.3000110.8V48 I49 Y50 K54 K55 T56 D66 I69 L70V48-I52 HydrophobicContact CG1-CD1 3.93Å; V48-I52 WeakPolarHBondContact O-CG1 3.22Å; V48-I52 PolarHBondContact O-N 3.36Å; I49-I52 PolarHBondContact O-N 3.35Å; Y50-I52 PolarHBondContact O-N 3.32Å; I52-K54 PolarHBondContact O-N 2.83Å; I52-K55 WeakPolarHBondContact O-CB 3.32Å; I52-K55 PolarHBondContact O-N 2.92Å; I52-T56 PolarHBondContact O-N 3.3Å; I52-T56 VanDerWaalsContact O-N 3.12Å; I52-T56 PolarHBondContact O-OG1 3.31Å; I52-D66 HydrophobicContact CG2-CB 4.34Å; I52-I69 HydrophobicContact CD1-CB 4.22Å; I52-I69 HydrophobicContact CD1-CG2 3.74Å; I52-L70 HydrophobicContact CB-CD1 4.47Å; I52-L70 HydrophobicContact CD1-CB 4.13Å; I52-L70 HydrophobicContact CG2-CB 4.4Å; I52-L70 HydrophobicContact CG2-CD1 4.33Å
53L87.9Confident84.7Confident95 Ų9569.5 Ų69.550%0.49734%0.342SS..Hα-helixtrans-62.8-41.2178.8-67.6-179.8000112I49 Y50 K55 T56 K57I49-L53 HydrophobicContact CG2-CD1 3.64Å; I49-L53 HydrophobicContact CG2-CG 4.1Å; I49-L53 WeakPolarHBondContact O-CB 3.16Å; I49-L53 VanDerWaalsContact O-CG 3.3Å; I49-L53 WeakPolarHBondContact O-CG 3.36Å; I49-L53 PolarHBondContact O-N 3.08Å; Y50-L53 PolarHBondContact O-N 3Å; L53-K55 VanDerWaalsContact C-N 3.33Å; L53-K55 PolarHBondContact O-N 2.77Å; L53-T56 PolarHBondContact O-N 3.44Å; L53-K57 PolarHBondContact O-N 3.47Å
54K84.2Confident84.4Confident53 Ų5366.4 Ų66.423%0.2333%0.327CS..Hα-helixtrans-63.4-38.8175.8-171.7170.6-177.2164.90111.8Y50 I52 K57 C58 A312Y50-K54 HydrophobicContact CE1-CD 4.15Å; Y50-K54 VanDerWaalsContact O-CB 3.24Å; Y50-K54 WeakPolarHBondContact O-CB 3.49Å; Y50-K54 PolarHBondContact O-N 3.21Å; Y50-K54 PolarHBondContact OH-NZ 2.97Å; I52-K54 PolarHBondContact O-N 2.83Å; K54-K57 PolarHBondContact O-N 3.46Å; K54-C58 PolarHBondContact O-N 2.77Å; K54-C58 PolarHBondContact O-SG 3.19Å; K54-C58 VanDerWaalsContact O-SG 3.35Å; K54-A312 HydrophobicContact CD-CB 3.76Å; K54-A312 PolarHBondContact NZ-O 2.89Å
55K82.2Confident84Confident22 Ų2266.9 Ų66.910%0.09633%0.328CS..Hα-helixtrans-58.7-46.5174.3177.3-172-179.3-171.70111.2T51 I52 L53 C58 A60 D66 H308T51-K55 WeakPolarHBondContact O-CB 3.25Å; T51-K55 PolarHBondContact O-N 3.47Å; I52-K55 WeakPolarHBondContact O-CB 3.32Å; I52-K55 PolarHBondContact O-N 2.92Å; L53-K55 VanDerWaalsContact C-N 3.33Å; L53-K55 PolarHBondContact O-N 2.77Å; K55-C58 PolarHBondContact O-N 2.97Å; K55-A60 HydrophobicContact CG-CB 3.96Å; K55-A60 WeakPolarHBondContact O-CB 3.25Å; K55-A60 PolarHBondContact O-N 2.93Å; K55-D66 IonicContact NZ-OD1 2.67Å; K55-D66 PolarHBondContact NZ-OD1 3.24Å; K55-D66 IonicContact NZ-OD2 2.86Å; K55-D66 PolarHBondContact NZ-OD2 3.01Å; K55-H308 WeakPolarHBondContact CE-NE2 3.24Å
56T78Confident83.7Confident58 Ų5867.9 Ų67.936%0.35633%0.333SS..Hα-helixtrans-63.8-43.4177.2-53.20000111.7I52 L53 C58 R59I52-T56 PolarHBondContact O-N 3.3Å; I52-T56 VanDerWaalsContact O-N 3.12Å; I52-T56 PolarHBondContact O-OG1 3.31Å; L53-T56 PolarHBondContact O-N 3.44Å; T56-C58 VanDerWaalsContact C-N 3.28Å; T56-C58 PolarHBondContact O-N 3.24Å; T56-R59 PolarHBondContact O-N 3.06Å
57K74.9Confident83.6Confident187 Ų18765.4 Ų65.481%0.81332%0.316SS*.Hα-helixtrans-61.8-33177.8-170.2173-177.9174.10113L53 K54 R59L53-K57 PolarHBondContact O-N 3.47Å; K54-K57 PolarHBondContact O-N 3.46Å; K57-R59 PolarHBondContact O-N 2.99Å; K57-R59 VanDerWaalsContact O-N 3.09Å
58C72.3Confident83.7Confident95 Ų9562.9 Ų62.964%0.64230%0.303SS*.THydrogen-bonded Turntrans-76.821.4173.8-660000114.2K54 K55 T56 A60K54-C58 PolarHBondContact O-N 2.77Å; K54-C58 PolarHBondContact O-SG 3.19Å; K54-C58 VanDerWaalsContact O-SG 3.35Å; K55-C58 PolarHBondContact O-N 2.97Å; T56-C58 VanDerWaalsContact C-N 3.28Å; T56-C58 PolarHBondContact O-N 3.24Å; C58-A60 PolarHBondContact O-N 2.88Å; C58-A60 VanDerWaalsContact O-N 3.17Å
59R64.9Low83.6Confident238 Ų23863.2 Ų63.290%0.89831%0.305SS*.THydrogen-bonded Turntrans58.719.1-179.9-60.2-166177.5-175.50.3115.3T56 K57T56-R59 PolarHBondContact O-N 3.06Å; K57-R59 PolarHBondContact O-N 2.99Å; K57-R59 VanDerWaalsContact O-N 3.09Å
60A73.1Confident83.7Confident39 Ų3962.9 Ų62.932%0.32230%0.303SS..PPolyproline II helixtrans-80134.6168.900000109.6K55 C58 Q62K55-A60 HydrophobicContact CG-CB 3.96Å; K55-A60 WeakPolarHBondContact O-CB 3.25Å; K55-A60 PolarHBondContact O-N 2.93Å; C58-A60 PolarHBondContact O-N 2.88Å; C58-A60 VanDerWaalsContact O-N 3.17Å; A60-Q62 PolarHBondContact O-N 3.14Å
61K76.6Confident83.9Confident195 Ų19558.1 Ų58.185%0.84829%0.286SS*.PPolyproline II helixtrans-62.9129.4176.7-70-174.4178.3-176.10110.3
62Q80.7Confident84.2Confident56 Ų5658 Ų5826%0.26229%0.285SS..PPolyproline II helixtrans-68.1133.4171.2-169.4171.4-1400109.5A60 D66 I67A60-Q62 PolarHBondContact O-N 3.14Å; Q62-D66 HydrophobicContact CG-CB 3.83Å; Q62-I67 HydrophobicContact CG-CG1 4.02Å
63T85.8Confident84.5Confident52 Ų5257.8 Ų57.832%0.31928%0.284SS..PPolyproline II helixtrans-98.2158.2179.167.60000110.6P65 D66 I67T63-P65 VanDerWaalsContact C-N 3.35Å; T63-D66 WeakPolarHBondContact CB-OD2 3.42Å; T63-D66 PolarHBondContact N-OD2 3.4Å; T63-D66 WeakPolarHBondContact O-CA 3.37Å; T63-D66 WeakPolarHBondContact O-CB 3.37Å; T63-D66 PolarHBondContact O-N 3.44Å; T63-D66 PolarHBondContact OG1-OD2 3.04Å; T63-I67 PolarHBondContact O-N 3.49Å
64V87.8Confident84.9Confident10 Ų1056.4 Ų56.46%0.06128%0.276CS..Hα-helixtrans-50.8-46.5176.9169.70000112.7D66 I67 F68 R142 A147V64-D66 VanDerWaalsContact C-N 3.29Å; V64-D66 PolarHBondContact O-N 3.48Å; V64-I67 WeakPolarHBondContact O-CB 3.46Å; V64-I67 PolarHBondContact O-N 3.41Å; V64-I67 VanDerWaalsContact O-N 3.12Å; V64-F68 HydrophobicContact CG1-CD2 3.86Å; V64-F68 HydrophobicContact CG1-CE2 3.38Å; V64-F68 HydrophobicContact CG1-CZ 4.36Å; V64-F68 WeakPolarHBondContact O-CD2 3.38Å; V64-F68 PolarHBondContact O-N 3.35Å; V64-R142 WeakPolarHBondContact CG2-O 3.47Å; V64-A147 HydrophobicContact CB-CB 4.39Å; V64-A147 HydrophobicContact CG1-CB 3.91Å; V64-A147 HydrophobicContact CG2-CB 4.13Å
65P85.3Confident85.4Confident21 Ų2153.9 Ų53.914%0.13627%0.265CS..Hα-helixtrans-60.2-33.5173.9-27.236.8000114.7T63 I67 F68 I69T63-P65 VanDerWaalsContact C-N 3.35Å; P65-I67 VanDerWaalsContact C-N 3.28Å; P65-I67 PolarHBondContact O-N 2.94Å; P65-F68 PolarHBondContact O-N 3.44Å; P65-I69 WeakPolarHBondContact O-CB 3.37Å; P65-I69 VanDerWaalsContact O-CG1 3.25Å; P65-I69 WeakPolarHBondContact O-CG1 3.25Å; P65-I69 PolarHBondContact O-N 3Å
66D88.3Confident86Confident20 Ų2052.9 Ų52.911%0.10726%0.261CS..Hα-helixtrans-67.2-31.9177.7-55.8-52.4000111I52 K55 Q62 T63 V64 L70I52-D66 HydrophobicContact CG2-CB 4.34Å; K55-D66 IonicContact NZ-OD1 2.67Å; K55-D66 PolarHBondContact NZ-OD1 3.24Å; K55-D66 IonicContact NZ-OD2 2.86Å; K55-D66 PolarHBondContact NZ-OD2 3.01Å; Q62-D66 HydrophobicContact CG-CB 3.83Å; T63-D66 WeakPolarHBondContact CB-OD2 3.42Å; T63-D66 PolarHBondContact N-OD2 3.4Å; T63-D66 WeakPolarHBondContact O-CA 3.37Å; T63-D66 WeakPolarHBondContact O-CB 3.37Å; T63-D66 PolarHBondContact O-N 3.44Å; T63-D66 PolarHBondContact OG1-OD2 3.04Å; V64-D66 VanDerWaalsContact C-N 3.29Å; V64-D66 PolarHBondContact O-N 3.48Å; D66-L70 WeakPolarHBondContact O-CB 3.39Å; D66-L70 PolarHBondContact O-N 3.03Å
67I92.1Very high86.8Confident7 Ų752.1 Ų52.14%0.03626%0.255CS..Hα-helixtrans-68.4-46.2176.1-65.7164.7000110.8Q62 T63 V64 P65 L70 N71 P144 A147 V148 I151Q62-I67 HydrophobicContact CG-CG1 4.02Å; T63-I67 PolarHBondContact O-N 3.49Å; V64-I67 WeakPolarHBondContact O-CB 3.46Å; V64-I67 PolarHBondContact O-N 3.41Å; V64-I67 VanDerWaalsContact O-N 3.12Å; P65-I67 VanDerWaalsContact C-N 3.28Å; P65-I67 PolarHBondContact O-N 2.94Å; I67-L70 PolarHBondContact O-N 3.44Å; I67-N71 PolarHBondContact O-N 3.27Å; I67-N71 PolarHBondContact O-ND2 3.43Å; I67-P144 HydrophobicContact CD1-CB 3.72Å; I67-P144 WeakPolarHBondContact CD1-O 3.27Å; I67-A147 HydrophobicContact CB-CB 4.41Å; I67-A147 HydrophobicContact CD1-CB 3.9Å; I67-A147 HydrophobicContact CG2-CB 4.27Å; I67-V148 HydrophobicContact CD1-CG2 4.25Å; I67-V148 HydrophobicContact CG2-CG2 4.28Å; I67-I151 HydrophobicContact CG2-CG1 4.24Å
68F92.5Very high87.8Confident6 Ų645.9 Ų45.93%0.02623%0.23CC..Hα-helixtrans-62.4-46.1177.2-70.7-60.2000111.6V64 P65 L70 N71 L72 I120 A123 M124 D127 V150 I151V64-F68 HydrophobicContact CG1-CD2 3.86Å; V64-F68 HydrophobicContact CG1-CE2 3.38Å; V64-F68 HydrophobicContact CG1-CZ 4.36Å; V64-F68 WeakPolarHBondContact O-CD2 3.38Å; V64-F68 PolarHBondContact O-N 3.35Å; P65-F68 PolarHBondContact O-N 3.44Å; F68-L70 PolarHBondContact O-N 3.45Å; F68-N71 PolarHBondContact O-N 3.32Å; F68-L72 WeakPolarHBondContact O-CB 3.07Å; F68-L72 PolarHBondContact O-N 2.9Å; F68-I120 HydrophobicContact CB-CG2 4.36Å; F68-I120 HydrophobicContact CD1-CG2 4.22Å; F68-A123 HydrophobicContact CE1-CB 3.88Å; F68-A123 HydrophobicContact CZ-CB 4.24Å; F68-M124 HydrophobicContact CD2-CB 4.48Å; F68-M124 HydrophobicContact CG-CB 4.37Å; F68-D127 HydrophobicContact CE2-CB 4Å; F68-V150 HydrophobicContact CE1-CG1 4.35Å; F68-I151 HydrophobicContact CD1-CD1 3.73Å; F68-I151 HydrophobicContact CD1-CG1 4.33Å; F68-I151 HydrophobicContact CE1-CD1 3.98Å; F68-I151 HydrophobicContact CE1-CG1 4.34Å
69I91.4Very high88.7Confident8 Ų841.8 Ų41.84%0.04120%0.201CC..Hα-helixtrans-63.2-42.8177.8-68.1168.3000111.1V48 I52 P65 N71 L72 S73 M244 Y298V48-I69 HydrophobicContact CG1-CG2 3.67Å; I52-I69 HydrophobicContact CD1-CB 4.22Å; I52-I69 HydrophobicContact CD1-CG2 3.74Å; P65-I69 WeakPolarHBondContact O-CB 3.37Å; P65-I69 VanDerWaalsContact O-CG1 3.25Å; P65-I69 WeakPolarHBondContact O-CG1 3.25Å; P65-I69 PolarHBondContact O-N 3Å; I69-N71 PolarHBondContact O-N 3.5Å; I69-L72 PolarHBondContact O-N 3.42Å; I69-S73 PolarHBondContact O-N 2.88Å; I69-S73 PolarHBondContact O-OG 3.44Å; I69-M244 HydrophobicContact CD1-CE 4.12Å; I69-Y298 HydrophobicContact CD1-CD1 4.36Å; I69-Y298 HydrophobicContact CD1-CE1 4.34Å; I69-Y298 HydrophobicContact CG1-CE1 4.04Å; I69-Y298 HydrophobicContact CG2-CD2 3.94Å; I69-Y298 HydrophobicContact CG2-CE1 4.2Å; I69-Y298 HydrophobicContact CG2-CE2 3.57Å; I69-Y298 HydrophobicContact CG2-CG 4.41Å
70L93.2Very high90.1Very high25 Ų2530.5 Ų30.513%0.13116%0.159CC..Hα-helixtrans-59.9-46.5177.5179.968.2000111.5I49 I52 D66 I67 F68 S73 I74I49-L70 HydrophobicContact CB-CD1 4.3Å; I49-L70 HydrophobicContact CG1-CD1 4.04Å; I49-L70 HydrophobicContact CG2-CD1 4.09Å; I52-L70 HydrophobicContact CB-CD1 4.47Å; I52-L70 HydrophobicContact CD1-CB 4.13Å; I52-L70 HydrophobicContact CG2-CB 4.4Å; I52-L70 HydrophobicContact CG2-CD1 4.33Å; D66-L70 WeakPolarHBondContact O-CB 3.39Å; D66-L70 PolarHBondContact O-N 3.03Å; I67-L70 PolarHBondContact O-N 3.44Å; F68-L70 PolarHBondContact O-N 3.45Å; L70-S73 PolarHBondContact O-N 3.43Å; L70-I74 HydrophobicContact CG-CD1 4.19Å; L70-I74 WeakPolarHBondContact O-CG1 3.5Å; L70-I74 PolarHBondContact O-N 3.13Å
71N95.1Very high91Very high24 Ų2433.5 Ų33.513%0.12817%0.169CC..Hα-helixtrans-67.4-39.5178.8-81-82.8000112.2I67 F68 I69 S73 I74 V75 I120 I151I67-N71 PolarHBondContact O-N 3.27Å; I67-N71 PolarHBondContact O-ND2 3.43Å; F68-N71 PolarHBondContact O-N 3.32Å; I69-N71 PolarHBondContact O-N 3.5Å; N71-S73 VanDerWaalsContact C-N 3.32Å; N71-S73 PolarHBondContact O-N 3.1Å; N71-I74 PolarHBondContact O-N 3.05Å; N71-I74 VanDerWaalsContact O-N 3.14Å; N71-V75 WeakPolarHBondContact O-CG2 3.32Å; N71-V75 PolarHBondContact O-N 3.12Å; N71-I120 HydrophobicContact CB-CD1 3.89Å; N71-I151 HydrophobicContact CB-CD1 3.93Å; N71-I151 HydrophobicContact CB-CG1 4.45Å; N71-I151 HydrophobicContact CB-CG2 4.39Å; N71-I151 VanDerWaalsContact OD1-CG2 3.32Å; N71-I151 WeakPolarHBondContact OD1-CG2 3.49Å
72L93.4Very high91.6Very high3 Ų324.6 Ų24.62%0.01613%0.132CC..Hα-helixtrans-59.9-43.6175.5-170.755.2000111.2F68 I69 I74 V75 D76 I120 L121 I248 Y298F68-L72 WeakPolarHBondContact O-CB 3.07Å; F68-L72 PolarHBondContact O-N 2.9Å; I69-L72 PolarHBondContact O-N 3.42Å; L72-I74 VanDerWaalsContact C-N 3.35Å; L72-I74 PolarHBondContact O-N 3.38Å; L72-V75 PolarHBondContact O-N 2.92Å; L72-D76 WeakPolarHBondContact O-CB 3.26Å; L72-D76 PolarHBondContact O-N 2.79Å; L72-I120 HydrophobicContact CB-CG2 4.28Å; L72-L121 HydrophobicContact CD2-CD2 4.06Å; L72-I248 HydrophobicContact CD2-CG2 4.47Å; L72-Y298 VanDerWaalsContact CD2-OH 3.25Å; L72-Y298 WeakPolarHBondContact CD2-OH 3.37Å
73S94.8Very high92.1Very high0 Ų022.1 Ų22.10%012%0.121CC..Hα-helixtrans-66.2-31.2174.2-70.20000114.2N45 V48 I69 L70 N71 L77N45-S73 WeakPolarHBondContact OD1-CB 3.24Å; N45-S73 PolarHBondContact OD1-OG 3Å; N45-S73 VanDerWaalsContact OD1-OG 3.07Å; V48-S73 VanDerWaalsContact CG1-OG 3.27Å; V48-S73 WeakPolarHBondContact CG1-OG 3.38Å; I69-S73 PolarHBondContact O-N 2.88Å; I69-S73 PolarHBondContact O-OG 3.44Å; L70-S73 PolarHBondContact O-N 3.43Å; N71-S73 VanDerWaalsContact C-N 3.32Å; N71-S73 PolarHBondContact O-N 3.1Å; S73-L77 WeakPolarHBondContact O-CG 3.31Å; S73-L77 PolarHBondContact O-N 3.45Å; S73-L77 VanDerWaalsContact O-N 3.1Å
74I95.8Very high92.4Very high65 Ų6522.8 Ų22.833%0.33313%0.126SC..Hα-helixtrans-67.1-45.2173.4-71.3165000110.1I49 L70 N71 L72 L77 L78I49-I74 HydrophobicContact CD1-CG1 4.11Å; L70-I74 HydrophobicContact CG-CD1 4.19Å; L70-I74 WeakPolarHBondContact O-CG1 3.5Å; L70-I74 PolarHBondContact O-N 3.13Å; N71-I74 PolarHBondContact O-N 3.05Å; N71-I74 VanDerWaalsContact O-N 3.14Å; L72-I74 VanDerWaalsContact C-N 3.35Å; L72-I74 PolarHBondContact O-N 3.38Å; I74-L77 PolarHBondContact O-N 3.34Å; I74-L78 HydrophobicContact CG2-CD1 4.17Å; I74-L78 WeakPolarHBondContact O-CG 3.33Å; I74-L78 PolarHBondContact O-N 3.43Å
75V95.9Very high92.6Very high0 Ų024.4 Ų24.40%013%0.132CC..Hα-helixtrans-63.4-43.5178.7175.40000110.8N71 L72 L77 L78 F79 S113 V116 S117 I120 W155N71-V75 WeakPolarHBondContact O-CG2 3.32Å; N71-V75 PolarHBondContact O-N 3.12Å; L72-V75 PolarHBondContact O-N 2.92Å; V75-L77 VanDerWaalsContact C-N 3.31Å; V75-L77 PolarHBondContact O-N 2.99Å; V75-L78 PolarHBondContact O-N 3.23Å; V75-F79 WeakPolarHBondContact O-CB 3.42Å; V75-F79 PolarHBondContact O-N 3.47Å; V75-S113 VanDerWaalsContact CG1-O 3.27Å; V75-S113 WeakPolarHBondContact CG1-O 3.42Å; V75-V116 HydrophobicContact CB-CG1 4.45Å; V75-V116 HydrophobicContact CG1-CB 4.16Å; V75-V116 HydrophobicContact CG1-CG1 4.23Å; V75-V116 HydrophobicContact CG2-CB 4.18Å; V75-V116 HydrophobicContact CG2-CG1 3.41Å; V75-V116 VanDerWaalsContact CG2-CG1 3.41Å; V75-S117 WeakPolarHBondContact CG1-OG 3.36Å; V75-I120 HydrophobicContact CG2-CD1 4.2Å; V75-W155 HydrophobicContact CG2-CH2 3.88Å; V75-W155 HydrophobicContact CG2-CZ2 3.51Å
76D94.9Very high92.7Very high1 Ų123.7 Ų23.71%0.00513%0.127CC..Hα-helixtrans-59.6-39.5173.8-76.1-33.3000111.9L72 F79 L80 S291 N294L72-D76 WeakPolarHBondContact O-CB 3.26Å; L72-D76 PolarHBondContact O-N 2.79Å; D76-F79 WeakPolarHBondContact O-CB 3.33Å; D76-F79 PolarHBondContact O-N 3.47Å; D76-L80 WeakPolarHBondContact O-CB 3.43Å; D76-L80 VanDerWaalsContact O-CD1 3.26Å; D76-L80 WeakPolarHBondContact O-CD1 3.35Å; D76-L80 WeakPolarHBondContact O-CG 3.32Å; D76-L80 PolarHBondContact O-N 2.79Å; D76-S291 WeakPolarHBondContact OD1-CA 3.38Å; D76-S291 VanDerWaalsContact OD1-CB 3.27Å; D76-S291 WeakPolarHBondContact OD1-CB 3.09Å; D76-S291 PolarHBondContact OD1-OG 2.68Å; D76-N294 PolarHBondContact OD2-ND2 3.21Å
77L95.3Very high92.7Very high43 Ų4324.1 Ų24.123%0.22513%0.129CC..Hα-helixtrans-68.3-38.3175.5-73.7178.5000113I42 N45 I49 S73 I74 V75 F79 L80 L81I42-L77 HydrophobicContact CB-CD2 4.46Å; I42-L77 HydrophobicContact CG1-CD2 4.37Å; N45-L77 HydrophobicContact CB-CD1 4.47Å; N45-L77 HydrophobicContact CB-CD2 3.84Å; N45-L77 HydrophobicContact CB-CG 3.84Å; I49-L77 HydrophobicContact CD1-CD1 3.42Å; I49-L77 VanDerWaalsContact CD1-CD1 3.42Å; I49-L77 HydrophobicContact CD1-CG 4.49Å; S73-L77 WeakPolarHBondContact O-CG 3.31Å; S73-L77 PolarHBondContact O-N 3.45Å; S73-L77 VanDerWaalsContact O-N 3.1Å; I74-L77 PolarHBondContact O-N 3.34Å; V75-L77 VanDerWaalsContact C-N 3.31Å; V75-L77 PolarHBondContact O-N 2.99Å; L77-F79 VanDerWaalsContact C-N 3.29Å; L77-F79 PolarHBondContact O-N 3.1Å; L77-L80 HydrophobicContact CD2-CD1 4.41Å; L77-L80 PolarHBondContact O-N 2.89Å; L77-L81 PolarHBondContact O-N 3.47Å
78L94.3Very high92.6Very high56 Ų5627.6 Ų27.629%0.29315%0.145SC..Hα-helixtrans-63.5-38.8175.2-71.8169.3000111.4I74 V75 L81 W155I74-L78 HydrophobicContact CG2-CD1 4.17Å; I74-L78 WeakPolarHBondContact O-CG 3.33Å; I74-L78 PolarHBondContact O-N 3.43Å; V75-L78 PolarHBondContact O-N 3.23Å; L78-L81 WeakPolarHBondContact O-CB 3.4Å; L78-L81 PolarHBondContact O-N 3.13Å; L78-W155 HydrophobicContact CD1-CH2 3.66Å; L78-W155 HydrophobicContact CD1-CZ2 4.48Å
79F92.1Very high92.3Very high9 Ų927.5 Ų27.54%0.03915%0.145CC..Hα-helixtrans-62.7-48.5172.7179.8-111.3000112.4V75 D76 L77 L81 G82 M83 D110 Q114 W256 Y288 S291V75-F79 WeakPolarHBondContact O-CB 3.42Å; V75-F79 PolarHBondContact O-N 3.47Å; D76-F79 WeakPolarHBondContact O-CB 3.33Å; D76-F79 PolarHBondContact O-N 3.47Å; L77-F79 VanDerWaalsContact C-N 3.29Å; L77-F79 PolarHBondContact O-N 3.1Å; F79-L81 VanDerWaalsContact C-N 3.26Å; F79-L81 PolarHBondContact O-N 3.4Å; F79-G82 PolarHBondContact O-N 2.97Å; F79-M83 HydrophobicContact CD1-CE 3.91Å; F79-M83 HydrophobicContact CE1-CE 3.29Å; F79-M83 HydrophobicContact CZ-CE 3.78Å; F79-D110 WeakPolarHBondContact CE2-OD1 3.23Å; F79-Q114 HydrophobicContact CE2-CG 4.39Å; F79-W256 HydrophobicContact CZ-CH2 4.41Å; F79-W256 HydrophobicContact CZ-CZ2 4.26Å; F79-Y288 AromaticContact CE1-CD1 3.92Å; F79-Y288 HydrophobicContact CE1-CD1 3.92Å; F79-Y288 HydrophobicContact CE1-CE1 4.41Å; F79-Y288 HydrophobicContact CE1-CG 4.47Å; F79-Y288 HydrophobicContact CE2-CD1 4.14Å; F79-Y288 AromaticContact CE2-CE1 3.88Å; F79-Y288 HydrophobicContact CE2-CE1 3.88Å; F79-Y288 AromaticContact CZ-CD1 3.24Å; F79-Y288 HydrophobicContact CZ-CD1 3.24Å; F79-Y288 AromaticContact CZ-CE1 3.44Å; F79-Y288 HydrophobicContact CZ-CE1 3.44Å; F79-Y288 VanDerWaalsContact CZ-CE1 3.44Å; F79-Y288 HydrophobicContact CZ-CG 4.18Å; F79-S291 VanDerWaalsContact CD1-OG 3.28Å; F79-S291 WeakPolarHBondContact CD1-OG 3.31Å
80L93.8Very high92Very high0 Ų027.9 Ų27.90%015%0.147CC..Hα-helixtrans-66.2-27-179.8-65.6161.5000112.5I37 I42 D76 L77 G82 M83 P84I37-L80 HydrophobicContact CG2-CD2 4.47Å; I42-L80 HydrophobicContact CG1-CB 4.11Å; I42-L80 HydrophobicContact CG1-CD1 4.27Å; D76-L80 WeakPolarHBondContact O-CB 3.43Å; D76-L80 VanDerWaalsContact O-CD1 3.26Å; D76-L80 WeakPolarHBondContact O-CD1 3.35Å; D76-L80 WeakPolarHBondContact O-CG 3.32Å; D76-L80 PolarHBondContact O-N 2.79Å; L77-L80 HydrophobicContact CD2-CD1 4.41Å; L77-L80 PolarHBondContact O-N 2.89Å; L80-G82 PolarHBondContact O-N 3.06Å; L80-M83 HydrophobicContact CD2-SD 4.22Å; L80-M83 PolarHBondContact O-N 2.88Å; L80-P84 VanDerWaalsContact O-CD 3.27Å; L80-P84 WeakPolarHBondContact O-CD 3.23Å
81L91.6Very high91.6Very high103 Ų10332 Ų3254%0.53917%0.169SC..Hα-helixtrans-62-28.1172.5-175.565.5000112.3L77 L78 F79 P84L77-L81 PolarHBondContact O-N 3.47Å; L78-L81 WeakPolarHBondContact O-CB 3.4Å; L78-L81 PolarHBondContact O-N 3.13Å; F79-L81 VanDerWaalsContact C-N 3.26Å; F79-L81 PolarHBondContact O-N 3.4Å; L81-P84 WeakPolarHBondContact O-CD 3.35Å
82G89.5Confident91Very high8 Ų832.1 Ų32.18%0.08218%0.175CC..Hα-helixtrans-75.8-26.7176.900000114.4F79 L80 F85 L86F79-G82 PolarHBondContact O-N 2.97Å; L80-G82 PolarHBondContact O-N 3.06Å; G82-F85 PolarHBondContact O-N 3.34Å; G82-L86 PolarHBondContact O-N 3.41Å
83M90.8Very high90.4Very high4 Ų438 Ų382%0.0221%0.206CC..Hα-helixtrans-63.8-39.1-172.1-70.5-155.6173.200115.7I37 C38 F79 L80 F85 L86 I87 Y288I37-M83 HydrophobicContact CG2-SD 4.17Å; C38-M83 HydrophobicContact CB-CB 4.34Å; F79-M83 HydrophobicContact CD1-CE 3.91Å; F79-M83 HydrophobicContact CE1-CE 3.29Å; F79-M83 HydrophobicContact CZ-CE 3.78Å; L80-M83 HydrophobicContact CD2-SD 4.22Å; L80-M83 PolarHBondContact O-N 2.88Å; M83-F85 PolarHBondContact O-N 3.32Å; M83-L86 WeakPolarHBondContact O-CB 3.36Å; M83-L86 PolarHBondContact O-N 2.93Å; M83-L86 VanDerWaalsContact O-N 3.11Å; M83-I87 WeakPolarHBondContact O-CB 3.27Å; M83-I87 VanDerWaalsContact O-CG1 3.26Å; M83-I87 WeakPolarHBondContact O-CG1 3.34Å; M83-I87 PolarHBondContact O-N 2.91Å; M83-Y288 VanDerWaalsContact CE-CB 3.45Å; M83-Y288 HydrophobicContact CE-CD1 3.65Å; M83-Y288 HydrophobicContact CE-CD2 3.49Å; M83-Y288 VanDerWaalsContact CE-CD2 3.49Å; M83-Y288 HydrophobicContact CE-CE1 4.11Å; M83-Y288 HydrophobicContact CE-CE2 4.06Å; M83-Y288 HydrophobicContact CE-CG 3.23Å; M83-Y288 HydrophobicContact SD-CD2 4.4Å
84P92.8Very high89.6Confident65 Ų6538 Ų3842%0.42221%0.206SC..Hα-helixtrans-55.8-38176.5-28.135.8000113.4L80 L81 I87 H88L80-P84 VanDerWaalsContact O-CD 3.27Å; L80-P84 WeakPolarHBondContact O-CD 3.23Å; L81-P84 WeakPolarHBondContact O-CD 3.35Å; P84-I87 PolarHBondContact O-N 2.98Å; P84-H88 WeakPolarHBondContact O-CB 3.37Å; P84-H88 PolarHBondContact O-N 3.11Å
85F91.6Very high89.1Confident44 Ų4435.6 Ų35.619%0.19320%0.195CC..Hα-helixtrans-69.5-39.7177.5-60.5-87.2000111.6G82 M83 H88 Q89 W96 F98 M102 I106G82-F85 PolarHBondContact O-N 3.34Å; M83-F85 PolarHBondContact O-N 3.32Å; F85-H88 PolarHBondContact O-N 2.94Å; F85-Q89 PolarHBondContact O-N 3.44Å; F85-W96 HydrophobicContact CB-CH2 3.82Å; F85-W96 HydrophobicContact CB-CZ3 4.02Å; F85-F98 AromaticContact CD1-CD1 3.96Å; F85-F98 HydrophobicContact CD1-CD1 3.96Å; F85-F98 AromaticContact CD1-CD2 3.83Å; F85-F98 HydrophobicContact CD1-CD2 3.83Å; F85-F98 AromaticContact CD1-CE1 3.99Å; F85-F98 HydrophobicContact CD1-CE1 3.99Å; F85-F98 AromaticContact CD1-CE2 3.87Å; F85-F98 HydrophobicContact CD1-CE2 3.87Å; F85-F98 AromaticContact CD1-CG 3.88Å; F85-F98 HydrophobicContact CD1-CG 3.88Å; F85-F98 AromaticContact CD1-CZ 3.95Å; F85-F98 HydrophobicContact CD1-CZ 3.95Å; F85-F98 AromaticContact CE1-CD1 3.96Å; F85-F98 HydrophobicContact CE1-CD1 3.96Å; F85-F98 HydrophobicContact CE1-CE1 4.05Å; F85-F98 HydrophobicContact CE1-CG 4.26Å; F85-F98 HydrophobicContact CE1-CZ 4.44Å; F85-M102 HydrophobicContact CD1-CE 4.36Å; F85-M102 HydrophobicContact CE1-CE 3.5Å; F85-M102 VanDerWaalsContact CE1-CE 3.5Å; F85-M102 HydrophobicContact CE2-CE 4.35Å; F85-M102 HydrophobicContact CZ-CE 3.49Å; F85-M102 VanDerWaalsContact CZ-CE 3.49Å; F85-I106 HydrophobicContact CB-CG1 4.41Å; F85-I106 HydrophobicContact CB-CG2 4.47Å; F85-I106 HydrophobicContact CD2-CD1 3.48Å; F85-I106 VanDerWaalsContact CD2-CD1 3.48Å; F85-I106 HydrophobicContact CD2-CG1 4.16Å; F85-I106 HydrophobicContact CE2-CD1 3.82Å; F85-I106 HydrophobicContact CG-CD1 4.06Å; F85-I106 HydrophobicContact CG-CG1 4.23Å
