A0A077Z4Q4_TRITR Loading...

Putative cell cycle-associated protein

AlphaFold DB , UniProt , Accession A0A077Z4Q4, Species TRITR (Trichuris trichiura, Whipworm), Gene n/a, Length 1,420 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
1M27.2Very low61Low237 Ų23785 Ų85100%1.16752%0.52SS*.  0104.10-70177.3176.200106.7N3M1-N3 PolarHBondContact O-N 2.79Å
2A41Very low61.6Low101 Ų10183.3 Ų83.384%0.83551%0.511SS*.  trans-62.6127.7168.800000107.2S4A2-S4 PolarHBondContact O-N 2.92Å
3N48.5Very low62.4Low82 Ų8290.5 Ų90.544%0.43954%0.544SS..  trans-59.3109.5178.3-83.1-7.6000108.1M1 W5 L6 E30M1-N3 PolarHBondContact O-N 2.79Å; N3-W5 PolarHBondContact O-N 3.18Å; N3-L6 HydrophobicContact CB-CD1 4.12Å; N3-L6 HydrophobicContact CB-CG 4.4Å; N3-L6 PolarHBondContact O-N 2.62Å; N3-L6 VanDerWaalsContact O-N 3.1Å; N3-E30 PolarHBondContact ND2-OE2 3.27Å
4S53.5Low63.7Low125 Ų12588.1 Ų88.187%0.87453%0.528SS*.THydrogen-bonded Turntrans-62.2-3.4-171.757.30000115.3A2A2-S4 PolarHBondContact O-N 2.92Å
5W71.6Confident64.9Low56 Ų5683.1 Ų83.121%0.21250%0.498CS..THydrogen-bonded Turntrans-104.1-10.4179.181.2-87.3000114.2N3 D7 F18 A22 R27 E30 L31N3-W5 PolarHBondContact O-N 3.18Å; W5-D7 VanDerWaalsContact C-N 3.27Å; W5-D7 PolarHBondContact O-N 3.3Å; W5-F18 AromaticContact CE3-CE2 3.99Å; W5-F18 HydrophobicContact CE3-CE2 3.99Å; W5-F18 AromaticContact CE3-CZ 3.89Å; W5-F18 HydrophobicContact CE3-CZ 3.89Å; W5-F18 AromaticContact CZ3-CE2 3.95Å; W5-F18 HydrophobicContact CZ3-CE2 3.95Å; W5-F18 AromaticContact CZ3-CZ 3.57Å; W5-F18 HydrophobicContact CZ3-CZ 3.57Å; W5-A22 HydrophobicContact CH2-CB 4.4Å; W5-A22 HydrophobicContact CZ3-CB 4.48Å; W5-R27 HydrophobicContact CH2-CB 4.19Å; W5-R27 HydrophobicContact CZ2-CB 4.17Å; W5-E30 HydrophobicContact CH2-CB 4.38Å; W5-E30 HydrophobicContact CZ2-CB 3.73Å; W5-E30 HydrophobicContact CZ2-CG 4.41Å; W5-E30 VanDerWaalsContact CZ2-OE2 3.24Å; W5-E30 WeakPolarHBondContact CZ2-OE2 3.36Å; W5-E30 PolarHBondContact NE1-OE2 2.86Å; W5-L31 HydrophobicContact CH2-CD2 3.73Å; W5-L31 HydrophobicContact CH2-CG 4.06Å; W5-L31 HydrophobicContact CZ3-CD2 3.77Å
6L67.2Low66.2Low18 Ų1878.5 Ų78.59%0.09447%0.47CS..  trans-92.351.3175.2-67.2171.1000110.6N3 L31 C35 M42N3-L6 HydrophobicContact CB-CD1 4.12Å; N3-L6 HydrophobicContact CB-CG 4.4Å; N3-L6 PolarHBondContact O-N 2.62Å; N3-L6 VanDerWaalsContact O-N 3.1Å; L6-L31 HydrophobicContact CD2-CD2 4.01Å; L6-C35 WeakPolarHBondContact O-CB 3.48Å; L6-M42 HydrophobicContact CB-SD 4.12Å; L6-M42 HydrophobicContact CD2-SD 3.34Å; L6-M42 WeakPolarHBondContact CD2-SD 3.32Å; L6-M42 HydrophobicContact CG-SD 4.32Å
7D75.6Confident67.2Low74 Ų7476.6 Ų76.640%0.39647%0.466SS..  trans-105.6114.4176.9-174.3-7.3000109.7W5 S9 A10W5-D7 VanDerWaalsContact C-N 3.27Å; W5-D7 PolarHBondContact O-N 3.3Å; D7-S9 PolarHBondContact O-N 3.28Å; D7-S9 WeakPolarHBondContact OD1-CB 3.42Å; D7-S9 PolarHBondContact OD1-N 3.35Å; D7-S9 PolarHBondContact OD1-OG 2.66Å; D7-S9 PolarHBondContact OD2-OG 3.48Å; D7-S9 VanDerWaalsContact OD2-OG 3.06Å; D7-A10 HydrophobicContact CB-CB 4.2Å; D7-A10 PolarHBondContact O-N 3.45Å
8C74.8Confident68.1Low33 Ų3374.4 Ų74.422%0.22345%0.449CS..G310 helixtrans-68.5-21.717855.80000113.1A10 C35 V46C8-A10 PolarHBondContact O-N 3.23Å; C8-C35 HydrophobicContact CB-CB 4.37Å; C8-C35 VanDerWaalsContact CB-SG 3.57Å; C8-V46 HydrophobicContact CB-CG1 4.1Å; C8-V46 HydrophobicContact CB-CG2 4.05Å
9S74Confident69Low103 Ų10370.5 Ų70.572%0.7243%0.425SS*.G310 helixtrans-75-12.4175.772.90000113.2D7D7-S9 PolarHBondContact O-N 3.28Å; D7-S9 WeakPolarHBondContact OD1-CB 3.42Å; D7-S9 PolarHBondContact OD1-N 3.35Å; D7-S9 PolarHBondContact OD1-OG 2.66Å; D7-S9 PolarHBondContact OD2-OG 3.48Å; D7-S9 VanDerWaalsContact OD2-OG 3.06Å
10A67.7Low69.8Low66 Ų6667.9 Ų67.955%0.54541%0.411SS..G310 helixtrans-116.723.8-177.800000113.5D7 C8D7-A10 HydrophobicContact CB-CB 4.2Å; D7-A10 PolarHBondContact O-N 3.45Å; C8-A10 PolarHBondContact O-N 3.23Å
11L69.5Low70.5Confident40 Ų4067 Ų6721%0.20941%0.411CS..  trans-58.9128.6177.1-141.9102.9000109.5P15 M42 V46 A50L11-P15 HydrophobicContact CD2-CB 3.8Å; L11-M42 HydrophobicContact CD1-CE 3.84Å; L11-V46 HydrophobicContact CD1-CG1 3.7Å; L11-A50 HydrophobicContact CD2-CB 3.86Å
12P68.2Low73.1Confident64 Ų6455.8 Ų55.842%0.41636%0.356SS..  trans-60154.2179.9-23.934.4000112.3D14 F18P12-D14 PolarHBondContact O-N 3.25Å; P12-F18 HydrophobicContact CG-CB 4.03Å; P12-F18 HydrophobicContact CG-CD2 3.79Å; P12-F18 HydrophobicContact CG-CG 4.13Å
13D72.4Confident75.1Confident177 Ų17752.1 Ų52.195%0.94732%0.322SS*.SBendtrans-53.7-22.9176-66-31.3000113.5P15D13-P15 WeakPolarHBondContact O-CD 3.38Å
14D81Confident76.5Confident58 Ų5857 Ų5731%0.3134%0.34SS..  trans-111.791.6173.5-169.8-17.2000111.4P12 V16 A17 F18P12-D14 PolarHBondContact O-N 3.25Å; D14-V16 PolarHBondContact O-N 2.96Å; D14-V16 WeakPolarHBondContact OD1-CB 3.5Å; D14-V16 PolarHBondContact OD1-N 3.27Å; D14-A17 HydrophobicContact CB-CB 4.04Å; D14-A17 VanDerWaalsContact CG-CB 3.48Å; D14-A17 PolarHBondContact O-N 3.04Å; D14-A17 PolarHBondContact OD1-N 3.31Å; D14-A17 WeakPolarHBondContact OD2-CB 3.24Å; D14-F18 PolarHBondContact O-N 3.45Å; D14-F18 VanDerWaalsContact O-N 3.16Å
15P81.5Confident77.8Confident12 Ų1256.3 Ų56.38%0.07833%0.326CS..Hα-helixtrans-65.8-26.8178.225.6-33.9000112.8L11 D13 C19 A50 I51L11-P15 HydrophobicContact CD2-CB 3.8Å; D13-P15 WeakPolarHBondContact O-CD 3.38Å; P15-C19 WeakPolarHBondContact O-CB 3.48Å; P15-C19 PolarHBondContact O-N 2.91Å; P15-C19 VanDerWaalsContact O-N 3.08Å; P15-C19 PolarHBondContact O-SG 3.18Å; P15-A50 HydrophobicContact CB-CB 3.83Å; P15-A50 HydrophobicContact CG-CB 4.2Å; P15-A50 WeakPolarHBondContact CG-O 3.31Å; P15-I51 HydrophobicContact CB-CG1 4.23Å
16V85Confident78.1Confident10 Ų1056.5 Ų56.56%0.06135%0.345CS..Hα-helixtrans-68.6-51.2179.2179.30000109.5D14 F18 C19 A20 I51 E66 A67 V70D14-V16 PolarHBondContact O-N 2.96Å; D14-V16 WeakPolarHBondContact OD1-CB 3.5Å; D14-V16 PolarHBondContact OD1-N 3.27Å; V16-F18 VanDerWaalsContact C-N 3.34Å; V16-F18 PolarHBondContact O-N 3.36Å; V16-C19 PolarHBondContact O-N 3.17Å; V16-A20 VanDerWaalsContact O-CB 3.27Å; V16-A20 WeakPolarHBondContact O-CB 3.18Å; V16-A20 PolarHBondContact O-N 3.36Å; V16-I51 HydrophobicContact CG2-CG2 4.12Å; V16-E66 HydrophobicContact CG1-CB 4.07Å; V16-E66 HydrophobicContact CG1-CG 3.88Å; V16-A67 HydrophobicContact CG1-CB 4.28Å; V16-A67 HydrophobicContact CG2-CB 4.02Å; V16-V70 HydrophobicContact CG1-CB 4.42Å; V16-V70 HydrophobicContact CG1-CG2 3.99Å
17A82.9Confident78.8Confident47 Ų4760 Ų6039%0.38836%0.357SS..Hα-helixtrans-62.9-40.3178.900000112.2D14 A21D14-A17 HydrophobicContact CB-CB 4.04Å; D14-A17 VanDerWaalsContact CG-CB 3.48Å; D14-A17 PolarHBondContact O-N 3.04Å; D14-A17 PolarHBondContact OD1-N 3.31Å; D14-A17 WeakPolarHBondContact OD2-CB 3.24Å; A17-A21 VanDerWaalsContact O-CB 3.3Å; A17-A21 WeakPolarHBondContact O-CB 3.31Å; A17-A21 PolarHBondContact O-N 2.89Å
18F84.6Confident79.1Confident37 Ų3756.5 Ų56.516%0.16234%0.338CS..Hα-helixtrans-58.2-52.2175.5172.8-101.6000111.8W5 P12 D14 V16 A21 A22 L31 M42W5-F18 AromaticContact CE3-CE2 3.99Å; W5-F18 HydrophobicContact CE3-CE2 3.99Å; W5-F18 AromaticContact CE3-CZ 3.89Å; W5-F18 HydrophobicContact CE3-CZ 3.89Å; W5-F18 AromaticContact CZ3-CE2 3.95Å; W5-F18 HydrophobicContact CZ3-CE2 3.95Å; W5-F18 AromaticContact CZ3-CZ 3.57Å; W5-F18 HydrophobicContact CZ3-CZ 3.57Å; P12-F18 HydrophobicContact CG-CB 4.03Å; P12-F18 HydrophobicContact CG-CD2 3.79Å; P12-F18 HydrophobicContact CG-CG 4.13Å; D14-F18 PolarHBondContact O-N 3.45Å; D14-F18 VanDerWaalsContact O-N 3.16Å; V16-F18 VanDerWaalsContact C-N 3.34Å; V16-F18 PolarHBondContact O-N 3.36Å; F18-A21 PolarHBondContact O-N 3.47Å; F18-A22 WeakPolarHBondContact O-CB 3.48Å; F18-A22 PolarHBondContact O-N 3.45Å; F18-L31 HydrophobicContact CE1-CD2 3.99Å; F18-L31 HydrophobicContact CZ-CD2 4.17Å; F18-M42 HydrophobicContact CE1-CE 3.77Å; F18-M42 HydrophobicContact CZ-CE 3.68Å
19C84.9Confident79.4Confident0 Ų060.2 Ų60.20%036%0.356CS..Hα-helixtrans-67.6-41.3-179.3-68.20000112.1P15 V16 A21 A22 L23 C47 I51 V70P15-C19 WeakPolarHBondContact O-CB 3.48Å; P15-C19 PolarHBondContact O-N 2.91Å; P15-C19 VanDerWaalsContact O-N 3.08Å; P15-C19 PolarHBondContact O-SG 3.18Å; V16-C19 PolarHBondContact O-N 3.17Å; C19-A21 VanDerWaalsContact C-N 3.33Å; C19-A21 PolarHBondContact O-N 3.25Å; C19-A22 PolarHBondContact O-N 3.3Å; C19-L23 WeakPolarHBondContact O-CB 3.24Å; C19-L23 VanDerWaalsContact O-CG 3.26Å; C19-L23 WeakPolarHBondContact O-CG 3.45Å; C19-L23 PolarHBondContact O-N 3.25Å; C19-C47 VanDerWaalsContact SG-CB 3.55Å; C19-I51 HydrophobicContact CB-CD1 3.96Å; C19-V70 HydrophobicContact CB-CG1 3.62Å
20A85.2Confident79.9Confident18 Ų1857.8 Ų57.815%0.14933%0.333CS..Hα-helixtrans-56.7-47.4175.200000111.4V16 K24 V70V16-A20 VanDerWaalsContact O-CB 3.27Å; V16-A20 WeakPolarHBondContact O-CB 3.18Å; V16-A20 PolarHBondContact O-N 3.36Å; A20-K24 WeakPolarHBondContact O-CB 3.34Å; A20-K24 PolarHBondContact O-N 3.29Å; A20-V70 HydrophobicContact CB-CG2 3.65Å
21A83.7Confident80.8Confident49 Ų4954.7 Ų54.741%0.40531%0.308SS..Hα-helixtrans-64.9-42.6178.400000112.1A17 F18 C19 N25A17-A21 VanDerWaalsContact O-CB 3.3Å; A17-A21 WeakPolarHBondContact O-CB 3.31Å; A17-A21 PolarHBondContact O-N 2.89Å; F18-A21 PolarHBondContact O-N 3.47Å; C19-A21 VanDerWaalsContact C-N 3.33Å; C19-A21 PolarHBondContact O-N 3.25Å; A21-N25 WeakPolarHBondContact O-CB 3.25Å; A21-N25 VanDerWaalsContact O-CG 3.23Å; A21-N25 PolarHBondContact O-N 3.16Å; A21-N25 PolarHBondContact O-ND2 2.84Å
22A82.2Confident81.4Confident2 Ų254.6 Ų54.62%0.01731%0.307CS..Hα-helixtrans-63.9-46.9178.600000112.2W5 F18 C19 N25 G26 R27 L31W5-A22 HydrophobicContact CH2-CB 4.4Å; W5-A22 HydrophobicContact CZ3-CB 4.48Å; F18-A22 WeakPolarHBondContact O-CB 3.48Å; F18-A22 PolarHBondContact O-N 3.45Å; C19-A22 PolarHBondContact O-N 3.3Å; A22-N25 PolarHBondContact O-N 2.82Å; A22-G26 PolarHBondContact O-N 2.93Å; A22-R27 PolarHBondContact O-N 3.11Å; A22-L31 HydrophobicContact CB-CD1 3.68Å; A22-L31 HydrophobicContact CB-CG 4.42Å
23L82.2Confident82.2Confident24 Ų2457.1 Ų57.113%0.12631%0.312CS..Hα-helixtrans-65.6-42178.3-67.5170.2000111.7C19 N25 G26 T73 V74 F77C19-L23 WeakPolarHBondContact O-CB 3.24Å; C19-L23 VanDerWaalsContact O-CG 3.26Å; C19-L23 WeakPolarHBondContact O-CG 3.45Å; C19-L23 PolarHBondContact O-N 3.25Å; L23-N25 VanDerWaalsContact C-N 3.28Å; L23-N25 PolarHBondContact O-N 3.49Å; L23-G26 PolarHBondContact O-N 3.08Å; L23-T73 HydrophobicContact CD1-CG2 3.82Å; L23-T73 HydrophobicContact CD2-CG2 4.49Å; L23-V74 HydrophobicContact CD1-CG2 4Å; L23-F77 HydrophobicContact CD2-CD2 3.7Å; L23-F77 HydrophobicContact CD2-CE2 3.68Å; L23-F77 HydrophobicContact CD2-CG 4.27Å; L23-F77 HydrophobicContact CD2-CZ 4.24Å
24K78.6Confident82.7Confident184 Ų18457.9 Ų57.980%0.830%0.301SS*.Hα-helixtrans-63.1-33.6176.4-174.3177.5179.6-179.10112.9A20 G26A20-K24 WeakPolarHBondContact O-CB 3.34Å; A20-K24 PolarHBondContact O-N 3.29Å; K24-G26 PolarHBondContact O-N 2.86Å