86L87.4Confident88.8Confident7 Ų735.9 Ų35.94%0.03720%0.196CC..Hα-helixtrans-64.8-43173.9179.960.7000111.8M1 F34 G82 M83 H88 Q89 L90 Y288M1-L86 HydrophobicContact CE-CB 4.37Å; M1-L86 HydrophobicContact CE-CD1 4.12Å; M1-L86 HydrophobicContact CG-CD1 4.02Å; F34-L86 HydrophobicContact CD2-CD2 4.12Å; F34-L86 HydrophobicContact CD2-CG 4.44Å; F34-L86 HydrophobicContact CE2-CD2 3.76Å; F34-L86 HydrophobicContact CE2-CG 4.29Å; G82-L86 PolarHBondContact O-N 3.41Å; M83-L86 WeakPolarHBondContact O-CB 3.36Å; M83-L86 PolarHBondContact O-N 2.93Å; M83-L86 VanDerWaalsContact O-N 3.11Å; L86-H88 VanDerWaalsContact C-N 3.31Å; L86-H88 PolarHBondContact O-N 3.46Å; L86-Q89 PolarHBondContact O-N 3.07Å; L86-L90 HydrophobicContact CG-CD1 4.41Å; L86-L90 WeakPolarHBondContact O-CG 3.48Å; L86-L90 PolarHBondContact O-N 3.34Å; L86-Y288 HydrophobicContact CD2-CE2 3.44Å; L86-Y288 VanDerWaalsContact CD2-CE2 3.44Å; L86-Y288 VanDerWaalsContact CD2-OH 3.3Å; L86-Y288 WeakPolarHBondContact CD2-OH 3.19Å
87I88.9Confident88.6Confident28 Ų2841.4 Ų41.414%0.14422%0.221CC..Hα-helixtrans-60.1-43.8175.6-69.5164.6000110.2P31 F34 M83 P84 Q89 L90 L91P31-I87 HydrophobicContact CB-CG2 4.21Å; F34-I87 HydrophobicContact CB-CD1 3.89Å; F34-I87 HydrophobicContact CB-CG1 3.7Å; F34-I87 HydrophobicContact CD2-CG1 4.44Å; M83-I87 WeakPolarHBondContact O-CB 3.27Å; M83-I87 VanDerWaalsContact O-CG1 3.26Å; M83-I87 WeakPolarHBondContact O-CG1 3.34Å; M83-I87 PolarHBondContact O-N 2.91Å; P84-I87 PolarHBondContact O-N 2.98Å; I87-Q89 PolarHBondContact O-N 3.18Å; I87-L90 PolarHBondContact O-N 2.67Å; I87-L91 HydrophobicContact CG2-CD1 3.98Å; I87-L91 HydrophobicContact CG2-CG 4.41Å; I87-L91 WeakPolarHBondContact O-CG 3.25Å; I87-L91 PolarHBondContact O-N 3.31Å
88H90.1Very high88.4Confident80 Ų8042.9 Ų42.937%0.3723%0.226SC..Hα-helixtrans-60.5-44.4175.3-176.9-73.5000111.8P84 F85 L86 L90 L91 G92 H97 F98P84-H88 WeakPolarHBondContact O-CB 3.37Å; P84-H88 PolarHBondContact O-N 3.11Å; F85-H88 PolarHBondContact O-N 2.94Å; L86-H88 VanDerWaalsContact C-N 3.31Å; L86-H88 PolarHBondContact O-N 3.46Å; H88-L90 VanDerWaalsContact C-N 3.32Å; H88-L90 PolarHBondContact O-N 3.1Å; H88-L91 PolarHBondContact O-N 2.99Å; H88-G92 PolarHBondContact O-N 2.76Å; H88-H97 AromaticContact CE1-CD2 3.58Å; H88-F98 HydrophobicContact CB-CE2 4.06Å; H88-F98 HydrophobicContact CB-CZ 4.18Å; H88-F98 AromaticContact CD2-CZ 3.99Å; H88-F98 AromaticContact CG-CE2 3.79Å; H88-F98 AromaticContact CG-CZ 3.76Å; H88-F98 AromaticContact ND1-CE2 3.67Å; H88-F98 AromaticContact ND1-CZ 3.94Å
89Q86.3Confident88.4Confident4 Ų441.8 Ų41.82%0.01923%0.228CC..Hα-helixtrans-61.7-41.1176-173.3176.5-7.700111.7M1 F85 L86 I87 G92 G94 W96 C181M1-Q89 VanDerWaalsContact CE-OE1 3.24Å; F85-Q89 PolarHBondContact O-N 3.44Å; L86-Q89 PolarHBondContact O-N 3.07Å; I87-Q89 PolarHBondContact O-N 3.18Å; Q89-G92 CarbonylContact O-C 3.56Å; Q89-G92 PolarHBondContact O-N 3.05Å; Q89-G94 VanDerWaalsContact CG-C 3.5Å; Q89-G94 VanDerWaalsContact CG-O 3.26Å; Q89-G94 WeakPolarHBondContact CG-O 3.42Å; Q89-G94 PolarHBondContact NE2-O 3.3Å; Q89-G94 VanDerWaalsContact O-CA 3.29Å; Q89-G94 WeakPolarHBondContact O-CA 3.28Å; Q89-G94 PolarHBondContact O-N 2.85Å; Q89-W96 HydrophobicContact CB-CE3 4.13Å; Q89-W96 HydrophobicContact CB-CZ3 4.49Å; Q89-W96 HydrophobicContact CG-CE3 4.35Å; Q89-C181 PolarHBondContact NE2-O 3.5Å
90L83.9Confident88.4Confident17 Ų1743.8 Ų43.89%0.08925%0.246CC..Hα-helixtrans-64.3-42.9176.6-71.3173.3000112.4N5 F9 L30 P31 F34 L86 I87 H88 G92 N93N5-L90 WeakPolarHBondContact ND2-CD2 3.39Å; F9-L90 HydrophobicContact CE2-CD2 4.44Å; F9-L90 HydrophobicContact CZ-CD2 4.02Å; L30-L90 HydrophobicContact CD2-CD1 4.1Å; L30-L90 HydrophobicContact CD2-CD2 4.22Å; L30-L90 HydrophobicContact CG-CD1 4.27Å; P31-L90 HydrophobicContact CG-CB 3.97Å; F34-L90 HydrophobicContact CD2-CD1 3.65Å; F34-L90 HydrophobicContact CE2-CD1 3.61Å; L86-L90 HydrophobicContact CG-CD1 4.41Å; L86-L90 WeakPolarHBondContact O-CG 3.48Å; L86-L90 PolarHBondContact O-N 3.34Å; I87-L90 PolarHBondContact O-N 2.67Å; H88-L90 VanDerWaalsContact C-N 3.32Å; H88-L90 PolarHBondContact O-N 3.1Å; L90-G92 VanDerWaalsContact C-N 3.3Å; L90-G92 PolarHBondContact O-N 3.01Å; L90-N93 PolarHBondContact O-N 3.08Å
91L86Confident88.4Confident112 Ų11247.4 Ų47.459%0.58628%0.276SS*.Hα-helixtrans-68-30.5177.4-71.8172.4000112.5P31 I87 H88 N93P31-L91 HydrophobicContact CB-CD2 3.81Å; P31-L91 HydrophobicContact CB-CG 4.05Å; P31-L91 HydrophobicContact CG-CD2 3.85Å; P31-L91 HydrophobicContact CG-CG 4.18Å; I87-L91 HydrophobicContact CG2-CD1 3.98Å; I87-L91 HydrophobicContact CG2-CG 4.41Å; I87-L91 WeakPolarHBondContact O-CG 3.25Å; I87-L91 PolarHBondContact O-N 3.31Å; H88-L91 PolarHBondContact O-N 2.99Å; L91-N93 PolarHBondContact O-N 2.9Å
92G82.3Confident88.5Confident25 Ų2545.9 Ų45.926%0.25827%0.267SS..THydrogen-bonded Turntrans-86.626.2176.100000113.9H88 Q89 L90 G94 T95H88-G92 PolarHBondContact O-N 2.76Å; Q89-G92 CarbonylContact O-C 3.56Å; Q89-G92 PolarHBondContact O-N 3.05Å; L90-G92 VanDerWaalsContact C-N 3.3Å; L90-G92 PolarHBondContact O-N 3.01Å; G92-G94 PolarHBondContact O-N 3.03Å; G92-T95 VanDerWaalsContact O-CB 3.24Å; G92-T95 WeakPolarHBondContact O-CB 3.48Å; G92-T95 WeakPolarHBondContact O-CG2 3.25Å; G92-T95 PolarHBondContact O-N 3.4Å; G92-T95 PolarHBondContact O-OG1 3.43Å
93N79.7Confident88.7Confident126 Ų12645.5 Ų45.567%0.67426%0.263SS*.THydrogen-bonded Turntrans50.441-178-67.2-2.3000113.9F9 L90 L91F9-N93 VanDerWaalsContact CD1-O 3.25Å; F9-N93 WeakPolarHBondContact CD1-O 3.32Å; L90-N93 PolarHBondContact O-N 3.08Å; L91-N93 PolarHBondContact O-N 2.9Å
94G78.1Confident88.8Confident0 Ų046.4 Ų46.40%027%0.269CS..THydrogen-bonded Turntrans91.7-5.8178.400000114.7F9 Q89 G92 A180F9-G94 VanDerWaalsContact CD2-CA 3.42Å; F9-G94 VanDerWaalsContact CE1-N 3.32Å; Q89-G94 VanDerWaalsContact CG-C 3.5Å; Q89-G94 VanDerWaalsContact CG-O 3.26Å; Q89-G94 WeakPolarHBondContact CG-O 3.42Å; Q89-G94 PolarHBondContact NE2-O 3.3Å; Q89-G94 VanDerWaalsContact O-CA 3.29Å; Q89-G94 WeakPolarHBondContact O-CA 3.28Å; Q89-G94 PolarHBondContact O-N 2.85Å; G92-G94 PolarHBondContact O-N 3.03Å; G94-A180 WeakPolarHBondContact O-CB 3.37Å
95T85.9Confident88.9Confident15 Ų1546 Ų469%0.09227%0.266CS..  trans-75.1137.5-17665.60000112.5G92 H97 L174 L178 V179G92-T95 VanDerWaalsContact O-CB 3.24Å; G92-T95 WeakPolarHBondContact O-CB 3.48Å; G92-T95 WeakPolarHBondContact O-CG2 3.25Å; G92-T95 PolarHBondContact O-N 3.4Å; G92-T95 PolarHBondContact O-OG1 3.43Å; T95-H97 PolarHBondContact OG1-NE2 3.45Å; T95-L174 HydrophobicContact CG2-CD2 4.49Å; T95-L178 HydrophobicContact CG2-CB 4.04Å; T95-L178 HydrophobicContact CG2-CD1 3.58Å; T95-L178 HydrophobicContact CG2-CG 4.29Å; T95-V179 CarbonylContact C-O 3.58Å; T95-V179 WeakPolarHBondContact CA-O 3.43Å
96W89.3Confident88.9Confident7 Ų744.4 Ų44.43%0.02726%0.259CS..  trans-114.1122-176.9-175.8-96.9000111.6M1 F85 Q89 F98 G99 M102 C103 I106 L171 V179 C181M1-W96 HydrophobicContact CE-CE3 4.11Å; M1-W96 HydrophobicContact CE-CH2 3.89Å; M1-W96 HydrophobicContact CE-CZ3 3.37Å; F85-W96 HydrophobicContact CB-CH2 3.82Å; F85-W96 HydrophobicContact CB-CZ3 4.02Å; Q89-W96 HydrophobicContact CB-CE3 4.13Å; Q89-W96 HydrophobicContact CB-CZ3 4.49Å; Q89-W96 HydrophobicContact CG-CE3 4.35Å; W96-F98 HydrophobicContact CD2-CD2 4.15Å; W96-F98 AromaticContact CE2-CD2 3.99Å; W96-F98 HydrophobicContact CE3-CD2 4.12Å; W96-F98 HydrophobicContact CH2-CB 4.44Å; W96-F98 AromaticContact CH2-CD2 3.88Å; W96-F98 HydrophobicContact CH2-CD2 3.88Å; W96-F98 HydrophobicContact CZ2-CB 3.69Å; W96-F98 AromaticContact CZ2-CD2 3.88Å; W96-F98 HydrophobicContact CZ2-CD2 3.88Å; W96-F98 HydrophobicContact CZ2-CG 4.22Å; W96-F98 AromaticContact CZ3-CD2 3.96Å; W96-F98 HydrophobicContact CZ3-CD2 3.96Å; W96-G99 PolarHBondContact NE1-O 2.97Å; W96-M102 HydrophobicContact CZ2-CB 3.95Å; W96-C103 HydrophobicContact CZ2-CB 4Å; W96-I106 HydrophobicContact CH2-CG1 4.46Å; W96-L171 VanDerWaalsContact CD1-CD2 3.45Å; W96-L171 HydrophobicContact CG-CD2 4.27Å; W96-V179 PolarHBondContact N-O 3.45Å; W96-V179 VanDerWaalsContact O-CG2 3.3Å; W96-V179 WeakPolarHBondContact O-CG2 3.18Å; W96-C181 HydrophobicContact CB-CB 4.18Å; W96-C181 HydrophobicContact CD2-CB 3.66Å; W96-C181 HydrophobicContact CE3-CB 3.84Å; W96-C181 HydrophobicContact CG-CB 3.83Å; W96-C181 HydrophobicContact CZ3-CB 4.49Å
97H91.1Very high89.1Confident116 Ų11644.3 Ų44.354%0.53726%0.259SS..  trans-111.4-5.6-172.3-64.5-96.1000113.9H88 T95H88-H97 AromaticContact CE1-CD2 3.58Å; T95-H97 PolarHBondContact OG1-NE2 3.45Å
98F92.1Very high89.3Confident74 Ų7443 Ų4333%0.32525%0.252SS..SBendtrans-96.27-169.3-52.9-80.9000114.2F85 H88 W96 M102F85-F98 AromaticContact CD1-CD1 3.96Å; F85-F98 HydrophobicContact CD1-CD1 3.96Å; F85-F98 AromaticContact CD1-CD2 3.83Å; F85-F98 HydrophobicContact CD1-CD2 3.83Å; F85-F98 AromaticContact CD1-CE1 3.99Å; F85-F98 HydrophobicContact CD1-CE1 3.99Å; F85-F98 AromaticContact CD1-CE2 3.87Å; F85-F98 HydrophobicContact CD1-CE2 3.87Å; F85-F98 AromaticContact CD1-CG 3.88Å; F85-F98 HydrophobicContact CD1-CG 3.88Å; F85-F98 AromaticContact CD1-CZ 3.95Å; F85-F98 HydrophobicContact CD1-CZ 3.95Å; F85-F98 AromaticContact CE1-CD1 3.96Å; F85-F98 HydrophobicContact CE1-CD1 3.96Å; F85-F98 HydrophobicContact CE1-CE1 4.05Å; F85-F98 HydrophobicContact CE1-CG 4.26Å; F85-F98 HydrophobicContact CE1-CZ 4.44Å; H88-F98 HydrophobicContact CB-CE2 4.06Å; H88-F98 HydrophobicContact CB-CZ 4.18Å; H88-F98 AromaticContact CD2-CZ 3.99Å; H88-F98 AromaticContact CG-CE2 3.79Å; H88-F98 AromaticContact CG-CZ 3.76Å; H88-F98 AromaticContact ND1-CE2 3.67Å; H88-F98 AromaticContact ND1-CZ 3.94Å; W96-F98 HydrophobicContact CD2-CD2 4.15Å; W96-F98 AromaticContact CE2-CD2 3.99Å; W96-F98 HydrophobicContact CE3-CD2 4.12Å; W96-F98 HydrophobicContact CH2-CB 4.44Å; W96-F98 AromaticContact CH2-CD2 3.88Å; W96-F98 HydrophobicContact CH2-CD2 3.88Å; W96-F98 HydrophobicContact CZ2-CB 3.69Å; W96-F98 AromaticContact CZ2-CD2 3.88Å; W96-F98 HydrophobicContact CZ2-CD2 3.88Å; W96-F98 HydrophobicContact CZ2-CG 4.22Å; W96-F98 AromaticContact CZ3-CD2 3.96Å; W96-F98 HydrophobicContact CZ3-CD2 3.96Å; F98-M102 HydrophobicContact CB-CB 3.77Å; F98-M102 HydrophobicContact CB-CG 4.17Å; F98-M102 WeakPolarHBondContact O-CB 3.32Å; F98-M102 WeakPolarHBondContact O-CG 3.49Å
99G92.9Very high89.5Confident33 Ų3341.2 Ų41.234%0.3425%0.245SC..Hα-helixtrans75.6172.7179.900000114.7W96 C103W96-G99 PolarHBondContact NE1-O 2.97Å; G99-C103 PolarHBondContact O-N 2.76Å
100A92.6Very high89.7Confident51 Ų5141.7 Ų41.742%0.42125%0.248SC..Hα-helixtrans-65.1-42.7-172.500000112.9M102 C103 T104 L171A100-M102 PolarHBondContact O-N 3.05Å; A100-C103 WeakPolarHBondContact O-CB 3.16Å; A100-C103 PolarHBondContact O-N 3.38Å; A100-C103 VanDerWaalsContact O-N 3.13Å; A100-T104 PolarHBondContact O-N 3.5Å; A100-T104 PolarHBondContact O-OG1 3.3Å; A100-L171 HydrophobicContact CB-CD1 3.97Å; A100-L171 HydrophobicContact CB-CG 3.98Å
101A94.1Very high90.2Very high76 Ų7641.5 Ų41.563%0.62825%0.248SC*.Hα-helixtrans-59.3-45.3-178.100000112.4T104 V105A101-T104 PolarHBondContact O-N 2.75Å; A101-V105 WeakPolarHBondContact O-CB 3.2Å; A101-V105 VanDerWaalsContact O-CG2 3.28Å; A101-V105 WeakPolarHBondContact O-CG2 3.45Å; A101-V105 PolarHBondContact O-N 2.98Å
102M93.1Very high90.6Very high71 Ų7136.3 Ų36.335%0.3522%0.22SC..Hα-helixtrans-68.4-36.5177.3-69.5-65.9-86.500111.7F85 W96 F98 A100 T104 V105 I106F85-M102 HydrophobicContact CD1-CE 4.36Å; F85-M102 HydrophobicContact CE1-CE 3.5Å; F85-M102 VanDerWaalsContact CE1-CE 3.5Å; F85-M102 HydrophobicContact CE2-CE 4.35Å; F85-M102 HydrophobicContact CZ-CE 3.49Å; F85-M102 VanDerWaalsContact CZ-CE 3.49Å; W96-M102 HydrophobicContact CZ2-CB 3.95Å; F98-M102 HydrophobicContact CB-CB 3.77Å; F98-M102 HydrophobicContact CB-CG 4.17Å; F98-M102 WeakPolarHBondContact O-CB 3.32Å; F98-M102 WeakPolarHBondContact O-CG 3.49Å; A100-M102 PolarHBondContact O-N 3.05Å; M102-T104 VanDerWaalsContact C-N 3.35Å; M102-T104 PolarHBondContact O-N 3.1Å; M102-V105 PolarHBondContact O-N 3.17Å; M102-I106 WeakPolarHBondContact O-CB 3.14Å; M102-I106 WeakPolarHBondContact O-CG1 3.27Å; M102-I106 PolarHBondContact O-N 2.93Å
103C93.4Very high91.1Very high0 Ų035.2 Ų35.20%021%0.209CC..Hα-helixtrans-57.7-48.7175.4168.30000111.1W96 G99 A100 T107 T169 G170 L171 C181W96-C103 HydrophobicContact CZ2-CB 4Å; G99-C103 PolarHBondContact O-N 2.76Å; A100-C103 WeakPolarHBondContact O-CB 3.16Å; A100-C103 PolarHBondContact O-N 3.38Å; A100-C103 VanDerWaalsContact O-N 3.13Å; C103-T107 WeakPolarHBondContact O-CB 3.08Å; C103-T107 PolarHBondContact O-N 3.2Å; C103-T107 VanDerWaalsContact O-N 3.1Å; C103-T107 PolarHBondContact O-OG1 2.99Å; C103-T169 VanDerWaalsContact SG-CG2 3.51Å; C103-G170 PolarHBondContact SG-O 2.97Å; C103-L171 HydrophobicContact CB-CD2 4.15Å; C103-C181 WeakPolarHBondContact CA-SG 3.43Å; C103-C181 HydrophobicContact CB-CB 3.76Å; C103-C181 WeakPolarHBondContact CB-SG 3.26Å; C103-C181 WeakPolarHBondContact SG-CA 3.21Å; C103-C181 WeakPolarHBondContact SG-CB 3.25Å; C103-C181 CovalentContact SG-SG 2.01Å; C103-C181 PolarHBondContact SG-SG 3.33Å
104T93.3Very high91.7Very high24 Ų2429.5 Ų29.515%0.14718%0.178CC..Hα-helixtrans-63.2-48.7176.5-49.90000111.7A100 A101 M102 I106 T107 A108 W166 T169A100-T104 PolarHBondContact O-N 3.5Å; A100-T104 PolarHBondContact O-OG1 3.3Å; A101-T104 PolarHBondContact O-N 2.75Å; M102-T104 VanDerWaalsContact C-N 3.35Å; M102-T104 PolarHBondContact O-N 3.1Å; T104-I106 PolarHBondContact O-N 3.28Å; T104-T107 PolarHBondContact O-N 3.04Å; T104-A108 WeakPolarHBondContact O-CB 3.35Å; T104-A108 PolarHBondContact O-N 3.21Å; T104-W166 HydrophobicContact CG2-CE3 3.65Å; T104-W166 HydrophobicContact CG2-CZ3 4.03Å; T104-T169 PolarHBondContact OG1-O 3.39Å
105V94.1Very high92.5Very high57 Ų5729.8 Ų29.835%0.34518%0.18SC..Hα-helixtrans-61.8-45.1-1781680000111.8A101 M102 A108 L109 W166A101-V105 WeakPolarHBondContact O-CB 3.2Å; A101-V105 VanDerWaalsContact O-CG2 3.28Å; A101-V105 WeakPolarHBondContact O-CG2 3.45Å; A101-V105 PolarHBondContact O-N 2.98Å; M102-V105 PolarHBondContact O-N 3.17Å; V105-A108 PolarHBondContact O-N 3.12Å; V105-L109 HydrophobicContact CG1-CD1 3.84Å; V105-L109 HydrophobicContact CG1-CG 4.34Å; V105-L109 VanDerWaalsContact O-CB 3.32Å; V105-L109 WeakPolarHBondContact O-CB 3.03Å; V105-L109 VanDerWaalsContact O-CG 3.25Å; V105-L109 WeakPolarHBondContact O-CG 3.4Å; V105-L109 PolarHBondContact O-N 3.03Å; V105-W166 HydrophobicContact CG2-CH2 4.45Å; V105-W166 HydrophobicContact CG2-CZ3 4.4Å
106I92.8Very high93Very high10 Ų1029.1 Ų29.15%0.05118%0.175CC..Hα-helixtrans-69.5-41.5-177.6-63.1-69.7000110.8M1 F85 W96 M102 T104 L109 D110M1-I106 HydrophobicContact CE-CG2 4.1Å; F85-I106 HydrophobicContact CB-CG1 4.41Å; F85-I106 HydrophobicContact CB-CG2 4.47Å; F85-I106 HydrophobicContact CD2-CD1 3.48Å; F85-I106 VanDerWaalsContact CD2-CD1 3.48Å; F85-I106 HydrophobicContact CD2-CG1 4.16Å; F85-I106 HydrophobicContact CE2-CD1 3.82Å; F85-I106 HydrophobicContact CG-CD1 4.06Å; F85-I106 HydrophobicContact CG-CG1 4.23Å; W96-I106 HydrophobicContact CH2-CG1 4.46Å; M102-I106 WeakPolarHBondContact O-CB 3.14Å; M102-I106 WeakPolarHBondContact O-CG1 3.27Å; M102-I106 PolarHBondContact O-N 2.93Å; T104-I106 PolarHBondContact O-N 3.28Å; I106-L109 PolarHBondContact O-N 3.02Å; I106-D110 WeakPolarHBondContact O-CB 3.21Å; I106-D110 PolarHBondContact O-N 3.32Å
107T91.9Very high93.2Very high5 Ų529 Ų293%0.03118%0.176CC..Hα-helixtrans-67.2-38.5176.6-53.10000111.9M1 C103 T104 S111 V165 T169M1-T107 HydrophobicContact CB-CG2 4.1Å; C103-T107 WeakPolarHBondContact O-CB 3.08Å; C103-T107 PolarHBondContact O-N 3.2Å; C103-T107 VanDerWaalsContact O-N 3.1Å; C103-T107 PolarHBondContact O-OG1 2.99Å; T104-T107 PolarHBondContact O-N 3.04Å; T107-S111 WeakPolarHBondContact O-CB 3.35Å; T107-S111 PolarHBondContact O-N 2.81Å; T107-S111 PolarHBondContact O-OG 3.31Å; T107-V165 HydrophobicContact CG2-CG1 3.79Å; T107-T169 HydrophobicContact CG2-CG2 4.2Å
108A93.2Very high93.4Very high1 Ų123.4 Ų23.41%0.00815%0.15CC..Hα-helixtrans-67.2-41.4174.200000111.8T104 V105 N112 I162 V165 W166T104-A108 WeakPolarHBondContact O-CB 3.35Å; T104-A108 PolarHBondContact O-N 3.21Å; V105-A108 PolarHBondContact O-N 3.12Å; A108-N112 WeakPolarHBondContact O-CB 3.46Å; A108-N112 PolarHBondContact O-N 3.46Å; A108-I162 HydrophobicContact CB-CD1 4.04Å; A108-V165 HydrophobicContact CB-CG1 4.41Å; A108-W166 HydrophobicContact CB-CD2 3.91Å; A108-W166 HydrophobicContact CB-CE3 4.26Å; A108-W166 HydrophobicContact CB-CH2 3.88Å; A108-W166 HydrophobicContact CB-CZ2 3.5Å; A108-W166 HydrophobicContact CB-CZ3 4.25Å
109L93.3Very high93.6Very high42 Ų4221.8 Ų21.822%0.2214%0.142CC..Hα-helixtrans-62.8-44.1175-79.3171.6000111.8V105 I106 S113V105-L109 HydrophobicContact CG1-CD1 3.84Å; V105-L109 HydrophobicContact CG1-CG 4.34Å; V105-L109 VanDerWaalsContact O-CB 3.32Å; V105-L109 WeakPolarHBondContact O-CB 3.03Å; V105-L109 VanDerWaalsContact O-CG 3.25Å; V105-L109 WeakPolarHBondContact O-CG 3.4Å; V105-L109 PolarHBondContact O-N 3.03Å; I106-L109 PolarHBondContact O-N 3.02Å; L109-S113 WeakPolarHBondContact O-CB 3.38Å; L109-S113 PolarHBondContact O-N 2.96Å; L109-S113 PolarHBondContact O-OG 2.91Å
110D91.7Very high93.7Very high14 Ų1420.2 Ų20.28%0.07513%0.126CC..Hα-helixtrans-55.8-58.1174.3175.934.1000110.3M1 F79 I106 N112 S113 Q114M1-D110 PolarHBondContact N-OD2 3.34Å; F79-D110 WeakPolarHBondContact CE2-OD1 3.23Å; I106-D110 WeakPolarHBondContact O-CB 3.21Å; I106-D110 PolarHBondContact O-N 3.32Å; D110-N112 PolarHBondContact O-N 2.83Å; D110-S113 PolarHBondContact O-N 3.43Å; D110-Q114 WeakPolarHBondContact O-CG 3.44Å; D110-Q114 PolarHBondContact O-N 3.37Å; D110-Q114 PolarHBondContact OD1-NE2 3.19Å
111S92.4Very high93.8Very high12 Ų1217.9 Ų17.98%0.08411%0.106CC..Hα-helixtrans-61.3-45.8-178.9-54.40000112.5T107 S113 Q114 I115T107-S111 WeakPolarHBondContact O-CB 3.35Å; T107-S111 PolarHBondContact O-N 2.81Å; T107-S111 PolarHBondContact O-OG 3.31Å; S111-S113 VanDerWaalsContact C-N 3.34Å; S111-S113 PolarHBondContact O-N 3.44Å; S111-Q114 PolarHBondContact O-N 3.08Å; S111-I115 WeakPolarHBondContact O-CG1 3.3Å; S111-I115 PolarHBondContact O-N 3.44Å
112N94.4Very high93.8Very high3 Ų315 Ų152%0.0168%0.081CC..Hα-helixtrans-63.8-41179.9-173.463.7000111.3A108 D110 Q114 I115 V116 W155 S158 I162A108-N112 WeakPolarHBondContact O-CB 3.46Å; A108-N112 PolarHBondContact O-N 3.46Å; D110-N112 PolarHBondContact O-N 2.83Å; N112-Q114 VanDerWaalsContact C-N 3.29Å; N112-Q114 PolarHBondContact O-N 2.65Å; N112-I115 PolarHBondContact O-N 2.94Å; N112-V116 WeakPolarHBondContact O-CB 3.4Å; N112-V116 VanDerWaalsContact O-CG2 3.25Å; N112-V116 WeakPolarHBondContact O-CG2 3.22Å; N112-V116 PolarHBondContact O-N 2.89Å; N112-W155 WeakPolarHBondContact ND2-CZ3 3.09Å; N112-S158 VanDerWaalsContact OD1-CB 3.26Å; N112-S158 WeakPolarHBondContact OD1-CB 3.33Å; N112-S158 PolarHBondContact OD1-OG 3.28Å; N112-I162 HydrophobicContact CB-CD1 3.71Å; N112-I162 HydrophobicContact CB-CG1 4.38Å
113S93.9Very high93.9Very high3 Ų312.2 Ų12.22%0.0217%0.069CC..Hα-helixtrans-65.4-36-177.9-59.40000112V75 L109 D110 S111 S117V75-S113 VanDerWaalsContact CG1-O 3.27Å; V75-S113 WeakPolarHBondContact CG1-O 3.42Å; L109-S113 WeakPolarHBondContact O-CB 3.38Å; L109-S113 PolarHBondContact O-N 2.96Å; L109-S113 PolarHBondContact O-OG 2.91Å; D110-S113 PolarHBondContact O-N 3.43Å; S111-S113 VanDerWaalsContact C-N 3.34Å; S111-S113 PolarHBondContact O-N 3.44Å; S113-S117 WeakPolarHBondContact O-CB 3.47Å; S113-S117 PolarHBondContact O-N 2.99Å; S113-S117 PolarHBondContact O-OG 3.36Å
114Q92Very high93.8Very high6 Ų612.3 Ų12.33%0.0287%0.07CC..Hα-helixtrans-62.2-51.4172.6-63.8177.147.700111.2F79 D110 S111 N112 S117 T118 W256 Y260F79-Q114 HydrophobicContact CE2-CG 4.39Å; D110-Q114 WeakPolarHBondContact O-CG 3.44Å; D110-Q114 PolarHBondContact O-N 3.37Å; D110-Q114 PolarHBondContact OD1-NE2 3.19Å; S111-Q114 PolarHBondContact O-N 3.08Å; N112-Q114 VanDerWaalsContact C-N 3.29Å; N112-Q114 PolarHBondContact O-N 2.65Å; Q114-S117 PolarHBondContact O-N 3.29Å; Q114-T118 PolarHBondContact O-N 2.79Å; Q114-T118 PolarHBondContact O-OG1 3.18Å; Q114-W256 VanDerWaalsContact CD-CZ3 3.43Å; Q114-W256 HydrophobicContact CG-CH2 3.4Å; Q114-W256 HydrophobicContact CG-CZ2 3.61Å; Q114-W256 HydrophobicContact CG-CZ3 4.08Å; Q114-W256 VanDerWaalsContact OE1-CH2 3.23Å; Q114-Y260 PolarHBondContact OE1-OH 3.42Å
115I94Very high93.7Very high6 Ų611.2 Ų11.23%0.0316%0.063CC..Hα-helixtrans-62.2-49.4-179.5-62.9-62.6000111.7S111 N112 S117 T118 Y119 T161 I162 A203S111-I115 WeakPolarHBondContact O-CG1 3.3Å; S111-I115 PolarHBondContact O-N 3.44Å; N112-I115 PolarHBondContact O-N 2.94Å; I115-S117 VanDerWaalsContact C-N 3.32Å; I115-S117 PolarHBondContact O-N 2.85Å; I115-T118 PolarHBondContact O-N 3.04Å; I115-Y119 HydrophobicContact CG2-CD2 3.82Å; I115-Y119 HydrophobicContact CG2-CE1 4.17Å; I115-Y119 HydrophobicContact CG2-CE2 3.44Å; I115-Y119 VanDerWaalsContact CG2-CE2 3.44Å; I115-Y119 HydrophobicContact CG2-CG 4.34Å; I115-Y119 PolarHBondContact O-N 3.46Å; I115-T161 HydrophobicContact CD1-CG2 3.92Å; I115-T161 HydrophobicContact CG1-CG2 4.09Å; I115-T161 HydrophobicContact CG2-CG2 4.26Å; I115-I162 HydrophobicContact CG1-CG2 4.12Å; I115-A203 HydrophobicContact CD1-CB 3.46Å; I115-A203 VanDerWaalsContact CD1-CB 3.46Å
116V96.6Very high93.7Very high0 Ų012.1 Ų12.10%07%0.065CC..Hα-helixtrans-60.1-44.2179175.50000110.5V75 N112 T118 Y119 I120 V154 W155 S158V75-V116 HydrophobicContact CB-CG1 4.45Å; V75-V116 HydrophobicContact CG1-CB 4.16Å; V75-V116 HydrophobicContact CG1-CG1 4.23Å; V75-V116 HydrophobicContact CG2-CB 4.18Å; V75-V116 HydrophobicContact CG2-CG1 3.41Å; V75-V116 VanDerWaalsContact CG2-CG1 3.41Å; N112-V116 WeakPolarHBondContact O-CB 3.4Å; N112-V116 VanDerWaalsContact O-CG2 3.25Å; N112-V116 WeakPolarHBondContact O-CG2 3.22Å; N112-V116 PolarHBondContact O-N 2.89Å; V116-T118 PolarHBondContact O-N 3.43Å; V116-Y119 PolarHBondContact O-N 3.45Å; V116-I120 HydrophobicContact CG1-CD1 3.62Å; V116-I120 HydrophobicContact CG1-CG1 4.11Å; V116-I120 WeakPolarHBondContact O-CB 3.37Å; V116-I120 VanDerWaalsContact O-CG1 3.25Å; V116-I120 WeakPolarHBondContact O-CG1 3.4Å; V116-I120 PolarHBondContact O-N 3.37Å; V116-V154 HydrophobicContact CG1-CG1 4.04Å; V116-W155 HydrophobicContact CG1-CD2 4.42Å; V116-W155 HydrophobicContact CG1-CZ2 4.23Å; V116-W155 HydrophobicContact CG2-CD2 4.25Å; V116-W155 HydrophobicContact CG2-CE3 3.99Å; V116-W155 HydrophobicContact CG2-CZ3 4.2Å; V116-S158 WeakPolarHBondContact CG2-OG 3.45Å
117S94.8Very high93.6Very high4 Ų412.1 Ų12.13%0.0287%0.066CC..Hα-helixtrans-58.7-48178.1-64.60000111.3V75 S113 Q114 I115 Y119 I120 L121V75-S117 WeakPolarHBondContact CG1-OG 3.36Å; S113-S117 WeakPolarHBondContact O-CB 3.47Å; S113-S117 PolarHBondContact O-N 2.99Å; S113-S117 PolarHBondContact O-OG 3.36Å; Q114-S117 PolarHBondContact O-N 3.29Å; I115-S117 VanDerWaalsContact C-N 3.32Å; I115-S117 PolarHBondContact O-N 2.85Å; S117-Y119 PolarHBondContact O-N 3.4Å; S117-I120 PolarHBondContact O-N 3.42Å; S117-L121 VanDerWaalsContact O-CG 3.3Å; S117-L121 WeakPolarHBondContact O-CG 3.39Å; S117-L121 PolarHBondContact O-N 2.69Å
118T94.9Very high93.4Very high0 Ų012.6 Ų12.60%07%0.067CC..Hα-helixtrans-58.5-48.9176.5-61.60000111.7Q114 I115 V116 I120 L121 T122 A203 P207 F252Q114-T118 PolarHBondContact O-N 2.79Å; Q114-T118 PolarHBondContact O-OG1 3.18Å; I115-T118 PolarHBondContact O-N 3.04Å; V116-T118 PolarHBondContact O-N 3.43Å; T118-I120 VanDerWaalsContact C-N 3.35Å; T118-I120 PolarHBondContact O-N 3.06Å; T118-L121 WeakPolarHBondContact O-CB 3.22Å; T118-L121 PolarHBondContact O-N 2.92Å; T118-L121 VanDerWaalsContact O-N 3.12Å; T118-T122 PolarHBondContact O-N 2.71Å; T118-T122 PolarHBondContact O-OG1 2.99Å; T118-T122 VanDerWaalsContact O-OG1 3.12Å; T118-A203 WeakPolarHBondContact CG2-O 3.43Å; T118-A203 PolarHBondContact OG1-O 3.28Å; T118-A203 VanDerWaalsContact OG1-O 3.11Å; T118-P207 HydrophobicContact CG2-CB 3.24Å; T118-P207 HydrophobicContact CG2-CG 3.38Å; T118-F252 HydrophobicContact CG2-CE1 4.49Å; T118-F252 WeakPolarHBondContact OG1-CE1 3.06Å; T118-F252 WeakPolarHBondContact OG1-CZ 3.28Å
119Y96.6Very high93.2Very high40 Ų4015.4 Ų15.416%0.1578%0.078CC..Hα-helixtrans-66.1-36.6-178.1-71-1.5000112.3I115 V116 S117 L121 T122 A123 V154 L157 T161 P207I115-Y119 HydrophobicContact CG2-CD2 3.82Å; I115-Y119 HydrophobicContact CG2-CE1 4.17Å; I115-Y119 HydrophobicContact CG2-CE2 3.44Å; I115-Y119 VanDerWaalsContact CG2-CE2 3.44Å; I115-Y119 HydrophobicContact CG2-CG 4.34Å; I115-Y119 PolarHBondContact O-N 3.46Å; V116-Y119 PolarHBondContact O-N 3.45Å; S117-Y119 PolarHBondContact O-N 3.4Å; Y119-L121 VanDerWaalsContact C-N 3.34Å; Y119-T122 PolarHBondContact O-N 3.26Å; Y119-A123 WeakPolarHBondContact O-CB 3.45Å; Y119-A123 PolarHBondContact O-N 2.84Å; Y119-V154 HydrophobicContact CD2-CG1 4.31Å; Y119-V154 HydrophobicContact CG-CG1 4.45Å; Y119-L157 HydrophobicContact CD2-CB 4.46Å; Y119-L157 HydrophobicContact CE2-CB 4.17Å; Y119-T161 PolarHBondContact OH-OG1 2.75Å; Y119-P207 HydrophobicContact CE1-CG 4.48Å
120I95.6Very high92.9Very high0 Ų015.3 Ų15.30%08%0.077CC..Hα-helixtrans-61-43.2171.3-72174.9000110.5F68 N71 L72 V75 V116 S117 T118 A123 M124 I151 V154F68-I120 HydrophobicContact CB-CG2 4.36Å; F68-I120 HydrophobicContact CD1-CG2 4.22Å; N71-I120 HydrophobicContact CB-CD1 3.89Å; L72-I120 HydrophobicContact CB-CG2 4.28Å; V75-I120 HydrophobicContact CG2-CD1 4.2Å; V116-I120 HydrophobicContact CG1-CD1 3.62Å; V116-I120 HydrophobicContact CG1-CG1 4.11Å; V116-I120 WeakPolarHBondContact O-CB 3.37Å; V116-I120 VanDerWaalsContact O-CG1 3.25Å; V116-I120 WeakPolarHBondContact O-CG1 3.4Å; V116-I120 PolarHBondContact O-N 3.37Å; S117-I120 PolarHBondContact O-N 3.42Å; T118-I120 VanDerWaalsContact C-N 3.35Å; T118-I120 PolarHBondContact O-N 3.06Å; I120-A123 PolarHBondContact O-N 3.32Å; I120-M124 WeakPolarHBondContact O-CB 3.47Å; I120-M124 PolarHBondContact O-N 2.98Å; I120-I151 HydrophobicContact CD1-CD1 4.06Å; I120-I151 HydrophobicContact CG1-CD1 3.78Å; I120-V154 HydrophobicContact CG1-CG1 4.18Å
121L93Very high92.6Very high1 Ų115.1 Ų15.11%0.0058%0.077CC..Hα-helixtrans-65.7-39.2178.2-68.9174.8000112.6L72 S117 T118 Y119 M124 T125 I211 I248 F252L72-L121 HydrophobicContact CD2-CD2 4.06Å; S117-L121 VanDerWaalsContact O-CG 3.3Å; S117-L121 WeakPolarHBondContact O-CG 3.39Å; S117-L121 PolarHBondContact O-N 2.69Å; T118-L121 WeakPolarHBondContact O-CB 3.22Å; T118-L121 PolarHBondContact O-N 2.92Å; T118-L121 VanDerWaalsContact O-N 3.12Å; Y119-L121 VanDerWaalsContact C-N 3.34Å; L121-M124 PolarHBondContact O-N 3.36Å; L121-T125 WeakPolarHBondContact O-CB 3.36Å; L121-T125 PolarHBondContact O-N 3.3Å; L121-T125 PolarHBondContact O-OG1 3.12Å; L121-I211 HydrophobicContact CB-CD1 4.39Å; L121-I248 HydrophobicContact CD2-CB 4.44Å; L121-I248 HydrophobicContact CD2-CG2 3.41Å; L121-I248 VanDerWaalsContact CD2-CG2 3.41Å; L121-F252 HydrophobicContact CD1-CB 3.41Å; L121-F252 VanDerWaalsContact CD1-CB 3.41Å; L121-F252 HydrophobicContact CD1-CD1 3.79Å; L121-F252 HydrophobicContact CD1-CD2 3.46Å; L121-F252 VanDerWaalsContact CD1-CD2 3.46Å; L121-F252 HydrophobicContact CD1-CE1 4.45Å; L121-F252 HydrophobicContact CD1-CE2 4.18Å; L121-F252 HydrophobicContact CD1-CG 3.25Å
122T95.2Very high92.1Very high16 Ų1615.2 Ų15.210%0.0988%0.078CC..Hα-helixtrans-62.7-48.9173.5-52.40000110.7T118 Y119 M124 T125 L126 I210T118-T122 PolarHBondContact O-N 2.71Å; T118-T122 PolarHBondContact O-OG1 2.99Å; T118-T122 VanDerWaalsContact O-OG1 3.12Å; Y119-T122 PolarHBondContact O-N 3.26Å; T122-M124 PolarHBondContact O-N 3.34Å; T122-T125 PolarHBondContact O-N 3.24Å; T122-L126 HydrophobicContact CG2-CD1 4.37Å; T122-L126 WeakPolarHBondContact O-CG 3.28Å; T122-L126 PolarHBondContact O-N 3.44Å; T122-I210 HydrophobicContact CG2-CB 4.32Å; T122-I210 HydrophobicContact CG2-CG2 3.75Å
123A95.2Very high91.6Very high13 Ų1316 Ų1611%0.1078%0.082CC..Hα-helixtrans-61.7-42.2177.500000112.2F68 Y119 I120 T125 L126 D127 V150F68-A123 HydrophobicContact CE1-CB 3.88Å; F68-A123 HydrophobicContact CZ-CB 4.24Å; Y119-A123 WeakPolarHBondContact O-CB 3.45Å; Y119-A123 PolarHBondContact O-N 2.84Å; I120-A123 PolarHBondContact O-N 3.32Å; A123-T125 VanDerWaalsContact C-N 3.32Å; A123-T125 PolarHBondContact O-N 3.24Å; A123-L126 PolarHBondContact O-N 3.36Å; A123-D127 PolarHBondContact O-N 3.12Å; A123-V150 HydrophobicContact CB-CG1 3.91Å
124M91.6Very high91.1Very high2 Ų218.8 Ų18.81%0.0110%0.095CC..Hα-helixtrans-59.6-44.1175-176.6178-179.700110.6F68 I120 L121 T122 D127 R128 M244 A245 I248F68-M124 HydrophobicContact CD2-CB 4.48Å; F68-M124 HydrophobicContact CG-CB 4.37Å; I120-M124 WeakPolarHBondContact O-CB 3.47Å; I120-M124 PolarHBondContact O-N 2.98Å; L121-M124 PolarHBondContact O-N 3.36Å; T122-M124 PolarHBondContact O-N 3.34Å; M124-D127 PolarHBondContact O-N 2.94Å; M124-R128 VanDerWaalsContact O-CG 3.32Å; M124-R128 WeakPolarHBondContact O-CG 3.33Å; M124-R128 PolarHBondContact O-N 3.27Å; M124-M244 HydrophobicContact CE-CE 3.84Å; M124-A245 HydrophobicContact CE-CB 4.21Å; M124-I248 HydrophobicContact CE-CD1 3.87Å; M124-I248 HydrophobicContact SD-CD1 4.46Å
125T91.1Very high90.4Very high1 Ų122 Ų221%0.00612%0.116CC..Hα-helixtrans-64.6-41.8178.1-62.10000112.2L121 T122 A123 R128 Y129 I211 V214 F215 C249L121-T125 WeakPolarHBondContact O-CB 3.36Å; L121-T125 PolarHBondContact O-N 3.3Å; L121-T125 PolarHBondContact O-OG1 3.12Å; T122-T125 PolarHBondContact O-N 3.24Å; A123-T125 VanDerWaalsContact C-N 3.32Å; A123-T125 PolarHBondContact O-N 3.24Å; T125-R128 WeakPolarHBondContact O-CB 3.12Å; T125-R128 PolarHBondContact O-N 3.45Å; T125-Y129 PolarHBondContact O-N 2.86Å; T125-I211 HydrophobicContact CG2-CB 4.48Å; T125-I211 HydrophobicContact CG2-CG1 4.27Å; T125-I211 HydrophobicContact CG2-CG2 4.28Å; T125-V214 HydrophobicContact CG2-CB 3.96Å; T125-V214 HydrophobicContact CG2-CG1 3.66Å; T125-F215 HydrophobicContact CG2-CD1 4.06Å; T125-F215 HydrophobicContact CG2-CD2 4.41Å; T125-F215 HydrophobicContact CG2-CE1 3.67Å; T125-F215 HydrophobicContact CG2-CE2 4.09Å; T125-F215 HydrophobicContact CG2-CG 4.38Å; T125-F215 HydrophobicContact CG2-CZ 3.67Å; T125-C249 PolarHBondContact OG1-SG 3.11Å; T125-C249 VanDerWaalsContact OG1-SG 3.34Å
126L92.8Very high89.7Confident75 Ų7529 Ų2939%0.39315%0.152SC..Hα-helixtrans-63.1-43.5173.8-70170.3000111.8T122 A123 R128 Y129 L130 V214T122-L126 HydrophobicContact CG2-CD1 4.37Å; T122-L126 WeakPolarHBondContact O-CG 3.28Å; T122-L126 PolarHBondContact O-N 3.44Å; A123-L126 PolarHBondContact O-N 3.36Å; L126-R128 VanDerWaalsContact C-N 3.27Å; L126-R128 PolarHBondContact O-N 2.84Å; L126-Y129 WeakPolarHBondContact O-CB 3.33Å; L126-Y129 PolarHBondContact O-N 3.46Å; L126-Y129 VanDerWaalsContact O-N 3.11Å; L126-L130 WeakPolarHBondContact O-CG 3.41Å; L126-L130 PolarHBondContact O-N 3.28Å; L126-V214 HydrophobicContact CD2-CG2 3.79Å
127D90.6Very high88.8Confident11 Ų1137.8 Ų37.86%0.05919%0.185CC..Hα-helixtrans-59.8-37.3173.3165.564.8000111.8F68 A123 M124 L130 A131 R142F68-D127 HydrophobicContact CE2-CB 4Å; A123-D127 PolarHBondContact O-N 3.12Å; M124-D127 PolarHBondContact O-N 2.94Å; D127-L130 PolarHBondContact O-N 3.37Å; D127-A131 VanDerWaalsContact O-CB 3.31Å; D127-A131 WeakPolarHBondContact O-CB 3.23Å; D127-A131 PolarHBondContact O-N 2.85Å; D127-R142 PolarHBondContact O-NE 3.47Å; D127-R142 IonicContact OD1-CZ 2.75Å; D127-R142 VanDerWaalsContact OD1-CZ 3.25Å; D127-R142 IonicContact OD1-NE 3.04Å; D127-R142 PolarHBondContact OD1-NE 2.95Å; D127-R142 IonicContact OD1-NH2 3.57Å; D127-R142 PolarHBondContact OD1-NH2 3.12Å; D127-R142 IonicContact OD2-NH2 3Å
128R88.1Confident88.2Confident14 Ų1440.3 Ų40.35%0.05320%0.196CC..Hα-helixtrans-65.2-38.3174-64.6-56.581.2-149.86112.7M124 T125 L126 A131 T132 I218 A245M124-R128 VanDerWaalsContact O-CG 3.32Å; M124-R128 WeakPolarHBondContact O-CG 3.33Å; M124-R128 PolarHBondContact O-N 3.27Å; T125-R128 WeakPolarHBondContact O-CB 3.12Å; T125-R128 PolarHBondContact O-N 3.45Å; L126-R128 VanDerWaalsContact C-N 3.27Å; L126-R128 PolarHBondContact O-N 2.84Å; R128-A131 PolarHBondContact O-N 3.17Å; R128-T132 WeakPolarHBondContact O-CB 3.49Å; R128-T132 PolarHBondContact O-N 3.04Å; R128-T132 PolarHBondContact O-OG1 3Å; R128-I218 HydrophobicContact CB-CD1 4.34Å; R128-A245 HydrophobicContact CG-CB 3.6Å
129Y88.6Confident87.4Confident61 Ų6145.3 Ų45.324%0.23922%0.223CC..Hα-helixtrans-61.6-51.2174.7173.6-99.9000111.2T125 L126 A131 T132 V133 V214 K217 I218T125-Y129 PolarHBondContact O-N 2.86Å; L126-Y129 WeakPolarHBondContact O-CB 3.33Å; L126-Y129 PolarHBondContact O-N 3.46Å; L126-Y129 VanDerWaalsContact O-N 3.11Å; Y129-A131 VanDerWaalsContact C-N 3.27Å; Y129-A131 PolarHBondContact O-N 3.04Å; Y129-T132 PolarHBondContact O-N 3.32Å; Y129-V133 HydrophobicContact CD2-CB 4.18Å; Y129-V133 HydrophobicContact CD2-CG2 3.6Å; Y129-V133 HydrophobicContact CE2-CB 3.88Å; Y129-V133 HydrophobicContact CE2-CG1 4.03Å; Y129-V133 HydrophobicContact CE2-CG2 3.51Å; Y129-V133 HydrophobicContact CG-CG2 4.41Å; Y129-V133 PolarHBondContact O-N 2.92Å; Y129-V214 VanDerWaalsContact CB-CG1 3.48Å; Y129-V214 HydrophobicContact CD2-CG1 4.14Å; Y129-V214 HydrophobicContact CG-CG1 4Å; Y129-K217 HydrophobicContact CD2-CB 4.41Å; Y129-K217 HydrophobicContact CE2-CB 3.91Å; Y129-I218 HydrophobicContact CD2-CG1 3.9Å
130L88.9Confident86.8Confident39 Ų3949.8 Ų49.820%0.20425%0.245CC..Hα-helixtrans-58.4-41.2177.2-62.5173.6000111.5L126 D127 T132 H134 F138 I141L126-L130 WeakPolarHBondContact O-CG 3.41Å; L126-L130 PolarHBondContact O-N 3.28Å; D127-L130 PolarHBondContact O-N 3.37Å; L130-T132 VanDerWaalsContact C-N 3.28Å; L130-T132 PolarHBondContact O-N 3.02Å; L130-H134 CarbonylContact O-C 3.14Å; L130-H134 PolarHBondContact O-N 3.4Å; L130-F138 HydrophobicContact CB-CB 4.4Å; L130-F138 HydrophobicContact CD2-CB 4.26Å; L130-F138 HydrophobicContact CD2-CD2 3.57Å; L130-F138 HydrophobicContact CD2-CE2 4.05Å; L130-F138 HydrophobicContact CD2-CG 3.94Å; L130-I141 HydrophobicContact CD1-CD1 3.85Å
131A84.8Confident86.2Confident10 Ų1052.3 Ų52.38%0.08326%0.258CS..Hα-helixtrans-64.4-29.4177.200000114.2D127 R128 Y129D127-A131 VanDerWaalsContact O-CB 3.31Å; D127-A131 WeakPolarHBondContact O-CB 3.23Å; D127-A131 PolarHBondContact O-N 2.85Å; R128-A131 PolarHBondContact O-N 3.17Å; Y129-A131 VanDerWaalsContact C-N 3.27Å; Y129-A131 PolarHBondContact O-N 3.04Å
132T82.1Confident86Confident15 Ų1555 Ų559%0.09227%0.268CS..Hα-helixtrans-101.4-45.7-169.5-54.60000112.5R128 Y129 L130 I218 H221 M222 T238R128-T132 WeakPolarHBondContact O-CB 3.49Å; R128-T132 PolarHBondContact O-N 3.04Å; R128-T132 PolarHBondContact O-OG1 3Å; Y129-T132 PolarHBondContact O-N 3.32Å; L130-T132 VanDerWaalsContact C-N 3.28Å; L130-T132 PolarHBondContact O-N 3.02Å; T132-I218 HydrophobicContact CG2-CG2 4.08Å; T132-H221 PolarHBondContact O-CE1 2.83Å; T132-M222 HydrophobicContact CG2-CE 3.46Å; T132-M222 VanDerWaalsContact CG2-CE 3.46Å; T132-M222 HydrophobicContact CG2-CG 4.13Å; T132-T238 HydrophobicContact CG2-CG2 4.08Å; T132-T238 WeakPolarHBondContact OG1-CG2 3.5Å
133V83.4Confident85.8Confident19 Ų1956.6 Ų56.612%0.11528%0.277CS..Hα-helixtrans-89.4-30.8-173.4-178.40000111Y129 P135 I218 H221Y129-V133 HydrophobicContact CD2-CB 4.18Å; Y129-V133 HydrophobicContact CD2-CG2 3.6Å; Y129-V133 HydrophobicContact CE2-CB 3.88Å; Y129-V133 HydrophobicContact CE2-CG1 4.03Å; Y129-V133 HydrophobicContact CE2-CG2 3.51Å; Y129-V133 HydrophobicContact CG-CG2 4.41Å; Y129-V133 PolarHBondContact O-N 2.92Å; V133-P135 VanDerWaalsContact C-CD 3.45Å; V133-I218 HydrophobicContact CG2-CG1 4.49Å; V133-H221 HydrophobicContact CG2-CB 3.89Å
134H82.6Confident85.5Confident62 Ų6258.9 Ų58.929%0.28729%0.291SS..  trans-133.455.2-176.6-63.8-48.7000112.9L130 I136 R137 F138L130-H134 CarbonylContact O-C 3.14Å; L130-H134 PolarHBondContact O-N 3.4Å; H134-I136 VanDerWaalsContact C-N 3.25Å; H134-I136 PolarHBondContact O-N 3.31Å; H134-I136 VanDerWaalsContact O-N 3.14Å; H134-R137 HydrophobicContact CB-CB 4.5Å; H134-F138 HydrophobicContact CB-CD2 3.45Å; H134-F138 VanDerWaalsContact CB-CD2 3.45Å; H134-F138 HydrophobicContact CB-CE2 4.01Å; H134-F138 AromaticContact CD2-CE2 3.77Å; H134-F138 AromaticContact CG-CD2 3.97Å; H134-F138 PolarHBondContact O-N 3.01Å
135P78.6Confident85.5Confident73 Ų7366.6 Ų66.647%0.47432%0.321SS..THydrogen-bonded Turntrans-61.6-27.4-170.424.5-34.8000114.5V133V133-P135 VanDerWaalsContact C-CD 3.45Å
136I78.6Confident85.6Confident152 Ų15269.4 Ų69.478%0.77934%0.336SS*.THydrogen-bonded Turntrans-95.4-50.8-177.7-57.6172.4000110.6H134 F138 N139H134-I136 VanDerWaalsContact C-N 3.25Å; H134-I136 PolarHBondContact O-N 3.31Å; H134-I136 VanDerWaalsContact O-N 3.14Å; I136-F138 VanDerWaalsContact C-N 3.32Å; I136-F138 PolarHBondContact O-N 3.05Å; I136-N139 PolarHBondContact O-N 3.03Å
137R77.9Confident85.7Confident186 Ų18666 Ų6670%0.70232%0.318SS*.THydrogen-bonded Turntrans-57.7-42-175.1-174.3173.9-177.4163.60.7112.6H134 H140H134-R137 HydrophobicContact CB-CB 4.5Å; R137-H140 PolarHBondContact O-CE1 3.45Å; R137-H140 PolarHBondContact O-ND1 2.93Å
138F82.6Confident85.8Confident56 Ų5669.4 Ų69.425%0.24634%0.34CS..THydrogen-bonded Turntrans-106.115.8-175.3-68.3-60.3000113.7L130 H134 I136 H140 I141 R142L130-F138 HydrophobicContact CB-CB 4.4Å; L130-F138 HydrophobicContact CD2-CB 4.26Å; L130-F138 HydrophobicContact CD2-CD2 3.57Å; L130-F138 HydrophobicContact CD2-CE2 4.05Å; L130-F138 HydrophobicContact CD2-CG 3.94Å; H134-F138 HydrophobicContact CB-CD2 3.45Å; H134-F138 VanDerWaalsContact CB-CD2 3.45Å; H134-F138 HydrophobicContact CB-CE2 4.01Å; H134-F138 AromaticContact CD2-CE2 3.77Å; H134-F138 AromaticContact CG-CD2 3.97Å; H134-F138 PolarHBondContact O-N 3.01Å; I136-F138 VanDerWaalsContact C-N 3.32Å; I136-F138 PolarHBondContact O-N 3.05Å; F138-H140 PolarHBondContact O-N 3.19Å; F138-I141 HydrophobicContact CB-CD1 3.77Å; F138-I141 HydrophobicContact CB-CG1 3.71Å; F138-I141 HydrophobicContact CD1-CD1 3.41Å; F138-I141 VanDerWaalsContact CD1-CD1 3.41Å; F138-I141 HydrophobicContact CD1-CG1 3.95Å; F138-I141 HydrophobicContact CE1-CD1 4.27Å; F138-I141 HydrophobicContact CG-CD1 3.83Å; F138-I141 HydrophobicContact CG-CG1 4.24Å; F138-I141 WeakPolarHBondContact O-CG1 3.23Å; F138-I141 PolarHBondContact O-N 3.4Å; F138-R142 WeakPolarHBondContact O-CG 3.35Å; F138-R142 PolarHBondContact O-N 3.39Å
139N78.3Confident86.2Confident106 Ų10673.1 Ų73.157%0.56736%0.36SS*.THydrogen-bonded Turntrans-62.4-33.6177.6-166.742.6000112.4I136 I141 R142I136-N139 PolarHBondContact O-N 3.03Å; N139-I141 VanDerWaalsContact C-N 3.34Å; N139-I141 PolarHBondContact O-N 2.83Å; N139-R142 PolarHBondContact O-N 3.47Å
140H82.3Confident86.6Confident134 Ų13472.7 Ų72.762%0.6236%0.363SS*.THydrogen-bonded Turntrans-69.3-26.9-179.968.4-80.4000113.8R137 F138 T143R137-H140 PolarHBondContact O-CE1 3.45Å; R137-H140 PolarHBondContact O-ND1 2.93Å; F138-H140 PolarHBondContact O-N 3.19Å; H140-T143 WeakPolarHBondContact O-CG2 3.44Å
141I84.8Confident87Confident53 Ų5371.2 Ų71.227%0.27236%0.356SS..THydrogen-bonded Turntrans-86.6-17.6176.161.1166.4000113.1L130 F138 N139 T143 I146L130-I141 HydrophobicContact CD1-CD1 3.85Å; F138-I141 HydrophobicContact CB-CD1 3.77Å; F138-I141 HydrophobicContact CB-CG1 3.71Å; F138-I141 HydrophobicContact CD1-CD1 3.41Å; F138-I141 VanDerWaalsContact CD1-CD1 3.41Å; F138-I141 HydrophobicContact CD1-CG1 3.95Å; F138-I141 HydrophobicContact CE1-CD1 4.27Å; F138-I141 HydrophobicContact CG-CD1 3.83Å; F138-I141 HydrophobicContact CG-CG1 4.24Å; F138-I141 WeakPolarHBondContact O-CG1 3.23Å; F138-I141 PolarHBondContact O-N 3.4Å; N139-I141 VanDerWaalsContact C-N 3.34Å; N139-I141 PolarHBondContact O-N 2.83Å; I141-T143 PolarHBondContact O-N 2.92Å; I141-I146 HydrophobicContact CB-CD1 4.11Å; I141-I146 HydrophobicContact CG2-CD1 4.49Å; I141-I146 WeakPolarHBondContact O-CB 3.46Å; I141-I146 WeakPolarHBondContact O-CD1 3.27Å; I141-I146 WeakPolarHBondContact O-CG2 3.42Å
142R88.3Confident87.6Confident58 Ų5872.4 Ų72.422%0.21937%0.369CS..  trans-86.452.2-176.9-66.6-179.471-108.1-23.3111.6V64 D127 F138 N139V64-R142 WeakPolarHBondContact CG2-O 3.47Å; D127-R142 PolarHBondContact O-NE 3.47Å; D127-R142 IonicContact OD1-CZ 2.75Å; D127-R142 VanDerWaalsContact OD1-CZ 3.25Å; D127-R142 IonicContact OD1-NE 3.04Å; D127-R142 PolarHBondContact OD1-NE 2.95Å; D127-R142 IonicContact OD1-NH2 3.57Å; D127-R142 PolarHBondContact OD1-NH2 3.12Å; D127-R142 IonicContact OD2-NH2 3Å; F138-R142 WeakPolarHBondContact O-CG 3.35Å; F138-R142 PolarHBondContact O-N 3.39Å; N139-R142 PolarHBondContact O-N 3.47Å
143T89.8Confident88.3Confident48 Ų4876.4 Ų76.429%0.29439%0.389SS..  trans-99152.7179.864.80000111.4H140 I141 Y145 I146 A147H140-T143 WeakPolarHBondContact O-CG2 3.44Å; I141-T143 PolarHBondContact O-N 2.92Å; T143-Y145 PolarHBondContact O-N 3.42Å; T143-I146 PolarHBondContact O-N 3.3Å; T143-I146 WeakPolarHBondContact OG1-CG1 3.47Å; T143-I146 PolarHBondContact OG1-N 2.93Å; T143-A147 PolarHBondContact O-N 3.35Å
144P89.6Confident89Confident62 Ų6276 Ų7640%0.40339%0.387SS..Hα-helixtrans-52.6-38.3171.9-30.638.5000113.3I67 A147 V148I67-P144 HydrophobicContact CD1-CB 3.72Å; I67-P144 WeakPolarHBondContact CD1-O 3.27Å; P144-A147 PolarHBondContact O-N 3.18Å; P144-V148 WeakPolarHBondContact O-CG2 3.16Å; P144-V148 PolarHBondContact O-N 3.45Å
145Y91.7Very high89.6Confident163 Ų16376 Ų7664%0.63938%0.384SS*.Hα-helixtrans-62-50.8178.8178.3-103.8000112T143 A147 V148 L149T143-Y145 PolarHBondContact O-N 3.42Å; Y145-A147 VanDerWaalsContact C-N 3.27Å; Y145-A147 PolarHBondContact O-N 2.97Å; Y145-V148 PolarHBondContact O-N 3.07Å; Y145-V148 VanDerWaalsContact O-N 3.15Å; Y145-L149 HydrophobicContact CD1-CD1 4.01Å; Y145-L149 HydrophobicContact CE1-CD1 3.44Å; Y145-L149 VanDerWaalsContact CE1-CD1 3.44Å; Y145-L149 HydrophobicContact CE1-CG 4.16Å; Y145-L149 PolarHBondContact O-N 3Å
146I93.8Very high90.5Very high60 Ų6076.1 Ų76.131%0.30838%0.383SS..Hα-helixtrans-62.9-37.5177.7-69.8168.4000110.8I141 T143 V148 L149 V150I141-I146 HydrophobicContact CB-CD1 4.11Å; I141-I146 HydrophobicContact CG2-CD1 4.49Å; I141-I146 WeakPolarHBondContact O-CB 3.46Å; I141-I146 WeakPolarHBondContact O-CD1 3.27Å; I141-I146 WeakPolarHBondContact O-CG2 3.42Å; T143-I146 PolarHBondContact O-N 3.3Å; T143-I146 WeakPolarHBondContact OG1-CG1 3.47Å; T143-I146 PolarHBondContact OG1-N 2.93Å; I146-V148 VanDerWaalsContact C-N 3.34Å; I146-V148 PolarHBondContact O-N 3Å; I146-L149 PolarHBondContact O-N 3.18Å; I146-V150 HydrophobicContact CG2-CG2 4.26Å; I146-V150 WeakPolarHBondContact O-CG2 3.22Å; I146-V150 PolarHBondContact O-N 3.19Å
147A93.5Very high91.4Very high4 Ų472.7 Ų72.73%0.03337%0.366CS..Hα-helixtrans-61-41.1175.400000112.5V64 I67 T143 P144 Y145 V150 I151V64-A147 HydrophobicContact CB-CB 4.39Å; V64-A147 HydrophobicContact CG1-CB 3.91Å; V64-A147 HydrophobicContact CG2-CB 4.13Å; I67-A147 HydrophobicContact CB-CB 4.41Å; I67-A147 HydrophobicContact CD1-CB 3.9Å; I67-A147 HydrophobicContact CG2-CB 4.27Å; T143-A147 PolarHBondContact O-N 3.35Å; P144-A147 PolarHBondContact O-N 3.18Å; Y145-A147 VanDerWaalsContact C-N 3.27Å; Y145-A147 PolarHBondContact O-N 2.97Å; A147-V150 PolarHBondContact O-N 2.83Å; A147-I151 WeakPolarHBondContact O-CG1 3.27Å; A147-I151 PolarHBondContact O-N 3.23Å
148V94.1Very high92.2Very high83 Ų8363.9 Ų63.950%0.50333%0.333SS..Hα-helixtrans-63.8-41174.1172.30000111.4I67 P144 Y145 I146 I151 G152I67-V148 HydrophobicContact CD1-CG2 4.25Å; I67-V148 HydrophobicContact CG2-CG2 4.28Å; P144-V148 WeakPolarHBondContact O-CG2 3.16Å; P144-V148 PolarHBondContact O-N 3.45Å; Y145-V148 PolarHBondContact O-N 3.07Å; Y145-V148 VanDerWaalsContact O-N 3.15Å; I146-V148 VanDerWaalsContact C-N 3.34Å; I146-V148 PolarHBondContact O-N 3Å; V148-I151 PolarHBondContact O-N 2.98Å; V148-G152 PolarHBondContact O-N 2.96Å
149L95.9Very high92.8Very high92 Ų9265 Ų6548%0.48234%0.34SS..Hα-helixtrans-62.7-43.7175.1-67.1-179.8000112.3Y145 I146 I151 G152 L153Y145-L149 HydrophobicContact CD1-CD1 4.01Å; Y145-L149 HydrophobicContact CE1-CD1 3.44Å; Y145-L149 VanDerWaalsContact CE1-CD1 3.44Å; Y145-L149 HydrophobicContact CE1-CG 4.16Å; Y145-L149 PolarHBondContact O-N 3Å; I146-L149 PolarHBondContact O-N 3.18Å; L149-I151 VanDerWaalsContact C-N 3.32Å; L149-I151 PolarHBondContact O-N 3.48Å; L149-G152 PolarHBondContact O-N 2.9Å; L149-L153 PolarHBondContact O-N 3.49Å
150V96.8Very high93.6Very high51 Ų5166.2 Ų66.231%0.30934%0.341SS..Hα-helixtrans-60.6-43.1176.1169.90000110.6F68 A123 I146 A147 L153 V154F68-V150 HydrophobicContact CE1-CG1 4.35Å; A123-V150 HydrophobicContact CB-CG1 3.91Å; I146-V150 HydrophobicContact CG2-CG2 4.26Å; I146-V150 WeakPolarHBondContact O-CG2 3.22Å; I146-V150 PolarHBondContact O-N 3.19Å; A147-V150 PolarHBondContact O-N 2.83Å; V150-L153 PolarHBondContact O-N 3.32Å; V150-V154 WeakPolarHBondContact O-CG2 3.45Å; V150-V154 PolarHBondContact O-N 2.91Å
151I97.1Very high94.2Very high9 Ų960.7 Ų60.75%0.04632%0.316CS..Hα-helixtrans-60.5-47.2174-72-62.2000111.1I67 F68 N71 I120 A147 V148 L149 L153 V154 W155I67-I151 HydrophobicContact CG2-CG1 4.24Å; F68-I151 HydrophobicContact CD1-CD1 3.73Å; F68-I151 HydrophobicContact CD1-CG1 4.33Å; F68-I151 HydrophobicContact CE1-CD1 3.98Å; F68-I151 HydrophobicContact CE1-CG1 4.34Å; N71-I151 HydrophobicContact CB-CD1 3.93Å; N71-I151 HydrophobicContact CB-CG1 4.45Å; N71-I151 HydrophobicContact CB-CG2 4.39Å; N71-I151 VanDerWaalsContact OD1-CG2 3.32Å; N71-I151 WeakPolarHBondContact OD1-CG2 3.49Å; I120-I151 HydrophobicContact CD1-CD1 4.06Å; I120-I151 HydrophobicContact CG1-CD1 3.78Å; A147-I151 WeakPolarHBondContact O-CG1 3.27Å; A147-I151 PolarHBondContact O-N 3.23Å; V148-I151 PolarHBondContact O-N 2.98Å; L149-I151 VanDerWaalsContact C-N 3.32Å; L149-I151 PolarHBondContact O-N 3.48Å; I151-L153 VanDerWaalsContact C-N 3.28Å; I151-L153 PolarHBondContact O-N 3.49Å; I151-V154 WeakPolarHBondContact O-CB 3.47Å; I151-V154 PolarHBondContact O-N 2.95Å; I151-V154 VanDerWaalsContact O-N 3.08Å; I151-W155 PolarHBondContact O-N 3.04Å