25N80.5Confident82.7Confident111 Ų11156.4 Ų56.459%0.59430%0.295SS*.THydrogen-bonded Turntrans-83.88.6176.5-69.2-31.9000113.3A21 A22 L23 R27A21-N25 WeakPolarHBondContact O-CB 3.25Å; A21-N25 VanDerWaalsContact O-CG 3.23Å; A21-N25 PolarHBondContact O-N 3.16Å; A21-N25 PolarHBondContact O-ND2 2.84Å; A22-N25 PolarHBondContact O-N 2.82Å; L23-N25 VanDerWaalsContact C-N 3.28Å; L23-N25 PolarHBondContact O-N 3.49Å; N25-R27 HydrophobicContact CB-CG 4.36Å; N25-R27 PolarHBondContact O-N 3.5Å
26G79.2Confident82.7Confident59 Ų5957.8 Ų57.861%0.60831%0.305SS*.THydrogen-bonded Turntrans69.817.9179.800000114.2A22 L23 K24 G28A22-G26 PolarHBondContact O-N 2.93Å; L23-G26 PolarHBondContact O-N 3.08Å; K24-G26 PolarHBondContact O-N 2.86Å; G26-G28 VanDerWaalsContact C-N 3.31Å; G26-G28 PolarHBondContact O-N 3.06Å
27R81.2Confident82.5Confident92 Ų9266.6 Ų66.635%0.34735%0.345SS..  trans-92.922.4-179.6-59.4-157.8-63-163.51.5113.6W5 A22 N25 D29 E30 L31W5-R27 HydrophobicContact CH2-CB 4.19Å; W5-R27 HydrophobicContact CZ2-CB 4.17Å; A22-R27 PolarHBondContact O-N 3.11Å; N25-R27 HydrophobicContact CB-CG 4.36Å; N25-R27 PolarHBondContact O-N 3.5Å; R27-D29 VanDerWaalsContact C-N 3.35Å; R27-D29 PolarHBondContact O-N 3.28Å; R27-E30 PolarHBondContact O-N 3.31Å; R27-L31 PolarHBondContact O-N 3.21Å
28G81.4Confident82.5Confident0 Ų071.2 Ų71.20%036%0.363CS..Hα-helixtrans-60.3-42.2178.700000112.9G26 E30 L31 L32G26-G28 VanDerWaalsContact C-N 3.31Å; G26-G28 PolarHBondContact O-N 3.06Å; G28-E30 PolarHBondContact O-N 2.97Å; G28-L31 PolarHBondContact O-N 2.87Å; G28-L31 VanDerWaalsContact O-N 3.11Å; G28-L32 PolarHBondContact O-N 3.43Å
29D81.8Confident82.5Confident112 Ų11271.7 Ų71.760%0.59937%0.366SS*.Hα-helixtrans-63.9-27.4179.2-63.6-26.5000113.2R27R27-D29 VanDerWaalsContact C-N 3.35Å; R27-D29 PolarHBondContact O-N 3.28Å
30E83.8Confident82.4Confident52 Ų5280 Ų8024%0.24341%0.405CS..Hα-helixtrans-72.4-37.6175.7-68.4-176-130.800111.5N3 W5 R27 G28 L32 K33N3-E30 PolarHBondContact ND2-OE2 3.27Å; W5-E30 HydrophobicContact CH2-CB 4.38Å; W5-E30 HydrophobicContact CZ2-CB 3.73Å; W5-E30 HydrophobicContact CZ2-CG 4.41Å; W5-E30 VanDerWaalsContact CZ2-OE2 3.24Å; W5-E30 WeakPolarHBondContact CZ2-OE2 3.36Å; W5-E30 PolarHBondContact NE1-OE2 2.86Å; R27-E30 PolarHBondContact O-N 3.31Å; G28-E30 PolarHBondContact O-N 2.97Å; E30-L32 PolarHBondContact O-N 3.3Å; E30-K33 WeakPolarHBondContact O-CB 3.47Å; E30-K33 PolarHBondContact O-N 2.95Å
31L85.9Confident82.4Confident0 Ų079.4 Ų79.40%040%0.4CS..Hα-helixtrans-69.4-22176.9-66.4176000112.6W5 L6 F18 A22 R27 G28 K33 M42 L43W5-L31 HydrophobicContact CH2-CD2 3.73Å; W5-L31 HydrophobicContact CH2-CG 4.06Å; W5-L31 HydrophobicContact CZ3-CD2 3.77Å; L6-L31 HydrophobicContact CD2-CD2 4.01Å; F18-L31 HydrophobicContact CE1-CD2 3.99Å; F18-L31 HydrophobicContact CZ-CD2 4.17Å; A22-L31 HydrophobicContact CB-CD1 3.68Å; A22-L31 HydrophobicContact CB-CG 4.42Å; R27-L31 PolarHBondContact O-N 3.21Å; G28-L31 PolarHBondContact O-N 2.87Å; G28-L31 VanDerWaalsContact O-N 3.11Å; L31-K33 PolarHBondContact O-N 3.16Å; L31-M42 HydrophobicContact CD2-CE 4.24Å; L31-M42 HydrophobicContact CD2-CG 4.37Å; L31-M42 HydrophobicContact CD2-SD 3.79Å; L31-M42 CarbonylContact O-C 3.28Å; L31-M42 WeakPolarHBondContact O-CB 3.27Å; L31-M42 PolarHBondContact O-N 3.26Å; L31-L43 HydrophobicContact CB-CB 3.95Å; L31-L43 HydrophobicContact CB-CD1 4.15Å; L31-L43 HydrophobicContact CB-CG 4.5Å; L31-L43 HydrophobicContact CD1-CD1 4Å; L31-L43 WeakPolarHBondContact O-CB 3.36Å; L31-L43 PolarHBondContact O-N 2.91Å
32L83.9Confident82.6Confident38 Ų3877.1 Ų77.120%0.19938%0.381CS..THydrogen-bonded Turntrans-68.7-18.3174.1-72.9173.4000113G28 E30 S41 L43 L78G28-L32 PolarHBondContact O-N 3.43Å; E30-L32 PolarHBondContact O-N 3.3Å; L32-S41 PolarHBondContact O-OG 2.83Å; L32-L43 HydrophobicContact CD2-CB 4.44Å; L32-L43 HydrophobicContact CD2-CD2 3.95Å; L32-L43 HydrophobicContact CG-CD2 4.44Å; L32-L78 HydrophobicContact CD2-CD2 3.94Å
33K84.2Confident83Confident118 Ų11877 Ų7751%0.51338%0.38SS..SBendtrans-77158.2179.7-60.1176.6-177173.10111.5E30 L31 M42E30-K33 WeakPolarHBondContact O-CB 3.47Å; E30-K33 PolarHBondContact O-N 2.95Å; L31-K33 PolarHBondContact O-N 3.16Å; K33-M42 PolarHBondContact O-N 3.11Å
34R83.5Confident83.3Confident192 Ų19276.8 Ų76.873%0.72538%0.379SS*.  trans-62.2136.3169.961.9179.7-178.8176.31.2111.6H39 Q40R34-H39 WeakPolarHBondContact CB-O 3.37Å; R34-Q40 PolarHBondContact N-O 3.08Å
35C81.4Confident83.7Confident27 Ų2770.5 Ų70.518%0.18235%0.354CS..SBendtrans-92.8-33.9172.556.90000112.8L6 C8 H39 M42L6-C35 WeakPolarHBondContact O-CB 3.48Å; C8-C35 HydrophobicContact CB-CB 4.37Å; C8-C35 VanDerWaalsContact CB-SG 3.57Å; C35-H39 PolarHBondContact SG-ND1 3.18Å; C35-H39 VanDerWaalsContact SG-ND1 3.37Å; C35-M42 HydrophobicContact CB-CB 4.11Å; C35-M42 HydrophobicContact CB-CG 4.21Å; C35-M42 HydrophobicContact CB-SD 4.27Å
36C81.1Confident84.1Confident42 Ų4266.2 Ų66.228%0.28433%0.332SS..SBendtrans-146-171.817667.40000110.5D38 H39C36-D38 VanDerWaalsContact C-N 3.31Å; C36-H39 PolarHBondContact SG-ND1 3.26Å
37E80.2Confident84.5Confident194 Ų19463.4 Ų63.491%0.90730%0.303SS*.SBendtrans-70.8-24.7178.2-64.7-171.516500113.3
38D82.3Confident85Confident144 Ų14459 Ų5977%0.7729%0.286SS*.SBendtrans-81.8-18.7-176.8-55.5-50.1000113.9C36C36-D38 VanDerWaalsContact C-N 3.31Å
39H84.9Confident85.4Confident47 Ų4760.9 Ų60.922%0.21830%0.298CS..  trans-118.3130.7-173.8-58114000111.3R34 C35 C36 D45 V46R34-H39 WeakPolarHBondContact CB-O 3.37Å; C35-H39 PolarHBondContact SG-ND1 3.18Å; C35-H39 VanDerWaalsContact SG-ND1 3.37Å; C36-H39 PolarHBondContact SG-ND1 3.26Å; H39-D45 HydrophobicContact CB-CB 4.15Å; H39-V46 HydrophobicContact CB-CG2 4.38Å
40Q82.9Confident85.7Confident174 Ų17456.6 Ų56.681%0.81328%0.278SS*.SBendtrans-80.3-33174.3-64.9-163.3-9.700112R34 D45R34-Q40 PolarHBondContact N-O 3.08Å; Q40-D45 WeakPolarHBondContact CA-OD2 3.39Å; Q40-D45 PolarHBondContact N-OD2 2.99Å
41S86.4Confident86Confident7 Ų754.1 Ų54.15%0.04927%0.267CS..  trans-144.9121.2179.5177.90000110.5L32 L43 N44 D45L32-S41 PolarHBondContact O-OG 2.83Å; S41-L43 PolarHBondContact O-N 2.55Å; S41-N44 PolarHBondContact O-N 2.9Å; S41-N44 PolarHBondContact OG-N 3.4Å; S41-D45 PolarHBondContact N-OD2 2.71Å; S41-D45 WeakPolarHBondContact O-CB 3.45Å; S41-D45 PolarHBondContact O-N 2.98Å
42M87.8Confident86.1Confident1 Ų154.2 Ų54.21%0.00527%0.267CS..Hα-helixtrans-59.8-34.7176.3-175.4-179.1176.900111.8L6 L11 F18 L31 K33 C35 V46 C47L6-M42 HydrophobicContact CB-SD 4.12Å; L6-M42 HydrophobicContact CD2-SD 3.34Å; L6-M42 WeakPolarHBondContact CD2-SD 3.32Å; L6-M42 HydrophobicContact CG-SD 4.32Å; L11-M42 HydrophobicContact CD1-CE 3.84Å; F18-M42 HydrophobicContact CE1-CE 3.77Å; F18-M42 HydrophobicContact CZ-CE 3.68Å; L31-M42 HydrophobicContact CD2-CE 4.24Å; L31-M42 HydrophobicContact CD2-CG 4.37Å; L31-M42 HydrophobicContact CD2-SD 3.79Å; L31-M42 CarbonylContact O-C 3.28Å; L31-M42 WeakPolarHBondContact O-CB 3.27Å; L31-M42 PolarHBondContact O-N 3.26Å; K33-M42 PolarHBondContact O-N 3.11Å; C35-M42 HydrophobicContact CB-CB 4.11Å; C35-M42 HydrophobicContact CB-CG 4.21Å; C35-M42 HydrophobicContact CB-SD 4.27Å; M42-V46 HydrophobicContact CG-CB 4.48Å; M42-V46 WeakPolarHBondContact O-CB 3.41Å; M42-V46 PolarHBondContact O-N 3.26Å; M42-C47 PolarHBondContact O-N 2.57Å; M42-C47 PolarHBondContact O-SG 3.43Å
43L89Confident86.2Confident0 Ų059.3 Ų59.30%029%0.29CS..Iπ-helixtrans-67.8-47.5179.1-168.861.6000112L31 L32 S41 C47 L48 V74 F77 L78L31-L43 HydrophobicContact CB-CB 3.95Å; L31-L43 HydrophobicContact CB-CD1 4.15Å; L31-L43 HydrophobicContact CB-CG 4.5Å; L31-L43 HydrophobicContact CD1-CD1 4Å; L31-L43 WeakPolarHBondContact O-CB 3.36Å; L31-L43 PolarHBondContact O-N 2.91Å; L32-L43 HydrophobicContact CD2-CB 4.44Å; L32-L43 HydrophobicContact CD2-CD2 3.95Å; L32-L43 HydrophobicContact CG-CD2 4.44Å; S41-L43 PolarHBondContact O-N 2.55Å; L43-C47 HydrophobicContact CD1-CB 4.18Å; L43-C47 WeakPolarHBondContact O-CB 3.49Å; L43-L48 WeakPolarHBondContact O-CB 3.21Å; L43-L48 PolarHBondContact O-N 2.8Å; L43-V74 HydrophobicContact CD1-CG1 4.03Å; L43-V74 HydrophobicContact CD1-CG2 4.04Å; L43-V74 HydrophobicContact CD2-CG1 4.36Å; L43-V74 HydrophobicContact CG-CG1 4Å; L43-F77 HydrophobicContact CD2-CB 4.12Å; L43-L78 HydrophobicContact CB-CD2 4.42Å; L43-L78 HydrophobicContact CD2-CD2 4Å; L43-L78 HydrophobicContact CD2-CG 4.18Å; L43-L78 HydrophobicContact CG-CD2 4.22Å
44N89.3Confident86.2Confident19 Ų1956 Ų5610%0.10228%0.282CS..Iπ-helixtrans-80.1-45.8-176-174.457.1000112.8S41 P49 L78 T83S41-N44 PolarHBondContact O-N 2.9Å; S41-N44 PolarHBondContact OG-N 3.4Å; N44-P49 WeakPolarHBondContact O-CD 3.46Å; N44-L78 HydrophobicContact CB-CD2 3.91Å; N44-T83 HydrophobicContact CB-CG2 4.22Å
45D87.3Confident86.2Confident52 Ų5247 Ų4728%0.27825%0.248SC..Iπ-helixtrans-91.7-16.5-167.2-49.7-28.5000112.3H39 Q40 S41 P49H39-D45 HydrophobicContact CB-CB 4.15Å; Q40-D45 WeakPolarHBondContact CA-OD2 3.39Å; Q40-D45 PolarHBondContact N-OD2 2.99Å; S41-D45 PolarHBondContact N-OD2 2.71Å; S41-D45 WeakPolarHBondContact O-CB 3.45Å; S41-D45 PolarHBondContact O-N 2.98Å; D45-P49 WeakPolarHBondContact O-CG 3.37Å
46V87.7Confident86.1Confident21 Ų2151.9 Ų51.913%0.12726%0.264CS..Iπ-helixtrans-123.6-59.5-177.7-167.20000111.7C8 L11 H39 M42 A50C8-V46 HydrophobicContact CB-CG1 4.1Å; C8-V46 HydrophobicContact CB-CG2 4.05Å; L11-V46 HydrophobicContact CD1-CG1 3.7Å; H39-V46 HydrophobicContact CB-CG2 4.38Å; M42-V46 HydrophobicContact CG-CB 4.48Å; M42-V46 WeakPolarHBondContact O-CB 3.41Å; M42-V46 PolarHBondContact O-N 3.26Å; V46-A50 WeakPolarHBondContact O-CB 3.24Å; V46-A50 PolarHBondContact O-N 3.43Å
47C89.5Confident85.7Confident0 Ų052.3 Ų52.30%028%0.275CS..Iπ-helixtrans-67.4-47.2-171.8-64.60000112.8C19 M42 L43 A50 I51C19-C47 VanDerWaalsContact SG-CB 3.55Å; M42-C47 PolarHBondContact O-N 2.57Å; M42-C47 PolarHBondContact O-SG 3.43Å; L43-C47 HydrophobicContact CD1-CB 4.18Å; L43-C47 WeakPolarHBondContact O-CB 3.49Å; C47-A50 PolarHBondContact O-N 3.12Å; C47-I51 WeakPolarHBondContact O-CB 3.42Å; C47-I51 WeakPolarHBondContact O-CD1 3.42Å; C47-I51 WeakPolarHBondContact O-CG1 2.75Å; C47-I51 PolarHBondContact O-N 3.17Å
48L91.2Very high84.7Confident0 Ų053.6 Ų53.60%028%0.278CS..Hα-helixtrans-60.4-51.9179.5175.764.6000112.4L43 A50 I51 L52 L71 V74 L78 I85 M89 L93L43-L48 WeakPolarHBondContact O-CB 3.21Å; L43-L48 PolarHBondContact O-N 2.8Å; L48-A50 VanDerWaalsContact C-N 3.33Å; L48-A50 PolarHBondContact O-N 3.41Å; L48-I51 PolarHBondContact O-N 2.98Å; L48-L52 HydrophobicContact CD1-CD1 4.35Å; L48-L52 PolarHBondContact O-N 3.43Å; L48-L71 HydrophobicContact CD1-CD2 3.72Å; L48-V74 HydrophobicContact CB-CG1 4.4Å; L48-V74 HydrophobicContact CD1-CG1 4.22Å; L48-L78 HydrophobicContact CD2-CD1 3.96Å; L48-I85 HydrophobicContact CD2-CD1 4.39Å; L48-M89 HydrophobicContact CD2-CG 3.71Å; L48-M89 HydrophobicContact CD2-SD 4.06Å; L48-M89 HydrophobicContact CG-CG 4.26Å; L48-M89 HydrophobicContact CG-SD 3.93Å; L48-L93 HydrophobicContact CD1-CD2 4.29Å