152G97Very high94.6Very high34 Ų3458.3 Ų58.335%0.35130%0.304SS..Hα-helixtrans-56.8-43176.800000112.3V148 L149 W155 V156V148-G152 PolarHBondContact O-N 2.96Å; L149-G152 PolarHBondContact O-N 2.9Å; G152-W155 PolarHBondContact O-N 3.32Å; G152-V156 WeakPolarHBondContact O-CG2 3.49Å; G152-V156 PolarHBondContact O-N 3.07Å; G152-V156 VanDerWaalsContact O-N 3.07Å
153L97.4Very high94.9Very high100 Ų10059.2 Ų59.252%0.52431%0.312SS..Hα-helixtrans-62.7-42.3174.4179.762.2000112L149 V150 I151 W155 V156 L157L149-L153 PolarHBondContact O-N 3.49Å; V150-L153 PolarHBondContact O-N 3.32Å; I151-L153 VanDerWaalsContact C-N 3.28Å; I151-L153 PolarHBondContact O-N 3.49Å; L153-W155 VanDerWaalsContact C-N 3.33Å; L153-W155 PolarHBondContact O-N 3.22Å; L153-V156 PolarHBondContact O-N 2.84Å; L153-L157 HydrophobicContact CD1-CD1 4.1Å; L153-L157 HydrophobicContact CD1-CG 4.03Å; L153-L157 HydrophobicContact CD2-CD1 4.45Å; L153-L157 HydrophobicContact CG-CD1 3.87Å; L153-L157 HydrophobicContact CG-CG 4.24Å; L153-L157 WeakPolarHBondContact O-CB 3.45Å; L153-L157 VanDerWaalsContact O-CG 3.29Å; L153-L157 WeakPolarHBondContact O-CG 3.26Å; L153-L157 PolarHBondContact O-N 2.95Å
154V97.6Very high94.9Very high11 Ų1158.6 Ų58.67%0.06731%0.309CS..Hα-helixtrans-58.5-44.5176.7163.30000111.5V116 Y119 I120 V150 I151 L157 S158V116-V154 HydrophobicContact CG1-CG1 4.04Å; Y119-V154 HydrophobicContact CD2-CG1 4.31Å; Y119-V154 HydrophobicContact CG-CG1 4.45Å; I120-V154 HydrophobicContact CG1-CG1 4.18Å; V150-V154 WeakPolarHBondContact O-CG2 3.45Å; V150-V154 PolarHBondContact O-N 2.91Å; I151-V154 WeakPolarHBondContact O-CB 3.47Å; I151-V154 PolarHBondContact O-N 2.95Å; I151-V154 VanDerWaalsContact O-N 3.08Å; V154-L157 PolarHBondContact O-N 3.01Å; V154-S158 WeakPolarHBondContact O-CB 3.34Å; V154-S158 PolarHBondContact O-N 2.99Å; V154-S158 PolarHBondContact O-OG 2.8Å
155W96.9Very high95Very high61 Ų6155.9 Ų55.923%0.23129%0.292CS..Hα-helixtrans-63.8-40.9176.5-80.3102.7000112.8V75 L78 N112 V116 I151 G152 L153 S158 M159V75-W155 HydrophobicContact CG2-CH2 3.88Å; V75-W155 HydrophobicContact CG2-CZ2 3.51Å; L78-W155 HydrophobicContact CD1-CH2 3.66Å; L78-W155 HydrophobicContact CD1-CZ2 4.48Å; N112-W155 WeakPolarHBondContact ND2-CZ3 3.09Å; V116-W155 HydrophobicContact CG1-CD2 4.42Å; V116-W155 HydrophobicContact CG1-CZ2 4.23Å; V116-W155 HydrophobicContact CG2-CD2 4.25Å; V116-W155 HydrophobicContact CG2-CE3 3.99Å; V116-W155 HydrophobicContact CG2-CZ3 4.2Å; I151-W155 PolarHBondContact O-N 3.04Å; G152-W155 PolarHBondContact O-N 3.32Å; L153-W155 VanDerWaalsContact C-N 3.33Å; L153-W155 PolarHBondContact O-N 3.22Å; W155-S158 PolarHBondContact O-OG 3.1Å; W155-M159 HydrophobicContact CE3-CE 4.23Å; W155-M159 HydrophobicContact CZ3-CE 4.34Å; W155-M159 VanDerWaalsContact O-CG 3.25Å; W155-M159 WeakPolarHBondContact O-CG 3.43Å; W155-M159 PolarHBondContact O-N 3.13Å; W155-M159 VanDerWaalsContact O-N 3.1Å
156V97Very high95Very high75 Ų7553.8 Ų53.846%0.45528%0.282SS..Hα-helixtrans-64.7-48.4177.2169.30000110.2G152 L153 S158 M159 F160G152-V156 WeakPolarHBondContact O-CG2 3.49Å; G152-V156 PolarHBondContact O-N 3.07Å; G152-V156 VanDerWaalsContact O-N 3.07Å; L153-V156 PolarHBondContact O-N 2.84Å; V156-S158 VanDerWaalsContact C-N 3.33Å; V156-S158 PolarHBondContact O-N 3.28Å; V156-M159 PolarHBondContact O-N 2.91Å; V156-F160 HydrophobicContact CG1-CD2 3.8Å; V156-F160 HydrophobicContact CG1-CE2 3.38Å; V156-F160 HydrophobicContact CG1-CZ 4.48Å; V156-F160 WeakPolarHBondContact O-CD2 3.36Å; V156-F160 PolarHBondContact O-N 3.36Å; V156-F160 VanDerWaalsContact O-N 3.13Å
157L96.1Very high94.9Very high81 Ų8157 Ų5742%0.42430%0.298SS..Hα-helixtrans-61.1-41.1177.9-70.5174.3000112Y119 L153 V154 M159 F160 T161Y119-L157 HydrophobicContact CD2-CB 4.46Å; Y119-L157 HydrophobicContact CE2-CB 4.17Å; L153-L157 HydrophobicContact CD1-CD1 4.1Å; L153-L157 HydrophobicContact CD1-CG 4.03Å; L153-L157 HydrophobicContact CD2-CD1 4.45Å; L153-L157 HydrophobicContact CG-CD1 3.87Å; L153-L157 HydrophobicContact CG-CG 4.24Å; L153-L157 WeakPolarHBondContact O-CB 3.45Å; L153-L157 VanDerWaalsContact O-CG 3.29Å; L153-L157 WeakPolarHBondContact O-CG 3.26Å; L153-L157 PolarHBondContact O-N 2.95Å; V154-L157 PolarHBondContact O-N 3.01Å; L157-M159 PolarHBondContact O-N 3.15Å; L157-F160 WeakPolarHBondContact O-CB 3.35Å; L157-F160 PolarHBondContact O-N 3.45Å; L157-T161 PolarHBondContact O-N 2.68Å; L157-T161 PolarHBondContact O-OG1 3.47Å; L157-T161 VanDerWaalsContact O-OG1 3.06Å
158S96.4Very high94.7Very high0 Ų060.8 Ų60.80%031%0.312CS..Hα-helixtrans-64.9-40.6178.9730000112.2N112 V116 V154 W155 V156 F160 T161 I162N112-S158 VanDerWaalsContact OD1-CB 3.26Å; N112-S158 WeakPolarHBondContact OD1-CB 3.33Å; N112-S158 PolarHBondContact OD1-OG 3.28Å; V116-S158 WeakPolarHBondContact CG2-OG 3.45Å; V154-S158 WeakPolarHBondContact O-CB 3.34Å; V154-S158 PolarHBondContact O-N 2.99Å; V154-S158 PolarHBondContact O-OG 2.8Å; W155-S158 PolarHBondContact O-OG 3.1Å; V156-S158 VanDerWaalsContact C-N 3.33Å; V156-S158 PolarHBondContact O-N 3.28Å; S158-F160 VanDerWaalsContact C-N 3.3Å; S158-F160 PolarHBondContact O-N 3.43Å; S158-T161 WeakPolarHBondContact O-CB 3.36Å; S158-T161 PolarHBondContact O-N 2.01Å; S158-T161 VanDerWaalsContact O-N 3.12Å; S158-I162 WeakPolarHBondContact O-CG1 3.02Å; S158-I162 PolarHBondContact O-N 3.26Å
159M95.1Very high94.6Very high80 Ų8057.4 Ų57.439%0.39429%0.291SS..Hα-helixtrans-62.6-38.7176-71-64.8170.600111.6W155 V156 L157 I162 I163W155-M159 HydrophobicContact CE3-CE 4.23Å; W155-M159 HydrophobicContact CZ3-CE 4.34Å; W155-M159 VanDerWaalsContact O-CG 3.25Å; W155-M159 WeakPolarHBondContact O-CG 3.43Å; W155-M159 PolarHBondContact O-N 3.13Å; W155-M159 VanDerWaalsContact O-N 3.1Å; V156-M159 PolarHBondContact O-N 2.91Å; L157-M159 PolarHBondContact O-N 3.15Å; M159-I162 PolarHBondContact O-N 3.44Å; M159-I162 HydrophobicContact SD-CD1 4.37Å; M159-I163 PolarHBondContact O-N 2.91Å
160F95.4Very high94.3Very high132 Ų13253.5 Ų53.558%0.57927%0.273SS*.Hα-helixtrans-63.6-42.3172-75-62.8000112.2V156 L157 S158 I162 I163V156-F160 HydrophobicContact CG1-CD2 3.8Å; V156-F160 HydrophobicContact CG1-CE2 3.38Å; V156-F160 HydrophobicContact CG1-CZ 4.48Å; V156-F160 WeakPolarHBondContact O-CD2 3.36Å; V156-F160 PolarHBondContact O-N 3.36Å; V156-F160 VanDerWaalsContact O-N 3.13Å; L157-F160 WeakPolarHBondContact O-CB 3.35Å; L157-F160 PolarHBondContact O-N 3.45Å; S158-F160 VanDerWaalsContact C-N 3.3Å; S158-F160 PolarHBondContact O-N 3.43Å; F160-I162 VanDerWaalsContact C-N 3.27Å; F160-I162 PolarHBondContact O-N 2.99Å; F160-I163 HydrophobicContact CD1-CD1 3.84Å; F160-I163 WeakPolarHBondContact O-CG1 3.37Å; F160-I163 PolarHBondContact O-N 3.48Å
161T93.6Very high94Very high17 Ų1753.9 Ų53.910%0.10427%0.273CS..Hα-helixtrans-63-32.5179.4-60.50000112.8I115 Y119 L157 S158 Y198 L202I115-T161 HydrophobicContact CD1-CG2 3.92Å; I115-T161 HydrophobicContact CG1-CG2 4.09Å; I115-T161 HydrophobicContact CG2-CG2 4.26Å; Y119-T161 PolarHBondContact OH-OG1 2.75Å; L157-T161 PolarHBondContact O-N 2.68Å; L157-T161 PolarHBondContact O-OG1 3.47Å; L157-T161 VanDerWaalsContact O-OG1 3.06Å; S158-T161 WeakPolarHBondContact O-CB 3.36Å; S158-T161 PolarHBondContact O-N 2.01Å; S158-T161 VanDerWaalsContact O-N 3.12Å; T161-Y198 VanDerWaalsContact CA-OH 3.22Å; T161-Y198 WeakPolarHBondContact CA-OH 3.36Å; T161-Y198 HydrophobicContact CG2-CE1 4.11Å; T161-Y198 WeakPolarHBondContact CG2-OH 3.45Å; T161-Y198 WeakPolarHBondContact O-CE1 3.35Å; T161-Y198 PolarHBondContact O-OH 2.92Å; T161-L202 HydrophobicContact CG2-CB 4.45Å; T161-L202 HydrophobicContact CG2-CD1 3.83Å
162I94Very high93.5Very high4 Ų456.8 Ų56.82%0.02129%0.287CS..THydrogen-bonded Turntrans-96.311.1-177.568.4142.7000114.3A108 N112 I115 S158 M159 F160 P164 V165 W166A108-I162 HydrophobicContact CB-CD1 4.04Å; N112-I162 HydrophobicContact CB-CD1 3.71Å; N112-I162 HydrophobicContact CB-CG1 4.38Å; I115-I162 HydrophobicContact CG1-CG2 4.12Å; S158-I162 WeakPolarHBondContact O-CG1 3.02Å; S158-I162 PolarHBondContact O-N 3.26Å; M159-I162 PolarHBondContact O-N 3.44Å; M159-I162 HydrophobicContact SD-CD1 4.37Å; F160-I162 VanDerWaalsContact C-N 3.27Å; F160-I162 PolarHBondContact O-N 2.99Å; I162-P164 VanDerWaalsContact C-CD 3.43Å; I162-P164 VanDerWaalsContact C-N 3.3Å; I162-V165 HydrophobicContact CB-CB 4.42Å; I162-V165 HydrophobicContact CB-CG2 4.34Å; I162-V165 WeakPolarHBondContact O-CB 3Å; I162-V165 PolarHBondContact O-N 3.33Å; I162-W166 PolarHBondContact O-N 2.97Å
163I93.6Very high93Very high76 Ų7660 Ų6039%0.3930%0.302SS..Hα-helixtrans-49.4-45.2174.3-73.1171.7000112.5M159 F160 V165 W166 M167M159-I163 PolarHBondContact O-N 2.91Å; F160-I163 HydrophobicContact CD1-CD1 3.84Å; F160-I163 WeakPolarHBondContact O-CG1 3.37Å; F160-I163 PolarHBondContact O-N 3.48Å; I163-V165 PolarHBondContact O-N 3.18Å; I163-W166 WeakPolarHBondContact O-CB 3.35Å; I163-W166 PolarHBondContact O-N 2.87Å; I163-W166 VanDerWaalsContact O-N 3.12Å; I163-M167 HydrophobicContact CG2-CG 4.25Å; I163-M167 HydrophobicContact CG2-SD 3.78Å; I163-M167 WeakPolarHBondContact O-CG 3.14Å; I163-M167 PolarHBondContact O-N 2.9Å
164P90.9Very high92.3Very high36 Ų3657 Ų5723%0.23429%0.286CS..Hα-helixtrans-60.3-33.3178.5-24.435.1000113.1I162 M167 Y168 F195I162-P164 VanDerWaalsContact C-CD 3.43Å; I162-P164 VanDerWaalsContact C-N 3.3Å; P164-M167 PolarHBondContact O-N 3.38Å; P164-Y168 HydrophobicContact CB-CD2 4.16Å; P164-Y168 HydrophobicContact CB-CE2 4.41Å; P164-Y168 WeakPolarHBondContact O-CB 3.28Å; P164-Y168 WeakPolarHBondContact O-CD2 3.35Å; P164-Y168 PolarHBondContact O-N 2.96Å; P164-F195 HydrophobicContact CB-CD2 4.36Å; P164-F195 HydrophobicContact CB-CE2 4.13Å
165V91.5Very high91.3Very high5 Ų561.8 Ų61.83%0.0332%0.318CS..Hα-helixtrans-65.1-45.3176.5-178.30000110.2T107 A108 I162 I163 M167 T169 F195T107-V165 HydrophobicContact CG2-CG1 3.79Å; A108-V165 HydrophobicContact CB-CG1 4.41Å; I162-V165 HydrophobicContact CB-CB 4.42Å; I162-V165 HydrophobicContact CB-CG2 4.34Å; I162-V165 WeakPolarHBondContact O-CB 3Å; I162-V165 PolarHBondContact O-N 3.33Å; I163-V165 PolarHBondContact O-N 3.18Å; V165-M167 VanDerWaalsContact C-N 3.26Å; V165-M167 PolarHBondContact O-N 2.68Å; V165-T169 VanDerWaalsContact O-CB 3.29Å; V165-T169 WeakPolarHBondContact O-CB 3.41Å; V165-T169 PolarHBondContact O-N 2.86Å; V165-T169 PolarHBondContact O-OG1 2.99Å; V165-F195 HydrophobicContact CG2-CE2 4.25Å; V165-F195 HydrophobicContact CG2-CZ 4.04Å
166W92.3Very high90.5Very high118 Ų11865 Ų6545%0.44734%0.34SS..Hα-helixtrans-60.7-35.3175.7-74.9105.8000113.3T104 V105 A108 I162 I163T104-W166 HydrophobicContact CG2-CE3 3.65Å; T104-W166 HydrophobicContact CG2-CZ3 4.03Å; V105-W166 HydrophobicContact CG2-CH2 4.45Å; V105-W166 HydrophobicContact CG2-CZ3 4.4Å; A108-W166 HydrophobicContact CB-CD2 3.91Å; A108-W166 HydrophobicContact CB-CE3 4.26Å; A108-W166 HydrophobicContact CB-CH2 3.88Å; A108-W166 HydrophobicContact CB-CZ2 3.5Å; A108-W166 HydrophobicContact CB-CZ3 4.25Å; I162-W166 PolarHBondContact O-N 2.97Å; I163-W166 WeakPolarHBondContact O-CB 3.35Å; I163-W166 PolarHBondContact O-N 2.87Å; I163-W166 VanDerWaalsContact O-N 3.12Å
167M90.9Very high89.8Confident127 Ų12764.9 Ų64.963%0.62635%0.353SS*.Hα-helixtrans-79.6-39.1-177.3-69.8-17864.200113.2I163 P164 V165I163-M167 HydrophobicContact CG2-CG 4.25Å; I163-M167 HydrophobicContact CG2-SD 3.78Å; I163-M167 WeakPolarHBondContact O-CG 3.14Å; I163-M167 PolarHBondContact O-N 2.9Å; P164-M167 PolarHBondContact O-N 3.38Å; V165-M167 VanDerWaalsContact C-N 3.26Å; V165-M167 PolarHBondContact O-N 2.68Å
168Y89.8Confident89.4Confident85 Ų8564.4 Ų64.433%0.33335%0.35SS..Hα-helixtrans-107-8.6-168-62.6-63.9000114.1P164 L184 L185 P186P164-Y168 HydrophobicContact CB-CD2 4.16Å; P164-Y168 HydrophobicContact CB-CE2 4.41Å; P164-Y168 WeakPolarHBondContact O-CB 3.28Å; P164-Y168 WeakPolarHBondContact O-CD2 3.35Å; P164-Y168 PolarHBondContact O-N 2.96Å; Y168-L184 WeakPolarHBondContact O-CA 3.4Å; Y168-L184 WeakPolarHBondContact O-CB 3.27Å; Y168-L184 PolarHBondContact O-N 2.96Å; Y168-L185 HydrophobicContact CD2-CD1 4.37Å; Y168-L185 HydrophobicContact CG-CD1 4.14Å; Y168-P186 HydrophobicContact CD1-CG 4.41Å; Y168-P186 HydrophobicContact CE1-CG 3.83Å
169T90.8Very high89Confident11 Ų1166.7 Ų66.77%0.06737%0.365CS..EExtended strand (participates in β ladder)trans-73.9130.4174.8-640000111.5C103 T104 T107 V165 L183C103-T169 VanDerWaalsContact SG-CG2 3.51Å; T104-T169 PolarHBondContact OG1-O 3.39Å; T107-T169 HydrophobicContact CG2-CG2 4.2Å; V165-T169 VanDerWaalsContact O-CB 3.29Å; V165-T169 WeakPolarHBondContact O-CB 3.41Å; V165-T169 PolarHBondContact O-N 2.86Å; V165-T169 PolarHBondContact O-OG1 2.99Å; T169-L183 WeakPolarHBondContact OG1-CD1 3.41Å
170G90.4Very high88.7Confident10 Ų1063 Ų6310%0.10335%0.347CS..EExtended strand (participates in β ladder)trans-163.2-165.9177.700000114C103 A182C103-G170 PolarHBondContact SG-O 2.97Å; G170-A182 PolarHBondContact N-O 3.22Å; G170-A182 PolarHBondContact O-N 3.39Å; G170-A182 VanDerWaalsContact O-N 3.07Å; G170-A182 VanDerWaalsContact O-O 3.08Å
171L90.7Very high88.4Confident59 Ų5956.8 Ų56.831%0.30932%0.32SS..EExtended strand (participates in β ladder)trans-94120-179.5-59.6179.9000110.2W96 A100 C103 V179 A180W96-L171 VanDerWaalsContact CD1-CD2 3.45Å; W96-L171 HydrophobicContact CG-CD2 4.27Å; A100-L171 HydrophobicContact CB-CD1 3.97Å; A100-L171 HydrophobicContact CB-CG 3.98Å; C103-L171 HydrophobicContact CB-CD2 4.15Å; L171-V179 HydrophobicContact CB-CB 4.35Å; L171-V179 HydrophobicContact CD1-CG2 4.41Å; L171-V179 HydrophobicContact CD2-CG2 4.39Å; L171-A180 CarbonylContact C-O 3.57Å; L171-A180 WeakPolarHBondContact CA-O 3.29Å
172M86.8Confident88Confident70 Ų7056.1 Ų56.135%0.34532%0.316SS..EExtended strand (participates in β ladder)trans-93.9127.9173.1-176.9171.6178.600109.7V6 V179 A180 A182 L184V6-M172 HydrophobicContact CG1-SD 3.61Å; M172-V179 CarbonylContact O-C 3.52Å; M172-V179 VanDerWaalsContact O-CA 3.31Å; M172-V179 WeakPolarHBondContact O-CA 3.42Å; M172-A180 PolarHBondContact N-O 2.75Å; M172-A180 PolarHBondContact O-N 3.03Å; M172-A182 HydrophobicContact CB-CB 4.06Å; M172-A182 HydrophobicContact SD-CB 4.45Å; M172-L184 HydrophobicContact CB-CD2 3.99Å; M172-L184 HydrophobicContact CG-CD2 4.43Å
173P86.4Confident87.6Confident103 Ų10356.6 Ų56.667%0.66932%0.318SS*.EExtended strand (participates in β ladder)trans-70.3140176.428.1-32.9000111.8
174L81.9Confident87.2Confident36 Ų3656.5 Ų56.519%0.18832%0.318CS..PPolyproline II helixtrans-102.7160.4172.7-111.865.8000110.9T95 D176 G177 L178 A180T95-L174 HydrophobicContact CG2-CD2 4.49Å; L174-D176 VanDerWaalsContact C-N 3.27Å; L174-D176 PolarHBondContact O-N 3.25Å; L174-G177 PolarHBondContact O-N 3.46Å; L174-L178 HydrophobicContact CB-CB 4.2Å; L174-L178 WeakPolarHBondContact CB-O 3.48Å; L174-L178 PolarHBondContact N-O 2.98Å; L174-A180 HydrophobicContact CD1-CB 3.75Å
175P77.3Confident86.8Confident111 Ų11155.7 Ų55.772%0.72131%0.312SS*.THydrogen-bonded Turntrans-56.6-33.7-176.9-26.135.3000114.9G177P175-G177 PolarHBondContact O-N 2.98Å
176D80.3Confident86.2Confident130 Ų13059.8 Ų59.870%0.69534%0.339SS*.THydrogen-bonded Turntrans-8514.3-176.7-59.2-37.1000114.1L174 L178L174-D176 VanDerWaalsContact C-N 3.27Å; L174-D176 PolarHBondContact O-N 3.25Å; D176-L178 HydrophobicContact CB-CD1 4.23Å; D176-L178 HydrophobicContact CB-CG 4.37Å; D176-L178 PolarHBondContact O-N 3.33Å
177G80.9Confident85.7Confident71 Ų7159.1 Ų59.173%0.73234%0.344SS*.SBendtrans75.95.3-174.200000114.1L174 P175L174-G177 PolarHBondContact O-N 3.46Å; P175-G177 PolarHBondContact O-N 2.98Å
178L87.9Confident84.9Confident71 Ų7158.3 Ų58.337%0.37234%0.342SS..  trans-80.2171.2172.3-61.8170000110.5T95 L174 D176T95-L178 HydrophobicContact CG2-CB 4.04Å; T95-L178 HydrophobicContact CG2-CD1 3.58Å; T95-L178 HydrophobicContact CG2-CG 4.29Å; L174-L178 HydrophobicContact CB-CB 4.2Å; L174-L178 WeakPolarHBondContact CB-O 3.48Å; L174-L178 PolarHBondContact N-O 2.98Å; D176-L178 HydrophobicContact CB-CD1 4.23Å; D176-L178 HydrophobicContact CB-CG 4.37Å; D176-L178 PolarHBondContact O-N 3.33Å
179V89.1Confident84.3Confident49 Ų4960.5 Ų60.530%0.29736%0.363SS..EExtended strand (participates in β ladder)trans-129.2147.9177.3-62.50000110.8T95 W96 L171 M172T95-V179 CarbonylContact C-O 3.58Å; T95-V179 WeakPolarHBondContact CA-O 3.43Å; W96-V179 PolarHBondContact N-O 3.45Å; W96-V179 VanDerWaalsContact O-CG2 3.3Å; W96-V179 WeakPolarHBondContact O-CG2 3.18Å; L171-V179 HydrophobicContact CB-CB 4.35Å; L171-V179 HydrophobicContact CD1-CG2 4.41Å; L171-V179 HydrophobicContact CD2-CG2 4.39Å; M172-V179 CarbonylContact O-C 3.52Å; M172-V179 VanDerWaalsContact O-CA 3.31Å; M172-V179 WeakPolarHBondContact O-CA 3.42Å
180A87.3Confident84Confident3 Ų363.9 Ų63.93%0.02538%0.381CS..EExtended strand (participates in β ladder)trans-114.9152171.500000110.3G94 L171 M172 L174G94-A180 WeakPolarHBondContact O-CB 3.37Å; L171-A180 CarbonylContact C-O 3.57Å; L171-A180 WeakPolarHBondContact CA-O 3.29Å; M172-A180 PolarHBondContact N-O 2.75Å; M172-A180 PolarHBondContact O-N 3.03Å; L174-A180 HydrophobicContact CD1-CB 3.75Å
181C89.4Confident83.8Confident1 Ų165.4 Ų65.41%0.00739%0.387CS..EExtended strand (participates in β ladder)trans-85.5123.8169.6-179.70000109.6M1 Q89 W96 C103M1-C181 HydrophobicContact SD-CB 3.78Å; M1-C181 PolarHBondContact SD-SG 2.93Å; Q89-C181 PolarHBondContact NE2-O 3.5Å; W96-C181 HydrophobicContact CB-CB 4.18Å; W96-C181 HydrophobicContact CD2-CB 3.66Å; W96-C181 HydrophobicContact CE3-CB 3.84Å; W96-C181 HydrophobicContact CG-CB 3.83Å; W96-C181 HydrophobicContact CZ3-CB 4.49Å; C103-C181 WeakPolarHBondContact CA-SG 3.43Å; C103-C181 HydrophobicContact CB-CB 3.76Å; C103-C181 WeakPolarHBondContact CB-SG 3.26Å; C103-C181 WeakPolarHBondContact SG-CA 3.21Å; C103-C181 WeakPolarHBondContact SG-CB 3.25Å; C103-C181 CovalentContact SG-SG 2.01Å; C103-C181 PolarHBondContact SG-SG 3.33Å
182A85.8Confident83.5Confident3 Ų363.2 Ų63.23%0.02538%0.376CS..EExtended strand (participates in β ladder)trans-151.5166.5-174.900000112.3V6 G170 M172V6-A182 HydrophobicContact CG1-CB 4.41Å; V6-A182 HydrophobicContact CG2-CB 3.73Å; G170-A182 PolarHBondContact N-O 3.22Å; G170-A182 PolarHBondContact O-N 3.39Å; G170-A182 VanDerWaalsContact O-N 3.07Å; G170-A182 VanDerWaalsContact O-O 3.08Å; M172-A182 HydrophobicContact CB-CB 4.06Å; M172-A182 HydrophobicContact SD-CB 4.45Å
183L85.7Confident83.5Confident14 Ų1465 Ų657%0.07338%0.38CS..EExtended strand (participates in β ladder)trans-87.8116.5168.4-162.376.9000109.3F3 T169 L185 F195F3-L183 HydrophobicContact CE1-CB 4.4Å; F3-L183 WeakPolarHBondContact CE1-O 3.41Å; F3-L183 HydrophobicContact CE2-CB 3.81Å; F3-L183 HydrophobicContact CE2-CD2 3.59Å; F3-L183 HydrophobicContact CE2-CG 4.24Å; F3-L183 HydrophobicContact CZ-CB 3.67Å; F3-L183 HydrophobicContact CZ-CD2 3.85Å; F3-L183 HydrophobicContact CZ-CG 4.13Å; F3-L183 WeakPolarHBondContact CZ-O 3.36Å; T169-L183 WeakPolarHBondContact OG1-CD1 3.41Å; L183-L185 HydrophobicContact CB-CD1 4.48Å; L183-L185 HydrophobicContact CD1-CD1 4.47Å; L183-L185 HydrophobicContact CD2-CD1 3.36Å; L183-L185 HydrophobicContact CG-CD1 3.47Å; L183-L185 VanDerWaalsContact CG-CD1 3.47Å; L183-L185 PolarHBondContact O-N 3.19Å; L183-F195 HydrophobicContact CD2-CD1 3.76Å; L183-F195 HydrophobicContact CD2-CE1 3.2Å; L183-F195 HydrophobicContact CD2-CE2 4.12Å; L183-F195 HydrophobicContact CD2-CG 4.37Å; L183-F195 HydrophobicContact CD2-CZ 3.39Å
184L85.9Confident83.7Confident74 Ų7467.3 Ų67.339%0.38738%0.375SS..  trans-97.382.4-176-59.6172.9000109.7Y168 M172Y168-L184 WeakPolarHBondContact O-CA 3.4Å; Y168-L184 WeakPolarHBondContact O-CB 3.27Å; Y168-L184 PolarHBondContact O-N 2.96Å; M172-L184 HydrophobicContact CB-CD2 3.99Å; M172-L184 HydrophobicContact CG-CD2 4.43Å
185L82.4Confident84Confident18 Ų1867 Ų679%0.09437%0.372CS..  trans-79.3134.6175.1-9854.7000110.8F3 Y168 L183 D191 T192 F195F3-L185 HydrophobicContact CZ-CD1 4.23Å; F3-L185 HydrophobicContact CZ-CD2 4.17Å; Y168-L185 HydrophobicContact CD2-CD1 4.37Å; Y168-L185 HydrophobicContact CG-CD1 4.14Å; L183-L185 HydrophobicContact CB-CD1 4.48Å; L183-L185 HydrophobicContact CD1-CD1 4.47Å; L183-L185 HydrophobicContact CD2-CD1 3.36Å; L183-L185 HydrophobicContact CG-CD1 3.47Å; L183-L185 VanDerWaalsContact CG-CD1 3.47Å; L183-L185 PolarHBondContact O-N 3.19Å; L185-D191 HydrophobicContact CB-CB 3.93Å; L185-D191 HydrophobicContact CD2-CB 3.42Å; L185-D191 VanDerWaalsContact CD2-CB 3.42Å; L185-D191 WeakPolarHBondContact CD2-O 3.35Å; L185-D191 HydrophobicContact CG-CB 3.63Å; L185-T192 VanDerWaalsContact CD2-N 3.32Å; L185-F195 HydrophobicContact CD2-CB 4.15Å
186P78.8Confident84.6Confident92 Ų9262 Ų6260%0.59734%0.34SS*.SBendtrans-56.2-51.9178.8-24.532.8000112.9Y168 D191Y168-P186 HydrophobicContact CD1-CG 4.41Å; Y168-P186 HydrophobicContact CE1-CG 3.83Å; P186-D191 WeakPolarHBondContact CD-OD2 3.4Å
187D80.8Confident85.2Confident104 Ų10457.4 Ų57.456%0.55632%0.315SS*.SBendtrans-106.390.9175.6-74.8-44.4000110.1V189 N190 D191D187-V189 PolarHBondContact O-N 3.11Å; D187-N190 HydrophobicContact CB-CB 4.31Å; D187-N190 PolarHBondContact O-N 2.98Å; D187-D191 PolarHBondContact N-OD2 3.19Å; D187-D191 VanDerWaalsContact O-CB 3.27Å; D187-D191 WeakPolarHBondContact O-CB 3.24Å; D187-D191 PolarHBondContact O-N 3.4Å
188L75Confident85.7Confident110 Ų11057.9 Ų57.958%0.57630%0.295SS*.THydrogen-bonded Turntrans-52.1-34.8-171-172.466.7000114.1F3 T192F3-L188 HydrophobicContact CD1-CD1 4.24Å; F3-L188 HydrophobicContact CE1-CD1 3.74Å; L188-T192 WeakPolarHBondContact O-CB 3.48Å; L188-T192 PolarHBondContact O-OG1 2.84Å
189V76.4Confident85.9Confident130 Ų13056.1 Ų56.179%0.78829%0.285SS*.THydrogen-bonded Turntrans-81.9-55.4-179.2-179.20000111.3D187 Y193D187-V189 PolarHBondContact O-N 3.11Å; V189-Y193 WeakPolarHBondContact O-CB 3.48Å; V189-Y193 PolarHBondContact O-N 2.97Å
190N84.6Confident86.1Confident83 Ų8355.5 Ų55.544%0.44428%0.278SS..Hα-helixtrans-69.7-48.5-174.4179.571.5000111.5D187 T192 Y193 W194D187-N190 HydrophobicContact CB-CB 4.31Å; D187-N190 PolarHBondContact O-N 2.98Å; N190-T192 VanDerWaalsContact C-N 3.31Å; N190-T192 PolarHBondContact O-N 3.38Å; N190-Y193 WeakPolarHBondContact O-CB 3.44Å; N190-Y193 PolarHBondContact O-N 3.16Å; N190-W194 PolarHBondContact O-N 3.34Å; N190-W194 VanDerWaalsContact O-N 3.11Å; N190-W194 PolarHBondContact OD1-NE1 3.31Å