49P90.1Very high83.9Confident39 Ų3948.8 Ų48.825%0.25325%0.251SS..Hα-helixtrans-57.1-43.2172.5-11.79.5000112.7N44 D45 I51 L52 Q53 M89N44-P49 WeakPolarHBondContact O-CD 3.46Å; D45-P49 WeakPolarHBondContact O-CG 3.37Å; P49-I51 PolarHBondContact O-N 3.46Å; P49-L52 PolarHBondContact O-N 3.04Å; P49-Q53 WeakPolarHBondContact O-CB 3.33Å; P49-Q53 PolarHBondContact O-N 2.84Å; P49-M89 HydrophobicContact CB-CE 3.79Å; P49-M89 HydrophobicContact CG-CE 3.58Å
50A88.2Confident83.2Confident21 Ų2149.3 Ų49.317%0.17426%0.259CS..Hα-helixtrans-64.7-41.1-179.600000112.5L11 P15 V46 C47 L48 Q53 S54L11-A50 HydrophobicContact CD2-CB 3.86Å; P15-A50 HydrophobicContact CB-CB 3.83Å; P15-A50 HydrophobicContact CG-CB 4.2Å; P15-A50 WeakPolarHBondContact CG-O 3.31Å; V46-A50 WeakPolarHBondContact O-CB 3.24Å; V46-A50 PolarHBondContact O-N 3.43Å; C47-A50 PolarHBondContact O-N 3.12Å; L48-A50 VanDerWaalsContact C-N 3.33Å; L48-A50 PolarHBondContact O-N 3.41Å; A50-Q53 PolarHBondContact O-N 3.05Å; A50-S54 PolarHBondContact O-N 3.31Å
51I90.1Very high82.5Confident0 Ų047.3 Ų47.30%025%0.248CC..Hα-helixtrans-61.5-48174.1-68.2159.2000110P15 V16 C19 C47 L48 P49 Q53 S54 T55 V70 L71 V74P15-I51 HydrophobicContact CB-CG1 4.23Å; V16-I51 HydrophobicContact CG2-CG2 4.12Å; C19-I51 HydrophobicContact CB-CD1 3.96Å; C47-I51 WeakPolarHBondContact O-CB 3.42Å; C47-I51 WeakPolarHBondContact O-CD1 3.42Å; C47-I51 WeakPolarHBondContact O-CG1 2.75Å; C47-I51 PolarHBondContact O-N 3.17Å; L48-I51 PolarHBondContact O-N 2.98Å; P49-I51 PolarHBondContact O-N 3.46Å; I51-Q53 VanDerWaalsContact C-N 3.33Å; I51-Q53 PolarHBondContact O-N 2.77Å; I51-S54 WeakPolarHBondContact O-CB 3.41Å; I51-S54 PolarHBondContact O-N 2.9Å; I51-S54 PolarHBondContact O-OG 3.19Å; I51-T55 VanDerWaalsContact O-CG2 3.3Å; I51-T55 WeakPolarHBondContact O-CG2 3.45Å; I51-T55 PolarHBondContact O-N 3.38Å; I51-V70 HydrophobicContact CD1-CG1 3.62Å; I51-L71 HydrophobicContact CB-CD2 4.22Å; I51-L71 HydrophobicContact CG2-CD1 4.28Å; I51-L71 HydrophobicContact CG2-CD2 3.56Å; I51-L71 HydrophobicContact CG2-CG 3.66Å; I51-V74 HydrophobicContact CD1-CG2 4.25Å
52L88.3Confident82.1Confident2 Ų250 Ų501%0.0127%0.265CS..Hα-helixtrans-63-40.5177.7-76.4169.5000111.8L48 P49 S54 T55 L71 M89 D92 L93 Y96L48-L52 HydrophobicContact CD1-CD1 4.35Å; L48-L52 PolarHBondContact O-N 3.43Å; P49-L52 PolarHBondContact O-N 3.04Å; L52-S54 VanDerWaalsContact C-N 3.26Å; L52-S54 PolarHBondContact O-N 3.38Å; L52-T55 WeakPolarHBondContact O-CA 3.38Å; L52-T55 WeakPolarHBondContact O-CB 3.34Å; L52-T55 PolarHBondContact O-N 3.41Å; L52-T55 PolarHBondContact O-OG1 3.49Å; L52-L71 HydrophobicContact CD2-CD1 4.13Å; L52-L71 HydrophobicContact CD2-CD2 4.16Å; L52-L71 HydrophobicContact CG-CD2 4.15Å; L52-M89 HydrophobicContact CD1-SD 3.46Å; L52-M89 WeakPolarHBondContact CD1-SD 3.44Å; L52-D92 HydrophobicContact CD1-CB 4.16Å; L52-L93 HydrophobicContact CD1-CD2 3.97Å; L52-L93 HydrophobicContact CD1-CG 4Å; L52-L93 HydrophobicContact CD2-CD2 4.02Å; L52-L93 HydrophobicContact CG-CD2 4.39Å; L52-Y96 HydrophobicContact CD2-CD2 4.22Å; L52-Y96 HydrophobicContact CD2-CG 4.06Å
53Q85Confident81.7Confident146 Ų14653.3 Ų53.368%0.68228%0.283SS*.Hα-helixtrans-61-38176.5-165174.5600111.8P49 A50 I51 T55 Y56P49-Q53 WeakPolarHBondContact O-CB 3.33Å; P49-Q53 PolarHBondContact O-N 2.84Å; A50-Q53 PolarHBondContact O-N 3.05Å; I51-Q53 VanDerWaalsContact C-N 3.33Å; I51-Q53 PolarHBondContact O-N 2.77Å; Q53-T55 PolarHBondContact O-N 2.66Å; Q53-T55 VanDerWaalsContact O-N 3.12Å; Q53-Y56 PolarHBondContact O-N 3.23Å
54S84.3Confident81.3Confident48 Ų4853.5 Ų53.534%0.33629%0.285SS..THydrogen-bonded Turntrans-65.6-9.9173.782.90000114A50 I51 L52 Q59A50-S54 PolarHBondContact O-N 3.31Å; I51-S54 WeakPolarHBondContact O-CB 3.41Å; I51-S54 PolarHBondContact O-N 2.9Å; I51-S54 PolarHBondContact O-OG 3.19Å; L52-S54 VanDerWaalsContact C-N 3.26Å; L52-S54 PolarHBondContact O-N 3.38Å; S54-Q59 PolarHBondContact O-NE2 3.18Å; S54-Q59 VanDerWaalsContact O-NE2 3.08Å
55T83.4Confident81Confident4 Ų453.7 Ų53.73%0.02529%0.285CS..THydrogen-bonded Turntrans-99.1-14.6-18071.10000115.2I51 L52 Q53 G57 Q59 A67 Y96I51-T55 VanDerWaalsContact O-CG2 3.3Å; I51-T55 WeakPolarHBondContact O-CG2 3.45Å; I51-T55 PolarHBondContact O-N 3.38Å; L52-T55 WeakPolarHBondContact O-CA 3.38Å; L52-T55 WeakPolarHBondContact O-CB 3.34Å; L52-T55 PolarHBondContact O-N 3.41Å; L52-T55 PolarHBondContact O-OG1 3.49Å; Q53-T55 PolarHBondContact O-N 2.66Å; Q53-T55 VanDerWaalsContact O-N 3.12Å; T55-G57 PolarHBondContact O-N 3.42Å; T55-Q59 VanDerWaalsContact CA-NE2 3.25Å; T55-A67 HydrophobicContact CG2-CB 4.14Å; T55-Y96 HydrophobicContact CG2-CD2 3.99Å; T55-Y96 HydrophobicContact CG2-CE2 3.59Å; T55-Y96 WeakPolarHBondContact OG1-CD2 3.4Å
56Y79.1Confident81Confident128 Ų12854.6 Ų54.650%0.50229%0.288SS..SBendtrans-68.7-1.4-178.7-70.4-58.1000115.1Q53 D92Q53-Y56 PolarHBondContact O-N 3.23Å; Y56-D92 VanDerWaalsContact OH-CG 3.3Å; Y56-D92 PolarHBondContact OH-OD1 3.44Å
57G71.8Confident80.9Confident51 Ų5153.6 Ų53.653%0.52628%0.282SS..SBendtrans-112.9176.3177.700000114.2T55 Q59T55-G57 PolarHBondContact O-N 3.42Å; G57-Q59 PolarHBondContact O-N 3.19Å
58K60.6Low81Confident222 Ų22253.6 Ų53.697%0.96528%0.282SS*.  trans-62.9105170.6-78.8-174.7178.4178.50109.8
59Q64.5Low80.9Confident43 Ų4359 Ų5920%0.20130%0.302CS..  trans-81.6147.6177.7-62.3-163.6-41.400111.8S54 T55 G57 A64S54-Q59 PolarHBondContact O-NE2 3.18Å; S54-Q59 VanDerWaalsContact O-NE2 3.08Å; T55-Q59 VanDerWaalsContact CA-NE2 3.25Å; G57-Q59 PolarHBondContact O-N 3.19Å; Q59-A64 HydrophobicContact CB-CB 4.38Å
60S70.6Confident81Confident57 Ų5757.3 Ų57.340%0.39929%0.292SS..  trans-69150164.873.60000109.4N63 A64S60-N63 PolarHBondContact O-N 3.14Å; S60-N63 WeakPolarHBondContact OG-CB 3.29Å; S60-N63 PolarHBondContact OG-N 3.2Å; S60-N63 PolarHBondContact OG-ND2 3.46Å; S60-N63 PolarHBondContact OG-OD1 3.09Å; S60-A64 PolarHBondContact O-N 2.92Å
61F69.3Low81.3Confident133 Ų13356.3 Ų56.358%0.58328%0.283SS*.Hα-helixtrans-51.9-44.9-179.6175-80.6000114.1N63 I65 T105F61-N63 VanDerWaalsContact C-N 3.34Å; F61-N63 PolarHBondContact O-N 2.98Å; F61-I65 HydrophobicContact CD1-CD1 3.92Å; F61-I65 HydrophobicContact CE1-CD1 3.46Å; F61-I65 VanDerWaalsContact CE1-CD1 3.46Å; F61-I65 HydrophobicContact CZ-CD1 3.97Å; F61-I65 PolarHBondContact O-N 3.47Å; F61-T105 HydrophobicContact CD2-CG2 3.67Å; F61-T105 HydrophobicContact CE1-CG2 4.23Å; F61-T105 HydrophobicContact CE2-CG2 2.89Å; F61-T105 HydrophobicContact CZ-CG2 3.22Å
62P77.1Confident81.4Confident62 Ų6257.5 Ų57.540%0.40329%0.289SS..Hα-helixtrans-63.4-38.6175.2-22.534.8000113I65 E66P62-I65 PolarHBondContact O-N 3.33Å; P62-E66 PolarHBondContact O-N 3.35Å
63N78.7Confident81.5Confident71 Ų7160 Ų6038%0.3831%0.305SS..Hα-helixtrans-68.6-37.8-178.3-71.911.3000111.7S60 F61 I65 E66 A67S60-N63 PolarHBondContact O-N 3.14Å; S60-N63 WeakPolarHBondContact OG-CB 3.29Å; S60-N63 PolarHBondContact OG-N 3.2Å; S60-N63 PolarHBondContact OG-ND2 3.46Å; S60-N63 PolarHBondContact OG-OD1 3.09Å; F61-N63 VanDerWaalsContact C-N 3.34Å; F61-N63 PolarHBondContact O-N 2.98Å; N63-I65 VanDerWaalsContact C-N 3.34Å; N63-I65 PolarHBondContact O-N 2.99Å; N63-E66 PolarHBondContact O-N 3.28Å; N63-A67 WeakPolarHBondContact O-CB 3.37Å; N63-A67 PolarHBondContact O-N 3.1Å
64A80.9Confident81.9Confident4 Ų453 Ų533%0.03327%0.272CS..Hα-helixtrans-61.9-42.7175.200000111.9Q59 S60 S68 E103 V108Q59-A64 HydrophobicContact CB-CB 4.38Å; S60-A64 PolarHBondContact O-N 2.92Å; A64-S68 VanDerWaalsContact O-CB 3.29Å; A64-S68 WeakPolarHBondContact O-CB 3.12Å; A64-S68 PolarHBondContact O-N 3.37Å; A64-S68 PolarHBondContact O-OG 3.5Å; A64-S68 VanDerWaalsContact O-OG 3.11Å; A64-E103 WeakPolarHBondContact CB-OE2 3.27Å; A64-V108 HydrophobicContact CB-CG2 4.25Å
65I84.1Confident82.3Confident23 Ų2350.8 Ų50.812%0.11826%0.257CS..Hα-helixtrans-61.8-49.3175.4-68.3171.1000110.5F61 P62 N63 S68 R69 T105 V107 V108F61-I65 HydrophobicContact CD1-CD1 3.92Å; F61-I65 HydrophobicContact CE1-CD1 3.46Å; F61-I65 VanDerWaalsContact CE1-CD1 3.46Å; F61-I65 HydrophobicContact CZ-CD1 3.97Å; F61-I65 PolarHBondContact O-N 3.47Å; P62-I65 PolarHBondContact O-N 3.33Å; N63-I65 VanDerWaalsContact C-N 3.34Å; N63-I65 PolarHBondContact O-N 2.99Å; I65-S68 PolarHBondContact O-OG 3.11Å; I65-R69 VanDerWaalsContact CG2-NH1 3.35Å; I65-R69 WeakPolarHBondContact O-CG 3.24Å; I65-R69 PolarHBondContact O-N 3.35Å; I65-R69 VanDerWaalsContact O-N 3.14Å; I65-T105 HydrophobicContact CD1-CG2 4.37Å; I65-V107 HydrophobicContact CG2-CG1 4.18Å; I65-V108 HydrophobicContact CG1-CG2 4Å
66E85.6Confident82.6Confident72 Ų7253.8 Ų53.834%0.33627%0.273SS..Hα-helixtrans-69.3-44.5-176.3-160.664.3-169.600111.7V16 P62 N63 S68 R69 V70V16-E66 HydrophobicContact CG1-CB 4.07Å; V16-E66 HydrophobicContact CG1-CG 3.88Å; P62-E66 PolarHBondContact O-N 3.35Å; N63-E66 PolarHBondContact O-N 3.28Å; E66-S68 VanDerWaalsContact C-N 3.35Å; E66-S68 PolarHBondContact O-N 2.95Å; E66-R69 PolarHBondContact O-N 3.3Å; E66-R69 VanDerWaalsContact O-N 3.16Å; E66-R69 IonicContact OE2-NH1 2.87Å; E66-R69 PolarHBondContact OE2-NH1 3.41Å; E66-V70 HydrophobicContact CG-CG2 4.41Å; E66-V70 WeakPolarHBondContact O-CB 3.34Å; E66-V70 VanDerWaalsContact O-CG2 3.29Å; E66-V70 WeakPolarHBondContact O-CG2 3.39Å; E66-V70 PolarHBondContact O-N 3.33Å
67A87.1Confident83.1Confident0 Ų050.3 Ų50.30%026%0.26CS..Hα-helixtrans-57.8-46.3176.200000111.4V16 T55 N63 R69 V70 L71V16-A67 HydrophobicContact CG1-CB 4.28Å; V16-A67 HydrophobicContact CG2-CB 4.02Å; T55-A67 HydrophobicContact CG2-CB 4.14Å; N63-A67 WeakPolarHBondContact O-CB 3.37Å; N63-A67 PolarHBondContact O-N 3.1Å; A67-R69 VanDerWaalsContact C-N 3.34Å; A67-R69 PolarHBondContact O-N 3.31Å; A67-V70 PolarHBondContact O-N 3.48Å; A67-L71 WeakPolarHBondContact O-CB 3.31Å; A67-L71 VanDerWaalsContact O-CG 3.32Å; A67-L71 WeakPolarHBondContact O-CG 3.45Å; A67-L71 PolarHBondContact O-N 3.43Å
68S90.5Very high84Confident0 Ų047.9 Ų47.90%024%0.235CC..Hα-helixtrans-62.9-37.6178.171.20000112.6A64 I65 E66 N72 Y96 N111A64-S68 VanDerWaalsContact O-CB 3.29Å; A64-S68 WeakPolarHBondContact O-CB 3.12Å; A64-S68 PolarHBondContact O-N 3.37Å; A64-S68 PolarHBondContact O-OG 3.5Å; A64-S68 VanDerWaalsContact O-OG 3.11Å; I65-S68 PolarHBondContact O-OG 3.11Å; E66-S68 VanDerWaalsContact C-N 3.35Å; E66-S68 PolarHBondContact O-N 2.95Å; S68-N72 VanDerWaalsContact O-CB 3.25Å; S68-N72 WeakPolarHBondContact O-CB 3.31Å; S68-N72 PolarHBondContact O-N 2.98Å; S68-N72 VanDerWaalsContact O-N 3.12Å; S68-Y96 WeakPolarHBondContact CA-OH 3.49Å; S68-Y96 WeakPolarHBondContact CB-OH 3.19Å; S68-N111 PolarHBondContact OG-ND2 3.48Å
69R90.6Very high85.4Confident113 Ų11341.4 Ų41.443%0.42621%0.205SC..Hα-helixtrans-68.5-44.4175.5-74.3176.2-177.9148.80.7112.1I65 E66 A67 N72 T73 N111I65-R69 VanDerWaalsContact CG2-NH1 3.35Å; I65-R69 WeakPolarHBondContact O-CG 3.24Å; I65-R69 PolarHBondContact O-N 3.35Å; I65-R69 VanDerWaalsContact O-N 3.14Å; E66-R69 PolarHBondContact O-N 3.3Å; E66-R69 VanDerWaalsContact O-N 3.16Å; E66-R69 IonicContact OE2-NH1 2.87Å; E66-R69 PolarHBondContact OE2-NH1 3.41Å; A67-R69 VanDerWaalsContact C-N 3.34Å; A67-R69 PolarHBondContact O-N 3.31Å; R69-N72 PolarHBondContact O-N 3.35Å; R69-T73 PolarHBondContact O-N 3.34Å; R69-T73 PolarHBondContact O-OG1 3.12Å; R69-N111 WeakPolarHBondContact CG-ND2 3.33Å; R69-N111 PolarHBondContact N-ND2 3.44Å
70V91.6Very high86.5Confident4 Ų446.5 Ų46.52%0.02423%0.229CC..Hα-helixtrans-64.3-50.5179.8173.40000109.5V16 C19 A20 I51 E66 A67 N72 T73 V74V16-V70 HydrophobicContact CG1-CB 4.42Å; V16-V70 HydrophobicContact CG1-CG2 3.99Å; C19-V70 HydrophobicContact CB-CG1 3.62Å; A20-V70 HydrophobicContact CB-CG2 3.65Å; I51-V70 HydrophobicContact CD1-CG1 3.62Å; E66-V70 HydrophobicContact CG-CG2 4.41Å; E66-V70 WeakPolarHBondContact O-CB 3.34Å; E66-V70 VanDerWaalsContact O-CG2 3.29Å; E66-V70 WeakPolarHBondContact O-CG2 3.39Å; E66-V70 PolarHBondContact O-N 3.33Å; A67-V70 PolarHBondContact O-N 3.48Å; V70-N72 VanDerWaalsContact C-N 3.28Å; V70-N72 PolarHBondContact O-N 3.11Å; V70-T73 PolarHBondContact O-N 3.24Å; V70-V74 HydrophobicContact CG1-CG2 3.98Å; V70-V74 WeakPolarHBondContact O-CB 3.49Å; V70-V74 VanDerWaalsContact O-CG2 3.22Å; V70-V74 WeakPolarHBondContact O-CG2 3.44Å; V70-V74 PolarHBondContact O-N 3.33Å
71L93.3Very high87.2Confident0 Ų045.9 Ų45.90%023%0.225CC..Hα-helixtrans-53.4-46.4175.2-76.5172.4000111.8L48 I51 L52 A67 T73 V74 L75 L93 Y96 I115L48-L71 HydrophobicContact CD1-CD2 3.72Å; I51-L71 HydrophobicContact CB-CD2 4.22Å; I51-L71 HydrophobicContact CG2-CD1 4.28Å; I51-L71 HydrophobicContact CG2-CD2 3.56Å; I51-L71 HydrophobicContact CG2-CG 3.66Å; L52-L71 HydrophobicContact CD2-CD1 4.13Å; L52-L71 HydrophobicContact CD2-CD2 4.16Å; L52-L71 HydrophobicContact CG-CD2 4.15Å; A67-L71 WeakPolarHBondContact O-CB 3.31Å; A67-L71 VanDerWaalsContact O-CG 3.32Å; A67-L71 WeakPolarHBondContact O-CG 3.45Å; A67-L71 PolarHBondContact O-N 3.43Å; L71-T73 VanDerWaalsContact C-N 3.34Å; L71-T73 PolarHBondContact O-N 2.73Å; L71-V74 PolarHBondContact O-N 3.23Å; L71-L75 WeakPolarHBondContact O-CG 3.48Å; L71-L75 PolarHBondContact O-N 3.03Å; L71-L93 HydrophobicContact CD2-CD2 4.29Å; L71-Y96 HydrophobicContact CD1-CD1 3.91Å; L71-Y96 HydrophobicContact CD1-CD2 4.1Å; L71-Y96 HydrophobicContact CD1-CE1 3.6Å; L71-Y96 HydrophobicContact CD1-CE2 3.84Å; L71-Y96 HydrophobicContact CD1-CG 4.16Å; L71-I115 HydrophobicContact CB-CD1 3.85Å; L71-I115 HydrophobicContact CD1-CD1 4.48Å
72N92.5Very high88Confident24 Ų2445.6 Ų45.613%0.12823%0.229CC..Hα-helixtrans-59.9-44.7178.4-159.922.2000111.4S68 R69 V70 D76 N111 A114 I115 K118S68-N72 VanDerWaalsContact O-CB 3.25Å; S68-N72 WeakPolarHBondContact O-CB 3.31Å; S68-N72 PolarHBondContact O-N 2.98Å; S68-N72 VanDerWaalsContact O-N 3.12Å; R69-N72 PolarHBondContact O-N 3.35Å; V70-N72 VanDerWaalsContact C-N 3.28Å; V70-N72 PolarHBondContact O-N 3.11Å; N72-D76 PolarHBondContact O-N 2.84Å; N72-N111 PolarHBondContact ND2-OD1 2.87Å; N72-N111 VanDerWaalsContact ND2-OD1 3.15Å; N72-A114 WeakPolarHBondContact OD1-CB 3.27Å; N72-I115 HydrophobicContact CB-CG1 4.24Å; N72-K118 PolarHBondContact O-NZ 2.86Å; N72-K118 VanDerWaalsContact OD1-CE 3.3Å; N72-K118 WeakPolarHBondContact OD1-CE 3.22Å; N72-K118 PolarHBondContact OD1-NZ 3.14Å
73T91.3Very high88.4Confident55 Ų5544.1 Ų44.134%0.33722%0.219SC..Hα-helixtrans-69.6-41.3179.5-49.60000112.1L23 R69 V70 L71 L75 D76 F77L23-T73 HydrophobicContact CD1-CG2 3.82Å; L23-T73 HydrophobicContact CD2-CG2 4.49Å; R69-T73 PolarHBondContact O-N 3.34Å; R69-T73 PolarHBondContact O-OG1 3.12Å; V70-T73 PolarHBondContact O-N 3.24Å; L71-T73 VanDerWaalsContact C-N 3.34Å; L71-T73 PolarHBondContact O-N 2.73Å; T73-L75 VanDerWaalsContact C-N 3.33Å; T73-L75 PolarHBondContact O-N 3.31Å; T73-D76 WeakPolarHBondContact O-CB 3.45Å; T73-D76 PolarHBondContact O-N 3.48Å; T73-F77 HydrophobicContact CG2-CD2 4.12Å; T73-F77 HydrophobicContact CG2-CE2 4.21Å; T73-F77 PolarHBondContact O-N 3.39Å
74V92.1Very high88.7Confident0 Ų044.7 Ų44.70%023%0.225CC..Hα-helixtrans-58.2-46.8176.1168.80000110.2L23 L43 L48 I51 V70 L71 D76 F77 L78L23-V74 HydrophobicContact CD1-CG2 4Å; L43-V74 HydrophobicContact CD1-CG1 4.03Å; L43-V74 HydrophobicContact CD1-CG2 4.04Å; L43-V74 HydrophobicContact CD2-CG1 4.36Å; L43-V74 HydrophobicContact CG-CG1 4Å; L48-V74 HydrophobicContact CB-CG1 4.4Å; L48-V74 HydrophobicContact CD1-CG1 4.22Å; I51-V74 HydrophobicContact CD1-CG2 4.25Å; V70-V74 HydrophobicContact CG1-CG2 3.98Å; V70-V74 WeakPolarHBondContact O-CB 3.49Å; V70-V74 VanDerWaalsContact O-CG2 3.22Å; V70-V74 WeakPolarHBondContact O-CG2 3.44Å; V70-V74 PolarHBondContact O-N 3.33Å; L71-V74 PolarHBondContact O-N 3.23Å; V74-D76 VanDerWaalsContact C-N 3.32Å; V74-D76 PolarHBondContact O-N 3.38Å; V74-F77 PolarHBondContact O-N 3.27Å; V74-L78 HydrophobicContact CG1-CD1 3.84Å; V74-L78 HydrophobicContact CG1-CG 4.32Å; V74-L78 WeakPolarHBondContact O-CG 3.41Å; V74-L78 PolarHBondContact O-N 3.04Å
75L93.7Very high89.1Confident0 Ų045 Ų450%023%0.226CC..Hα-helixtrans-64.4-33.4178-71.3175.4000113.2L71 T73 Y79 I85 L93 I115 K118 F122L71-L75 WeakPolarHBondContact O-CG 3.48Å; L71-L75 PolarHBondContact O-N 3.03Å; T73-L75 VanDerWaalsContact C-N 3.33Å; T73-L75 PolarHBondContact O-N 3.31Å; L75-Y79 VanDerWaalsContact O-CB 3.25Å; L75-Y79 WeakPolarHBondContact O-CB 3.46Å; L75-Y79 PolarHBondContact O-N 3.11Å; L75-I85 HydrophobicContact CD2-CD1 3.64Å; L75-L93 HydrophobicContact CD1-CD1 4.37Å; L75-L93 HydrophobicContact CD1-CD2 4.31Å; L75-L93 HydrophobicContact CD2-CD1 3.76Å; L75-I115 HydrophobicContact CD1-CB 4.28Å; L75-I115 HydrophobicContact CD1-CG1 4.15Å; L75-I115 HydrophobicContact CD1-CG2 3.84Å; L75-K118 HydrophobicContact CB-CB 4.31Å; L75-K118 HydrophobicContact CB-CD 3.72Å; L75-K118 HydrophobicContact CD1-CB 4.13Å; L75-K118 HydrophobicContact CD1-CD 4.31Å; L75-F122 HydrophobicContact CB-CE2 4.5Å; L75-F122 HydrophobicContact CD2-CE2 4Å
76D90.6Very high89.3Confident68 Ų6846.9 Ų46.936%0.36424%0.242SC..Hα-helixtrans-64.2-47.2173.1-82.7-31.8000111.3N72 T73 V74 Y79 Q80 K118N72-D76 PolarHBondContact O-N 2.84Å; T73-D76 WeakPolarHBondContact O-CB 3.45Å; T73-D76 PolarHBondContact O-N 3.48Å; V74-D76 VanDerWaalsContact C-N 3.32Å; V74-D76 PolarHBondContact O-N 3.38Å; D76-Y79 PolarHBondContact O-N 2.81Å; D76-Q80 WeakPolarHBondContact O-CB 3.49Å; D76-Q80 VanDerWaalsContact O-CG 3.28Å; D76-Q80 WeakPolarHBondContact O-CG 3.41Å; D76-Q80 PolarHBondContact O-N 2.83Å; D76-K118 WeakPolarHBondContact OD1-CE 3.22Å; D76-K118 IonicContact OD1-NZ 3.49Å; D76-K118 PolarHBondContact OD1-NZ 3.49Å; D76-K118 IonicContact OD2-NZ 2.84Å; D76-K118 PolarHBondContact OD2-NZ 3.41Å
77F89.2Confident89.4Confident55 Ų5547.9 Ų47.924%0.24125%0.245CC..Hα-helixtrans-58.6-49.6177.2-95.3-87.9000111.2L23 L43 T73 V74 Y79 Q80 S81L23-F77 HydrophobicContact CD2-CD2 3.7Å; L23-F77 HydrophobicContact CD2-CE2 3.68Å; L23-F77 HydrophobicContact CD2-CG 4.27Å; L23-F77 HydrophobicContact CD2-CZ 4.24Å; L43-F77 HydrophobicContact CD2-CB 4.12Å; T73-F77 HydrophobicContact CG2-CD2 4.12Å; T73-F77 HydrophobicContact CG2-CE2 4.21Å; T73-F77 PolarHBondContact O-N 3.39Å; V74-F77 PolarHBondContact O-N 3.27Å; F77-Y79 VanDerWaalsContact C-N 3.31Å; F77-Y79 PolarHBondContact O-N 2.8Å; F77-Q80 PolarHBondContact O-N 3.31Å; F77-S81 WeakPolarHBondContact O-CB 3.15Å; F77-S81 PolarHBondContact O-N 3.34Å; F77-S81 PolarHBondContact O-OG 2.94Å
78L91.1Very high89.5Confident0 Ų055.3 Ų55.30%028%0.28CS..Hα-helixtrans-62.3-36.2178.9-68.2174.7000112.8L32 L43 N44 L48 V74 S81 T83 I85 F122L32-L78 HydrophobicContact CD2-CD2 3.94Å; L43-L78 HydrophobicContact CB-CD2 4.42Å; L43-L78 HydrophobicContact CD2-CD2 4Å; L43-L78 HydrophobicContact CD2-CG 4.18Å; L43-L78 HydrophobicContact CG-CD2 4.22Å; N44-L78 HydrophobicContact CB-CD2 3.91Å; L48-L78 HydrophobicContact CD2-CD1 3.96Å; V74-L78 HydrophobicContact CG1-CD1 3.84Å; V74-L78 HydrophobicContact CG1-CG 4.32Å; V74-L78 WeakPolarHBondContact O-CG 3.41Å; V74-L78 PolarHBondContact O-N 3.04Å; L78-S81 WeakPolarHBondContact CA-OG 3.46Å; L78-S81 PolarHBondContact O-OG 3.3Å; L78-S81 VanDerWaalsContact O-OG 3.13Å; L78-T83 HydrophobicContact CD2-CG2 3.97Å; L78-T83 PolarHBondContact O-N 3.26Å; L78-I85 HydrophobicContact CB-CD1 4.39Å; L78-I85 HydrophobicContact CD1-CD1 3.82Å; L78-I85 HydrophobicContact CD1-CG1 4.28Å; L78-F122 HydrophobicContact CB-CZ 4Å
79Y90Very high89.5Confident86 Ų8656.5 Ų56.534%0.33729%0.286SS..Hα-helixtrans-71.6-43.4179.1-169-93.3000111L75 D76 F77 S81 N82 K121 F122L75-Y79 VanDerWaalsContact O-CB 3.25Å; L75-Y79 WeakPolarHBondContact O-CB 3.46Å; L75-Y79 PolarHBondContact O-N 3.11Å; D76-Y79 PolarHBondContact O-N 2.81Å; F77-Y79 VanDerWaalsContact C-N 3.31Å; F77-Y79 PolarHBondContact O-N 2.8Å; Y79-S81 VanDerWaalsContact C-N 3.33Å; Y79-S81 PolarHBondContact O-N 3.34Å; Y79-N82 PolarHBondContact O-N 2.97Å; Y79-K121 HydrophobicContact CD2-CB 4.45Å; Y79-K121 HydrophobicContact CE2-CB 3.73Å; Y79-F122 HydrophobicContact CD2-CD1 4.17Å; Y79-F122 HydrophobicContact CD2-CD2 4.22Å; Y79-F122 AromaticContact CD2-CE1 3.94Å; Y79-F122 HydrophobicContact CD2-CE1 3.94Å; Y79-F122 AromaticContact CD2-CE2 3.98Å; Y79-F122 HydrophobicContact CD2-CE2 3.98Å; Y79-F122 HydrophobicContact CD2-CG 4.3Å; Y79-F122 AromaticContact CD2-CZ 3.85Å; Y79-F122 HydrophobicContact CD2-CZ 3.85Å; Y79-F122 HydrophobicContact CG-CE2 4.5Å; Y79-F122 HydrophobicContact CG-CZ 4.25Å
80Q87.7Confident89.6Confident149 Ų14951.4 Ų51.470%0.69627%0.267SS*.Hα-helixtrans-65.6-34.2177-71.8176.615.200112.6D76 F77 N82D76-Q80 WeakPolarHBondContact O-CB 3.49Å; D76-Q80 VanDerWaalsContact O-CG 3.28Å; D76-Q80 WeakPolarHBondContact O-CG 3.41Å; D76-Q80 PolarHBondContact O-N 2.83Å; F77-Q80 PolarHBondContact O-N 3.31Å; Q80-N82 PolarHBondContact O-N 3.29Å
81S85.1Confident89.5Confident45 Ų4553.2 Ų53.232%0.31528%0.282SS..THydrogen-bonded Turntrans-80.65.1177.9620000114.3F77 L78 Y79 T83F77-S81 WeakPolarHBondContact O-CB 3.15Å; F77-S81 PolarHBondContact O-N 3.34Å; F77-S81 PolarHBondContact O-OG 2.94Å; L78-S81 WeakPolarHBondContact CA-OG 3.46Å; L78-S81 PolarHBondContact O-OG 3.3Å; L78-S81 VanDerWaalsContact O-OG 3.13Å; Y79-S81 VanDerWaalsContact C-N 3.33Å; Y79-S81 PolarHBondContact O-N 3.34Å; S81-T83 PolarHBondContact O-N 3.15Å; S81-T83 VanDerWaalsContact O-N 3.14Å; S81-T83 PolarHBondContact OG-OG1 3.31Å
82N84.5Confident89.4Confident126 Ų12655.8 Ų55.867%0.67430%0.296SS*.THydrogen-bonded Turntrans53.527.7-173.9-85.2-14.6000113.9Y79 Q80Y79-N82 PolarHBondContact O-N 2.97Å; Q80-N82 PolarHBondContact O-N 3.29Å
83T86.1Confident89.5Confident31 Ų3154.6 Ų54.619%0.1929%0.29CS..PPolyproline II helixtrans-75.3135.1177.6-530000109.7N44 L78 S81 F122 R125N44-T83 HydrophobicContact CB-CG2 4.22Å; L78-T83 HydrophobicContact CD2-CG2 3.97Å; L78-T83 PolarHBondContact O-N 3.26Å; S81-T83 PolarHBondContact O-N 3.15Å; S81-T83 VanDerWaalsContact O-N 3.14Å; S81-T83 PolarHBondContact OG-OG1 3.31Å; T83-F122 WeakPolarHBondContact O-CE1 3.21Å; T83-R125 PolarHBondContact O-NH2 3.14Å
84T85.6Confident89.5Confident83 Ų8353.4 Ų53.451%0.50928%0.281SS..PPolyproline II helixtrans-85.4130.2177.152.30000110.3