191D86.6Confident86.5Confident41 Ų4160 Ų6022%0.21930%0.298CS..Hα-helixtrans-68.9-34.4-176.2-63.2-20.3000110.8L185 P186 D187 Y193 W194 F195L185-D191 HydrophobicContact CB-CB 3.93Å; L185-D191 HydrophobicContact CD2-CB 3.42Å; L185-D191 VanDerWaalsContact CD2-CB 3.42Å; L185-D191 WeakPolarHBondContact CD2-O 3.35Å; L185-D191 HydrophobicContact CG-CB 3.63Å; P186-D191 WeakPolarHBondContact CD-OD2 3.4Å; D187-D191 PolarHBondContact N-OD2 3.19Å; D187-D191 VanDerWaalsContact O-CB 3.27Å; D187-D191 WeakPolarHBondContact O-CB 3.24Å; D187-D191 PolarHBondContact O-N 3.4Å; D191-Y193 VanDerWaalsContact C-N 3.32Å; D191-Y193 PolarHBondContact O-N 3.29Å; D191-W194 PolarHBondContact O-N 2.99Å; D191-F195 WeakPolarHBondContact O-CB 3.17Å; D191-F195 PolarHBondContact O-N 3.45Å
192T83.9Confident86.6Confident14 Ų1462.1 Ų62.19%0.08631%0.309CS..Hα-helixtrans-68.4-36.7178.4-610000110.7F3 L185 L188 N190 T196 L267F3-T192 HydrophobicContact CD2-CG2 4.4Å; F3-T192 HydrophobicContact CE2-CG2 4.37Å; L185-T192 VanDerWaalsContact CD2-N 3.32Å; L188-T192 WeakPolarHBondContact O-CB 3.48Å; L188-T192 PolarHBondContact O-OG1 2.84Å; N190-T192 VanDerWaalsContact C-N 3.31Å; N190-T192 PolarHBondContact O-N 3.38Å; T192-T196 WeakPolarHBondContact O-CB 3.2Å; T192-T196 PolarHBondContact O-N 3.45Å; T192-T196 PolarHBondContact O-OG1 3.12Å; T192-L267 HydrophobicContact CG2-CD2 4.38Å
193Y87.5Confident86.8Confident108 Ų10862 Ų6242%0.42431%0.308SS..Hα-helixtrans-59.7-54.5173.3175.4-92.1000111.2V189 N190 D191 F195 T196 L197 L267V189-Y193 WeakPolarHBondContact O-CB 3.48Å; V189-Y193 PolarHBondContact O-N 2.97Å; N190-Y193 WeakPolarHBondContact O-CB 3.44Å; N190-Y193 PolarHBondContact O-N 3.16Å; D191-Y193 VanDerWaalsContact C-N 3.32Å; D191-Y193 PolarHBondContact O-N 3.29Å; Y193-F195 PolarHBondContact O-N 2.9Å; Y193-T196 PolarHBondContact O-N 2.95Å; Y193-L197 HydrophobicContact CD1-CD1 4.03Å; Y193-L197 HydrophobicContact CE1-CD1 3.38Å; Y193-L197 HydrophobicContact CE1-CG 4.4Å; Y193-L197 HydrophobicContact CE2-CD1 4.17Å; Y193-L197 VanDerWaalsContact CZ-CD1 3.46Å; Y193-L197 WeakPolarHBondContact O-CG 3.41Å; Y193-L197 PolarHBondContact O-N 2.89Å; Y193-L267 HydrophobicContact CD2-CD1 3.84Å; Y193-L267 HydrophobicContact CE2-CD1 4.32Å
194W90.1Very high87.1Confident150 Ų15062.1 Ų62.157%0.56831%0.308SS*.Hα-helixtrans-65.7-40.8-179.2-68112.9000112.5N190 D191 L197 Y198N190-W194 PolarHBondContact O-N 3.34Å; N190-W194 VanDerWaalsContact O-N 3.11Å; N190-W194 PolarHBondContact OD1-NE1 3.31Å; D191-W194 PolarHBondContact O-N 2.99Å; W194-L197 PolarHBondContact O-N 3.13Å; W194-Y198 WeakPolarHBondContact O-CB 3.34Å; W194-Y198 PolarHBondContact O-N 2.81Å
195F89.1Confident87.5Confident29 Ų2959.4 Ų59.413%0.12730%0.296CS..Hα-helixtrans-64.4-41.9177.4179.5-107.6000112.1P164 V165 L183 L185 D191 Y193 Y198 Q199P164-F195 HydrophobicContact CB-CD2 4.36Å; P164-F195 HydrophobicContact CB-CE2 4.13Å; V165-F195 HydrophobicContact CG2-CE2 4.25Å; V165-F195 HydrophobicContact CG2-CZ 4.04Å; L183-F195 HydrophobicContact CD2-CD1 3.76Å; L183-F195 HydrophobicContact CD2-CE1 3.2Å; L183-F195 HydrophobicContact CD2-CE2 4.12Å; L183-F195 HydrophobicContact CD2-CG 4.37Å; L183-F195 HydrophobicContact CD2-CZ 3.39Å; L185-F195 HydrophobicContact CD2-CB 4.15Å; D191-F195 WeakPolarHBondContact O-CB 3.17Å; D191-F195 PolarHBondContact O-N 3.45Å; Y193-F195 PolarHBondContact O-N 2.9Å; F195-Y198 WeakPolarHBondContact O-CB 3.04Å; F195-Y198 PolarHBondContact O-N 3.41Å; F195-Q199 HydrophobicContact CE2-CG 4.42Å; F195-Q199 HydrophobicContact CZ-CG 4.34Å; F195-Q199 WeakPolarHBondContact O-CG 3.47Å; F195-Q199 PolarHBondContact O-N 3.08Å
196T89.3Confident88.1Confident7 Ų762.6 Ų62.64%0.04331%0.312CS..Hα-helixtrans-64.4-46.1176.3-64.30000111.3T192 Y193 Q199 F200 Q263 L264 L267T192-T196 WeakPolarHBondContact O-CB 3.2Å; T192-T196 PolarHBondContact O-N 3.45Å; T192-T196 PolarHBondContact O-OG1 3.12Å; Y193-T196 PolarHBondContact O-N 2.95Å; T196-Q199 PolarHBondContact O-N 3.48Å; T196-F200 VanDerWaalsContact O-CB 3.31Å; T196-F200 WeakPolarHBondContact O-CB 3.48Å; T196-F200 PolarHBondContact O-N 2.89Å; T196-Q263 HydrophobicContact CG2-CB 4.31Å; T196-Q263 HydrophobicContact CG2-CG 3.56Å; T196-L264 HydrophobicContact CG2-CD2 4.22Å; T196-L267 HydrophobicContact CG2-CD1 3.76Å; T196-L267 HydrophobicContact CG2-CD2 4.31Å; T196-L267 HydrophobicContact CG2-CG 4.13Å
197L92.5Very high88.9Confident34 Ų3458.4 Ų58.418%0.17829%0.285CS..Hα-helixtrans-62.4-46175.7-74-178000111.8Y193 W194 Q199 F200 F201 L264Y193-L197 HydrophobicContact CD1-CD1 4.03Å; Y193-L197 HydrophobicContact CE1-CD1 3.38Å; Y193-L197 HydrophobicContact CE1-CG 4.4Å; Y193-L197 HydrophobicContact CE2-CD1 4.17Å; Y193-L197 VanDerWaalsContact CZ-CD1 3.46Å; Y193-L197 WeakPolarHBondContact O-CG 3.41Å; Y193-L197 PolarHBondContact O-N 2.89Å; W194-L197 PolarHBondContact O-N 3.13Å; L197-Q199 VanDerWaalsContact C-N 3.34Å; L197-Q199 PolarHBondContact O-N 2.83Å; L197-F200 WeakPolarHBondContact O-CB 3.31Å; L197-F200 PolarHBondContact O-N 3.37Å; L197-F201 HydrophobicContact CB-CD2 4.46Å; L197-F201 HydrophobicContact CD2-CE2 4.28Å; L197-F201 WeakPolarHBondContact O-CD2 3.43Å; L197-F201 PolarHBondContact O-N 3.37Å; L197-L264 HydrophobicContact CD2-CD2 3.75Å
198Y92.5Very high89.5Confident81 Ų8155.9 Ų55.932%0.31827%0.271SS..Hα-helixtrans-53.1-51.2176.9168.5-96.7000111.6T161 W194 F195 F201 L202T161-Y198 VanDerWaalsContact CA-OH 3.22Å; T161-Y198 WeakPolarHBondContact CA-OH 3.36Å; T161-Y198 HydrophobicContact CG2-CE1 4.11Å; T161-Y198 WeakPolarHBondContact CG2-OH 3.45Å; T161-Y198 WeakPolarHBondContact O-CE1 3.35Å; T161-Y198 PolarHBondContact O-OH 2.92Å; W194-Y198 WeakPolarHBondContact O-CB 3.34Å; W194-Y198 PolarHBondContact O-N 2.81Å; F195-Y198 WeakPolarHBondContact O-CB 3.04Å; F195-Y198 PolarHBondContact O-N 3.41Å; Y198-F201 PolarHBondContact O-N 3.4Å; Y198-L202 HydrophobicContact CD2-CD1 3.77Å; Y198-L202 HydrophobicContact CE1-CD1 4.02Å; Y198-L202 HydrophobicContact CE2-CD1 3.18Å; Y198-L202 HydrophobicContact CE2-CG 4.32Å; Y198-L202 HydrophobicContact CG-CD1 4.42Å; Y198-L202 WeakPolarHBondContact O-CB 3.45Å; Y198-L202 PolarHBondContact O-N 3.33Å; Y198-L202 VanDerWaalsContact O-N 3.08Å
199Q91.1Very high90.4Very high33 Ų3354.6 Ų54.615%0.15427%0.268CS..Hα-helixtrans-63-46.4175.9-76-155.748.800112F195 T196 L197 F201 L202 A203F195-Q199 HydrophobicContact CE2-CG 4.42Å; F195-Q199 HydrophobicContact CZ-CG 4.34Å; F195-Q199 WeakPolarHBondContact O-CG 3.47Å; F195-Q199 PolarHBondContact O-N 3.08Å; T196-Q199 PolarHBondContact O-N 3.48Å; L197-Q199 VanDerWaalsContact C-N 3.34Å; L197-Q199 PolarHBondContact O-N 2.83Å; Q199-F201 VanDerWaalsContact C-N 3.32Å; Q199-F201 PolarHBondContact O-N 2.93Å; Q199-L202 PolarHBondContact O-N 3.48Å; Q199-A203 WeakPolarHBondContact O-CA 3.49Å; Q199-A203 WeakPolarHBondContact O-CB 3.11Å; Q199-A203 PolarHBondContact O-N 2.95Å
200F93.4Very high91.3Very high36 Ų3651.6 Ų51.616%0.15825%0.247CC..Iπ-helixtrans-55.1-46.8178.7175.3-101.8000112.1T196 L197 F204 A205 Y260 L264T196-F200 VanDerWaalsContact O-CB 3.31Å; T196-F200 WeakPolarHBondContact O-CB 3.48Å; T196-F200 PolarHBondContact O-N 2.89Å; L197-F200 WeakPolarHBondContact O-CB 3.31Å; L197-F200 PolarHBondContact O-N 3.37Å; F200-F204 HydrophobicContact CD2-CD1 4.32Å; F200-F204 AromaticContact CE2-CD1 3.69Å; F200-F204 HydrophobicContact CE2-CD1 3.69Å; F200-F204 HydrophobicContact CE2-CE1 4.27Å; F200-F204 HydrophobicContact CE2-CG 4.5Å; F200-F204 HydrophobicContact CZ-CD1 4.2Å; F200-F204 CarbonylContact O-C 3.58Å; F200-F204 WeakPolarHBondContact O-CA 3.34Å; F200-F204 VanDerWaalsContact O-CB 3.28Å; F200-F204 WeakPolarHBondContact O-CB 3.49Å; F200-F204 PolarHBondContact O-N 2.87Å; F200-F204 VanDerWaalsContact O-N 3.12Å; F200-A205 HydrophobicContact CD1-CB 4.19Å; F200-A205 HydrophobicContact CE1-CB 3.73Å; F200-A205 HydrophobicContact CZ-CB 4.1Å; F200-A205 PolarHBondContact O-N 3.3Å; F200-Y260 HydrophobicContact CD2-CD1 4.29Å; F200-Y260 HydrophobicContact CD2-CG 4.39Å; F200-L264 HydrophobicContact CB-CD2 4.32Å; F200-L264 HydrophobicContact CD1-CD1 4.07Å; F200-L264 HydrophobicContact CD2-CD1 3.58Å; F200-L264 HydrophobicContact CD2-CG 4.09Å; F200-L264 HydrophobicContact CE1-CD1 3.99Å; F200-L264 HydrophobicContact CE2-CD1 3.51Å; F200-L264 HydrophobicContact CE2-CG 4.46Å; F200-L264 HydrophobicContact CG-CD1 3.87Å; F200-L264 HydrophobicContact CG-CD2 4.22Å; F200-L264 HydrophobicContact CG-CG 4.26Å; F200-L264 HydrophobicContact CZ-CD1 3.72Å
201F94.8Very high91.7Very high99 Ų9947.8 Ų47.843%0.43423%0.227SC..Iπ-helixtrans-70-46.8-178.6-79-71.1000112.6L197 Y198 Q199 A205 I206L197-F201 HydrophobicContact CB-CD2 4.46Å; L197-F201 HydrophobicContact CD2-CE2 4.28Å; L197-F201 WeakPolarHBondContact O-CD2 3.43Å; L197-F201 PolarHBondContact O-N 3.37Å; Y198-F201 PolarHBondContact O-N 3.4Å; Q199-F201 VanDerWaalsContact C-N 3.32Å; Q199-F201 PolarHBondContact O-N 2.93Å; F201-A205 HydrophobicContact CD1-CB 3.95Å; F201-A205 HydrophobicContact CE1-CB 4.44Å; F201-A205 PolarHBondContact O-N 3.01Å; F201-I206 HydrophobicContact CB-CD1 4.28Å; F201-I206 WeakPolarHBondContact O-CB 3.07Å; F201-I206 PolarHBondContact O-N 3.29Å
202L92.6Very high91.9Very high45 Ų4549.2 Ų49.224%0.23624%0.239CC..Iπ-helixtrans-78.1-37.4-174.3-68.3-176.1000113.6T161 Y198 Q199 I206 P207T161-L202 HydrophobicContact CG2-CB 4.45Å; T161-L202 HydrophobicContact CG2-CD1 3.83Å; Y198-L202 HydrophobicContact CD2-CD1 3.77Å; Y198-L202 HydrophobicContact CE1-CD1 4.02Å; Y198-L202 HydrophobicContact CE2-CD1 3.18Å; Y198-L202 HydrophobicContact CE2-CG 4.32Å; Y198-L202 HydrophobicContact CG-CD1 4.42Å; Y198-L202 WeakPolarHBondContact O-CB 3.45Å; Y198-L202 PolarHBondContact O-N 3.33Å; Y198-L202 VanDerWaalsContact O-N 3.08Å; Q199-L202 PolarHBondContact O-N 3.48Å; L202-I206 HydrophobicContact CD2-CD1 4.34Å; L202-P207 WeakPolarHBondContact O-CD 3.22Å; L202-P207 VanDerWaalsContact O-CG 3.22Å; L202-P207 WeakPolarHBondContact O-CG 3.46Å
203A90.6Very high92.3Very high0 Ų053.8 Ų53.80%026%0.262CS..Iπ-helixtrans-89.3-21.8-176.600000113I115 T118 Q199 Y260I115-A203 HydrophobicContact CD1-CB 3.46Å; I115-A203 VanDerWaalsContact CD1-CB 3.46Å; T118-A203 WeakPolarHBondContact CG2-O 3.43Å; T118-A203 PolarHBondContact OG1-O 3.28Å; T118-A203 VanDerWaalsContact OG1-O 3.11Å; Q199-A203 WeakPolarHBondContact O-CA 3.49Å; Q199-A203 WeakPolarHBondContact O-CB 3.11Å; Q199-A203 PolarHBondContact O-N 2.95Å; A203-Y260 HydrophobicContact CB-CE1 4.05Å; A203-Y260 WeakPolarHBondContact CB-OH 3.29Å
204F92.3Very high92.5Very high16 Ų1649.6 Ų49.67%0.0725%0.247CC..Iπ-helixtrans-129.7-67.6-173.5-171.5-94.1000113.5F200 P207 L208 F253 A257 Y260F200-F204 HydrophobicContact CD2-CD1 4.32Å; F200-F204 AromaticContact CE2-CD1 3.69Å; F200-F204 HydrophobicContact CE2-CD1 3.69Å; F200-F204 HydrophobicContact CE2-CE1 4.27Å; F200-F204 HydrophobicContact CE2-CG 4.5Å; F200-F204 HydrophobicContact CZ-CD1 4.2Å; F200-F204 CarbonylContact O-C 3.58Å; F200-F204 WeakPolarHBondContact O-CA 3.34Å; F200-F204 VanDerWaalsContact O-CB 3.28Å; F200-F204 WeakPolarHBondContact O-CB 3.49Å; F200-F204 PolarHBondContact O-N 2.87Å; F200-F204 VanDerWaalsContact O-N 3.12Å; F204-P207 WeakPolarHBondContact O-CD 3.21Å; F204-L208 HydrophobicContact CD1-CD2 4.45Å; F204-L208 HydrophobicContact CE1-CD2 3.74Å; F204-L208 HydrophobicContact CZ-CD2 3.93Å; F204-L208 WeakPolarHBondContact O-CB 3.32Å; F204-L208 PolarHBondContact O-N 3.44Å; F204-F253 AromaticContact CD2-CD1 3.71Å; F204-F253 HydrophobicContact CD2-CD1 3.71Å; F204-F253 HydrophobicContact CD2-CE1 4.13Å; F204-F253 HydrophobicContact CE2-CB 4.33Å; F204-F253 AromaticContact CE2-CD1 3.53Å; F204-F253 HydrophobicContact CE2-CD1 3.53Å; F204-F253 HydrophobicContact CE2-CE1 4.36Å; F204-F253 HydrophobicContact CE2-CG 4.4Å; F204-F253 HydrophobicContact CZ-CD1 4.26Å; F204-A257 HydrophobicContact CE2-CB 3.7Å; F204-A257 HydrophobicContact CZ-CB 3.55Å; F204-Y260 HydrophobicContact CB-CD1 4.24Å; F204-Y260 HydrophobicContact CB-CD2 3.7Å; F204-Y260 HydrophobicContact CB-CE1 4.46Å; F204-Y260 HydrophobicContact CB-CE2 3.99Å; F204-Y260 HydrophobicContact CB-CG 3.88Å; F204-Y260 AromaticContact CD2-CD2 3.47Å; F204-Y260 HydrophobicContact CD2-CD2 3.47Å; F204-Y260 VanDerWaalsContact CD2-CD2 3.47Å; F204-Y260 HydrophobicContact CD2-CE2 4.09Å; F204-Y260 HydrophobicContact CD2-CG 4.16Å; F204-Y260 HydrophobicContact CE2-CD2 4.31Å; F204-Y260 AromaticContact CG-CD2 3.78Å; F204-Y260 HydrophobicContact CG-CD2 3.78Å; F204-Y260 HydrophobicContact CG-CE2 4.42Å; F204-Y260 HydrophobicContact CG-CG 4.05Å
205A94.1Very high92.4Very high18 Ų1843.5 Ų43.515%0.14923%0.225CC..Iπ-helixtrans-66.9-50.2-164.400000114.1F200 F201 L208 V209F200-A205 HydrophobicContact CD1-CB 4.19Å; F200-A205 HydrophobicContact CE1-CB 3.73Å; F200-A205 HydrophobicContact CZ-CB 4.1Å; F200-A205 PolarHBondContact O-N 3.3Å; F201-A205 HydrophobicContact CD1-CB 3.95Å; F201-A205 HydrophobicContact CE1-CB 4.44Å; F201-A205 PolarHBondContact O-N 3.01Å; A205-L208 PolarHBondContact O-N 2.93Å; A205-V209 VanDerWaalsContact O-CG2 3.31Å; A205-V209 WeakPolarHBondContact O-CG2 3.37Å; A205-V209 PolarHBondContact O-N 2.91Å
206I95.1Very high92.3Very high84 Ų8448.3 Ų48.343%0.43125%0.246SC..Hα-helixtrans-63.6-50.8-179.7-67.6166.4000110.6F201 L202 L208 V209 I210F201-I206 HydrophobicContact CB-CD1 4.28Å; F201-I206 WeakPolarHBondContact O-CB 3.07Å; F201-I206 PolarHBondContact O-N 3.29Å; L202-I206 HydrophobicContact CD2-CD1 4.34Å; I206-L208 VanDerWaalsContact C-N 3.32Å; I206-L208 PolarHBondContact O-N 3.36Å; I206-V209 PolarHBondContact O-N 3.48Å; I206-I210 HydrophobicContact CG2-CD1 3.79Å; I206-I210 HydrophobicContact CG2-CG1 4.49Å; I206-I210 WeakPolarHBondContact O-CG1 3.25Å; I206-I210 PolarHBondContact O-N 3.41Å
207P94.7Very high92.2Very high5 Ų553.1 Ų53.13%0.03227%0.267CS..Hα-helixtrans-56.8-41.8174.8-29.839.2000113.7T118 Y119 L202 F204 I210 I211 F253T118-P207 HydrophobicContact CG2-CB 3.24Å; T118-P207 HydrophobicContact CG2-CG 3.38Å; Y119-P207 HydrophobicContact CE1-CG 4.48Å; L202-P207 WeakPolarHBondContact O-CD 3.22Å; L202-P207 VanDerWaalsContact O-CG 3.22Å; L202-P207 WeakPolarHBondContact O-CG 3.46Å; F204-P207 WeakPolarHBondContact O-CD 3.21Å; P207-I210 PolarHBondContact O-N 2.86Å; P207-I211 WeakPolarHBondContact O-CB 3.42Å; P207-I211 WeakPolarHBondContact O-CD1 3.45Å; P207-I211 WeakPolarHBondContact O-CG1 3.32Å; P207-I211 PolarHBondContact O-N 2.89Å; P207-F253 HydrophobicContact CB-CZ 4.32Å
208L93.5Very high91.9Very high50 Ų5051.6 Ų51.626%0.26226%0.258SS..Hα-helixtrans-61.8-47.7178178.964.4000111.3F204 A205 I206 I210 I211 C212 F253F204-L208 HydrophobicContact CD1-CD2 4.45Å; F204-L208 HydrophobicContact CE1-CD2 3.74Å; F204-L208 HydrophobicContact CZ-CD2 3.93Å; F204-L208 WeakPolarHBondContact O-CB 3.32Å; F204-L208 PolarHBondContact O-N 3.44Å; A205-L208 PolarHBondContact O-N 2.93Å; I206-L208 VanDerWaalsContact C-N 3.32Å; I206-L208 PolarHBondContact O-N 3.36Å; L208-I210 PolarHBondContact O-N 3.43Å; L208-I211 PolarHBondContact O-N 3.45Å; L208-C212 VanDerWaalsContact O-CB 3.31Å; L208-C212 WeakPolarHBondContact O-CB 3.11Å; L208-C212 PolarHBondContact O-N 3.26Å; L208-C212 PolarHBondContact O-SG 2.85Å; L208-F253 HydrophobicContact CB-CD1 4.21Å; L208-F253 HydrophobicContact CB-CE1 3.73Å; L208-F253 HydrophobicContact CB-CE2 4.43Å; L208-F253 HydrophobicContact CB-CZ 3.87Å; L208-F253 HydrophobicContact CD1-CB 4.25Å; L208-F253 HydrophobicContact CD1-CD1 3.92Å; L208-F253 HydrophobicContact CD1-CD2 3.59Å; L208-F253 HydrophobicContact CD1-CE1 4.13Å; L208-F253 HydrophobicContact CD1-CE2 3.83Å; L208-F253 HydrophobicContact CD1-CG 3.66Å; L208-F253 HydrophobicContact CD1-CZ 4.09Å; L208-F253 HydrophobicContact CG-CE1 4.47Å
209V94.4Very high91.4Very high84 Ų8453 Ų5351%0.50927%0.271SS..Hα-helixtrans-60-47.5178169.60000110.7A205 I206 I211 C212 L213A205-V209 VanDerWaalsContact O-CG2 3.31Å; A205-V209 WeakPolarHBondContact O-CG2 3.37Å; A205-V209 PolarHBondContact O-N 2.91Å; I206-V209 PolarHBondContact O-N 3.48Å; V209-I211 VanDerWaalsContact C-N 3.35Å; V209-I211 PolarHBondContact O-N 3.19Å; V209-C212 PolarHBondContact O-N 3.39Å; V209-L213 HydrophobicContact CG1-CD1 3.81Å; V209-L213 HydrophobicContact CG1-CG 4.28Å; V209-L213 WeakPolarHBondContact O-CB 3.36Å; V209-L213 VanDerWaalsContact O-CG 3.25Å; V209-L213 WeakPolarHBondContact O-CG 3.31Å; V209-L213 PolarHBondContact O-N 2.87Å
210I94.7Very high91Very high66 Ų6655.9 Ų55.934%0.33828%0.284SS..Hα-helixtrans-57.9-49.7177.5-66.2167.3000110.2T122 I206 P207 L208 C212 L213 V214T122-I210 HydrophobicContact CG2-CB 4.32Å; T122-I210 HydrophobicContact CG2-CG2 3.75Å; I206-I210 HydrophobicContact CG2-CD1 3.79Å; I206-I210 HydrophobicContact CG2-CG1 4.49Å; I206-I210 WeakPolarHBondContact O-CG1 3.25Å; I206-I210 PolarHBondContact O-N 3.41Å; P207-I210 PolarHBondContact O-N 2.86Å; L208-I210 PolarHBondContact O-N 3.43Å; I210-C212 PolarHBondContact O-N 3.45Å; I210-L213 PolarHBondContact O-N 2.87Å; I210-V214 HydrophobicContact CG2-CG2 4.23Å; I210-V214 WeakPolarHBondContact O-CB 3.5Å; I210-V214 WeakPolarHBondContact O-CG2 3.44Å; I210-V214 PolarHBondContact O-N 3.43Å
211I92.9Very high90.5Very high4 Ų457.3 Ų57.32%0.02129%0.291CS..Hα-helixtrans-61.9-45-178.5-74.1169.2000111.2L121 T125 P207 L208 V209 V214 F215 C249 F253L121-I211 HydrophobicContact CB-CD1 4.39Å; T125-I211 HydrophobicContact CG2-CB 4.48Å; T125-I211 HydrophobicContact CG2-CG1 4.27Å; T125-I211 HydrophobicContact CG2-CG2 4.28Å; P207-I211 WeakPolarHBondContact O-CB 3.42Å; P207-I211 WeakPolarHBondContact O-CD1 3.45Å; P207-I211 WeakPolarHBondContact O-CG1 3.32Å; P207-I211 PolarHBondContact O-N 2.89Å; L208-I211 PolarHBondContact O-N 3.45Å; V209-I211 VanDerWaalsContact C-N 3.35Å; V209-I211 PolarHBondContact O-N 3.19Å; I211-V214 PolarHBondContact O-N 3.45Å; I211-F215 HydrophobicContact CG2-CD2 3.53Å; I211-F215 HydrophobicContact CG2-CE2 3.32Å; I211-F215 HydrophobicContact CG2-CZ 4.29Å; I211-F215 WeakPolarHBondContact O-CB 3.31Å; I211-F215 WeakPolarHBondContact O-CD2 3.26Å; I211-F215 PolarHBondContact O-N 3.4Å; I211-C249 HydrophobicContact CG2-CB 4.02Å; I211-F253 HydrophobicContact CB-CE2 4.44Å; I211-F253 HydrophobicContact CD1-CE2 3.56Å; I211-F253 HydrophobicContact CD1-CZ 3.79Å; I211-F253 HydrophobicContact CG2-CE2 4.36Å
212C90.9Very high89.6Confident70 Ų7054.7 Ų54.747%0.47328%0.281SS..Hα-helixtrans-61.6-48.1177.5-750000112.1L208 V209 I210 V214 F215 F216L208-C212 VanDerWaalsContact O-CB 3.31Å; L208-C212 WeakPolarHBondContact O-CB 3.11Å; L208-C212 PolarHBondContact O-N 3.26Å; L208-C212 PolarHBondContact O-SG 2.85Å; V209-C212 PolarHBondContact O-N 3.39Å; I210-C212 PolarHBondContact O-N 3.45Å; C212-V214 VanDerWaalsContact C-N 3.33Å; C212-V214 PolarHBondContact O-N 2.95Å; C212-F215 PolarHBondContact O-N 3.47Å; C212-F216 WeakPolarHBondContact O-CB 3.34Å; C212-F216 PolarHBondContact O-N 2.94Å
213L92.6Very high88.7Confident111 Ų11157.3 Ų57.358%0.58130%0.303SS*.Hα-helixtrans-61.3-43.6178-70.6175.3000111.5V209 I210 F216 K217V209-L213 HydrophobicContact CG1-CD1 3.81Å; V209-L213 HydrophobicContact CG1-CG 4.28Å; V209-L213 WeakPolarHBondContact O-CB 3.36Å; V209-L213 VanDerWaalsContact O-CG 3.25Å; V209-L213 WeakPolarHBondContact O-CG 3.31Å; V209-L213 PolarHBondContact O-N 2.87Å; I210-L213 PolarHBondContact O-N 2.87Å; L213-F216 PolarHBondContact O-N 3.34Å; L213-K217 WeakPolarHBondContact O-CG 3.41Å; L213-K217 PolarHBondContact O-N 3.24Å
214V92.1Very high87.8Confident19 Ų1960.7 Ų60.712%0.11533%0.331CS..Hα-helixtrans-66.1-45.1179.5174.70000110.9T125 L126 Y129 I210 I211 C212 K217 I218T125-V214 HydrophobicContact CG2-CB 3.96Å; T125-V214 HydrophobicContact CG2-CG1 3.66Å; L126-V214 HydrophobicContact CD2-CG2 3.79Å; Y129-V214 VanDerWaalsContact CB-CG1 3.48Å; Y129-V214 HydrophobicContact CD2-CG1 4.14Å; Y129-V214 HydrophobicContact CG-CG1 4Å; I210-V214 HydrophobicContact CG2-CG2 4.23Å; I210-V214 WeakPolarHBondContact O-CB 3.5Å; I210-V214 WeakPolarHBondContact O-CG2 3.44Å; I210-V214 PolarHBondContact O-N 3.43Å; I211-V214 PolarHBondContact O-N 3.45Å; C212-V214 VanDerWaalsContact C-N 3.33Å; C212-V214 PolarHBondContact O-N 2.95Å; V214-K217 PolarHBondContact O-N 2.97Å; V214-I218 HydrophobicContact CG1-CD1 4.01Å; V214-I218 VanDerWaalsContact O-CG1 3.28Å; V214-I218 WeakPolarHBondContact O-CG1 3.21Å; V214-I218 PolarHBondContact O-N 3.5Å
215F87.8Confident86.4Confident22 Ų2261.6 Ų61.610%0.09634%0.339CS..Hα-helixtrans-65.2-39.2175.8-76.1-40.1000112.9T125 I211 C212 K217 I218 L219 A245 V246 C249T125-F215 HydrophobicContact CG2-CD1 4.06Å; T125-F215 HydrophobicContact CG2-CD2 4.41Å; T125-F215 HydrophobicContact CG2-CE1 3.67Å; T125-F215 HydrophobicContact CG2-CE2 4.09Å; T125-F215 HydrophobicContact CG2-CG 4.38Å; T125-F215 HydrophobicContact CG2-CZ 3.67Å; I211-F215 HydrophobicContact CG2-CD2 3.53Å; I211-F215 HydrophobicContact CG2-CE2 3.32Å; I211-F215 HydrophobicContact CG2-CZ 4.29Å; I211-F215 WeakPolarHBondContact O-CB 3.31Å; I211-F215 WeakPolarHBondContact O-CD2 3.26Å; I211-F215 PolarHBondContact O-N 3.4Å; C212-F215 PolarHBondContact O-N 3.47Å; F215-K217 VanDerWaalsContact C-N 3.33Å; F215-K217 PolarHBondContact O-N 3.44Å; F215-I218 HydrophobicContact CD1-CD1 3.88Å; F215-I218 HydrophobicContact CE1-CD1 4.36Å; F215-I218 WeakPolarHBondContact O-CB 3.47Å; F215-I218 PolarHBondContact O-N 2.98Å; F215-L219 WeakPolarHBondContact O-CG 3.3Å; F215-L219 PolarHBondContact O-N 3.39Å; F215-A245 HydrophobicContact CE1-CB 4.46Å; F215-A245 HydrophobicContact CZ-CB 4.36Å; F215-V246 HydrophobicContact CD1-CG2 3.5Å; F215-V246 VanDerWaalsContact CD1-CG2 3.5Å; F215-V246 HydrophobicContact CD2-CG2 4.07Å; F215-V246 HydrophobicContact CE1-CB 4.4Å; F215-V246 HydrophobicContact CE1-CG2 3.4Å; F215-V246 VanDerWaalsContact CE1-CG2 3.4Å; F215-V246 HydrophobicContact CE2-CB 4.35Å; F215-V246 HydrophobicContact CE2-CG2 3.94Å; F215-V246 HydrophobicContact CG-CG2 3.88Å; F215-V246 HydrophobicContact CZ-CB 4.21Å; F215-V246 HydrophobicContact CZ-CG2 3.65Å; F215-C249 HydrophobicContact CE2-CB 3.82Å; F215-C249 HydrophobicContact CZ-CB 4.33Å
216F86Confident84.5Confident130 Ų13067.6 Ų67.657%0.5737%0.374SS*.Hα-helixtrans-57.3-47.6173.5178.8-98000111.1C212 L213 I218 L219 Q220C212-F216 WeakPolarHBondContact O-CB 3.34Å; C212-F216 PolarHBondContact O-N 2.94Å; L213-F216 PolarHBondContact O-N 3.34Å; F216-I218 VanDerWaalsContact C-N 3.34Å; F216-I218 PolarHBondContact O-N 3.11Å; F216-L219 PolarHBondContact O-N 3Å; F216-Q220 WeakPolarHBondContact O-CB 3.5Å; F216-Q220 PolarHBondContact O-N 2.81Å