85I89.9Confident89.4Confident10 Ų1057.1 Ų57.15%0.05130%0.301CS..PPolyproline II helixtrans-101.7136.2175.5-58.9-178.9000108L48 L75 L78 M89 L90 F122L48-I85 HydrophobicContact CD2-CD1 4.39Å; L75-I85 HydrophobicContact CD2-CD1 3.64Å; L78-I85 HydrophobicContact CB-CD1 4.39Å; L78-I85 HydrophobicContact CD1-CD1 3.82Å; L78-I85 HydrophobicContact CD1-CG1 4.28Å; I85-M89 HydrophobicContact CG2-CB 3.62Å; I85-M89 HydrophobicContact CG2-CG 3.57Å; I85-L90 HydrophobicContact CB-CD2 4.05Å; I85-L90 HydrophobicContact CB-CG 4.38Å; I85-L90 HydrophobicContact CG2-CD2 3.79Å; I85-L90 HydrophobicContact CG2-CG 4Å; I85-F122 HydrophobicContact CD1-CD1 4.16Å; I85-F122 HydrophobicContact CD1-CD2 4.02Å; I85-F122 HydrophobicContact CD1-CE1 3.8Å; I85-F122 HydrophobicContact CD1-CE2 3.67Å; I85-F122 HydrophobicContact CD1-CG 4.27Å; I85-F122 HydrophobicContact CD1-CZ 3.54Å; I85-F122 HydrophobicContact CG1-CD1 4.24Å; I85-F122 HydrophobicContact CG1-CE1 3.97Å; I85-F122 HydrophobicContact CG1-CZ 4.2Å
86S88.2Confident89.3Confident64 Ų6457.3 Ų57.345%0.44830%0.302SS..PPolyproline II helixtrans-64.5151.7179.171.90000111.7E88 M89 L90S86-E88 PolarHBondContact O-N 3.31Å; S86-M89 PolarHBondContact O-N 3.17Å; S86-M89 VanDerWaalsContact O-N 3.15Å; S86-M89 WeakPolarHBondContact OG-CB 3.3Å; S86-M89 PolarHBondContact OG-N 3.5Å; S86-L90 PolarHBondContact O-N 3.25Å
87F87.4Confident89.2Confident93 Ų9354.1 Ų54.141%0.40829%0.285SS..Hα-helixtrans-62.9-31.7178.6-72.3-67.8000113.1L90 A91 Y123 E126 R127F87-L90 HydrophobicContact CD1-CD1 4.3Å; F87-L90 PolarHBondContact O-N 3.34Å; F87-A91 WeakPolarHBondContact O-CB 3.5Å; F87-A91 PolarHBondContact O-N 3.23Å; F87-Y123 HydrophobicContact CD1-CD2 4.22Å; F87-Y123 HydrophobicContact CD1-CE2 4.3Å; F87-Y123 AromaticContact CE1-CD2 3.87Å; F87-Y123 HydrophobicContact CE1-CD2 3.87Å; F87-Y123 AromaticContact CE1-CE2 3.95Å; F87-Y123 HydrophobicContact CE1-CE2 3.95Å; F87-E126 HydrophobicContact CZ-CB 4.2Å; F87-R127 HydrophobicContact CE1-CG 4.25Å; F87-R127 HydrophobicContact CZ-CG 4.11Å
88E88.1Confident89.1Confident156 Ų15653.4 Ų53.473%0.72928%0.28SS*.Hα-helixtrans-62.2-45.9173.8-65.7177.5175.500110.7S86 L90 A91 D92S86-E88 PolarHBondContact O-N 3.31Å; E88-L90 PolarHBondContact O-N 3.12Å; E88-A91 WeakPolarHBondContact O-CB 3.46Å; E88-A91 PolarHBondContact O-N 3.02Å; E88-A91 VanDerWaalsContact O-N 3.14Å; E88-D92 PolarHBondContact O-N 3.13Å
89M91.3Very high88.8Confident24 Ų2458.4 Ų58.412%0.11831%0.307CS..Hα-helixtrans-66.1-38.1177.3-172.661.157.500112.6L48 P49 L52 I85 S86 A91 D92 L93L48-M89 HydrophobicContact CD2-CG 3.71Å; L48-M89 HydrophobicContact CD2-SD 4.06Å; L48-M89 HydrophobicContact CG-CG 4.26Å; L48-M89 HydrophobicContact CG-SD 3.93Å; P49-M89 HydrophobicContact CB-CE 3.79Å; P49-M89 HydrophobicContact CG-CE 3.58Å; L52-M89 HydrophobicContact CD1-SD 3.46Å; L52-M89 WeakPolarHBondContact CD1-SD 3.44Å; I85-M89 HydrophobicContact CG2-CB 3.62Å; I85-M89 HydrophobicContact CG2-CG 3.57Å; S86-M89 PolarHBondContact O-N 3.17Å; S86-M89 VanDerWaalsContact O-N 3.15Å; S86-M89 WeakPolarHBondContact OG-CB 3.3Å; S86-M89 PolarHBondContact OG-N 3.5Å; M89-A91 VanDerWaalsContact C-N 3.31Å; M89-A91 PolarHBondContact O-N 3.18Å; M89-D92 PolarHBondContact O-N 3.47Å; M89-L93 WeakPolarHBondContact O-CG 3.49Å; M89-L93 PolarHBondContact O-N 3.42Å
90L91.7Very high88.6Confident6 Ų655 Ų553%0.03129%0.294CS..Hα-helixtrans-63-38.3172.5-66.1-179.7000111.6I85 S86 F87 E88 L93 L94 V119 F122I85-L90 HydrophobicContact CB-CD2 4.05Å; I85-L90 HydrophobicContact CB-CG 4.38Å; I85-L90 HydrophobicContact CG2-CD2 3.79Å; I85-L90 HydrophobicContact CG2-CG 4Å; S86-L90 PolarHBondContact O-N 3.25Å; F87-L90 HydrophobicContact CD1-CD1 4.3Å; F87-L90 PolarHBondContact O-N 3.34Å; E88-L90 PolarHBondContact O-N 3.12Å; L90-L93 HydrophobicContact CD2-CD1 4.36Å; L90-L93 PolarHBondContact O-N 3.1Å; L90-L94 WeakPolarHBondContact O-CG 3.24Å; L90-L94 PolarHBondContact O-N 3.31Å; L90-V119 HydrophobicContact CB-CG1 4.17Å; L90-V119 HydrophobicContact CD2-CG1 4.15Å; L90-V119 HydrophobicContact CD2-CG2 4.45Å; L90-F122 HydrophobicContact CD1-CB 4.16Å; L90-F122 HydrophobicContact CD2-CB 3.84Å; L90-F122 HydrophobicContact CD2-CD2 4.5Å; L90-F122 HydrophobicContact CD2-CG 4.32Å
91A90.2Very high88.4Confident42 Ų4248.2 Ų48.235%0.34726%0.262SS..Hα-helixtrans-65.6-40.4174.900000111.8F87 E88 M89 L94 N95F87-A91 WeakPolarHBondContact O-CB 3.5Å; F87-A91 PolarHBondContact O-N 3.23Å; E88-A91 WeakPolarHBondContact O-CB 3.46Å; E88-A91 PolarHBondContact O-N 3.02Å; E88-A91 VanDerWaalsContact O-N 3.14Å; M89-A91 VanDerWaalsContact C-N 3.31Å; M89-A91 PolarHBondContact O-N 3.18Å; A91-L94 WeakPolarHBondContact O-CB 3.31Å; A91-L94 PolarHBondContact O-N 2.94Å; A91-N95 PolarHBondContact O-N 3.23Å; A91-N95 PolarHBondContact O-ND2 2.99Å
92D92.2Very high87.9Confident54 Ų5448.3 Ų48.329%0.28926%0.259SS..Hα-helixtrans-64.1-38.8175-75.1-9.8000112.4L52 Y56 E88 M89 N95 Y96L52-D92 HydrophobicContact CD1-CB 4.16Å; Y56-D92 VanDerWaalsContact OH-CG 3.3Å; Y56-D92 PolarHBondContact OH-OD1 3.44Å; E88-D92 PolarHBondContact O-N 3.13Å; M89-D92 PolarHBondContact O-N 3.47Å; D92-N95 WeakPolarHBondContact O-CB 3.47Å; D92-N95 PolarHBondContact O-N 3.41Å; D92-Y96 PolarHBondContact O-N 2.96Å
93L94.3Very high87.2Confident0 Ų044.8 Ų44.80%024%0.239CC..Hα-helixtrans-64-39.2172.4-74.6164.6000112.5L48 L52 L71 L75 M89 L90 Y96 V97 I115 V119L48-L93 HydrophobicContact CD1-CD2 4.29Å; L52-L93 HydrophobicContact CD1-CD2 3.97Å; L52-L93 HydrophobicContact CD1-CG 4Å; L52-L93 HydrophobicContact CD2-CD2 4.02Å; L52-L93 HydrophobicContact CG-CD2 4.39Å; L71-L93 HydrophobicContact CD2-CD2 4.29Å; L75-L93 HydrophobicContact CD1-CD1 4.37Å; L75-L93 HydrophobicContact CD1-CD2 4.31Å; L75-L93 HydrophobicContact CD2-CD1 3.76Å; M89-L93 WeakPolarHBondContact O-CG 3.49Å; M89-L93 PolarHBondContact O-N 3.42Å; L90-L93 HydrophobicContact CD2-CD1 4.36Å; L90-L93 PolarHBondContact O-N 3.1Å; L93-Y96 WeakPolarHBondContact O-CB 3.31Å; L93-Y96 PolarHBondContact O-N 2.87Å; L93-V97 WeakPolarHBondContact O-CG2 3.44Å; L93-V97 PolarHBondContact O-N 2.72Å; L93-I115 HydrophobicContact CD2-CG2 4.29Å; L93-V119 HydrophobicContact CB-CG2 3.62Å; L93-V119 HydrophobicContact CD1-CG2 4.02Å; L93-V119 HydrophobicContact CG-CG2 4.42Å
94L91Very high86.1Confident30 Ų3053.1 Ų53.116%0.15727%0.268CS..Hα-helixtrans-65.7-40.4173.3-70174.2000111.6L90 A91 Y96 V97 W98 M116 V119 F133L90-L94 WeakPolarHBondContact O-CG 3.24Å; L90-L94 PolarHBondContact O-N 3.31Å; A91-L94 WeakPolarHBondContact O-CB 3.31Å; A91-L94 PolarHBondContact O-N 2.94Å; L94-Y96 VanDerWaalsContact C-N 3.34Å; L94-V97 PolarHBondContact O-N 3.02Å; L94-W98 PolarHBondContact O-N 3Å; L94-M116 HydrophobicContact CD2-CE 3.65Å; L94-M116 HydrophobicContact CD2-SD 3.32Å; L94-M116 WeakPolarHBondContact CD2-SD 3.36Å; L94-V119 HydrophobicContact CD1-CG1 4.18Å; L94-V119 HydrophobicContact CD2-CB 4.25Å; L94-V119 HydrophobicContact CD2-CG1 3.75Å; L94-V119 HydrophobicContact CG-CG1 3.76Å; L94-F133 HydrophobicContact CD1-CZ 4.43Å
95N89.8Confident85.5Confident78 Ų7850.1 Ų50.142%0.41725%0.25SC..Hα-helixtrans-62-42.6174.7-74.4-28.4000111.2A91 D92 V97 W98 N99A91-N95 PolarHBondContact O-N 3.23Å; A91-N95 PolarHBondContact O-ND2 2.99Å; D92-N95 WeakPolarHBondContact O-CB 3.47Å; D92-N95 PolarHBondContact O-N 3.41Å; N95-V97 PolarHBondContact O-N 2.89Å; N95-W98 PolarHBondContact O-N 3.24Å; N95-N99 WeakPolarHBondContact O-CB 3.27Å; N95-N99 PolarHBondContact O-N 3.05Å; N95-N99 PolarHBondContact O-ND2 3.36Å
96Y90.9Very high85Confident3 Ų354.3 Ų54.31%0.01227%0.269CS..Hα-helixtrans-56.1-49.8171.6173.2-93.7000111L52 T55 S68 L71 D92 L93 L94 W98 N99 H100 I115L52-Y96 HydrophobicContact CD2-CD2 4.22Å; L52-Y96 HydrophobicContact CD2-CG 4.06Å; T55-Y96 HydrophobicContact CG2-CD2 3.99Å; T55-Y96 HydrophobicContact CG2-CE2 3.59Å; T55-Y96 WeakPolarHBondContact OG1-CD2 3.4Å; S68-Y96 WeakPolarHBondContact CA-OH 3.49Å; S68-Y96 WeakPolarHBondContact CB-OH 3.19Å; L71-Y96 HydrophobicContact CD1-CD1 3.91Å; L71-Y96 HydrophobicContact CD1-CD2 4.1Å; L71-Y96 HydrophobicContact CD1-CE1 3.6Å; L71-Y96 HydrophobicContact CD1-CE2 3.84Å; L71-Y96 HydrophobicContact CD1-CG 4.16Å; D92-Y96 PolarHBondContact O-N 2.96Å; L93-Y96 WeakPolarHBondContact O-CB 3.31Å; L93-Y96 PolarHBondContact O-N 2.87Å; L94-Y96 VanDerWaalsContact C-N 3.34Å; Y96-W98 PolarHBondContact O-N 3.38Å; Y96-N99 PolarHBondContact O-N 3.34Å; Y96-H100 AromaticContact CD2-CD2 3.15Å; Y96-H100 WeakPolarHBondContact CD2-CD2 3.46Å; Y96-H100 AromaticContact CD2-NE2 3.58Å; Y96-H100 HydrophobicContact CE2-CB 4.37Å; Y96-H100 AromaticContact CE2-CD2 3.2Å; Y96-H100 WeakPolarHBondContact CE2-CD2 3.48Å; Y96-H100 AromaticContact CE2-CG 3.77Å; Y96-H100 AromaticContact CE2-NE2 3.6Å; Y96-H100 AromaticContact CG-CD2 3.83Å; Y96-H100 AromaticContact CZ-CD2 3.93Å; Y96-H100 WeakPolarHBondContact O-CB 3.38Å; Y96-H100 PolarHBondContact O-CD2 3.37Å; Y96-H100 PolarHBondContact O-N 3.45Å; Y96-I115 HydrophobicContact CD1-CD1 4.28Å; Y96-I115 HydrophobicContact CE1-CD1 3.82Å
97V89.7Confident84.9Confident1 Ų153.6 Ų53.61%0.00626%0.262CS..Hα-helixtrans-58.5-47.8178.3172.80000111.4L93 L94 N95 N99 H100 W101 C112 I115 M116L93-V97 WeakPolarHBondContact O-CG2 3.44Å; L93-V97 PolarHBondContact O-N 2.72Å; L94-V97 PolarHBondContact O-N 3.02Å; N95-V97 PolarHBondContact O-N 2.89Å; V97-N99 VanDerWaalsContact C-N 3.3Å; V97-N99 PolarHBondContact O-N 3.16Å; V97-H100 PolarHBondContact O-N 3Å; V97-W101 HydrophobicContact CG1-CB 4.23Å; V97-W101 HydrophobicContact CG1-CG 4.47Å; V97-W101 WeakPolarHBondContact O-CB 3.21Å; V97-W101 PolarHBondContact O-N 3.38Å; V97-C112 HydrophobicContact CG1-CB 4.11Å; V97-C112 HydrophobicContact CG2-CB 4.39Å; V97-C112 WeakPolarHBondContact CG2-O 3.47Å; V97-I115 HydrophobicContact CG2-CB 4Å; V97-I115 HydrophobicContact CG2-CG2 3.63Å; V97-M116 HydrophobicContact CB-CE 4.06Å; V97-M116 HydrophobicContact CG1-CB 4.33Å; V97-M116 HydrophobicContact CG1-CE 3.53Å
98W87.2Confident84.8Confident41 Ų4149.1 Ų49.116%0.15524%0.242CC..Hα-helixtrans-62.7-31.9178.1-75.8167.4000114.7L94 N95 Y96 W101 M116 L137 I141L94-W98 PolarHBondContact O-N 3Å; N95-W98 PolarHBondContact O-N 3.24Å; Y96-W98 PolarHBondContact O-N 3.38Å; W98-W101 HydrophobicContact CD2-CZ2 4.45Å; W98-W101 AromaticContact CE3-CD2 3.64Å; W98-W101 HydrophobicContact CE3-CD2 3.64Å; W98-W101 AromaticContact CE3-CE2 3.4Å; W98-W101 VanDerWaalsContact CE3-CE2 3.4Å; W98-W101 AromaticContact CE3-CE3 3.97Å; W98-W101 HydrophobicContact CE3-CE3 3.97Å; W98-W101 HydrophobicContact CE3-CG 4.22Å; W98-W101 AromaticContact CE3-CH2 3.91Å; W98-W101 HydrophobicContact CE3-CH2 3.91Å; W98-W101 AromaticContact CE3-CZ2 3.57Å; W98-W101 HydrophobicContact CE3-CZ2 3.57Å; W98-W101 HydrophobicContact CE3-CZ3 4.09Å; W98-W101 AromaticContact CE3-NE1 3.83Å; W98-W101 AromaticContact CH2-CH2 3.79Å; W98-W101 HydrophobicContact CH2-CH2 3.79Å; W98-W101 HydrophobicContact CH2-CZ2 4.22Å; W98-W101 AromaticContact CH2-CZ3 3.95Å; W98-W101 HydrophobicContact CH2-CZ3 3.95Å; W98-W101 AromaticContact CZ3-CD2 3.64Å; W98-W101 HydrophobicContact CZ3-CD2 3.64Å; W98-W101 AromaticContact CZ3-CE2 3.62Å; W98-W101 AromaticContact CZ3-CE3 3.45Å; W98-W101 HydrophobicContact CZ3-CE3 3.45Å; W98-W101 VanDerWaalsContact CZ3-CE3 3.45Å; W98-W101 AromaticContact CZ3-CH2 3.27Å; W98-W101 HydrophobicContact CZ3-CH2 3.27Å; W98-W101 AromaticContact CZ3-CZ2 3.47Å; W98-W101 HydrophobicContact CZ3-CZ2 3.47Å; W98-W101 VanDerWaalsContact CZ3-CZ2 3.47Å; W98-W101 AromaticContact CZ3-CZ3 3.26Å; W98-W101 HydrophobicContact CZ3-CZ3 3.26Å; W98-W101 VanDerWaalsContact O-CD1 3.29Å; W98-W101 PolarHBondContact O-NE1 2.85Å; W98-M116 HydrophobicContact CD2-CE 4.42Å; W98-M116 HydrophobicContact CE3-CE 4Å; W98-M116 HydrophobicContact CH2-CE 3.32Å; W98-M116 HydrophobicContact CZ2-CE 3.81Å; W98-M116 HydrophobicContact CZ3-CE 3.41Å; W98-M116 VanDerWaalsContact CZ3-CE 3.41Å; W98-L137 HydrophobicContact CZ2-CD1 4.14Å; W98-I141 HydrophobicContact CH2-CD1 4.37Å; W98-I141 HydrophobicContact CH2-CG1 3.6Å; W98-I141 HydrophobicContact CZ2-CG1 4.23Å