217K87.2Confident82.5Confident109 Ų10966.8 Ų66.847%0.47438%0.38SS..Hα-helixtrans-62.4-38.2175.6-70.5-72.3179.4-1780112.8Y129 L213 V214 F215 H221Y129-K217 HydrophobicContact CD2-CB 4.41Å; Y129-K217 HydrophobicContact CE2-CB 3.91Å; L213-K217 WeakPolarHBondContact O-CG 3.41Å; L213-K217 PolarHBondContact O-N 3.24Å; V214-K217 PolarHBondContact O-N 2.97Å; F215-K217 VanDerWaalsContact C-N 3.33Å; F215-K217 PolarHBondContact O-N 3.44Å; K217-H221 WeakPolarHBondContact O-CB 3.36Å; K217-H221 PolarHBondContact O-N 2.97Å
218I86Confident80.5Confident1 Ų172.9 Ų72.91%0.00542%0.419CS..Hα-helixtrans-62.1-47.5174.6-69.8166.2000110.7R128 Y129 T132 V133 V214 F215 F216 H221 M222 T242R128-I218 HydrophobicContact CB-CD1 4.34Å; Y129-I218 HydrophobicContact CD2-CG1 3.9Å; T132-I218 HydrophobicContact CG2-CG2 4.08Å; V133-I218 HydrophobicContact CG2-CG1 4.49Å; V214-I218 HydrophobicContact CG1-CD1 4.01Å; V214-I218 VanDerWaalsContact O-CG1 3.28Å; V214-I218 WeakPolarHBondContact O-CG1 3.21Å; V214-I218 PolarHBondContact O-N 3.5Å; F215-I218 HydrophobicContact CD1-CD1 3.88Å; F215-I218 HydrophobicContact CE1-CD1 4.36Å; F215-I218 WeakPolarHBondContact O-CB 3.47Å; F215-I218 PolarHBondContact O-N 2.98Å; F216-I218 VanDerWaalsContact C-N 3.34Å; F216-I218 PolarHBondContact O-N 3.11Å; I218-H221 PolarHBondContact O-N 3.36Å; I218-M222 HydrophobicContact CG2-CE 3.82Å; I218-M222 HydrophobicContact CG2-CG 4.45Å; I218-M222 WeakPolarHBondContact O-CG 3.28Å; I218-M222 PolarHBondContact O-N 3.24Å; I218-T242 HydrophobicContact CG2-CG2 3.68Å
219L82.7Confident78.8Confident111 Ų11175.6 Ų75.658%0.58143%0.433SS*.Hα-helixtrans-63.7-44.6179.8-70174000111.4F215 F216 H221 M222 S223F215-L219 WeakPolarHBondContact O-CG 3.3Å; F215-L219 PolarHBondContact O-N 3.39Å; F216-L219 PolarHBondContact O-N 3Å; L219-H221 VanDerWaalsContact C-N 3.34Å; L219-H221 PolarHBondContact O-N 3.39Å; L219-M222 PolarHBondContact O-N 3.22Å; L219-S223 PolarHBondContact O-N 3.25Å; L219-S223 PolarHBondContact O-OG 3.29Å
220Q82.9Confident77.3Confident93 Ų9375 Ų7544%0.43543%0.431SS..Hα-helixtrans-58.7-44.2175.5-172.4-176.20.900111.7F216 S223 A224F216-Q220 WeakPolarHBondContact O-CB 3.5Å; F216-Q220 PolarHBondContact O-N 2.81Å; Q220-S223 PolarHBondContact O-N 3.33Å; Q220-S223 PolarHBondContact O-OG 3.44Å; Q220-A224 VanDerWaalsContact O-CB 3.27Å; Q220-A224 WeakPolarHBondContact O-CB 3.39Å; Q220-A224 PolarHBondContact O-N 2.95Å
221H82.3Confident75.9Confident66 Ų6675.7 Ų75.731%0.30644%0.44SS..Hα-helixtrans-65.7-40.8176.4-176.8-91.3000111.7T132 V133 K217 I218 L219 S223 S225T132-H221 PolarHBondContact O-CE1 2.83Å; V133-H221 HydrophobicContact CG2-CB 3.89Å; K217-H221 WeakPolarHBondContact O-CB 3.36Å; K217-H221 PolarHBondContact O-N 2.97Å; I218-H221 PolarHBondContact O-N 3.36Å; L219-H221 VanDerWaalsContact C-N 3.34Å; L219-H221 PolarHBondContact O-N 3.39Å; H221-S223 VanDerWaalsContact C-N 3.32Å; H221-S223 PolarHBondContact O-N 2.84Å; H221-S225 PolarHBondContact CE1-OG 3.27Å; H221-S225 VanDerWaalsContact O-CB 3.23Å; H221-S225 WeakPolarHBondContact O-CB 3.07Å; H221-S225 PolarHBondContact O-N 2.81Å; H221-S225 VanDerWaalsContact O-N 3.07Å; H221-S225 PolarHBondContact O-OG 3.13Å
222M75.9Confident74.7Confident45 Ų4586.2 Ų86.222%0.22248%0.48CS..Hα-helixtrans-66.6-31.7178.4-74.5-161.9-171.500113.3T132 I218 L219 R239 T242T132-M222 HydrophobicContact CG2-CE 3.46Å; T132-M222 VanDerWaalsContact CG2-CE 3.46Å; T132-M222 HydrophobicContact CG2-CG 4.13Å; I218-M222 HydrophobicContact CG2-CE 3.82Å; I218-M222 HydrophobicContact CG2-CG 4.45Å; I218-M222 WeakPolarHBondContact O-CG 3.28Å; I218-M222 PolarHBondContact O-N 3.24Å; L219-M222 PolarHBondContact O-N 3.22Å; M222-R239 HydrophobicContact SD-CG 4.3Å; M222-T242 HydrophobicContact CE-CG2 3.98Å
223S74.3Confident73.5Confident100 Ų10087 Ų8770%0.69949%0.486SS*.Hα-helixtrans-81.8-37.6177.860.60000113L219 Q220 H221L219-S223 PolarHBondContact O-N 3.25Å; L219-S223 PolarHBondContact O-OG 3.29Å; Q220-S223 PolarHBondContact O-N 3.33Å; Q220-S223 PolarHBondContact O-OG 3.44Å; H221-S223 VanDerWaalsContact C-N 3.32Å; H221-S223 PolarHBondContact O-N 2.84Å
224A72.3Confident72.3Confident70 Ų7085.7 Ų85.758%0.57948%0.479SS*.Hα-helixtrans-81.9-18-179.300000114.2Q220 V226Q220-A224 VanDerWaalsContact O-CB 3.27Å; Q220-A224 WeakPolarHBondContact O-CB 3.39Å; Q220-A224 PolarHBondContact O-N 2.95Å; A224-V226 PolarHBondContact O-N 3.3Å
225S61.7Low71.2Confident36 Ų3690.2 Ų90.225%0.25249%0.494SS..  trans-7495.8-178.1-67.50000112.3H221H221-S225 PolarHBondContact CE1-OG 3.27Å; H221-S225 VanDerWaalsContact O-CB 3.23Å; H221-S225 WeakPolarHBondContact O-CB 3.07Å; H221-S225 PolarHBondContact O-N 2.81Å; H221-S225 VanDerWaalsContact O-N 3.07Å; H221-S225 PolarHBondContact O-OG 3.13Å
226V55Low70.2Confident143 Ų14392.5 Ų92.587%0.86751%0.51SS*.  trans-98.9-0.3164.7-147.30000111.9A224A224-V226 PolarHBondContact O-N 3.3Å
227A53Low69.4Low67 Ų6793.3 Ų93.355%0.55451%0.509SS*.SBendtrans-77164.2-173.600000113.8L229A227-L229 PolarHBondContact O-N 3.18Å; A227-L229 VanDerWaalsContact O-N 3.1Å
228P51.5Low68.5Low134 Ų13490.1 Ų90.187%0.8750%0.498SS*.SBendtrans-55.1115.8-162.6-1726.9000111.5
229L58.3Low67.8Low106 Ų10698.6 Ų98.656%0.55553%0.531SS*.PPolyproline II helixtrans-72.5135.7-162.9-73155.3000111.3A227A227-L229 PolarHBondContact O-N 3.18Å; A227-L229 VanDerWaalsContact O-N 3.1Å
230P62.7Low67.3Low71 Ų7196.8 Ų96.846%0.46152%0.518SS..PPolyproline II helixtrans-56151153.225.8-32.2000108.6R232 L234P230-R232 PolarHBondContact O-N 3.19Å; P230-L234 HydrophobicContact CB-CB 4.32Å; P230-L234 HydrophobicContact CB-CD1 4.32Å
231P65.8Low66.6Low82 Ų8293.8 Ų93.853%0.53251%0.506SS..PPolyproline II helixtrans-47.3139.8-175.610.6-25.2000111.7S233 L234 R235P231-S233 PolarHBondContact O-N 3.01Å; P231-L234 HydrophobicContact CG-CD1 3.74Å; P231-L234 HydrophobicContact CG-CG 4.07Å; P231-L234 WeakPolarHBondContact O-CB 3.3Å; P231-L234 PolarHBondContact O-N 3.07Å; P231-R235 PolarHBondContact O-N 3.42Å
232R67.3Low66.2Low224 Ų22491 Ų9185%0.84549%0.494SS*.Hα-helixtrans-45.7-34.5-172.7-171177.3179.4-175.20.6113.1P230 V236P230-R232 PolarHBondContact O-N 3.19Å; R232-V236 VanDerWaalsContact O-CG2 3.26Å; R232-V236 WeakPolarHBondContact O-CG2 3.41Å; R232-V236 PolarHBondContact O-N 2.94Å; R232-V236 VanDerWaalsContact O-N 3.13Å
233S66.5Low66.3Low86 Ų8695.9 Ų95.960%0.60151%0.51SS*.Hα-helixtrans-64.3-39.3176.458.20000114.4P231 R237P231-S233 PolarHBondContact O-N 3.01Å; S233-R237 WeakPolarHBondContact O-CB 3.41Å; S233-R237 PolarHBondContact O-N 3.06Å
234L66.9Low66.3Low84 Ų8491.4 Ų91.444%0.4448%0.477SS..Hα-helixtrans-69.7-42.6176.9-69.7-179.7000111.4P230 P231 V236 R237 T238P230-L234 HydrophobicContact CB-CB 4.32Å; P230-L234 HydrophobicContact CB-CD1 4.32Å; P231-L234 HydrophobicContact CG-CD1 3.74Å; P231-L234 HydrophobicContact CG-CG 4.07Å; P231-L234 WeakPolarHBondContact O-CB 3.3Å; P231-L234 PolarHBondContact O-N 3.07Å; L234-V236 PolarHBondContact O-N 2.88Å; L234-R237 PolarHBondContact O-N 3Å; L234-T238 PolarHBondContact O-N 3.45Å; L234-T238 PolarHBondContact O-OG1 3Å; L234-T238 VanDerWaalsContact O-OG1 3.1Å
235R68.3Low66.5Low115 Ų11588 Ų8843%0.43445%0.45SS..Hα-helixtrans-62.1-43.5177.2-168.2173.7-176.7-156.95.3111.8P231 T238 R239P231-R235 PolarHBondContact O-N 3.42Å; R235-T238 PolarHBondContact O-N 3.44Å; R235-R239 WeakPolarHBondContact O-CB 3.49Å; R235-R239 PolarHBondContact O-N 3.17Å
236V68.6Low67.4Low70 Ų7088.3 Ų88.342%0.42445%0.45SS..Hα-helixtrans-63.3-42.7175.1172.40000111.1R232 L234 K240R232-V236 VanDerWaalsContact O-CG2 3.26Å; R232-V236 WeakPolarHBondContact O-CG2 3.41Å; R232-V236 PolarHBondContact O-N 2.94Å; R232-V236 VanDerWaalsContact O-N 3.13Å; L234-V236 PolarHBondContact O-N 2.88Å; V236-K240 HydrophobicContact CG1-CD 4.34Å; V236-K240 WeakPolarHBondContact O-CG 3.36Å; V236-K240 PolarHBondContact O-N 3.41Å
237R67.5Low68.7Low147 Ų14782.6 Ų82.656%0.55542%0.418SS*.Hα-helixtrans-61.7-48.4176.9-175.1179.1-179.4178.1-0.6111.6S233 L234 K240 V241S233-R237 WeakPolarHBondContact O-CB 3.41Å; S233-R237 PolarHBondContact O-N 3.06Å; L234-R237 PolarHBondContact O-N 3Å; R237-K240 PolarHBondContact O-N 2.98Å; R237-V241 WeakPolarHBondContact O-CG2 3.09Å; R237-V241 PolarHBondContact O-N 2.85Å
238T68.7Low70Confident41 Ų4179.4 Ų79.425%0.25239%0.391SS..Hα-helixtrans-61.3-47.2179.1-57.40000111.2T132 L234 R235 K240 V241 T242T132-T238 HydrophobicContact CG2-CG2 4.08Å; T132-T238 WeakPolarHBondContact OG1-CG2 3.5Å; L234-T238 PolarHBondContact O-N 3.45Å; L234-T238 PolarHBondContact O-OG1 3Å; L234-T238 VanDerWaalsContact O-OG1 3.1Å; R235-T238 PolarHBondContact O-N 3.44Å; T238-K240 VanDerWaalsContact C-N 3.31Å; T238-K240 PolarHBondContact O-N 3.4Å; T238-V241 PolarHBondContact O-N 3.33Å; T238-V241 VanDerWaalsContact O-N 3.17Å; T238-T242 PolarHBondContact O-N 2.9Å; T238-T242 PolarHBondContact O-OG1 3.39Å
239R72.1Confident71.5Confident180 Ų18073.2 Ų73.268%0.67935%0.351SS*.Hα-helixtrans-58.4-41.1177.2-168.6176.7-176.4-173.11.5112.6M222 R235 R243M222-R239 HydrophobicContact SD-CG 4.3Å; R235-R239 WeakPolarHBondContact O-CB 3.49Å; R235-R239 PolarHBondContact O-N 3.17Å; R239-R243 WeakPolarHBondContact O-CB 3.47Å; R239-R243 PolarHBondContact O-N 3.46Å
240K72Confident72.8Confident72 Ų7273.2 Ų73.231%0.31335%0.351SS..Hα-helixtrans-63.2-46.6175.7-75.8-178-177.9-171.80111.9V236 R237 T238 R243 M244 E303V236-K240 HydrophobicContact CG1-CD 4.34Å; V236-K240 WeakPolarHBondContact O-CG 3.36Å; V236-K240 PolarHBondContact O-N 3.41Å; R237-K240 PolarHBondContact O-N 2.98Å; T238-K240 VanDerWaalsContact C-N 3.31Å; T238-K240 PolarHBondContact O-N 3.4Å; K240-R243 PolarHBondContact O-N 3.34Å; K240-M244 PolarHBondContact O-N 2.95Å; K240-E303 VanDerWaalsContact NZ-CD 3.34Å; K240-E303 IonicContact NZ-OE1 2.68Å; K240-E303 PolarHBondContact NZ-OE1 2.87Å; K240-E303 IonicContact NZ-OE2 3.46Å; K240-E303 PolarHBondContact NZ-OE2 3.4Å
241V68.3Low74Confident31 Ų3170.5 Ų70.519%0.18834%0.335CS..Hα-helixtrans-68.1-36.6-180-177.10000111.5R237 T238 M244 A245R237-V241 WeakPolarHBondContact O-CG2 3.09Å; R237-V241 PolarHBondContact O-N 2.85Å; T238-V241 PolarHBondContact O-N 3.33Å; T238-V241 VanDerWaalsContact O-N 3.17Å; V241-M244 HydrophobicContact CG1-CE 4.38Å; V241-M244 WeakPolarHBondContact O-CB 3.34Å; V241-M244 PolarHBondContact O-N 2.9Å; V241-A245 PolarHBondContact O-N 2.84Å
242T73.3Confident75Confident7 Ų766.7 Ų66.74%0.04331%0.31CS..Hα-helixtrans-63.7-46.5171.9-57.60000111.2I218 M222 T238 M244 A245 V246I218-T242 HydrophobicContact CG2-CG2 3.68Å; M222-T242 HydrophobicContact CE-CG2 3.98Å; T238-T242 PolarHBondContact O-N 2.9Å; T238-T242 PolarHBondContact O-OG1 3.39Å; T242-M244 PolarHBondContact O-N 2.96Å; T242-A245 PolarHBondContact O-N 3.44Å; T242-A245 VanDerWaalsContact O-N 3.13Å; T242-V246 HydrophobicContact CG2-CG2 4.4Å; T242-V246 WeakPolarHBondContact O-CG2 3.35Å; T242-V246 PolarHBondContact O-N 3.18Å
243R77.3Confident76Confident148 Ų14856.8 Ų56.856%0.55827%0.273SS*.Hα-helixtrans-58.1-39.2176.2-173.9179.870.5178.15.5112R239 K240 A247R239-R243 WeakPolarHBondContact O-CB 3.47Å; R239-R243 PolarHBondContact O-N 3.46Å; K240-R243 PolarHBondContact O-N 3.34Å; R243-A247 WeakPolarHBondContact O-CB 3.19Å; R243-A247 PolarHBondContact O-N 3.01Å
244M75.2Confident77.2Confident5 Ų556.6 Ų56.63%0.02527%0.268CS..Hα-helixtrans-63.3-48.1174.8-177.1-17384.300111.6I69 M124 K240 V241 T242 V246 A247 I248 L301 S302I69-M244 HydrophobicContact CD1-CE 4.12Å; M124-M244 HydrophobicContact CE-CE 3.84Å; K240-M244 PolarHBondContact O-N 2.95Å; V241-M244 HydrophobicContact CG1-CE 4.38Å; V241-M244 WeakPolarHBondContact O-CB 3.34Å; V241-M244 PolarHBondContact O-N 2.9Å; T242-M244 PolarHBondContact O-N 2.96Å; M244-V246 PolarHBondContact O-N 2.74Å; M244-A247 PolarHBondContact O-N 3.38Å; M244-I248 HydrophobicContact CE-CD1 4.42Å; M244-I248 HydrophobicContact CG-CD1 3.87Å; M244-I248 WeakPolarHBondContact O-CD1 3.4Å; M244-I248 VanDerWaalsContact O-CG1 3.24Å; M244-I248 WeakPolarHBondContact O-CG1 3.1Å; M244-I248 PolarHBondContact O-N 2.88Å; M244-L301 HydrophobicContact CB-CB 4.09Å; M244-L301 HydrophobicContact CG-CB 3.91Å; M244-S302 WeakPolarHBondContact SD-CB 3.35Å
245A75.5Confident78.4Confident0 Ų053 Ų530%025%0.25CC..Hα-helixtrans-61.4-42.1177.300000112.4M124 R128 F215 V241 T242 I248 C249M124-A245 HydrophobicContact CE-CB 4.21Å; R128-A245 HydrophobicContact CG-CB 3.6Å; F215-A245 HydrophobicContact CE1-CB 4.46Å; F215-A245 HydrophobicContact CZ-CB 4.36Å; V241-A245 PolarHBondContact O-N 2.84Å; T242-A245 PolarHBondContact O-N 3.44Å; T242-A245 VanDerWaalsContact O-N 3.13Å; A245-I248 PolarHBondContact O-N 3.3Å; A245-C249 PolarHBondContact O-N 3.4Å; A245-C249 PolarHBondContact O-SG 3.27Å
246V81Confident79.6Confident42 Ų4247.8 Ų47.826%0.25523%0.23SC..Hα-helixtrans-58.6-48.3174.1171.90000110.7F215 T242 M244 I248 C249 L250F215-V246 HydrophobicContact CD1-CG2 3.5Å; F215-V246 VanDerWaalsContact CD1-CG2 3.5Å; F215-V246 HydrophobicContact CD2-CG2 4.07Å; F215-V246 HydrophobicContact CE1-CB 4.4Å; F215-V246 HydrophobicContact CE1-CG2 3.4Å; F215-V246 VanDerWaalsContact CE1-CG2 3.4Å; F215-V246 HydrophobicContact CE2-CB 4.35Å; F215-V246 HydrophobicContact CE2-CG2 3.94Å; F215-V246 HydrophobicContact CG-CG2 3.88Å; F215-V246 HydrophobicContact CZ-CB 4.21Å; F215-V246 HydrophobicContact CZ-CG2 3.65Å; T242-V246 HydrophobicContact CG2-CG2 4.4Å; T242-V246 WeakPolarHBondContact O-CG2 3.35Å; T242-V246 PolarHBondContact O-N 3.18Å; M244-V246 PolarHBondContact O-N 2.74Å; V246-I248 PolarHBondContact O-N 2.84Å; V246-C249 PolarHBondContact O-N 3.48Å; V246-L250 HydrophobicContact CG1-CD1 3.78Å; V246-L250 HydrophobicContact CG1-CG 4.2Å; V246-L250 WeakPolarHBondContact O-CB 3.38Å; V246-L250 VanDerWaalsContact O-CG 3.31Å; V246-L250 WeakPolarHBondContact O-CG 3.33Å; V246-L250 PolarHBondContact O-N 2.89Å
247A82.3Confident80.7Confident23 Ų2345.3 Ų45.319%0.1922%0.217CC..Hα-helixtrans-63.9-39.4-179.400000113R243 M244 L250 A251 L301R243-A247 WeakPolarHBondContact O-CB 3.19Å; R243-A247 PolarHBondContact O-N 3.01Å; M244-A247 PolarHBondContact O-N 3.38Å; A247-L250 PolarHBondContact O-N 3.49Å; A247-A251 WeakPolarHBondContact O-CB 3.14Å; A247-A251 PolarHBondContact O-N 3.22Å; A247-L301 HydrophobicContact CB-CD1 3.22Å
248I81.1Confident82Confident0 Ų040.2 Ų40.20%020%0.203CC..Hα-helixtrans-64-44.9175.5-61.3157.1000110.3L72 L121 M124 M244 A245 V246 A251 F252 L297 Y298L72-I248 HydrophobicContact CD2-CG2 4.47Å; L121-I248 HydrophobicContact CD2-CB 4.44Å; L121-I248 HydrophobicContact CD2-CG2 3.41Å; L121-I248 VanDerWaalsContact CD2-CG2 3.41Å; M124-I248 HydrophobicContact CE-CD1 3.87Å; M124-I248 HydrophobicContact SD-CD1 4.46Å; M244-I248 HydrophobicContact CE-CD1 4.42Å; M244-I248 HydrophobicContact CG-CD1 3.87Å; M244-I248 WeakPolarHBondContact O-CD1 3.4Å; M244-I248 VanDerWaalsContact O-CG1 3.24Å; M244-I248 WeakPolarHBondContact O-CG1 3.1Å; M244-I248 PolarHBondContact O-N 2.88Å; A245-I248 PolarHBondContact O-N 3.3Å; V246-I248 PolarHBondContact O-N 2.84Å; I248-A251 PolarHBondContact O-N 3.41Å; I248-F252 WeakPolarHBondContact O-CB 3.48Å; I248-F252 PolarHBondContact O-N 2.81Å; I248-L297 HydrophobicContact CB-CD1 4.38Å; I248-L297 HydrophobicContact CG1-CB 4.32Å; I248-L297 HydrophobicContact CG1-CD1 4.03Å; I248-Y298 HydrophobicContact CD1-CD1 4.12Å; I248-Y298 HydrophobicContact CD1-CE1 3.61Å; I248-Y298 HydrophobicContact CG1-CE1 4.15Å
249C83.1Confident83.1Confident4 Ų438.6 Ų38.63%0.02719%0.192CC..Hα-helixtrans-63.9-44177.3-64.60000111.8T125 I211 F215 A245 V246 F252 F253T125-C249 PolarHBondContact OG1-SG 3.11Å; T125-C249 VanDerWaalsContact OG1-SG 3.34Å; I211-C249 HydrophobicContact CG2-CB 4.02Å; F215-C249 HydrophobicContact CE2-CB 3.82Å; F215-C249 HydrophobicContact CZ-CB 4.33Å; A245-C249 PolarHBondContact O-N 3.4Å; A245-C249 PolarHBondContact O-SG 3.27Å; V246-C249 PolarHBondContact O-N 3.48Å; C249-F252 PolarHBondContact O-N 2.99Å; C249-F253 WeakPolarHBondContact O-CD2 3.25Å; C249-F253 PolarHBondContact O-N 3Å
250L86.1Confident84Confident106 Ų10630.3 Ų30.356%0.55516%0.161SC*.Hα-helixtrans-60.1-48.1176.8-74.5174.2000110.8V246 A247 F252 F253 T254V246-L250 HydrophobicContact CG1-CD1 3.78Å; V246-L250 HydrophobicContact CG1-CG 4.2Å; V246-L250 WeakPolarHBondContact O-CB 3.38Å; V246-L250 VanDerWaalsContact O-CG 3.31Å; V246-L250 WeakPolarHBondContact O-CG 3.33Å; V246-L250 PolarHBondContact O-N 2.89Å; A247-L250 PolarHBondContact O-N 3.49Å; L250-F252 VanDerWaalsContact C-N 3.33Å; L250-F252 PolarHBondContact O-N 3.25Å; L250-F253 PolarHBondContact O-N 3.46Å; L250-T254 WeakPolarHBondContact O-CB 3.38Å; L250-T254 VanDerWaalsContact O-CG2 3.25Å; L250-T254 WeakPolarHBondContact O-CG2 3.15Å; L250-T254 PolarHBondContact O-N 3.44Å; L250-T254 PolarHBondContact O-OG1 3.01Å
251A86.7Confident85Confident14 Ų1431 Ų3112%0.11617%0.167CC..Hα-helixtrans-56.6-48.6177.300000111.3A247 I248 T254 C255 I293 L297A247-A251 WeakPolarHBondContact O-CB 3.14Å; A247-A251 PolarHBondContact O-N 3.22Å; I248-A251 PolarHBondContact O-N 3.41Å; A251-T254 WeakPolarHBondContact CA-OG1 3.45Å; A251-T254 PolarHBondContact O-N 2.98Å; A251-T254 PolarHBondContact O-OG1 2.97Å; A251-C255 WeakPolarHBondContact O-CB 3.47Å; A251-C255 PolarHBondContact O-N 3.4Å; A251-C255 PolarHBondContact O-SG 2.89Å; A251-I293 HydrophobicContact CB-CG2 4.05Å; A251-L297 HydrophobicContact CB-CD1 3.61Å
252F86.5Confident86Confident2 Ų230.8 Ų30.81%0.00917%0.165CC..Hα-helixtrans-55.8-56178.2-176.2-90.3000112.3T118 L121 I248 C249 L250 T254 C255 W256 N290T118-F252 HydrophobicContact CG2-CE1 4.49Å; T118-F252 WeakPolarHBondContact OG1-CE1 3.06Å; T118-F252 WeakPolarHBondContact OG1-CZ 3.28Å; L121-F252 HydrophobicContact CD1-CB 3.41Å; L121-F252 VanDerWaalsContact CD1-CB 3.41Å; L121-F252 HydrophobicContact CD1-CD1 3.79Å; L121-F252 HydrophobicContact CD1-CD2 3.46Å; L121-F252 VanDerWaalsContact CD1-CD2 3.46Å; L121-F252 HydrophobicContact CD1-CE1 4.45Å; L121-F252 HydrophobicContact CD1-CE2 4.18Å; L121-F252 HydrophobicContact CD1-CG 3.25Å; I248-F252 WeakPolarHBondContact O-CB 3.48Å; I248-F252 PolarHBondContact O-N 2.81Å; C249-F252 PolarHBondContact O-N 2.99Å; L250-F252 VanDerWaalsContact C-N 3.33Å; L250-F252 PolarHBondContact O-N 3.25Å; F252-T254 VanDerWaalsContact C-N 3.34Å; F252-T254 PolarHBondContact O-N 3.34Å; F252-C255 PolarHBondContact O-N 2.74Å; F252-W256 AromaticContact CD2-CD1 3.76Å; F252-W256 AromaticContact CD2-NE1 4Å; F252-W256 AromaticContact CE1-CD1 3.82Å; F252-W256 HydrophobicContact CE1-CG 4.33Å; F252-W256 AromaticContact CE2-CD1 3.49Å; F252-W256 VanDerWaalsContact CE2-CD1 3.49Å; F252-W256 AromaticContact CE2-NE1 3.48Å; F252-W256 AromaticContact CZ-CD1 3.5Å; F252-W256 VanDerWaalsContact CZ-CD1 3.5Å; F252-W256 HydrophobicContact CZ-CG 4.19Å; F252-W256 AromaticContact CZ-NE1 3.77Å; F252-W256 VanDerWaalsContact O-CD1 3.31Å; F252-W256 PolarHBondContact O-N 2.65Å; F252-N290 WeakPolarHBondContact CA-OD1 3.36Å; F252-N290 VanDerWaalsContact CD2-ND2 3.35Å; F252-N290 WeakPolarHBondContact CD2-ND2 3.4Å; F252-N290 WeakPolarHBondContact CD2-OD1 3.2Å
253F89.3Confident86.7Confident16 Ų1631.1 Ų31.17%0.0717%0.166CC..Hα-helixtrans-68.8-31.8-177.9-69.9-66.2000112.7F204 P207 L208 I211 C249 L250 C255 W256 A257F204-F253 AromaticContact CD2-CD1 3.71Å; F204-F253 HydrophobicContact CD2-CD1 3.71Å; F204-F253 HydrophobicContact CD2-CE1 4.13Å; F204-F253 HydrophobicContact CE2-CB 4.33Å; F204-F253 AromaticContact CE2-CD1 3.53Å; F204-F253 HydrophobicContact CE2-CD1 3.53Å; F204-F253 HydrophobicContact CE2-CE1 4.36Å; F204-F253 HydrophobicContact CE2-CG 4.4Å; F204-F253 HydrophobicContact CZ-CD1 4.26Å; P207-F253 HydrophobicContact CB-CZ 4.32Å; L208-F253 HydrophobicContact CB-CD1 4.21Å; L208-F253 HydrophobicContact CB-CE1 3.73Å; L208-F253 HydrophobicContact CB-CE2 4.43Å; L208-F253 HydrophobicContact CB-CZ 3.87Å; L208-F253 HydrophobicContact CD1-CB 4.25Å; L208-F253 HydrophobicContact CD1-CD1 3.92Å; L208-F253 HydrophobicContact CD1-CD2 3.59Å; L208-F253 HydrophobicContact CD1-CE1 4.13Å; L208-F253 HydrophobicContact CD1-CE2 3.83Å; L208-F253 HydrophobicContact CD1-CG 3.66Å; L208-F253 HydrophobicContact CD1-CZ 4.09Å; L208-F253 HydrophobicContact CG-CE1 4.47Å; I211-F253 HydrophobicContact CB-CE2 4.44Å; I211-F253 HydrophobicContact CD1-CE2 3.56Å; I211-F253 HydrophobicContact CD1-CZ 3.79Å; I211-F253 HydrophobicContact CG2-CE2 4.36Å; C249-F253 WeakPolarHBondContact O-CD2 3.25Å; C249-F253 PolarHBondContact O-N 3Å; L250-F253 PolarHBondContact O-N 3.46Å; F253-C255 VanDerWaalsContact C-N 3.31Å; F253-C255 PolarHBondContact O-N 3.25Å; F253-W256 PolarHBondContact O-N 2.8Å; F253-A257 WeakPolarHBondContact O-CA 3.27Å; F253-A257 WeakPolarHBondContact O-CB 3.4Å; F253-A257 PolarHBondContact O-N 3.49Å
254T91.3Very high87.3Confident82 Ų8226.5 Ų26.550%0.50315%0.152SC..Hα-helixtrans-67.6-31.9173.2550000112.8L250 A251 F252 P258 M286L250-T254 WeakPolarHBondContact O-CB 3.38Å; L250-T254 VanDerWaalsContact O-CG2 3.25Å; L250-T254 WeakPolarHBondContact O-CG2 3.15Å; L250-T254 PolarHBondContact O-N 3.44Å; L250-T254 PolarHBondContact O-OG1 3.01Å; A251-T254 WeakPolarHBondContact CA-OG1 3.45Å; A251-T254 PolarHBondContact O-N 2.98Å; A251-T254 PolarHBondContact O-OG1 2.97Å; F252-T254 VanDerWaalsContact C-N 3.34Å; F252-T254 PolarHBondContact O-N 3.34Å; T254-P258 VanDerWaalsContact O-CD 3.25Å; T254-P258 WeakPolarHBondContact O-CD 3.24Å; T254-M286 WeakPolarHBondContact O-CE 3.43Å
255C92.4Very high88Confident7 Ų730 Ų305%0.04717%0.17CC..Hα-helixtrans-73.8-40.7176.3-68.90000111.6A251 F252 F253 M286 G287 N290 I293A251-C255 WeakPolarHBondContact O-CB 3.47Å; A251-C255 PolarHBondContact O-N 3.4Å; A251-C255 PolarHBondContact O-SG 2.89Å; F252-C255 PolarHBondContact O-N 2.74Å; F253-C255 VanDerWaalsContact C-N 3.31Å; F253-C255 PolarHBondContact O-N 3.25Å; C255-M286 VanDerWaalsContact CB-O 3.29Å; C255-M286 WeakPolarHBondContact CB-O 3.49Å; C255-M286 CarbonylContact O-C 3.5Å; C255-G287 PolarHBondContact O-N 3.19Å; C255-N290 HydrophobicContact CB-CB 3.9Å; C255-I293 WeakPolarHBondContact SG-CD1 3.3Å
256W92.6Very high88.3Confident6 Ų632 Ų322%0.02318%0.179CC..Hα-helixtrans-91.8-25.3-174-76.9103.1000114.8F79 Q114 F252 F253 Y259 Y260 G287 Y288F79-W256 HydrophobicContact CZ-CH2 4.41Å; F79-W256 HydrophobicContact CZ-CZ2 4.26Å; Q114-W256 VanDerWaalsContact CD-CZ3 3.43Å; Q114-W256 HydrophobicContact CG-CH2 3.4Å; Q114-W256 HydrophobicContact CG-CZ2 3.61Å; Q114-W256 HydrophobicContact CG-CZ3 4.08Å; Q114-W256 VanDerWaalsContact OE1-CH2 3.23Å; F252-W256 AromaticContact CD2-CD1 3.76Å; F252-W256 AromaticContact CD2-NE1 4Å; F252-W256 AromaticContact CE1-CD1 3.82Å; F252-W256 HydrophobicContact CE1-CG 4.33Å; F252-W256 AromaticContact CE2-CD1 3.49Å; F252-W256 VanDerWaalsContact CE2-CD1 3.49Å; F252-W256 AromaticContact CE2-NE1 3.48Å; F252-W256 AromaticContact CZ-CD1 3.5Å; F252-W256 VanDerWaalsContact CZ-CD1 3.5Å; F252-W256 HydrophobicContact CZ-CG 4.19Å; F252-W256 AromaticContact CZ-NE1 3.77Å; F252-W256 VanDerWaalsContact O-CD1 3.31Å; F252-W256 PolarHBondContact O-N 2.65Å; F253-W256 PolarHBondContact O-N 2.8Å; W256-Y259 AromaticContact CE3-CD1 3.88Å; W256-Y259 HydrophobicContact CE3-CD1 3.88Å; W256-Y259 HydrophobicContact CE3-CG 4.39Å; W256-Y259 AromaticContact CZ3-CD1 3.97Å; W256-Y259 HydrophobicContact CZ3-CD1 3.97Å; W256-Y259 HydrophobicContact CZ3-CE1 4.29Å; W256-Y259 HydrophobicContact CZ3-CG 4.42Å; W256-Y259 WeakPolarHBondContact O-CB 3.48Å; W256-Y259 PolarHBondContact O-N 3.36Å; W256-Y260 HydrophobicContact CB-CD2 4.01Å; W256-Y260 HydrophobicContact CB-CE2 3.92Å; W256-Y260 HydrophobicContact CD2-CE2 4.34Å; W256-Y260 AromaticContact CE3-CE2 3.89Å; W256-Y260 HydrophobicContact CE3-CE2 3.89Å; W256-Y260 HydrophobicContact CG-CE2 4.39Å; W256-Y260 VanDerWaalsContact O-CD2 3.25Å; W256-Y260 WeakPolarHBondContact O-CD2 3.17Å; W256-Y260 PolarHBondContact O-N 3.37Å; W256-Y260 VanDerWaalsContact O-N 3.11Å; W256-G287 WeakPolarHBondContact CZ2-O 3.47Å; W256-Y288 HydrophobicContact CH2-CD1 4.46Å
257A93.2Very high88.5Confident19 Ų1932.6 Ų32.616%0.15718%0.181CC..Hα-helixtrans-56.6-45.1-178.600000113.5F204 F253 Y259 Y260 I261F204-A257 HydrophobicContact CE2-CB 3.7Å; F204-A257 HydrophobicContact CZ-CB 3.55Å; F253-A257 WeakPolarHBondContact O-CA 3.27Å; F253-A257 WeakPolarHBondContact O-CB 3.4Å; F253-A257 PolarHBondContact O-N 3.49Å; A257-Y259 VanDerWaalsContact C-N 3.25Å; A257-Y259 PolarHBondContact O-N 2.95Å; A257-Y260 PolarHBondContact O-N 2.91Å; A257-I261 HydrophobicContact CB-CD1 4.31Å; A257-I261 WeakPolarHBondContact O-CB 3.31Å; A257-I261 WeakPolarHBondContact O-CD1 3.38Å; A257-I261 WeakPolarHBondContact O-CG1 3.46Å; A257-I261 PolarHBondContact O-N 2.87Å
258P93.8Very high88.4Confident39 Ų3934.8 Ų34.825%0.25321%0.206SC..Hα-helixtrans-57.3-41.5178.6-2535.7000112.1T254 L262 A283 M286T254-P258 VanDerWaalsContact O-CD 3.25Å; T254-P258 WeakPolarHBondContact O-CD 3.24Å; P258-L262 WeakPolarHBondContact O-CB 3.45Å; P258-L262 VanDerWaalsContact O-CG 3.24Å; P258-L262 WeakPolarHBondContact O-CG 3.36Å; P258-L262 PolarHBondContact O-N 3.2Å; P258-A283 HydrophobicContact CB-CB 3.69Å; P258-M286 HydrophobicContact CG-CE 3.99Å; P258-M286 HydrophobicContact CG-SD 4.08Å
259Y91.6Very high88.2Confident7 Ų737.2 Ų37.23%0.02722%0.221CC..Hα-helixtrans-63.8-53.6179.3168.6-100000111.1D2 W256 A257 I261 L262 Q263 Y280D2-Y259 VanDerWaalsContact CG-OH 3.27Å; D2-Y259 PolarHBondContact OD1-OH 3.39Å; D2-Y259 WeakPolarHBondContact OD2-CE2 3.33Å; D2-Y259 PolarHBondContact OD2-OH 2.96Å; W256-Y259 AromaticContact CE3-CD1 3.88Å; W256-Y259 HydrophobicContact CE3-CD1 3.88Å; W256-Y259 HydrophobicContact CE3-CG 4.39Å; W256-Y259 AromaticContact CZ3-CD1 3.97Å; W256-Y259 HydrophobicContact CZ3-CD1 3.97Å; W256-Y259 HydrophobicContact CZ3-CE1 4.29Å; W256-Y259 HydrophobicContact CZ3-CG 4.42Å; W256-Y259 WeakPolarHBondContact O-CB 3.48Å; W256-Y259 PolarHBondContact O-N 3.36Å; A257-Y259 VanDerWaalsContact C-N 3.25Å; A257-Y259 PolarHBondContact O-N 2.95Å; Y259-I261 VanDerWaalsContact C-N 3.32Å; Y259-I261 PolarHBondContact O-N 3.44Å; Y259-L262 PolarHBondContact O-N 3.45Å; Y259-Q263 WeakPolarHBondContact O-CB 3.31Å; Y259-Q263 PolarHBondContact O-N 2.96Å; Y259-Y280 HydrophobicContact CD2-CE2 4.22Å; Y259-Y280 HydrophobicContact CE2-CE2 4.22Å; Y259-Y280 AromaticContact CE2-CZ 3.92Å; Y259-Y280 WeakPolarHBondContact CE2-OH 3.29Å
260Y91.6Very high87.6Confident7 Ų745.6 Ų45.63%0.02726%0.26CS..Hα-helixtrans-62.3-37.8-179.3-79.8-64.5000113Q114 F200 A203 F204 W256 A257 L264Q114-Y260 PolarHBondContact OE1-OH 3.42Å; F200-Y260 HydrophobicContact CD2-CD1 4.29Å; F200-Y260 HydrophobicContact CD2-CG 4.39Å; A203-Y260 HydrophobicContact CB-CE1 4.05Å; A203-Y260 WeakPolarHBondContact CB-OH 3.29Å; F204-Y260 HydrophobicContact CB-CD1 4.24Å; F204-Y260 HydrophobicContact CB-CD2 3.7Å; F204-Y260 HydrophobicContact CB-CE1 4.46Å; F204-Y260 HydrophobicContact CB-CE2 3.99Å; F204-Y260 HydrophobicContact CB-CG 3.88Å; F204-Y260 AromaticContact CD2-CD2 3.47Å; F204-Y260 HydrophobicContact CD2-CD2 3.47Å; F204-Y260 VanDerWaalsContact CD2-CD2 3.47Å; F204-Y260 HydrophobicContact CD2-CE2 4.09Å; F204-Y260 HydrophobicContact CD2-CG 4.16Å; F204-Y260 HydrophobicContact CE2-CD2 4.31Å; F204-Y260 AromaticContact CG-CD2 3.78Å; F204-Y260 HydrophobicContact CG-CD2 3.78Å; F204-Y260 HydrophobicContact CG-CE2 4.42Å; F204-Y260 HydrophobicContact CG-CG 4.05Å; W256-Y260 HydrophobicContact CB-CD2 4.01Å; W256-Y260 HydrophobicContact CB-CE2 3.92Å; W256-Y260 HydrophobicContact CD2-CE2 4.34Å; W256-Y260 AromaticContact CE3-CE2 3.89Å; W256-Y260 HydrophobicContact CE3-CE2 3.89Å; W256-Y260 HydrophobicContact CG-CE2 4.39Å; W256-Y260 VanDerWaalsContact O-CD2 3.25Å; W256-Y260 WeakPolarHBondContact O-CD2 3.17Å; W256-Y260 PolarHBondContact O-N 3.37Å; W256-Y260 VanDerWaalsContact O-N 3.11Å; A257-Y260 PolarHBondContact O-N 2.91Å; Y260-L264 WeakPolarHBondContact O-CG 3.34Å; Y260-L264 PolarHBondContact O-N 3.06Å
261I92.6Very high86.9Confident86 Ų8647.3 Ų47.344%0.44127%0.269SS..Hα-helixtrans-67.2-47.3176.7-68.6166.3000110.6A257 Y259 Q263 L264 I265A257-I261 HydrophobicContact CB-CD1 4.31Å; A257-I261 WeakPolarHBondContact O-CB 3.31Å; A257-I261 WeakPolarHBondContact O-CD1 3.38Å; A257-I261 WeakPolarHBondContact O-CG1 3.46Å; A257-I261 PolarHBondContact O-N 2.87Å; Y259-I261 VanDerWaalsContact C-N 3.32Å; Y259-I261 PolarHBondContact O-N 3.44Å; I261-Q263 VanDerWaalsContact C-N 3.3Å; I261-Q263 PolarHBondContact O-N 2.8Å; I261-L264 PolarHBondContact O-N 3.5Å; I261-I265 HydrophobicContact CG2-CD1 3.78Å; I261-I265 HydrophobicContact CG2-CG1 4.48Å; I261-I265 WeakPolarHBondContact O-CG1 3.31Å; I261-I265 PolarHBondContact O-N 3.43Å
262L90.4Very high86.4Confident26 Ų2648.5 Ų48.514%0.13628%0.276CS..Hα-helixtrans-66.2-33.9178.9-70.8174.6000112P258 Y259 L264 I265 H266 F276 A279 Y280 A283P258-L262 WeakPolarHBondContact O-CB 3.45Å; P258-L262 VanDerWaalsContact O-CG 3.24Å; P258-L262 WeakPolarHBondContact O-CG 3.36Å; P258-L262 PolarHBondContact O-N 3.2Å; Y259-L262 PolarHBondContact O-N 3.45Å; L262-L264 VanDerWaalsContact C-N 3.33Å; L262-L264 PolarHBondContact O-N 2.89Å; L262-I265 HydrophobicContact CD2-CD1 4.28Å; L262-I265 PolarHBondContact O-N 2.96Å; L262-H266 WeakPolarHBondContact O-CB 3.39Å; L262-H266 PolarHBondContact O-N 3.41Å; L262-F276 HydrophobicContact CD2-CD2 4.27Å; L262-F276 HydrophobicContact CD2-CE2 3.83Å; L262-A279 HydrophobicContact CD1-CB 4.08Å; L262-A279 WeakPolarHBondContact CD1-O 3.24Å; L262-Y280 HydrophobicContact CB-CD2 4.03Å; L262-Y280 HydrophobicContact CD1-CD2 4.48Å; L262-A283 HydrophobicContact CD1-CB 3.61Å
263Q87.7Confident86.2Confident14 Ų1451.6 Ų51.67%0.06530%0.298CS..Hα-helixtrans-62.6-39.6174.1-163.470.323.700111.7T196 Y259 I261 H266 Y280T196-Q263 HydrophobicContact CG2-CB 4.31Å; T196-Q263 HydrophobicContact CG2-CG 3.56Å; Y259-Q263 WeakPolarHBondContact O-CB 3.31Å; Y259-Q263 PolarHBondContact O-N 2.96Å; I261-Q263 VanDerWaalsContact C-N 3.3Å; I261-Q263 PolarHBondContact O-N 2.8Å; Q263-H266 WeakPolarHBondContact O-CB 3.26Å; Q263-H266 PolarHBondContact O-N 2.82Å; Q263-Y280 PolarHBondContact OE1-OH 3.11Å
264L90Very high85.6Confident51 Ų5157.1 Ų57.127%0.26733%0.326SS..Hα-helixtrans-68.2-42.3173.4-71.2175.7000112.5T196 L197 F200 Y260 I261 L262 H266 L267T196-L264 HydrophobicContact CG2-CD2 4.22Å; L197-L264 HydrophobicContact CD2-CD2 3.75Å; F200-L264 HydrophobicContact CB-CD2 4.32Å; F200-L264 HydrophobicContact CD1-CD1 4.07Å; F200-L264 HydrophobicContact CD2-CD1 3.58Å; F200-L264 HydrophobicContact CD2-CG 4.09Å; F200-L264 HydrophobicContact CE1-CD1 3.99Å; F200-L264 HydrophobicContact CE2-CD1 3.51Å; F200-L264 HydrophobicContact CE2-CG 4.46Å; F200-L264 HydrophobicContact CG-CD1 3.87Å; F200-L264 HydrophobicContact CG-CD2 4.22Å; F200-L264 HydrophobicContact CG-CG 4.26Å; F200-L264 HydrophobicContact CZ-CD1 3.72Å; Y260-L264 WeakPolarHBondContact O-CG 3.34Å; Y260-L264 PolarHBondContact O-N 3.06Å; I261-L264 PolarHBondContact O-N 3.5Å; L262-L264 VanDerWaalsContact C-N 3.33Å; L262-L264 PolarHBondContact O-N 2.89Å; L264-H266 PolarHBondContact O-N 3.41Å; L264-L267 HydrophobicContact CD2-CD1 4.33Å; L264-L267 WeakPolarHBondContact O-CB 3.48Å; L264-L267 PolarHBondContact O-N 3.05Å
265I88.4Confident85.2Confident80 Ų8056.5 Ų56.541%0.4133%0.33SS..Hα-helixtrans-61.5-38.9177.1-68165.9000110.2I261 L262 L267 G268 V269 F276I261-I265 HydrophobicContact CG2-CD1 3.78Å; I261-I265 HydrophobicContact CG2-CG1 4.48Å; I261-I265 WeakPolarHBondContact O-CG1 3.31Å; I261-I265 PolarHBondContact O-N 3.43Å; L262-I265 HydrophobicContact CD2-CD1 4.28Å; L262-I265 PolarHBondContact O-N 2.96Å; I265-L267 PolarHBondContact O-N 3.37Å; I265-G268 PolarHBondContact O-N 2.94Å; I265-V269 HydrophobicContact CG2-CG2 3.91Å; I265-V269 WeakPolarHBondContact O-CG2 3.41Å; I265-V269 PolarHBondContact O-N 3.19Å; I265-F276 HydrophobicContact CB-CE2 4.28Å; I265-F276 HydrophobicContact CG2-CE2 3.79Å
266H83.4Confident84.8Confident40 Ų4057.3 Ų57.319%0.18533%0.333CS..Hα-helixtrans-57-34.3178.9-171.450.8000112.8L4 L262 Q263 L264 G268 V269 F276L4-H266 HydrophobicContact CD1-CB 4.09Å; L262-H266 WeakPolarHBondContact O-CB 3.39Å; L262-H266 PolarHBondContact O-N 3.41Å; Q263-H266 WeakPolarHBondContact O-CB 3.26Å; Q263-H266 PolarHBondContact O-N 2.82Å; L264-H266 PolarHBondContact O-N 3.41Å; H266-G268 PolarHBondContact O-N 3.49Å; H266-G268 VanDerWaalsContact O-N 3.15Å; H266-V269 PolarHBondContact O-N 2.91Å; H266-V269 VanDerWaalsContact O-N 3.14Å; H266-F276 HydrophobicContact CB-CE1 4.41Å; H266-F276 HydrophobicContact CB-CZ 3.94Å; H266-F276 AromaticContact ND1-CE1 3.97Å
267L83.8Confident84.1Confident55 Ų5558.3 Ų58.329%0.28834%0.341SS..THydrogen-bonded Turntrans-59.9-25.9177.1-61.2177.1000113.3T192 Y193 T196 L264 I265T192-L267 HydrophobicContact CG2-CD2 4.38Å; Y193-L267 HydrophobicContact CD2-CD1 3.84Å; Y193-L267 HydrophobicContact CE2-CD1 4.32Å; T196-L267 HydrophobicContact CG2-CD1 3.76Å; T196-L267 HydrophobicContact CG2-CD2 4.31Å; T196-L267 HydrophobicContact CG2-CG 4.13Å; L264-L267 HydrophobicContact CD2-CD1 4.33Å; L264-L267 WeakPolarHBondContact O-CB 3.48Å; L264-L267 PolarHBondContact O-N 3.05Å; I265-L267 PolarHBondContact O-N 3.37Å
268G80Confident83.5Confident70 Ų7063.4 Ų63.472%0.72236%0.357SS*.THydrogen-bonded Turntrans-100.8-5.4179.200000114.7I265 H266I265-G268 PolarHBondContact O-N 2.94Å; H266-G268 PolarHBondContact O-N 3.49Å; H266-G268 VanDerWaalsContact O-N 3.15Å
269V77.9Confident83.2Confident50 Ų5063.5 Ų63.530%0.30336%0.361SS..  trans-109.1107.5-174.5176.10000109.7I265 H266 N271I265-V269 HydrophobicContact CG2-CG2 3.91Å; I265-V269 WeakPolarHBondContact O-CG2 3.41Å; I265-V269 PolarHBondContact O-N 3.19Å; H266-V269 PolarHBondContact O-N 2.91Å; H266-V269 VanDerWaalsContact O-N 3.14Å; V269-N271 WeakPolarHBondContact CG1-O 3.38Å
270Q69.8Low82.8Confident181 Ų18163.5 Ų63.585%0.84636%0.361SS*.SBendtrans-73.3-31.9178.3-67.6-175.1-18.300113.1
271N72.9Confident82.4Confident142 Ų14264.6 Ų64.676%0.75937%0.369SS*.SBendtrans-127.895.7-179.4-68.1-53.6000110.2V269 S273V269-N271 WeakPolarHBondContact CG1-O 3.38Å; N271-S273 PolarHBondContact O-N 3.35Å
272P75.4Confident82.1Confident38 Ų3865.5 Ų65.525%0.24737%0.374CS..  trans-67.1133.9179.626.4-32.3000110.8F276P272-F276 HydrophobicContact CB-CB 4.42Å; P272-F276 HydrophobicContact CB-CD1 3.58Å; P272-F276 HydrophobicContact CB-CE1 4.22Å; P272-F276 HydrophobicContact CB-CG 4.26Å
273S82.1Confident82.1Confident68 Ų6864.3 Ų64.348%0.47637%0.368SS..  trans-74.3163.5173.669.20000111.4N271 A275 F276 S277N271-S273 PolarHBondContact O-N 3.35Å; S273-A275 PolarHBondContact O-N 3.23Å; S273-F276 WeakPolarHBondContact O-CB 3.4Å; S273-F276 PolarHBondContact O-N 3.4Å; S273-F276 VanDerWaalsContact O-N 3.1Å; S273-F276 PolarHBondContact OG-N 2.88Å; S273-F276 VanDerWaalsContact OG-N 3.11Å; S273-S277 PolarHBondContact O-N 3.26Å; S273-S277 PolarHBondContact O-OG 2.86Å
274I77.3Confident82.1Confident131 Ų13164 Ų6467%0.67237%0.367SS*.Hα-helixtrans-56.6-41.7171.8-64.4171.2000110.3F276 S277 Y278I274-F276 VanDerWaalsContact C-N 3.34Å; I274-F276 PolarHBondContact O-N 3.15Å; I274-S277 WeakPolarHBondContact O-CB 3.28Å; I274-S277 PolarHBondContact O-N 3.24Å; I274-Y278 HydrophobicContact CG2-CD2 3.71Å; I274-Y278 HydrophobicContact CG2-CE2 3.46Å; I274-Y278 VanDerWaalsContact CG2-CE2 3.46Å; I274-Y278 VanDerWaalsContact O-CD2 3.25Å; I274-Y278 WeakPolarHBondContact O-CD2 3.36Å; I274-Y278 PolarHBondContact O-N 3.1Å
275A82.4Confident82.1Confident70 Ų7062.3 Ų62.358%0.57936%0.359SS*.Hα-helixtrans-61.7-39.4176.500000112.7S273 S277 Y278 A279S273-A275 PolarHBondContact O-N 3.23Å; A275-S277 VanDerWaalsContact C-N 3.33Å; A275-Y278 PolarHBondContact O-N 3.1Å; A275-A279 WeakPolarHBondContact O-CB 3.41Å; A275-A279 PolarHBondContact O-N 3.18Å
276F83.2Confident82.2Confident23 Ų2362 Ų6210%0.10136%0.357CS..Hα-helixtrans-62.6-41.8174.6-177.5-91.5000111.4L4 L262 I265 H266 P272 S273 I274 A279 Y280L4-F276 HydrophobicContact CD1-CE1 3.89Å; L4-F276 HydrophobicContact CD1-CZ 4.4Å; L4-F276 HydrophobicContact CD2-CE1 4.13Å; L262-F276 HydrophobicContact CD2-CD2 4.27Å; L262-F276 HydrophobicContact CD2-CE2 3.83Å; I265-F276 HydrophobicContact CB-CE2 4.28Å; I265-F276 HydrophobicContact CG2-CE2 3.79Å; H266-F276 HydrophobicContact CB-CE1 4.41Å; H266-F276 HydrophobicContact CB-CZ 3.94Å; H266-F276 AromaticContact ND1-CE1 3.97Å; P272-F276 HydrophobicContact CB-CB 4.42Å; P272-F276 HydrophobicContact CB-CD1 3.58Å; P272-F276 HydrophobicContact CB-CE1 4.22Å; P272-F276 HydrophobicContact CB-CG 4.26Å; S273-F276 WeakPolarHBondContact O-CB 3.4Å; S273-F276 PolarHBondContact O-N 3.4Å; S273-F276 VanDerWaalsContact O-N 3.1Å; S273-F276 PolarHBondContact OG-N 2.88Å; S273-F276 VanDerWaalsContact OG-N 3.11Å; I274-F276 VanDerWaalsContact C-N 3.34Å; I274-F276 PolarHBondContact O-N 3.15Å; F276-A279 PolarHBondContact O-N 2.99Å; F276-Y280 WeakPolarHBondContact O-CB 3.46Å; F276-Y280 PolarHBondContact O-N 2.79Å
277S78.7Confident82.6Confident28 Ų2860.1 Ų60.120%0.19635%0.348CS..Hα-helixtrans-63-45177.9-54.80000111.8S273 I274 A275 Y280 S281S273-S277 PolarHBondContact O-N 3.26Å; S273-S277 PolarHBondContact O-OG 2.86Å; I274-S277 WeakPolarHBondContact O-CB 3.28Å; I274-S277 PolarHBondContact O-N 3.24Å; A275-S277 VanDerWaalsContact C-N 3.33Å; S277-Y280 PolarHBondContact O-N 3.19Å; S277-S281 PolarHBondContact O-N 3.48Å; S277-S281 PolarHBondContact O-OG 2.59Å
278Y80.9Confident82.9Confident126 Ų12657.8 Ų57.849%0.49434%0.335SS..Hα-helixtrans-62.7-43.3173.7-80.8-71.2000112.7C26 I274 A275 Y280 S281 I282C26-Y278 PolarHBondContact SG-OH 3.3Å; I274-Y278 HydrophobicContact CG2-CD2 3.71Å; I274-Y278 HydrophobicContact CG2-CE2 3.46Å; I274-Y278 VanDerWaalsContact CG2-CE2 3.46Å; I274-Y278 VanDerWaalsContact O-CD2 3.25Å; I274-Y278 WeakPolarHBondContact O-CD2 3.36Å; I274-Y278 PolarHBondContact O-N 3.1Å; A275-Y278 PolarHBondContact O-N 3.1Å; Y278-Y280 VanDerWaalsContact C-N 3.27Å; Y278-Y280 PolarHBondContact O-N 2.79Å; Y278-S281 PolarHBondContact O-N 3.48Å; Y278-I282 WeakPolarHBondContact O-CG1 3.42Å; Y278-I282 PolarHBondContact O-N 3.48Å
279A86Confident83.4Confident40 Ų4055.6 Ų55.633%0.33131%0.311SS..Hα-helixtrans-60.6-39.6176.900000111.4L262 A275 F276 I282 A283L262-A279 HydrophobicContact CD1-CB 4.08Å; L262-A279 WeakPolarHBondContact CD1-O 3.24Å; A275-A279 WeakPolarHBondContact O-CB 3.41Å; A275-A279 PolarHBondContact O-N 3.18Å; F276-A279 PolarHBondContact O-N 2.99Å; A279-I282 PolarHBondContact O-N 3.22Å; A279-A283 VanDerWaalsContact O-CB 3.31Å; A279-A283 WeakPolarHBondContact O-CB 3.46Å; A279-A283 PolarHBondContact O-N 3.49Å
280Y84.3Confident84Confident8 Ų853.3 Ų53.33%0.03130%0.297CS..Hα-helixtrans-65.4-45.1176-167.5-97.6000112.2D2 L4 Y259 L262 Q263 F276 S277 Y278 I282 A283 I284D2-Y280 VanDerWaalsContact CB-OH 3.28Å; D2-Y280 WeakPolarHBondContact CB-OH 3.34Å; L4-Y280 HydrophobicContact CB-CD1 3.77Å; L4-Y280 HydrophobicContact CB-CE1 3.37Å; L4-Y280 HydrophobicContact CB-CE2 4.26Å; L4-Y280 HydrophobicContact CB-CG 4.34Å; L4-Y280 HydrophobicContact CD1-CD1 4.09Å; L4-Y280 HydrophobicContact CD1-CD2 3.42Å; L4-Y280 VanDerWaalsContact CD1-CD2 3.42Å; L4-Y280 HydrophobicContact CD1-CE1 3.97Å; L4-Y280 HydrophobicContact CD1-CE2 3.27Å; L4-Y280 HydrophobicContact CD1-CG 3.81Å; L4-Y280 HydrophobicContact CG-CE1 4.31Å; L4-Y280 HydrophobicContact CG-CE2 4.38Å; Y259-Y280 HydrophobicContact CD2-CE2 4.22Å; Y259-Y280 HydrophobicContact CE2-CE2 4.22Å; Y259-Y280 AromaticContact CE2-CZ 3.92Å; Y259-Y280 WeakPolarHBondContact CE2-OH 3.29Å; L262-Y280 HydrophobicContact CB-CD2 4.03Å; L262-Y280 HydrophobicContact CD1-CD2 4.48Å; Q263-Y280 PolarHBondContact OE1-OH 3.11Å; F276-Y280 WeakPolarHBondContact O-CB 3.46Å; F276-Y280 PolarHBondContact O-N 2.79Å; S277-Y280 PolarHBondContact O-N 3.19Å; Y278-Y280 VanDerWaalsContact C-N 3.27Å; Y278-Y280 PolarHBondContact O-N 2.79Å; Y280-I282 VanDerWaalsContact C-N 3.29Å; Y280-I282 PolarHBondContact O-N 3.17Å; Y280-A283 WeakPolarHBondContact O-CB 3.49Å; Y280-A283 PolarHBondContact O-N 3.44Å; Y280-A283 VanDerWaalsContact O-N 3.1Å; Y280-I284 WeakPolarHBondContact O-CG2 3.49Å; Y280-I284 PolarHBondContact O-N 2.91Å
281S82.7Confident84.9Confident30 Ų3044.9 Ų44.921%0.2126%0.258CS..Hα-helixtrans-59.7-38.2174.8-64.80000112.7S277 Y278 I284 S285S277-S281 PolarHBondContact O-N 3.48Å; S277-S281 PolarHBondContact O-OG 2.59Å; Y278-S281 PolarHBondContact O-N 3.48Å; S281-I284 VanDerWaalsContact O-CG2 3.24Å; S281-I284 WeakPolarHBondContact O-CG2 3.25Å; S281-S285 WeakPolarHBondContact O-CB 3Å; S281-S285 PolarHBondContact O-N 3.37Å; S281-S285 VanDerWaalsContact O-N 3.15Å; S281-S285 PolarHBondContact O-OG 3.26Å
282I86.6Confident85.6Confident105 Ų10538.6 Ų38.654%0.53823%0.225SC..Hα-helixtrans-67.8-44.2173.6-67.9166.6000110.3Y278 A279 Y280 S285 M286Y278-I282 WeakPolarHBondContact O-CG1 3.42Å; Y278-I282 PolarHBondContact O-N 3.48Å; A279-I282 PolarHBondContact O-N 3.22Å; Y280-I282 VanDerWaalsContact C-N 3.29Å; Y280-I282 PolarHBondContact O-N 3.17Å; I282-S285 WeakPolarHBondContact O-CB 3.44Å; I282-S285 PolarHBondContact O-N 3.24Å; I282-M286 HydrophobicContact CG2-CG 4.43Å; I282-M286 HydrophobicContact CG2-SD 4.2Å; I282-M286 WeakPolarHBondContact O-CG 3.36Å; I282-M286 PolarHBondContact O-N 3.2Å
283A90.5Very high86.2Confident1 Ų139.3 Ų39.31%0.00823%0.226CC..Hα-helixtrans-63.4-44.4-178.600000113.1P258 L262 A279 Y280 S285 M286 G287P258-A283 HydrophobicContact CB-CB 3.69Å; L262-A283 HydrophobicContact CD1-CB 3.61Å; A279-A283 VanDerWaalsContact O-CB 3.31Å; A279-A283 WeakPolarHBondContact O-CB 3.46Å; A279-A283 PolarHBondContact O-N 3.49Å; Y280-A283 WeakPolarHBondContact O-CB 3.49Å; Y280-A283 PolarHBondContact O-N 3.44Å; Y280-A283 VanDerWaalsContact O-N 3.1Å; A283-S285 VanDerWaalsContact C-N 3.33Å; A283-M286 WeakPolarHBondContact O-CB 3.42Å; A283-M286 PolarHBondContact O-N 2.87Å; A283-G287 PolarHBondContact O-N 3.35Å
284I87.9Confident86.3Confident8 Ų836.2 Ų36.24%0.04120%0.204CC..Hα-helixtrans-65-39.2174.6-165.4169.9000110.9D2 F34 Y280 S281 M286 G287 Y288D2-I284 WeakPolarHBondContact OD2-CD1 3.25Å; F34-I284 HydrophobicContact CZ-CG2 4.1Å; Y280-I284 WeakPolarHBondContact O-CG2 3.49Å; Y280-I284 PolarHBondContact O-N 2.91Å; S281-I284 VanDerWaalsContact O-CG2 3.24Å; S281-I284 WeakPolarHBondContact O-CG2 3.25Å; I284-M286 VanDerWaalsContact C-N 3.31Å; I284-M286 PolarHBondContact O-N 3.34Å; I284-G287 PolarHBondContact O-N 3.27Å; I284-Y288 HydrophobicContact CD1-CE2 4.16Å; I284-Y288 HydrophobicContact CG1-CD2 4.27Å; I284-Y288 HydrophobicContact CG1-CE1 4.31Å; I284-Y288 HydrophobicContact CG1-CE2 3.89Å; I284-Y288 WeakPolarHBondContact O-CB 3.44Å; I284-Y288 PolarHBondContact O-N 3.39Å
285S89.9Confident86.7Confident15 Ų1530.2 Ų30.211%0.10517%0.174CC..Hα-helixtrans-60.6-40.2174-59.60000112.1L30 F34 S281 I282 A283 Y288 A289L30-S285 VanDerWaalsContact CD1-OG 3.28Å; L30-S285 WeakPolarHBondContact CD1-OG 3Å; F34-S285 WeakPolarHBondContact CE1-OG 3.4Å; S281-S285 WeakPolarHBondContact O-CB 3Å; S281-S285 PolarHBondContact O-N 3.37Å; S281-S285 VanDerWaalsContact O-N 3.15Å; S281-S285 PolarHBondContact O-OG 3.26Å; I282-S285 WeakPolarHBondContact O-CB 3.44Å; I282-S285 PolarHBondContact O-N 3.24Å; A283-S285 VanDerWaalsContact C-N 3.33Å; S285-Y288 PolarHBondContact O-N 3.47Å; S285-A289 WeakPolarHBondContact O-CB 3.34Å; S285-A289 PolarHBondContact O-N 3.22Å
286M91.1Very high86.7Confident73 Ų7333 Ų3336%0.3617%0.173SC..Hα-helixtrans-64.6-46.1175.1-73.6179.867.400111.5T254 C255 P258 I282 A283 I284 Y288 A289 N290T254-M286 WeakPolarHBondContact O-CE 3.43Å; C255-M286 VanDerWaalsContact CB-O 3.29Å; C255-M286 WeakPolarHBondContact CB-O 3.49Å; C255-M286 CarbonylContact O-C 3.5Å; P258-M286 HydrophobicContact CG-CE 3.99Å; P258-M286 HydrophobicContact CG-SD 4.08Å; I282-M286 HydrophobicContact CG2-CG 4.43Å; I282-M286 HydrophobicContact CG2-SD 4.2Å; I282-M286 WeakPolarHBondContact O-CG 3.36Å; I282-M286 PolarHBondContact O-N 3.2Å; A283-M286 WeakPolarHBondContact O-CB 3.42Å; A283-M286 PolarHBondContact O-N 2.87Å; I284-M286 VanDerWaalsContact C-N 3.31Å; I284-M286 PolarHBondContact O-N 3.34Å; M286-Y288 VanDerWaalsContact C-N 3.26Å; M286-Y288 PolarHBondContact O-N 3.49Å; M286-A289 PolarHBondContact O-N 3.07Å; M286-N290 PolarHBondContact O-N 3.33Å
287G90.5Very high86.7Confident0 Ų033.4 Ų33.40%018%0.176CC..Hα-helixtrans-56.3-42.7175.300000111.8C255 W256 A283 I284 N290C255-G287 PolarHBondContact O-N 3.19Å; W256-G287 WeakPolarHBondContact CZ2-O 3.47Å; A283-G287 PolarHBondContact O-N 3.35Å; I284-G287 PolarHBondContact O-N 3.27Å; G287-N290 WeakPolarHBondContact O-CB 3.48Å; G287-N290 PolarHBondContact O-N 3.41Å