99N84.7Confident84.7Confident105 Ų10544 Ų4456%0.56122%0.216SC*.Hα-helixtrans-79.3-32.9177.8-68.3-22.5000112.7N95 Y96 V97N95-N99 WeakPolarHBondContact O-CB 3.27Å; N95-N99 PolarHBondContact O-N 3.05Å; N95-N99 PolarHBondContact O-ND2 3.36Å; Y96-N99 PolarHBondContact O-N 3.34Å; V97-N99 VanDerWaalsContact C-N 3.3Å; V97-N99 PolarHBondContact O-N 3.16Å
100H84.3Confident84.5Confident14 Ų1448.3 Ų48.37%0.06523%0.231CC..Hα-helixtrans-110.2-18-168.8-63.8-78.1000115.3Y96 V97 N102 E103 V108Y96-H100 AromaticContact CD2-CD2 3.15Å; Y96-H100 WeakPolarHBondContact CD2-CD2 3.46Å; Y96-H100 AromaticContact CD2-NE2 3.58Å; Y96-H100 HydrophobicContact CE2-CB 4.37Å; Y96-H100 AromaticContact CE2-CD2 3.2Å; Y96-H100 WeakPolarHBondContact CE2-CD2 3.48Å; Y96-H100 AromaticContact CE2-CG 3.77Å; Y96-H100 AromaticContact CE2-NE2 3.6Å; Y96-H100 AromaticContact CG-CD2 3.83Å; Y96-H100 AromaticContact CZ-CD2 3.93Å; Y96-H100 WeakPolarHBondContact O-CB 3.38Å; Y96-H100 PolarHBondContact O-CD2 3.37Å; Y96-H100 PolarHBondContact O-N 3.45Å; V97-H100 PolarHBondContact O-N 3Å; H100-N102 PolarHBondContact O-N 2.66Å; H100-N102 VanDerWaalsContact O-N 3.09Å; H100-E103 HydrophobicContact CB-CG 4.49Å; H100-E103 IonicContact CE1-OE1 2.74Å; H100-E103 IonicContact CG-OE1 2.8Å; H100-E103 IonicContact ND1-OE1 3.99Å; H100-E103 PolarHBondContact ND1-OE1 2.96Å; H100-E103 VanDerWaalsContact O-CB 3.28Å; H100-E103 WeakPolarHBondContact O-CB 3.48Å; H100-E103 WeakPolarHBondContact O-CG 3.47Å; H100-E103 PolarHBondContact O-N 3.05Å; H100-V108 HydrophobicContact CB-CG1 4.31Å
101W83.4Confident84.4Confident6 Ų649.1 Ų49.12%0.02324%0.235CC..THydrogen-bonded Turntrans-67.3-11.6-178.574.6-29.8000114.9V97 W98 R109 C112 P150V97-W101 HydrophobicContact CG1-CB 4.23Å; V97-W101 HydrophobicContact CG1-CG 4.47Å; V97-W101 WeakPolarHBondContact O-CB 3.21Å; V97-W101 PolarHBondContact O-N 3.38Å; W98-W101 HydrophobicContact CD2-CZ2 4.45Å; W98-W101 AromaticContact CE3-CD2 3.64Å; W98-W101 HydrophobicContact CE3-CD2 3.64Å; W98-W101 AromaticContact CE3-CE2 3.4Å; W98-W101 VanDerWaalsContact CE3-CE2 3.4Å; W98-W101 AromaticContact CE3-CE3 3.97Å; W98-W101 HydrophobicContact CE3-CE3 3.97Å; W98-W101 HydrophobicContact CE3-CG 4.22Å; W98-W101 AromaticContact CE3-CH2 3.91Å; W98-W101 HydrophobicContact CE3-CH2 3.91Å; W98-W101 AromaticContact CE3-CZ2 3.57Å; W98-W101 HydrophobicContact CE3-CZ2 3.57Å; W98-W101 HydrophobicContact CE3-CZ3 4.09Å; W98-W101 AromaticContact CE3-NE1 3.83Å; W98-W101 AromaticContact CH2-CH2 3.79Å; W98-W101 HydrophobicContact CH2-CH2 3.79Å; W98-W101 HydrophobicContact CH2-CZ2 4.22Å; W98-W101 AromaticContact CH2-CZ3 3.95Å; W98-W101 HydrophobicContact CH2-CZ3 3.95Å; W98-W101 AromaticContact CZ3-CD2 3.64Å; W98-W101 HydrophobicContact CZ3-CD2 3.64Å; W98-W101 AromaticContact CZ3-CE2 3.62Å; W98-W101 AromaticContact CZ3-CE3 3.45Å; W98-W101 HydrophobicContact CZ3-CE3 3.45Å; W98-W101 VanDerWaalsContact CZ3-CE3 3.45Å; W98-W101 AromaticContact CZ3-CH2 3.27Å; W98-W101 HydrophobicContact CZ3-CH2 3.27Å; W98-W101 AromaticContact CZ3-CZ2 3.47Å; W98-W101 HydrophobicContact CZ3-CZ2 3.47Å; W98-W101 VanDerWaalsContact CZ3-CZ2 3.47Å; W98-W101 AromaticContact CZ3-CZ3 3.26Å; W98-W101 HydrophobicContact CZ3-CZ3 3.26Å; W98-W101 VanDerWaalsContact O-CD1 3.29Å; W98-W101 PolarHBondContact O-NE1 2.85Å; W101-R109 WeakPolarHBondContact O-CG 3.49Å; W101-C112 HydrophobicContact CB-CB 3.75Å; W101-P150 HydrophobicContact CE3-CB 4.09Å; W101-P150 WeakPolarHBondContact O-CG 3.44Å
102N76.1Confident84.5Confident47 Ų4747.1 Ų47.125%0.25122%0.219SC..THydrogen-bonded Turntrans-100.73.6173.9-79.4-19.3000113H100 V146 C147H100-N102 PolarHBondContact O-N 2.66Å; H100-N102 VanDerWaalsContact O-N 3.09Å; N102-V146 PolarHBondContact ND2-O 3.27Å; N102-C147 WeakPolarHBondContact OD1-CB 3.27Å
103E69Low84.4Confident53 Ų5344.6 Ų44.625%0.24821%0.206CC..SBendtrans-63.1164.3174.4-74.4-171.1176.300112.7A64 H100 T105 R109A64-E103 WeakPolarHBondContact CB-OE2 3.27Å; H100-E103 HydrophobicContact CB-CG 4.49Å; H100-E103 IonicContact CE1-OE1 2.74Å; H100-E103 IonicContact CG-OE1 2.8Å; H100-E103 IonicContact ND1-OE1 3.99Å; H100-E103 PolarHBondContact ND1-OE1 2.96Å; H100-E103 VanDerWaalsContact O-CB 3.28Å; H100-E103 WeakPolarHBondContact O-CB 3.48Å; H100-E103 WeakPolarHBondContact O-CG 3.47Å; H100-E103 PolarHBondContact O-N 3.05Å; E103-T105 VanDerWaalsContact C-N 3.31Å; E103-T105 PolarHBondContact O-N 3.21Å; E103-R109 PolarHBondContact O-NE 2.86Å; E103-R109 PolarHBondContact O-NH2 3.38Å
104Y62.4Low84.3Confident206 Ų20645.3 Ų45.381%0.80821%0.211SC*.SBendtrans-67.9-21.9-167.8-58.8-83.3000114.8R109Y104-R109 PolarHBondContact O-NH2 3.15Å
105T74.4Confident84.5Confident19 Ų1943.9 Ų43.912%0.11720%0.204CC..  trans-96.4130.7-173.262.30000113.9F61 I65 E103 V107 V108 R109F61-T105 HydrophobicContact CD2-CG2 3.67Å; F61-T105 HydrophobicContact CE1-CG2 4.23Å; F61-T105 HydrophobicContact CE2-CG2 2.89Å; F61-T105 HydrophobicContact CZ-CG2 3.22Å; I65-T105 HydrophobicContact CD1-CG2 4.37Å; E103-T105 VanDerWaalsContact C-N 3.31Å; E103-T105 PolarHBondContact O-N 3.21Å; T105-V107 PolarHBondContact O-N 3.15Å; T105-V108 PolarHBondContact O-N 3.47Å; T105-V108 VanDerWaalsContact OG1-CB 3.3Å; T105-V108 WeakPolarHBondContact OG1-CB 3.36Å; T105-V108 WeakPolarHBondContact OG1-CG2 3.32Å; T105-V108 PolarHBondContact OG1-N 3.35Å; T105-R109 VanDerWaalsContact O-CG 3.32Å; T105-R109 WeakPolarHBondContact O-CG 2.92Å; T105-R109 PolarHBondContact O-N 3.22Å; T105-R109 VanDerWaalsContact O-N 3.15Å
106E79.5Confident84.6Confident98 Ų9840.1 Ų40.146%0.45818%0.184SC..Hα-helixtrans-57.6-35.8176.2-170.5171.1-146.600112.9R109 W110E106-R109 PolarHBondContact O-N 3.21Å; E106-W110 HydrophobicContact CG-CD2 3.9Å; E106-W110 HydrophobicContact CG-CE3 4.32Å; E106-W110 HydrophobicContact CG-CH2 3.72Å; E106-W110 HydrophobicContact CG-CZ2 3.26Å; E106-W110 HydrophobicContact CG-CZ3 4.23Å; E106-W110 VanDerWaalsContact O-CG 3.22Å; E106-W110 PolarHBondContact O-N 3.18Å; E106-W110 WeakPolarHBondContact OE1-CZ2 3.49Å
107V84.7Confident84.7Confident49 Ų4940.6 Ų40.630%0.29719%0.187SC..Hα-helixtrans-61.8-47.2177178.30000112.1I65 T105 W110 N111I65-V107 HydrophobicContact CG2-CG1 4.18Å; T105-V107 PolarHBondContact O-N 3.15Å; V107-W110 PolarHBondContact O-N 3.32Å; V107-N111 PolarHBondContact O-N 3.02Å; V107-N111 PolarHBondContact O-ND2 3.05Å
108V85.5Confident84.9Confident0 Ų041.6 Ų41.60%019%0.191CC..Hα-helixtrans-64.8-45178.6173.40000109.7A64 I65 H100 T105 W110 N111 C112A64-V108 HydrophobicContact CB-CG2 4.25Å; I65-V108 HydrophobicContact CG1-CG2 4Å; H100-V108 HydrophobicContact CB-CG1 4.31Å; T105-V108 PolarHBondContact O-N 3.47Å; T105-V108 VanDerWaalsContact OG1-CB 3.3Å; T105-V108 WeakPolarHBondContact OG1-CB 3.36Å; T105-V108 WeakPolarHBondContact OG1-CG2 3.32Å; T105-V108 PolarHBondContact OG1-N 3.35Å; V108-W110 VanDerWaalsContact C-N 3.3Å; V108-W110 PolarHBondContact O-N 3.4Å; V108-N111 PolarHBondContact O-N 2.95Å; V108-C112 WeakPolarHBondContact O-CB 3.28Å; V108-C112 PolarHBondContact O-N 3.34Å; V108-C112 PolarHBondContact O-SG 3.14Å
109R86Confident85.2Confident49 Ų4939.7 Ų39.719%0.18519%0.185CC..Hα-helixtrans-53.9-45.4177-62.6177.1-176.3149.93.8112.3W101 E103 Y104 T105 E106 C112 C113 P150W101-R109 WeakPolarHBondContact O-CG 3.49Å; E103-R109 PolarHBondContact O-NE 2.86Å; E103-R109 PolarHBondContact O-NH2 3.38Å; Y104-R109 PolarHBondContact O-NH2 3.15Å; T105-R109 VanDerWaalsContact O-CG 3.32Å; T105-R109 WeakPolarHBondContact O-CG 2.92Å; T105-R109 PolarHBondContact O-N 3.22Å; T105-R109 VanDerWaalsContact O-N 3.15Å; E106-R109 PolarHBondContact O-N 3.21Å; R109-C112 WeakPolarHBondContact O-CB 3.47Å; R109-C112 PolarHBondContact O-N 2.94Å; R109-C113 PolarHBondContact O-N 2.87Å; R109-C113 PolarHBondContact O-SG 2.86Å; R109-P150 HydrophobicContact CB-CG 4.38Å; R109-P150 HydrophobicContact CG-CG 4.29Å
110W86.7Confident85.5Confident114 Ų11434.7 Ų34.743%0.43216%0.158SC..Hα-helixtrans-71.8-39.8-179.8-64.4-14.3000113E106 V107 V108 C112 C113 A114E106-W110 HydrophobicContact CG-CD2 3.9Å; E106-W110 HydrophobicContact CG-CE3 4.32Å; E106-W110 HydrophobicContact CG-CH2 3.72Å; E106-W110 HydrophobicContact CG-CZ2 3.26Å; E106-W110 HydrophobicContact CG-CZ3 4.23Å; E106-W110 VanDerWaalsContact O-CG 3.22Å; E106-W110 PolarHBondContact O-N 3.18Å; E106-W110 WeakPolarHBondContact OE1-CZ2 3.49Å; V107-W110 PolarHBondContact O-N 3.32Å; V108-W110 VanDerWaalsContact C-N 3.3Å; V108-W110 PolarHBondContact O-N 3.4Å; W110-C112 VanDerWaalsContact C-N 3.3Å; W110-C112 PolarHBondContact O-N 2.78Å; W110-C113 WeakPolarHBondContact O-CB 3.16Å; W110-C113 PolarHBondContact O-N 3.17Å; W110-A114 PolarHBondContact O-N 3.26Å
111N91.1Very high85.9Confident22 Ų2237.8 Ų37.812%0.11817%0.171CC..Hα-helixtrans-61.8-40.9172.2-77.7-26.9000110.9S68 R69 N72 V107 V108 C113 A114 I115S68-N111 PolarHBondContact OG-ND2 3.48Å; R69-N111 WeakPolarHBondContact CG-ND2 3.33Å; R69-N111 PolarHBondContact N-ND2 3.44Å; N72-N111 PolarHBondContact ND2-OD1 2.87Å; N72-N111 VanDerWaalsContact ND2-OD1 3.15Å; V107-N111 PolarHBondContact O-N 3.02Å; V107-N111 PolarHBondContact O-ND2 3.05Å; V108-N111 PolarHBondContact O-N 2.95Å; N111-C113 PolarHBondContact O-N 3.47Å; N111-A114 PolarHBondContact O-N 3.48Å; N111-I115 WeakPolarHBondContact O-CB 3.34Å; N111-I115 WeakPolarHBondContact O-CD1 3.47Å; N111-I115 WeakPolarHBondContact O-CG1 3.31Å; N111-I115 PolarHBondContact O-N 3.04Å
112C91Very high86.3Confident0 Ų037.6 Ų37.60%017%0.17CC..Hα-helixtrans-59.8-42.9172.9-71.60000112.1V97 W101 V108 R109 W110 A114 I115 M116V97-C112 HydrophobicContact CG1-CB 4.11Å; V97-C112 HydrophobicContact CG2-CB 4.39Å; V97-C112 WeakPolarHBondContact CG2-O 3.47Å; W101-C112 HydrophobicContact CB-CB 3.75Å; V108-C112 WeakPolarHBondContact O-CB 3.28Å; V108-C112 PolarHBondContact O-N 3.34Å; V108-C112 PolarHBondContact O-SG 3.14Å; R109-C112 WeakPolarHBondContact O-CB 3.47Å; R109-C112 PolarHBondContact O-N 2.94Å; W110-C112 VanDerWaalsContact C-N 3.3Å; W110-C112 PolarHBondContact O-N 2.78Å; C112-A114 VanDerWaalsContact C-N 3.34Å; C112-A114 PolarHBondContact O-N 3.04Å; C112-I115 PolarHBondContact O-N 3.42Å; C112-M116 WeakPolarHBondContact O-CB 3.17Å; C112-M116 PolarHBondContact O-N 2.7Å
113C91.1Very high86.9Confident1 Ų137.8 Ų37.81%0.00717%0.168CC..Hα-helixtrans-61.3-41.7173.8-64.50000111.9R109 W110 N111 M116 V117 C154 M157R109-C113 PolarHBondContact O-N 2.87Å; R109-C113 PolarHBondContact O-SG 2.86Å; W110-C113 WeakPolarHBondContact O-CB 3.16Å; W110-C113 PolarHBondContact O-N 3.17Å; N111-C113 PolarHBondContact O-N 3.47Å; C113-M116 WeakPolarHBondContact O-CB 3.42Å; C113-M116 PolarHBondContact O-N 3.5Å; C113-V117 VanDerWaalsContact O-CG2 3.29Å; C113-V117 WeakPolarHBondContact O-CG2 3.32Å; C113-V117 PolarHBondContact O-N 2.78Å; C113-V117 VanDerWaalsContact O-N 3.12Å; C113-C154 HydrophobicContact CB-CB 4.18Å; C113-M157 HydrophobicContact CB-SD 3.9Å
114A92.3Very high87.9Confident15 Ų1537.8 Ų37.812%0.12417%0.169CC..Hα-helixtrans-66.9-42.6177.200000112.3N72 W110 N111 C112 V117 K118 M157N72-A114 WeakPolarHBondContact OD1-CB 3.27Å; W110-A114 PolarHBondContact O-N 3.26Å; N111-A114 PolarHBondContact O-N 3.48Å; C112-A114 VanDerWaalsContact C-N 3.34Å; C112-A114 PolarHBondContact O-N 3.04Å; A114-V117 PolarHBondContact O-N 3.38Å; A114-K118 VanDerWaalsContact O-CG 3.31Å; A114-K118 WeakPolarHBondContact O-CG 3.18Å; A114-K118 PolarHBondContact O-N 3.13Å; A114-M157 HydrophobicContact CB-CE 3.99Å
115I93.8Very high89Confident0 Ų031.7 Ų31.70%015%0.145CC..Hα-helixtrans-59.7-46.5174.7-70163000109.8L71 N72 L75 L93 Y96 V97 N111 C112 V117 K118 V119L71-I115 HydrophobicContact CB-CD1 3.85Å; L71-I115 HydrophobicContact CD1-CD1 4.48Å; N72-I115 HydrophobicContact CB-CG1 4.24Å; L75-I115 HydrophobicContact CD1-CB 4.28Å; L75-I115 HydrophobicContact CD1-CG1 4.15Å; L75-I115 HydrophobicContact CD1-CG2 3.84Å; L93-I115 HydrophobicContact CD2-CG2 4.29Å; Y96-I115 HydrophobicContact CD1-CD1 4.28Å; Y96-I115 HydrophobicContact CE1-CD1 3.82Å; V97-I115 HydrophobicContact CG2-CB 4Å; V97-I115 HydrophobicContact CG2-CG2 3.63Å; N111-I115 WeakPolarHBondContact O-CB 3.34Å; N111-I115 WeakPolarHBondContact O-CD1 3.47Å; N111-I115 WeakPolarHBondContact O-CG1 3.31Å; N111-I115 PolarHBondContact O-N 3.04Å; C112-I115 PolarHBondContact O-N 3.42Å; I115-V117 PolarHBondContact O-N 3.02Å; I115-K118 WeakPolarHBondContact O-CB 3.35Å; I115-K118 PolarHBondContact O-N 3.36Å; I115-K118 VanDerWaalsContact O-N 3.14Å; I115-V119 HydrophobicContact CG2-CG2 4.33Å; I115-V119 WeakPolarHBondContact O-CG2 2.95Å; I115-V119 PolarHBondContact O-N 2.87Å
116M92.6Very high89.4Confident0 Ų034.5 Ų34.50%016%0.156CC..Hα-helixtrans-54.3-50.5175.2178.665.467.400111.8L94 V97 W98 C112 C113 K118 V119 V120 L137 L158L94-M116 HydrophobicContact CD2-CE 3.65Å; L94-M116 HydrophobicContact CD2-SD 3.32Å; L94-M116 WeakPolarHBondContact CD2-SD 3.36Å; V97-M116 HydrophobicContact CB-CE 4.06Å; V97-M116 HydrophobicContact CG1-CB 4.33Å; V97-M116 HydrophobicContact CG1-CE 3.53Å; W98-M116 HydrophobicContact CD2-CE 4.42Å; W98-M116 HydrophobicContact CE3-CE 4Å; W98-M116 HydrophobicContact CH2-CE 3.32Å; W98-M116 HydrophobicContact CZ2-CE 3.81Å; W98-M116 HydrophobicContact CZ3-CE 3.41Å; W98-M116 VanDerWaalsContact CZ3-CE 3.41Å; C112-M116 WeakPolarHBondContact O-CB 3.17Å; C112-M116 PolarHBondContact O-N 2.7Å; C113-M116 WeakPolarHBondContact O-CB 3.42Å; C113-M116 PolarHBondContact O-N 3.5Å; M116-K118 VanDerWaalsContact C-N 3.28Å; M116-K118 PolarHBondContact O-N 2.96Å; M116-V119 PolarHBondContact O-N 3.3Å; M116-V120 WeakPolarHBondContact O-CG2 3.46Å; M116-V120 PolarHBondContact O-N 3.27Å; M116-V120 HydrophobicContact SD-CG2 4.47Å; M116-L137 HydrophobicContact CE-CD1 4.42Å; M116-L137 HydrophobicContact SD-CD1 3.92Å; M116-L137 HydrophobicContact SD-CD2 4.13Å; M116-L158 HydrophobicContact CG-CD1 4.46Å
117V93.4Very high89.5Confident13 Ų1335.7 Ų35.78%0.07916%0.157CC..Hα-helixtrans-60.1-39.9178.8172.50000111.4C113 A114 I115 V120 K121 M157 L158 L161C113-V117 VanDerWaalsContact O-CG2 3.29Å; C113-V117 WeakPolarHBondContact O-CG2 3.32Å; C113-V117 PolarHBondContact O-N 2.78Å; C113-V117 VanDerWaalsContact O-N 3.12Å; A114-V117 PolarHBondContact O-N 3.38Å; I115-V117 PolarHBondContact O-N 3.02Å; V117-V120 PolarHBondContact O-N 2.98Å; V117-K121 WeakPolarHBondContact O-CG 3.42Å; V117-K121 PolarHBondContact O-N 3.15Å; V117-M157 HydrophobicContact CG2-CB 3.57Å; V117-M157 HydrophobicContact CG2-CE 4.39Å; V117-L158 HydrophobicContact CB-CD2 4.34Å; V117-L158 HydrophobicContact CG2-CD2 3.8Å; V117-L158 HydrophobicContact CG2-CG 3.96Å; V117-L161 HydrophobicContact CG1-CD1 4.37Å
118K93.7Very high88.8Confident21 Ų2139 Ų399%0.09118%0.179CC..Hα-helixtrans-66.6-44.9177.1-70.9171.1-177.9-177.30111.8N72 L75 D76 A114 I115 M116 V120 K121 F122N72-K118 PolarHBondContact O-NZ 2.86Å; N72-K118 VanDerWaalsContact OD1-CE 3.3Å; N72-K118 WeakPolarHBondContact OD1-CE 3.22Å; N72-K118 PolarHBondContact OD1-NZ 3.14Å; L75-K118 HydrophobicContact CB-CB 4.31Å; L75-K118 HydrophobicContact CB-CD 3.72Å; L75-K118 HydrophobicContact CD1-CB 4.13Å; L75-K118 HydrophobicContact CD1-CD 4.31Å; D76-K118 WeakPolarHBondContact OD1-CE 3.22Å; D76-K118 IonicContact OD1-NZ 3.49Å; D76-K118 PolarHBondContact OD1-NZ 3.49Å; D76-K118 IonicContact OD2-NZ 2.84Å; D76-K118 PolarHBondContact OD2-NZ 3.41Å; A114-K118 VanDerWaalsContact O-CG 3.31Å; A114-K118 WeakPolarHBondContact O-CG 3.18Å; A114-K118 PolarHBondContact O-N 3.13Å; I115-K118 WeakPolarHBondContact O-CB 3.35Å; I115-K118 PolarHBondContact O-N 3.36Å; I115-K118 VanDerWaalsContact O-N 3.14Å; M116-K118 VanDerWaalsContact C-N 3.28Å; M116-K118 PolarHBondContact O-N 2.96Å; K118-V120 VanDerWaalsContact C-N 3.29Å; K118-V120 PolarHBondContact O-N 3.48Å; K118-K121 WeakPolarHBondContact O-CB 3.29Å; K118-K121 PolarHBondContact O-N 3.33Å; K118-K121 VanDerWaalsContact O-N 3.11Å; K118-F122 WeakPolarHBondContact O-CD2 3.42Å; K118-F122 PolarHBondContact O-N 2.86Å
119V92.9Very high88.4Confident2 Ų245.5 Ų45.51%0.01221%0.214CC..Hα-helixtrans-57.8-44.3175.1171.10000110.9L90 L93 L94 I115 M116 K121 F122 Y123L90-V119 HydrophobicContact CB-CG1 4.17Å; L90-V119 HydrophobicContact CD2-CG1 4.15Å; L90-V119 HydrophobicContact CD2-CG2 4.45Å; L93-V119 HydrophobicContact CB-CG2 3.62Å; L93-V119 HydrophobicContact CD1-CG2 4.02Å; L93-V119 HydrophobicContact CG-CG2 4.42Å; L94-V119 HydrophobicContact CD1-CG1 4.18Å; L94-V119 HydrophobicContact CD2-CB 4.25Å; L94-V119 HydrophobicContact CD2-CG1 3.75Å; L94-V119 HydrophobicContact CG-CG1 3.76Å; I115-V119 HydrophobicContact CG2-CG2 4.33Å; I115-V119 WeakPolarHBondContact O-CG2 2.95Å; I115-V119 PolarHBondContact O-N 2.87Å; M116-V119 PolarHBondContact O-N 3.3Å; V119-K121 PolarHBondContact O-N 2.96Å; V119-F122 PolarHBondContact O-N 3.47Å; V119-Y123 PolarHBondContact O-N 3Å
120V91.5Very high88.2Confident0 Ų044.1 Ų44.10%021%0.211CC..Hα-helixtrans-62-42.4175.6175.10000111.4M116 V117 K118 F122 Y123 I124 F133 L134 L137 L158 L161M116-V120 WeakPolarHBondContact O-CG2 3.46Å; M116-V120 PolarHBondContact O-N 3.27Å; M116-V120 HydrophobicContact SD-CG2 4.47Å; V117-V120 PolarHBondContact O-N 2.98Å; K118-V120 VanDerWaalsContact C-N 3.29Å; K118-V120 PolarHBondContact O-N 3.48Å; V120-F122 PolarHBondContact O-N 3.22Å; V120-Y123 PolarHBondContact O-N 2.84Å; V120-I124 HydrophobicContact CG1-CD1 3.68Å; V120-I124 HydrophobicContact CG1-CG1 4.25Å; V120-I124 VanDerWaalsContact O-CG1 3.3Å; V120-I124 WeakPolarHBondContact O-CG1 3.46Å; V120-I124 PolarHBondContact O-N 3.13Å; V120-F133 HydrophobicContact CG2-CE1 4.17Å; V120-L134 HydrophobicContact CG1-CD2 3.56Å; V120-L137 HydrophobicContact CG2-CD2 3.44Å; V120-L137 VanDerWaalsContact CG2-CD2 3.44Å; V120-L158 HydrophobicContact CB-CD2 4.05Å; V120-L158 HydrophobicContact CG1-CD2 4.19Å; V120-L158 HydrophobicContact CG2-CD2 3.86Å; V120-L161 HydrophobicContact CB-CD1 4.31Å; V120-L161 HydrophobicContact CG1-CD1 3.78Å
121K92Very high87.8Confident79 Ų7943.2 Ų43.234%0.34321%0.212SC..Hα-helixtrans-60.6-43.8174.9-75178.5176.8-176.70112.6Y79 V117 K118 V119 R125 L161Y79-K121 HydrophobicContact CD2-CB 4.45Å; Y79-K121 HydrophobicContact CE2-CB 3.73Å; V117-K121 WeakPolarHBondContact O-CG 3.42Å; V117-K121 PolarHBondContact O-N 3.15Å; K118-K121 WeakPolarHBondContact O-CB 3.29Å; K118-K121 PolarHBondContact O-N 3.33Å; K118-K121 VanDerWaalsContact O-N 3.11Å; V119-K121 PolarHBondContact O-N 2.96Å; K121-R125 WeakPolarHBondContact O-CB 3.48Å; K121-R125 PolarHBondContact O-N 2.91Å; K121-R125 VanDerWaalsContact O-N 3.08Å; K121-L161 HydrophobicContact CG-CD1 3.92Å; K121-L161 HydrophobicContact CG-CD2 4.09Å
122F91.8Very high87.4Confident1 Ų150.1 Ų50.10%0.00424%0.243CC..Hα-helixtrans-60.1-46.6173.7-81.8-74000111L75 L78 Y79 T83 I85 L90 K118 V119 V120 I124 R125 E126L75-F122 HydrophobicContact CB-CE2 4.5Å; L75-F122 HydrophobicContact CD2-CE2 4Å; L78-F122 HydrophobicContact CB-CZ 4Å; Y79-F122 HydrophobicContact CD2-CD1 4.17Å; Y79-F122 HydrophobicContact CD2-CD2 4.22Å; Y79-F122 AromaticContact CD2-CE1 3.94Å; Y79-F122 HydrophobicContact CD2-CE1 3.94Å; Y79-F122 AromaticContact CD2-CE2 3.98Å; Y79-F122 HydrophobicContact CD2-CE2 3.98Å; Y79-F122 HydrophobicContact CD2-CG 4.3Å; Y79-F122 AromaticContact CD2-CZ 3.85Å; Y79-F122 HydrophobicContact CD2-CZ 3.85Å; Y79-F122 HydrophobicContact CG-CE2 4.5Å; Y79-F122 HydrophobicContact CG-CZ 4.25Å; T83-F122 WeakPolarHBondContact O-CE1 3.21Å; I85-F122 HydrophobicContact CD1-CD1 4.16Å; I85-F122 HydrophobicContact CD1-CD2 4.02Å; I85-F122 HydrophobicContact CD1-CE1 3.8Å; I85-F122 HydrophobicContact CD1-CE2 3.67Å; I85-F122 HydrophobicContact CD1-CG 4.27Å; I85-F122 HydrophobicContact CD1-CZ 3.54Å; I85-F122 HydrophobicContact CG1-CD1 4.24Å; I85-F122 HydrophobicContact CG1-CE1 3.97Å; I85-F122 HydrophobicContact CG1-CZ 4.2Å; L90-F122 HydrophobicContact CD1-CB 4.16Å; L90-F122 HydrophobicContact CD2-CB 3.84Å; L90-F122 HydrophobicContact CD2-CD2 4.5Å; L90-F122 HydrophobicContact CD2-CG 4.32Å; K118-F122 WeakPolarHBondContact O-CD2 3.42Å; K118-F122 PolarHBondContact O-N 2.86Å; V119-F122 PolarHBondContact O-N 3.47Å; V120-F122 PolarHBondContact O-N 3.22Å; F122-I124 PolarHBondContact O-N 3.04Å; F122-R125 PolarHBondContact O-N 2.75Å; F122-E126 WeakPolarHBondContact O-CG 3.19Å; F122-E126 PolarHBondContact O-N 3.05Å