288Y90.4Very high86.8Confident6 Ų632.1 Ų32.12%0.02417%0.167CC..Hα-helixtrans-69.5-35.9178-75.50000113.5F34 I37 F79 M83 L86 W256 I284 S285 M286 N290F34-Y288 HydrophobicContact CD1-CD2 4.07Å; F34-Y288 HydrophobicContact CD2-CD2 4.14Å; F34-Y288 HydrophobicContact CD2-CE2 4.18Å; F34-Y288 AromaticContact CE1-CD2 3.61Å; F34-Y288 HydrophobicContact CE1-CD2 3.61Å; F34-Y288 HydrophobicContact CE1-CE2 4.24Å; F34-Y288 AromaticContact CE2-CD2 3.69Å; F34-Y288 HydrophobicContact CE2-CD2 3.69Å; F34-Y288 AromaticContact CE2-CE2 3.51Å; F34-Y288 HydrophobicContact CE2-CE2 3.51Å; F34-Y288 HydrophobicContact CG-CD2 4.32Å; F34-Y288 AromaticContact CZ-CD2 3.4Å; F34-Y288 HydrophobicContact CZ-CD2 3.4Å; F34-Y288 VanDerWaalsContact CZ-CD2 3.4Å; F34-Y288 AromaticContact CZ-CE2 3.55Å; F34-Y288 HydrophobicContact CZ-CE2 3.55Å; I37-Y288 WeakPolarHBondContact CG2-O 3.35Å; F79-Y288 AromaticContact CE1-CD1 3.92Å; F79-Y288 HydrophobicContact CE1-CD1 3.92Å; F79-Y288 HydrophobicContact CE1-CE1 4.41Å; F79-Y288 HydrophobicContact CE1-CG 4.47Å; F79-Y288 HydrophobicContact CE2-CD1 4.14Å; F79-Y288 AromaticContact CE2-CE1 3.88Å; F79-Y288 HydrophobicContact CE2-CE1 3.88Å; F79-Y288 AromaticContact CZ-CD1 3.24Å; F79-Y288 HydrophobicContact CZ-CD1 3.24Å; F79-Y288 AromaticContact CZ-CE1 3.44Å; F79-Y288 HydrophobicContact CZ-CE1 3.44Å; F79-Y288 VanDerWaalsContact CZ-CE1 3.44Å; F79-Y288 HydrophobicContact CZ-CG 4.18Å; M83-Y288 VanDerWaalsContact CE-CB 3.45Å; M83-Y288 HydrophobicContact CE-CD1 3.65Å; M83-Y288 HydrophobicContact CE-CD2 3.49Å; M83-Y288 VanDerWaalsContact CE-CD2 3.49Å; M83-Y288 HydrophobicContact CE-CE1 4.11Å; M83-Y288 HydrophobicContact CE-CE2 4.06Å; M83-Y288 HydrophobicContact CE-CG 3.23Å; M83-Y288 HydrophobicContact SD-CD2 4.4Å; L86-Y288 HydrophobicContact CD2-CE2 3.44Å; L86-Y288 VanDerWaalsContact CD2-CE2 3.44Å; L86-Y288 VanDerWaalsContact CD2-OH 3.3Å; L86-Y288 WeakPolarHBondContact CD2-OH 3.19Å; W256-Y288 HydrophobicContact CH2-CD1 4.46Å; I284-Y288 HydrophobicContact CD1-CE2 4.16Å; I284-Y288 HydrophobicContact CG1-CD2 4.27Å; I284-Y288 HydrophobicContact CG1-CE1 4.31Å; I284-Y288 HydrophobicContact CG1-CE2 3.89Å; I284-Y288 WeakPolarHBondContact O-CB 3.44Å; I284-Y288 PolarHBondContact O-N 3.39Å; S285-Y288 PolarHBondContact O-N 3.47Å; M286-Y288 VanDerWaalsContact C-N 3.26Å; M286-Y288 PolarHBondContact O-N 3.49Å; Y288-N290 PolarHBondContact O-N 3.29Å
289A91.1Very high86.6Confident25 Ų2528.9 Ų28.921%0.20716%0.158CC..Hα-helixtrans-64.3-20.117500000113.2I37 S285 M286 S291 C292 I293I37-A289 HydrophobicContact CD1-CB 4.13Å; I37-A289 HydrophobicContact CG1-CB 4.47Å; S285-A289 WeakPolarHBondContact O-CB 3.34Å; S285-A289 PolarHBondContact O-N 3.22Å; M286-A289 PolarHBondContact O-N 3.07Å; A289-S291 VanDerWaalsContact C-N 3.27Å; A289-S291 PolarHBondContact O-N 3.21Å; A289-C292 WeakPolarHBondContact O-CB 3.25Å; A289-C292 PolarHBondContact O-N 2.94Å; A289-I293 HydrophobicContact CB-CD1 4.49Å; A289-I293 WeakPolarHBondContact O-CG1 3.44Å; A289-I293 PolarHBondContact O-N 3.45Å
290N90.1Very high85.9Confident2 Ų229.9 Ų29.91%0.01117%0.172CC..Hα-helixtrans-50.1-46177.2176.164.3000112.7F252 C255 M286 G287 Y288 C292 I293F252-N290 WeakPolarHBondContact CA-OD1 3.36Å; F252-N290 VanDerWaalsContact CD2-ND2 3.35Å; F252-N290 WeakPolarHBondContact CD2-ND2 3.4Å; F252-N290 WeakPolarHBondContact CD2-OD1 3.2Å; C255-N290 HydrophobicContact CB-CB 3.9Å; M286-N290 PolarHBondContact O-N 3.33Å; G287-N290 WeakPolarHBondContact O-CB 3.48Å; G287-N290 PolarHBondContact O-N 3.41Å; Y288-N290 PolarHBondContact O-N 3.29Å; N290-C292 PolarHBondContact O-N 3.49Å; N290-I293 PolarHBondContact O-N 2.88Å; N290-I293 VanDerWaalsContact O-N 3.13Å
291S88.6Confident85.1Confident4 Ų431.6 Ų31.63%0.02818%0.181CC..Hα-helixtrans-64.7-22.3-179.5-640000113.2N45 D76 F79 A289N45-S291 PolarHBondContact ND2-O 2.64Å; D76-S291 WeakPolarHBondContact OD1-CA 3.38Å; D76-S291 VanDerWaalsContact OD1-CB 3.27Å; D76-S291 WeakPolarHBondContact OD1-CB 3.09Å; D76-S291 PolarHBondContact OD1-OG 2.68Å; F79-S291 VanDerWaalsContact CD1-OG 3.28Å; F79-S291 WeakPolarHBondContact CD1-OG 3.31Å; A289-S291 VanDerWaalsContact C-N 3.27Å; A289-S291 PolarHBondContact O-N 3.21Å
292C88.1Confident84.5Confident10 Ų1031 Ų317%0.06818%0.177CC..Hα-helixtrans-84.6-30.9175.7-59.60000112.9I37 G41 A289 N290 N294 P295 F296I37-C292 VanDerWaalsContact CG2-SG 3.51Å; I37-C292 PolarHBondContact O-SG 3.37Å; G41-C292 VanDerWaalsContact CA-SG 3.53Å; G41-C292 PolarHBondContact N-SG 3.12Å; G41-C292 VanDerWaalsContact N-SG 3.44Å; A289-C292 WeakPolarHBondContact O-CB 3.25Å; A289-C292 PolarHBondContact O-N 2.94Å; N290-C292 PolarHBondContact O-N 3.49Å; C292-N294 VanDerWaalsContact C-N 3.35Å; C292-P295 WeakPolarHBondContact O-CD 3.41Å; C292-F296 WeakPolarHBondContact O-CD2 3.34Å; C292-F296 VanDerWaalsContact O-CE2 3.28Å; C292-F296 WeakPolarHBondContact O-CE2 3.39Å
293I87.6Confident83.6Confident53 Ų5330.3 Ų30.327%0.27217%0.172SC..Hα-helixtrans-71-33.5-174.3-69.3163.3000111.2A251 C255 A289 N290 F296 L297A251-I293 HydrophobicContact CB-CG2 4.05Å; C255-I293 WeakPolarHBondContact SG-CD1 3.3Å; A289-I293 HydrophobicContact CB-CD1 4.49Å; A289-I293 WeakPolarHBondContact O-CG1 3.44Å; A289-I293 PolarHBondContact O-N 3.45Å; N290-I293 PolarHBondContact O-N 2.88Å; N290-I293 VanDerWaalsContact O-N 3.13Å; I293-F296 WeakPolarHBondContact O-CB 3.28Å; I293-F296 PolarHBondContact O-N 3.1Å; I293-L297 HydrophobicContact CG2-CD1 3.73Å; I293-L297 HydrophobicContact CG2-CD2 4.36Å; I293-L297 HydrophobicContact CG2-CG 3.76Å; I293-L297 WeakPolarHBondContact O-CG 3.5Å; I293-L297 PolarHBondContact O-N 2.89Å
294N84.8Confident82.4Confident2 Ų232.9 Ų32.91%0.01119%0.188CC..Hα-helixtrans-51-53.5-176.7-74.1-25000113.9D76 C292 F296 L297 Y298D76-N294 PolarHBondContact OD2-ND2 3.21Å; C292-N294 VanDerWaalsContact C-N 3.35Å; N294-F296 VanDerWaalsContact C-N 3.35Å; N294-F296 PolarHBondContact O-N 2.94Å; N294-L297 WeakPolarHBondContact O-CB 3.49Å; N294-L297 PolarHBondContact O-N 3.45Å; N294-Y298 HydrophobicContact CB-CE2 4Å; N294-Y298 WeakPolarHBondContact O-CD2 3.47Å; N294-Y298 VanDerWaalsContact O-CG 3.22Å; N294-Y298 PolarHBondContact O-N 3.37Å
295P84.6Confident81.5Confident5 Ų533.1 Ų33.13%0.03219%0.188CC..Hα-helixtrans-52.6-43.7173.2-29.333.3000115V48 C292 Y298 I299V48-P295 HydrophobicContact CG2-CB 4.06Å; V48-P295 HydrophobicContact CG2-CG 4.15Å; C292-P295 WeakPolarHBondContact O-CD 3.41Å; P295-Y298 PolarHBondContact O-N 2.98Å; P295-I299 WeakPolarHBondContact O-CG1 2.82Å; P295-I299 PolarHBondContact O-N 3.29Å
296F82.7Confident80.8Confident129 Ų12937.6 Ų37.657%0.56621%0.206SC*.Hα-helixtrans-65.9-40.2179.1-62-79.4000111.5C292 I293 N294 Y298 I299 G300C292-F296 WeakPolarHBondContact O-CD2 3.34Å; C292-F296 VanDerWaalsContact O-CE2 3.28Å; C292-F296 WeakPolarHBondContact O-CE2 3.39Å; I293-F296 WeakPolarHBondContact O-CB 3.28Å; I293-F296 PolarHBondContact O-N 3.1Å; N294-F296 VanDerWaalsContact C-N 3.35Å; N294-F296 PolarHBondContact O-N 2.94Å; F296-Y298 VanDerWaalsContact C-N 3.34Å; F296-Y298 PolarHBondContact O-N 2.96Å; F296-I299 PolarHBondContact O-N 3.4Å; F296-G300 PolarHBondContact O-N 2.89Å
297L83.1Confident80Confident31 Ų3140.7 Ų40.716%0.16221%0.213CC..Hα-helixtrans-62.2-41.4174.5-66.4178.3000111.5I248 A251 I293 N294 L301I248-L297 HydrophobicContact CB-CD1 4.38Å; I248-L297 HydrophobicContact CG1-CB 4.32Å; I248-L297 HydrophobicContact CG1-CD1 4.03Å; A251-L297 HydrophobicContact CB-CD1 3.61Å; I293-L297 HydrophobicContact CG2-CD1 3.73Å; I293-L297 HydrophobicContact CG2-CD2 4.36Å; I293-L297 HydrophobicContact CG2-CG 3.76Å; I293-L297 WeakPolarHBondContact O-CG 3.5Å; I293-L297 PolarHBondContact O-N 2.89Å; N294-L297 WeakPolarHBondContact O-CB 3.49Å; N294-L297 PolarHBondContact O-N 3.45Å; L297-L301 HydrophobicContact CB-CD1 4.37Å; L297-L301 HydrophobicContact CD2-CD1 3.98Å; L297-L301 WeakPolarHBondContact O-CB 3.48Å; L297-L301 WeakPolarHBondContact O-CG 3.08Å; L297-L301 PolarHBondContact O-N 2.97Å
298Y80.8Confident79.2Confident1 Ų142.7 Ų42.70%0.00422%0.223CC..Hα-helixtrans-65.7-43.6177.4-54.5-33.5000112V48 I69 L72 I248 N294 P295 F296 S302V48-Y298 HydrophobicContact CG1-CD2 3.98Å; V48-Y298 HydrophobicContact CG1-CE2 4.09Å; V48-Y298 HydrophobicContact CG2-CD2 3.71Å; V48-Y298 HydrophobicContact CG2-CE2 4.24Å; I69-Y298 HydrophobicContact CD1-CD1 4.36Å; I69-Y298 HydrophobicContact CD1-CE1 4.34Å; I69-Y298 HydrophobicContact CG1-CE1 4.04Å; I69-Y298 HydrophobicContact CG2-CD2 3.94Å; I69-Y298 HydrophobicContact CG2-CE1 4.2Å; I69-Y298 HydrophobicContact CG2-CE2 3.57Å; I69-Y298 HydrophobicContact CG2-CG 4.41Å; L72-Y298 VanDerWaalsContact CD2-OH 3.25Å; L72-Y298 WeakPolarHBondContact CD2-OH 3.37Å; I248-Y298 HydrophobicContact CD1-CD1 4.12Å; I248-Y298 HydrophobicContact CD1-CE1 3.61Å; I248-Y298 HydrophobicContact CG1-CE1 4.15Å; N294-Y298 HydrophobicContact CB-CE2 4Å; N294-Y298 WeakPolarHBondContact O-CD2 3.47Å; N294-Y298 VanDerWaalsContact O-CG 3.22Å; N294-Y298 PolarHBondContact O-N 3.37Å; P295-Y298 PolarHBondContact O-N 2.98Å; F296-Y298 VanDerWaalsContact C-N 3.34Å; F296-Y298 PolarHBondContact O-N 2.96Å; Y298-S302 WeakPolarHBondContact O-CA 3.45Å; Y298-S302 WeakPolarHBondContact O-CB 3.45Å; Y298-S302 PolarHBondContact O-N 3.14Å
299I76.9Confident78.6Confident59 Ų5944.8 Ų44.830%0.30323%0.232SC..Hα-helixtrans-65.2-42.2178.2-66.1167.3000111.4P295 F296 F305P295-I299 WeakPolarHBondContact O-CG1 2.82Å; P295-I299 PolarHBondContact O-N 3.29Å; F296-I299 PolarHBondContact O-N 3.4Å; I299-F305 HydrophobicContact CG1-CD1 4.08Å; I299-F305 HydrophobicContact CG1-CE1 3.72Å
300G70.7Confident78.1Confident61 Ų6147.5 Ų47.563%0.62924%0.243SC*.Hα-helixtrans-76.5-36.3-176.900000114.1F296F296-G300 PolarHBondContact O-N 2.89Å
301L68.7Low77.4Confident43 Ų4355.5 Ų55.523%0.22527%0.273CS..Hα-helixtrans-109.3-21.1-169-56173.9000113.9M244 A247 L297M244-L301 HydrophobicContact CB-CB 4.09Å; M244-L301 HydrophobicContact CG-CB 3.91Å; A247-L301 HydrophobicContact CB-CD1 3.22Å; L297-L301 HydrophobicContact CB-CD1 4.37Å; L297-L301 HydrophobicContact CD2-CD1 3.98Å; L297-L301 WeakPolarHBondContact O-CB 3.48Å; L297-L301 WeakPolarHBondContact O-CG 3.08Å; L297-L301 PolarHBondContact O-N 2.97Å
302S70.3Confident76.6Confident19 Ų1955.8 Ų55.813%0.13328%0.275CS..  trans-101.998.2176-172.40000111.5M244 Y298 T304 F305 K306M244-S302 WeakPolarHBondContact SD-CB 3.35Å; Y298-S302 WeakPolarHBondContact O-CA 3.45Å; Y298-S302 WeakPolarHBondContact O-CB 3.45Å; Y298-S302 PolarHBondContact O-N 3.14Å; S302-T304 PolarHBondContact O-N 3.29Å; S302-F305 VanDerWaalsContact CB-CB 3.49Å; S302-F305 PolarHBondContact O-N 2.97Å; S302-F305 VanDerWaalsContact OG-CB 3.32Å; S302-F305 WeakPolarHBondContact OG-CB 3.41Å; S302-F305 PolarHBondContact OG-N 3Å; S302-F305 VanDerWaalsContact OG-N 3.08Å; S302-K306 WeakPolarHBondContact O-CB 3.24Å; S302-K306 PolarHBondContact O-N 3.36Å
303E66.2Low75.9Confident89 Ų8959.7 Ų59.742%0.41630%0.299SS..Hα-helixtrans-60.9-26171.1-80.1-174.1-154.300113.4K240 R307K240-E303 VanDerWaalsContact NZ-CD 3.34Å; K240-E303 IonicContact NZ-OE1 2.68Å; K240-E303 PolarHBondContact NZ-OE1 2.87Å; K240-E303 IonicContact NZ-OE2 3.46Å; K240-E303 PolarHBondContact NZ-OE2 3.4Å; E303-R307 WeakPolarHBondContact O-CB 3.35Å; E303-R307 WeakPolarHBondContact O-CG 3.31Å; E303-R307 PolarHBondContact O-N 3.42Å; E303-R307 PolarHBondContact O-NE 3.15Å; E303-R307 IonicContact OE2-NH2 3.25Å; E303-R307 PolarHBondContact OE2-NH2 2.78Å
304T66.5Low75.3Confident56 Ų5665.8 Ų65.834%0.34432%0.318SS..Hα-helixtrans-70.3-50.2176.2-48.70000108.9S302 R307 H308S302-T304 PolarHBondContact O-N 3.29Å; T304-R307 PolarHBondContact O-N 3.39Å; T304-H308 PolarHBondContact O-CD2 3.48Å; T304-H308 PolarHBondContact O-N 3.38Å
305F69.3Low74Confident13 Ų1370.7 Ų70.76%0.05735%0.35CS..Hα-helixtrans-60.8-48.5175.7-173.8-94.6000111.1V48 T51 I299 S302 R307 H308 F309V48-F305 HydrophobicContact CB-CE2 4.27Å; V48-F305 HydrophobicContact CB-CZ 4.13Å; V48-F305 HydrophobicContact CG1-CE2 3.96Å; V48-F305 HydrophobicContact CG1-CZ 4.29Å; V48-F305 HydrophobicContact CG2-CE2 4.23Å; V48-F305 HydrophobicContact CG2-CZ 3.72Å; T51-F305 HydrophobicContact CG2-CD2 4.1Å; T51-F305 HydrophobicContact CG2-CE2 3.73Å; T51-F305 HydrophobicContact CG2-CZ 4.09Å; I299-F305 HydrophobicContact CG1-CD1 4.08Å; I299-F305 HydrophobicContact CG1-CE1 3.72Å; S302-F305 VanDerWaalsContact CB-CB 3.49Å; S302-F305 PolarHBondContact O-N 2.97Å; S302-F305 VanDerWaalsContact OG-CB 3.32Å; S302-F305 WeakPolarHBondContact OG-CB 3.41Å; S302-F305 PolarHBondContact OG-N 3Å; S302-F305 VanDerWaalsContact OG-N 3.08Å; F305-R307 VanDerWaalsContact C-N 3.31Å; F305-R307 PolarHBondContact O-N 3.21Å; F305-H308 CarbonylContact O-C 3.59Å; F305-H308 PolarHBondContact O-N 3.24Å; F305-F309 HydrophobicContact CE1-CB 4.3Å; F305-F309 WeakPolarHBondContact O-CB 3.44Å; F305-F309 PolarHBondContact O-N 2.97Å
306K75.6Confident72.7Confident108 Ų10877 Ų7747%0.4738%0.382SS..Hα-helixtrans-54.1-44.6176.5-174.1175.3-178.61740112.2S302 L310S302-K306 WeakPolarHBondContact O-CB 3.24Å; S302-K306 PolarHBondContact O-N 3.36Å; K306-L310 HydrophobicContact CG-CD1 4.17Å; K306-L310 WeakPolarHBondContact O-CB 3.35Å; K306-L310 VanDerWaalsContact O-CG 3.22Å; K306-L310 WeakPolarHBondContact O-CG 3.43Å; K306-L310 PolarHBondContact O-N 3.02Å
307R74.1Confident71Confident138 Ų13877.9 Ų77.952%0.52139%0.393SS..Hα-helixtrans-64.6-41.2175.7-84-176.5-95.6-151.2-10.8112.6E303 T304 F305 R311E303-R307 WeakPolarHBondContact O-CB 3.35Å; E303-R307 WeakPolarHBondContact O-CG 3.31Å; E303-R307 PolarHBondContact O-N 3.42Å; E303-R307 PolarHBondContact O-NE 3.15Å; E303-R307 IonicContact OE2-NH2 3.25Å; E303-R307 PolarHBondContact OE2-NH2 2.78Å; T304-R307 PolarHBondContact O-N 3.39Å; F305-R307 VanDerWaalsContact C-N 3.31Å; F305-R307 PolarHBondContact O-N 3.21Å; R307-R311 WeakPolarHBondContact O-CG 3.28Å; R307-R311 PolarHBondContact O-N 3.44Å
308H74Confident69.3Low43 Ų4386.9 Ų86.920%0.19943%0.425CS..Hα-helixtrans-69.1-41.9177.2-72.7-64.9000112.2T51 K55 T304 F305 R311 A312T51-H308 HydrophobicContact CG2-CB 3.79Å; K55-H308 WeakPolarHBondContact CE-NE2 3.24Å; T304-H308 PolarHBondContact O-CD2 3.48Å; T304-H308 PolarHBondContact O-N 3.38Å; F305-H308 CarbonylContact O-C 3.59Å; F305-H308 PolarHBondContact O-N 3.24Å; H308-R311 CarbonylContact O-C 3.58Å; H308-R311 PolarHBondContact O-N 3.4Å; H308-A312 VanDerWaalsContact O-CB 3.26Å; H308-A312 WeakPolarHBondContact O-CB 3.34Å; H308-A312 PolarHBondContact O-N 3.3Å
309F77.6Confident67.4Low49 Ų4996.1 Ų96.122%0.21547%0.465CS..Hα-helixtrans-58-50.6173.4174.8-104.6000110.9I47 T51 F305 R311 A312 V313I47-F309 HydrophobicContact CG2-CD2 3.64Å; I47-F309 HydrophobicContact CG2-CE2 3.39Å; T51-F309 HydrophobicContact CG2-CB 4.25Å; F305-F309 HydrophobicContact CE1-CB 4.3Å; F305-F309 WeakPolarHBondContact O-CB 3.44Å; F305-F309 PolarHBondContact O-N 2.97Å; F309-R311 VanDerWaalsContact C-N 3.3Å; F309-R311 PolarHBondContact O-N 2.9Å; F309-A312 WeakPolarHBondContact O-CA 3.44Å; F309-A312 WeakPolarHBondContact O-CB 3.4Å; F309-A312 PolarHBondContact O-N 3.4Å; F309-V313 HydrophobicContact CD2-CG2 4Å; F309-V313 HydrophobicContact CE1-CG2 4.23Å; F309-V313 HydrophobicContact CE2-CG2 3.62Å; F309-V313 HydrophobicContact CG-CG2 4.45Å; F309-V313 HydrophobicContact CZ-CG2 3.76Å; F309-V313 VanDerWaalsContact O-CG2 3.31Å; F309-V313 WeakPolarHBondContact O-CG2 3.39Å; F309-V313 PolarHBondContact O-N 3.18Å
310L79.1Confident65.6Low82 Ų82101.9 Ų101.943%0.42949%0.488SS..Hα-helixtrans-60.9-37176.8-71171.1000112.7K306 A312 R314K306-L310 HydrophobicContact CG-CD1 4.17Å; K306-L310 WeakPolarHBondContact O-CB 3.35Å; K306-L310 VanDerWaalsContact O-CG 3.22Å; K306-L310 WeakPolarHBondContact O-CG 3.43Å; K306-L310 PolarHBondContact O-N 3.02Å; L310-A312 VanDerWaalsContact C-N 3.35Å; L310-R314 WeakPolarHBondContact O-CB 3.49Å; L310-R314 VanDerWaalsContact O-CG 3.23Å; L310-R314 WeakPolarHBondContact O-CG 3.38Å; L310-R314 PolarHBondContact O-N 3.05Å
311R75.9Confident64.2Low171 Ų171109.5 Ų109.565%0.64550%0.498SS*.Hα-helixtrans-71.5-30.1172.6-74.1179-171.6171.61.8112.7R307 H308 F309R307-R311 WeakPolarHBondContact O-CG 3.28Å; R307-R311 PolarHBondContact O-N 3.44Å; H308-R311 CarbonylContact O-C 3.58Å; H308-R311 PolarHBondContact O-N 3.4Å; F309-R311 VanDerWaalsContact C-N 3.3Å; F309-R311 PolarHBondContact O-N 2.9Å
312A71.9Confident62.7Low10 Ų10112.1 Ų112.18%0.08352%0.516CS..Hα-helixtrans-72.5-35.8178.700000111.7Y50 K54 H308 F309 L310Y50-A312 HydrophobicContact CE1-CB 4.08Å; K54-A312 HydrophobicContact CD-CB 3.76Å; K54-A312 PolarHBondContact NZ-O 2.89Å; H308-A312 VanDerWaalsContact O-CB 3.26Å; H308-A312 WeakPolarHBondContact O-CB 3.34Å; H308-A312 PolarHBondContact O-N 3.3Å; F309-A312 WeakPolarHBondContact O-CA 3.44Å; F309-A312 WeakPolarHBondContact O-CB 3.4Å; F309-A312 PolarHBondContact O-N 3.4Å; L310-A312 VanDerWaalsContact C-N 3.35Å
313V74.5Confident61.1Low92 Ų92117.1 Ų117.156%0.55854%0.541SS*.Hα-helixtrans-88.6-23.7-178.4179.70000112.7F309F309-V313 HydrophobicContact CD2-CG2 4Å; F309-V313 HydrophobicContact CE1-CG2 4.23Å; F309-V313 HydrophobicContact CE2-CG2 3.62Å; F309-V313 HydrophobicContact CG-CG2 4.45Å; F309-V313 HydrophobicContact CZ-CG2 3.76Å; F309-V313 VanDerWaalsContact O-CG2 3.31Å; F309-V313 WeakPolarHBondContact O-CG2 3.39Å; F309-V313 PolarHBondContact O-N 3.18Å
314R74.9Confident59.7Low180 Ų180118.6 Ų118.668%0.67956%0.558SS**SBendtrans-60.2126.8173-86174.6-173.2-168.20.9110.2L310 I316L310-R314 WeakPolarHBondContact O-CB 3.49Å; L310-R314 VanDerWaalsContact O-CG 3.23Å; L310-R314 WeakPolarHBondContact O-CG 3.38Å; L310-R314 PolarHBondContact O-N 3.05Å; R314-I316 PolarHBondContact O-N 3.3Å
315P56.1Low58.3Low106 Ų106120.5 Ų120.569%0.68857%0.574SS**  trans-58.4138.8173.822.2-30000109.1N317P315-N317 PolarHBondContact O-N 2.95Å
316I57.8Low57.1Low137 Ų137126.3 Ų126.370%0.70361%0.61SS**  trans-67.785.6174.1-62.4169.3000106.4R314 R318R314-I316 PolarHBondContact O-N 3.3Å; I316-R318 HydrophobicContact CG2-CB 4.16Å; I316-R318 HydrophobicContact CG2-CG 3.79Å; I316-R318 PolarHBondContact O-N 3.23Å
317N46.5Very low55.1Low147 Ų147127.5 Ų127.579%0.78663%0.627SS**  trans-70.280.6156.5-81.8-6.5000106P315 K319P315-N317 PolarHBondContact O-N 2.95Å; N317-K319 PolarHBondContact O-N 3.15Å
318R48Very low53.4Low220 Ų220128.1 Ų128.183%0.8364%0.641SS**  trans-60.887.3156-103.2-179.3172.6-174.7-2.3104.7I316 F320I316-R318 HydrophobicContact CG2-CB 4.16Å; I316-R318 HydrophobicContact CG2-CG 3.79Å; I316-R318 PolarHBondContact O-N 3.23Å; R318-F320 PolarHBondContact O-N 3.45Å
319K41.1Very low51.3Low196 Ų196131.5 Ų131.585%0.85267%0.669SS**  trans-59.7100.7152-83.7-169.6175.9-1730104N317 R321N317-K319 PolarHBondContact O-N 3.15Å; K319-R321 PolarHBondContact O-N 3.43Å
320F39.5Very low49.3Very low179 Ų179135.9 Ų135.979%0.78570%0.699SS**  trans-58.795.1166.4-157.4-85.3000104.5R318 V322R318-F320 PolarHBondContact O-N 3.45Å; F320-V322 HydrophobicContact CD1-CG2 3.53Å; F320-V322 HydrophobicContact CE1-CG2 3.96Å; F320-V322 PolarHBondContact O-N 3.17Å
321R40.6Very low46.8Very low221 Ų221137.3 Ų137.383%0.83472%0.716SS**  trans-7485.4170.7-166.1175.1174.2172.4-2.1104.1K319 N323K319-R321 PolarHBondContact O-N 3.43Å; R321-N323 PolarHBondContact O-N 3.49Å
322V38.1Very low44.5Very low99 Ų99137.1 Ų137.160%0.673%0.725SS**  trans-54.4109160.9179.90000104.3F320 P324F320-V322 HydrophobicContact CD1-CG2 3.53Å; F320-V322 HydrophobicContact CE1-CG2 3.96Å; F320-V322 PolarHBondContact O-N 3.17Å; V322-P324 WeakPolarHBondContact O-CD 3.25Å
323N36.8Very low42.4Very low123 Ų123148.2 Ų148.266%0.65876%0.764SS**  trans-65.5119.3157.7-89.1-10.3000105R321 S325R321-N323 PolarHBondContact O-N 3.49Å; N323-S325 PolarHBondContact O-N 3.11Å
324P36.4Very low40.3Very low121 Ų121151.1 Ų151.179%0.78678%0.775SS**  trans-63.4109.5166.4-824.1000105.8V322 T326V322-P324 WeakPolarHBondContact O-CD 3.25Å; P324-T326 PolarHBondContact O-N 3.1Å
325S37.2Very low38.4Very low96 Ų96148.5 Ų148.567%0.67178%0.779SS**  trans-62.8123.7162.5-19.90000106.2N323 T327N323-S325 PolarHBondContact O-N 3.11Å; S325-T327 PolarHBondContact O-N 3.33Å
326T42.5Very low37.4Very low134 Ų134149 Ų14982%0.82278%0.782SS**  trans21.995.8144.429.60000115.3P324P324-T326 PolarHBondContact O-N 3.1Å
327T34.3Very low36Very low134 Ų134152 Ų15282%0.82279%0.793SS**  trans-110.8114.3148.6-42.50000106.3S325 S329S325-T327 PolarHBondContact O-N 3.33Å; T327-S329 PolarHBondContact O-N 3.25Å
328D38.2Very low35.2Very low151 Ų151148.8 Ų148.881%0.80779%0.794SS**  trans-50.8124.3171.2-69.8-50.2000110.5
329S31.1Very low34.3Very low113 Ų113142.5 Ų142.579%0.7979%0.79SS**  trans-146.195.6154.762.60000108.5T327 S331T327-S329 PolarHBondContact O-N 3.25Å; S329-S331 PolarHBondContact O-N 3.27Å
330V34Very low33.7Very low141 Ų141141.5 Ų141.586%0.85579%0.788SS**  trans-50124162.9172.50000109.6
331S27.4Very low33.3Very low112 Ų112139.8 Ų139.878%0.78378%0.783SS**  trans-153.4117.3151.768.90000110.4S329S329-S331 PolarHBondContact O-N 3.27Å
332M26.9Very low32.8Very low167 Ų167137 Ų13782%0.82378%0.779SS**  trans-46.3136.7-176.5-69.8-179.3-85.500114.9
333R28.1Very low32.4Very low243 Ų243142 Ų14292%0.91780%0.796SS**  trans-119.6115.2145-85.4-169.5-169.4-170.13.3109.2
334I31Very low32Very low153 Ų153139.7 Ų139.779%0.78579%0.794SS**  trans-65.2125.4172.2-63.2160.7000107.9
335V34.6Very low31.5Very low125 Ų125139.2 Ų139.276%0.75879%0.794SS**  trans-113.2128.4166.1175.40000106.3
336P34.5Very low31.2Very low117 Ų117146.7 Ų146.776%0.7681%0.807SS**  trans-78.6137.9178.2-3.420.9000111.3
337E30.1Very low30.7Very low201 Ų201149.1 Ų149.194%0.93981%0.809SS**  trans-75.8147.8165.7-84.2179.3121.700111.9
338G28.1Very low30.5Very low78 Ų78151.8 Ų151.880%0.80482%0.815SS**  trans137.397.914500000116.3
339A29.9Very low30.2Very low89 Ų89153 Ų15374%0.73682%0.82SS**  162.7115.8121.300000111.5
340Q28.7Very low30.7Very low174 Ų174152.9 Ų152.981%0.81382%0.817SS**  trans28.5135.7131.2-65.1169.1-51.500117.4
341Q30Very low30.7Very low144 Ų144151.9 Ų151.967%0.67382%0.816SS**  cis-178.1128.440.2-150.5145.7-25.300106.6
342E31.3Very low31Very low163 Ų163153.3 Ų153.376%0.76282%0.815SS**  70.4107114.3-149.8167.9-175.700116.9
343Q28.8Very low31.5Very low202 Ų202152.5 Ų152.594%0.94481%0.814SS**  trans-79.1107.1170.5-170.6172.2-0.200108.3
344A28.2Very low32.3Very low75 Ų75146.1 Ų146.162%0.6280%0.804SS**  trans-147.8116.9168.100000111.5
345S27.4Very low33.2Very low112 Ų112144.2 Ų144.278%0.78380%0.801SS**  trans63.2105.8141-53.30000119.1
346R30.5Very low33.3Very low252 Ų252151.1 Ų151.195%0.95183%0.825SS**  trans179.182.6131.3-99.8169.3179.2-168.50.8111.5
347E32.1Very low33.3Very low185 Ų185152.9 Ų152.986%0.86483%0.829SS**  trans-107.8121.6144.7-84.6-173.6147.800106.8
348M30Very low33.4Very low191 Ų191150.3 Ų150.394%0.94182%0.823SS**  trans162.5112.8143.5-91.3177-88.900109.6
349L31.5Very low33.7Very low176 Ų176154.3 Ų154.392%0.92182%0.824SS**  trans-126.7151.6153.9-124.9110.6000107.4
350P40.9Very low34Very low111 Ų111158.2 Ų158.272%0.72183%0.829SS**  trans-105.2158.5-138.739-32.5000113.1
351S34.6Very low34.3Very low119 Ų119157.2 Ų157.283%0.83283%0.83SS**  trans-110.1125.7161.854.50000109.8
352N34.4Very low34.6Very low142 Ų142158.1 Ų158.176%0.75984%0.841SS**  trans-43146.3172.3-66.1-27.3000114.3
353D35.8Very low34.8Very low151 Ų151157.7 Ų157.781%0.80785%0.846SS**  -171.4156.297.5-92.5-25.7000113.1
354P46.4Very low35.3Very low109 Ų109154.3 Ų154.371%0.70884%0.839SS**  trans-104.6-157.9-174.340.8-28.3000111.3
355P50.1Low35.9Very low112 Ų112160.9 Ų160.973%0.72786%0.857SS**  -119.7158-53.730.2-13.5000112
356Q36.5Very low36.6Very low271 Ų271165.4 Ų165.4100%1.26686%0.864SS**  trans-176.90131.8-103.5-179.9600110.9

Retrieved 356 of 356 residues in 76 ms (Link to these results)