123Y90.2Very high87.1Confident51 Ų5152 Ų5220%0.225%0.252CS..Hα-helixtrans-61.1-46.4179.3-173-87.3000112.8F87 V119 V120 R125 E126 R127 P130 F133F87-Y123 HydrophobicContact CD1-CD2 4.22Å; F87-Y123 HydrophobicContact CD1-CE2 4.3Å; F87-Y123 AromaticContact CE1-CD2 3.87Å; F87-Y123 HydrophobicContact CE1-CD2 3.87Å; F87-Y123 AromaticContact CE1-CE2 3.95Å; F87-Y123 HydrophobicContact CE1-CE2 3.95Å; V119-Y123 PolarHBondContact O-N 3Å; V120-Y123 PolarHBondContact O-N 2.84Å; Y123-R125 VanDerWaalsContact C-N 3.29Å; Y123-R125 PolarHBondContact O-N 2.83Å; Y123-E126 PolarHBondContact O-N 3.41Å; Y123-R127 HydrophobicContact CD1-CB 4.36Å; Y123-R127 HydrophobicContact CD1-CG 4.46Å; Y123-R127 HydrophobicContact CE1-CB 3.98Å; Y123-R127 HydrophobicContact CE1-CG 3.98Å; Y123-R127 HydrophobicContact CE2-CG 4.16Å; Y123-R127 WeakPolarHBondContact O-CB 3.43Å; Y123-R127 PolarHBondContact O-N 2.93Å; Y123-P130 HydrophobicContact CD1-CB 4.46Å; Y123-P130 HydrophobicContact CE1-CB 4.47Å; Y123-F133 HydrophobicContact CD1-CB 4.25Å; Y123-F133 AromaticContact CD1-CD1 3.42Å; Y123-F133 HydrophobicContact CD1-CD1 3.42Å; Y123-F133 VanDerWaalsContact CD1-CD1 3.42Å; Y123-F133 AromaticContact CD1-CE1 3.85Å; Y123-F133 HydrophobicContact CD1-CE1 3.85Å; Y123-F133 AromaticContact CD1-CG 3.84Å; Y123-F133 HydrophobicContact CD1-CG 3.84Å; Y123-F133 HydrophobicContact CE1-CB 3.5Å; Y123-F133 VanDerWaalsContact CE1-CB 3.5Å; Y123-F133 AromaticContact CE1-CD1 3.6Å; Y123-F133 HydrophobicContact CE1-CD1 3.6Å; Y123-F133 HydrophobicContact CE1-CD2 4.24Å; Y123-F133 HydrophobicContact CE1-CE1 4.38Å; Y123-F133 AromaticContact CE1-CG 3.5Å; Y123-F133 HydrophobicContact CE1-CG 3.5Å; Y123-F133 HydrophobicContact CE2-CD2 4.32Å; Y123-F133 HydrophobicContact CE2-CG 4.38Å; Y123-F133 AromaticContact CG-CD1 3.98Å; Y123-F133 HydrophobicContact CG-CD1 3.98Å; Y123-F133 AromaticContact CG-CE1 3.94Å; Y123-F133 HydrophobicContact CG-CE1 3.94Å; Y123-F133 HydrophobicContact CG-CG 4.41Å; Y123-F133 HydrophobicContact CG-CZ 4.35Å; Y123-F133 AromaticContact CZ-CG 3.79Å
124I88.5Confident86.9Confident53 Ų5352.3 Ų52.327%0.27225%0.253SS..Hα-helixtrans-61-38.6178.1-69.2169.2000111V120 F122 E126 P130 L134 L161V120-I124 HydrophobicContact CG1-CD1 3.68Å; V120-I124 HydrophobicContact CG1-CG1 4.25Å; V120-I124 VanDerWaalsContact O-CG1 3.3Å; V120-I124 WeakPolarHBondContact O-CG1 3.46Å; V120-I124 PolarHBondContact O-N 3.13Å; F122-I124 PolarHBondContact O-N 3.04Å; I124-E126 VanDerWaalsContact C-N 3.3Å; I124-E126 PolarHBondContact O-N 2.83Å; I124-P130 HydrophobicContact CG1-CB 3.77Å; I124-P130 HydrophobicContact CG1-CG 4.1Å; I124-P130 HydrophobicContact CG2-CG 4.38Å; I124-L134 HydrophobicContact CD1-CD1 4.4Å; I124-L161 HydrophobicContact CD1-CB 4.2Å; I124-L161 HydrophobicContact CD1-CD1 4.3Å
125R87.4Confident86.4Confident79 Ų7954.9 Ų54.930%0.29826%0.262SS..Hα-helixtrans-62.5-37.5179-170.2176.570.7-170.50.7112.4T83 K121 F122 Y123T83-R125 PolarHBondContact O-NH2 3.14Å; K121-R125 WeakPolarHBondContact O-CB 3.48Å; K121-R125 PolarHBondContact O-N 2.91Å; K121-R125 VanDerWaalsContact O-N 3.08Å; F122-R125 PolarHBondContact O-N 2.75Å; Y123-R125 VanDerWaalsContact C-N 3.29Å; Y123-R125 PolarHBondContact O-N 2.83Å
126E82.8Confident86Confident78 Ų7860.4 Ų60.436%0.36429%0.291SS..Hα-helixtrans-92.3-15.6-175.1-55.5-56.7142.400114F87 F122 Y123 I124F87-E126 HydrophobicContact CZ-CB 4.2Å; F122-E126 WeakPolarHBondContact O-CG 3.19Å; F122-E126 PolarHBondContact O-N 3.05Å; Y123-E126 PolarHBondContact O-N 3.41Å; I124-E126 VanDerWaalsContact C-N 3.3Å; I124-E126 PolarHBondContact O-N 2.83Å
127R81.5Confident85.8Confident123 Ų12361 Ų6146%0.46430%0.295SS..  trans-120.8125.4-176.2-73-70.6-172.5167.8-0.9112.2F87 Y123 N129F87-R127 HydrophobicContact CE1-CG 4.25Å; F87-R127 HydrophobicContact CZ-CG 4.11Å; Y123-R127 HydrophobicContact CD1-CB 4.36Å; Y123-R127 HydrophobicContact CD1-CG 4.46Å; Y123-R127 HydrophobicContact CE1-CB 3.98Å; Y123-R127 HydrophobicContact CE1-CG 3.98Å; Y123-R127 HydrophobicContact CE2-CG 4.16Å; Y123-R127 WeakPolarHBondContact O-CB 3.43Å; Y123-R127 PolarHBondContact O-N 2.93Å; R127-N129 VanDerWaalsContact C-N 3.34Å; R127-N129 PolarHBondContact O-N 3.47Å
128P69.5Low85.5Confident117 Ų11760.5 Ų60.576%0.7629%0.291SS*.SBendtrans-70.1-24.5-17825.1-32.5000114.4P130P128-P130 WeakPolarHBondContact O-CD 3.12Å
129N77.3Confident85.1Confident138 Ų13864.1 Ų64.174%0.73831%0.307SS*.  trans-122.877.4-179.7-72.6-17.9000111.6R127 E131R127-N129 VanDerWaalsContact C-N 3.34Å; R127-N129 PolarHBondContact O-N 3.47Å; N129-E131 VanDerWaalsContact C-N 3.29Å; N129-E131 PolarHBondContact O-N 3.38Å
130P80.8Confident84.7Confident19 Ų1971.5 Ų71.512%0.12334%0.335CS..  trans-78.2-8.5-178.332.5-36.1000114Y123 I124 P128 Q132 F133 L134Y123-P130 HydrophobicContact CD1-CB 4.46Å; Y123-P130 HydrophobicContact CE1-CB 4.47Å; I124-P130 HydrophobicContact CG1-CB 3.77Å; I124-P130 HydrophobicContact CG1-CG 4.1Å; I124-P130 HydrophobicContact CG2-CG 4.38Å; P128-P130 WeakPolarHBondContact O-CD 3.12Å; P130-Q132 PolarHBondContact O-N 3.44Å; P130-F133 WeakPolarHBondContact O-CB 3.33Å; P130-F133 PolarHBondContact O-N 3.37Å; P130-F133 VanDerWaalsContact O-N 3.08Å; P130-L134 HydrophobicContact CB-CD1 4.37Å; P130-L134 HydrophobicContact CB-CG 4.48Å; P130-L134 WeakPolarHBondContact O-CG 2.97Å; P130-L134 PolarHBondContact O-N 2.92Å
131E78Confident84.5Confident95 Ų9571.6 Ų71.644%0.44434%0.335SS..Hα-helixtrans-55.2-45.7-172.1-67.2-164.5132.600113.4N129 F133 L134 H135 S165N129-E131 VanDerWaalsContact C-N 3.29Å; N129-E131 PolarHBondContact O-N 3.38Å; E131-F133 VanDerWaalsContact C-N 3.32Å; E131-F133 PolarHBondContact O-N 2.74Å; E131-L134 PolarHBondContact O-N 3.43Å; E131-H135 VanDerWaalsContact O-CB 3.27Å; E131-H135 WeakPolarHBondContact O-CB 3.4Å; E131-H135 PolarHBondContact O-N 2.95Å; E131-S165 WeakPolarHBondContact OE1-CB 3.24Å; E131-S165 PolarHBondContact OE1-OG 2.87Å
132Q82.5Confident83.9Confident167 Ų16768.8 Ų68.878%0.7832%0.324SS*.Hα-helixtrans-65-37.6180-170-179.716.500111.9P130 L136P130-Q132 PolarHBondContact O-N 3.44Å; Q132-L136 WeakPolarHBondContact O-CB 3.48Å; Q132-L136 PolarHBondContact O-N 2.62Å
133F84.9Confident83.1Confident41 Ų4174 Ų7418%0.1835%0.351CS..Hα-helixtrans-67.9-47.5176.3168.8-102.7000111.3L94 V120 Y123 P130 E131 H135 L136 L137L94-F133 HydrophobicContact CD1-CZ 4.43Å; V120-F133 HydrophobicContact CG2-CE1 4.17Å; Y123-F133 HydrophobicContact CD1-CB 4.25Å; Y123-F133 AromaticContact CD1-CD1 3.42Å; Y123-F133 HydrophobicContact CD1-CD1 3.42Å; Y123-F133 VanDerWaalsContact CD1-CD1 3.42Å; Y123-F133 AromaticContact CD1-CE1 3.85Å; Y123-F133 HydrophobicContact CD1-CE1 3.85Å; Y123-F133 AromaticContact CD1-CG 3.84Å; Y123-F133 HydrophobicContact CD1-CG 3.84Å; Y123-F133 HydrophobicContact CE1-CB 3.5Å; Y123-F133 VanDerWaalsContact CE1-CB 3.5Å; Y123-F133 AromaticContact CE1-CD1 3.6Å; Y123-F133 HydrophobicContact CE1-CD1 3.6Å; Y123-F133 HydrophobicContact CE1-CD2 4.24Å; Y123-F133 HydrophobicContact CE1-CE1 4.38Å; Y123-F133 AromaticContact CE1-CG 3.5Å; Y123-F133 HydrophobicContact CE1-CG 3.5Å; Y123-F133 HydrophobicContact CE2-CD2 4.32Å; Y123-F133 HydrophobicContact CE2-CG 4.38Å; Y123-F133 AromaticContact CG-CD1 3.98Å; Y123-F133 HydrophobicContact CG-CD1 3.98Å; Y123-F133 AromaticContact CG-CE1 3.94Å; Y123-F133 HydrophobicContact CG-CE1 3.94Å; Y123-F133 HydrophobicContact CG-CG 4.41Å; Y123-F133 HydrophobicContact CG-CZ 4.35Å; Y123-F133 AromaticContact CZ-CG 3.79Å; P130-F133 WeakPolarHBondContact O-CB 3.33Å; P130-F133 PolarHBondContact O-N 3.37Å; P130-F133 VanDerWaalsContact O-N 3.08Å; E131-F133 VanDerWaalsContact C-N 3.32Å; E131-F133 PolarHBondContact O-N 2.74Å; F133-H135 VanDerWaalsContact C-N 3.32Å; F133-H135 PolarHBondContact O-N 2.93Å; F133-L136 PolarHBondContact O-N 3.25Å; F133-L137 HydrophobicContact CE1-CD2 4.27Å; F133-L137 HydrophobicContact CZ-CD2 4.34Å; F133-L137 VanDerWaalsContact O-CB 3.31Å; F133-L137 WeakPolarHBondContact O-CB 3.37Å; F133-L137 PolarHBondContact O-N 3.34Å
134L86.8Confident82.2Confident6 Ų674.3 Ų74.33%0.03136%0.356CS..Hα-helixtrans-60.8-42.2176.8-70.4176.1000111.4V120 I124 P130 E131 L137 V138 F162 T166V120-L134 HydrophobicContact CG1-CD2 3.56Å; I124-L134 HydrophobicContact CD1-CD1 4.4Å; P130-L134 HydrophobicContact CB-CD1 4.37Å; P130-L134 HydrophobicContact CB-CG 4.48Å; P130-L134 WeakPolarHBondContact O-CG 2.97Å; P130-L134 PolarHBondContact O-N 2.92Å; E131-L134 PolarHBondContact O-N 3.43Å; L134-L137 PolarHBondContact O-N 3.45Å; L134-V138 WeakPolarHBondContact O-CB 3.46Å; L134-V138 WeakPolarHBondContact O-CG2 3.48Å; L134-V138 PolarHBondContact O-N 3.11Å; L134-F162 HydrophobicContact CD2-CE1 4.34Å; L134-T166 HydrophobicContact CB-CG2 4.41Å
135H82.6Confident80.6Confident69 Ų6979.7 Ų79.732%0.31939%0.386SS..Hα-helixtrans-58.1-50.2175.5-179.565.5000111.6E131 F133 L137 K139 Q169E131-H135 VanDerWaalsContact O-CB 3.27Å; E131-H135 WeakPolarHBondContact O-CB 3.4Å; E131-H135 PolarHBondContact O-N 2.95Å; F133-H135 VanDerWaalsContact C-N 3.32Å; F133-H135 PolarHBondContact O-N 2.93Å; H135-L137 VanDerWaalsContact C-N 3.33Å; H135-L137 PolarHBondContact O-N 3.41Å; H135-K139 VanDerWaalsContact O-CB 3.31Å; H135-K139 WeakPolarHBondContact O-CB 3.42Å; H135-K139 PolarHBondContact O-N 3.34Å; H135-Q169 PolarHBondContact ND1-NE2 3.36Å; H135-Q169 PolarHBondContact ND1-OE1 3.11Å
136L85.7Confident79Confident116 Ų11680 Ų8061%0.60740%0.396SS*.Hα-helixtrans-64.8-38.6179.6-167.470.6000111.7Q132 F133 R140Q132-L136 WeakPolarHBondContact O-CB 3.48Å; Q132-L136 PolarHBondContact O-N 2.62Å; F133-L136 PolarHBondContact O-N 3.25Å; L136-R140 VanDerWaalsContact O-CB 3.27Å; L136-R140 WeakPolarHBondContact O-CB 3.45Å; L136-R140 PolarHBondContact O-N 3.12Å
137L88.4Confident77.6Confident14 Ų1479.2 Ų79.27%0.07340%0.398CS..Hα-helixtrans-65.3-50178.8-179.963.4000111.8W98 M116 V120 F133 L134 H135 K139 R140 I141W98-L137 HydrophobicContact CZ2-CD1 4.14Å; M116-L137 HydrophobicContact CE-CD1 4.42Å; M116-L137 HydrophobicContact SD-CD1 3.92Å; M116-L137 HydrophobicContact SD-CD2 4.13Å; V120-L137 HydrophobicContact CG2-CD2 3.44Å; V120-L137 VanDerWaalsContact CG2-CD2 3.44Å; F133-L137 HydrophobicContact CE1-CD2 4.27Å; F133-L137 HydrophobicContact CZ-CD2 4.34Å; F133-L137 VanDerWaalsContact O-CB 3.31Å; F133-L137 WeakPolarHBondContact O-CB 3.37Å; F133-L137 PolarHBondContact O-N 3.34Å; L134-L137 PolarHBondContact O-N 3.45Å; H135-L137 VanDerWaalsContact C-N 3.33Å; H135-L137 PolarHBondContact O-N 3.41Å; L137-K139 PolarHBondContact O-N 3.01Å; L137-R140 PolarHBondContact O-N 3.36Å; L137-I141 HydrophobicContact CD1-CD1 4.26Å; L137-I141 HydrophobicContact CG-CD1 4.03Å; L137-I141 WeakPolarHBondContact O-CG1 3.43Å; L137-I141 PolarHBondContact O-N 3.25Å
138V87.2Confident76.9Confident2 Ų275.5 Ų75.51%0.01239%0.389CS..Hα-helixtrans-59.5-47.7177.8164.90000110.7L134 R140 I141 I142 L155 F162 T166 L170 L173L134-V138 WeakPolarHBondContact O-CB 3.46Å; L134-V138 WeakPolarHBondContact O-CG2 3.48Å; L134-V138 PolarHBondContact O-N 3.11Å; V138-R140 VanDerWaalsContact C-N 3.27Å; V138-R140 PolarHBondContact O-N 3.21Å; V138-I141 PolarHBondContact O-N 3.01Å; V138-I142 HydrophobicContact CG1-CD1 3.8Å; V138-I142 WeakPolarHBondContact O-CG1 3.27Å; V138-I142 PolarHBondContact O-N 3.47Å; V138-L155 HydrophobicContact CG2-CD2 4.39Å; V138-F162 HydrophobicContact CG2-CE1 4.16Å; V138-F162 HydrophobicContact CG2-CE2 4Å; V138-F162 HydrophobicContact CG2-CZ 3.47Å; V138-F162 VanDerWaalsContact CG2-CZ 3.47Å; V138-T166 HydrophobicContact CG2-CG2 4.3Å; V138-L170 HydrophobicContact CG1-CD2 3.3Å; V138-L170 HydrophobicContact CG1-CG 4.49Å; V138-L173 HydrophobicContact CG1-CD1 4.35Å
139K84.5Confident76.9Confident96 Ų9672.7 Ų72.742%0.41737%0.365SS..Hα-helixtrans-59.3-40.4177-173.2174.1-179177.50111.2H135 L137 L143H135-K139 VanDerWaalsContact O-CB 3.31Å; H135-K139 WeakPolarHBondContact O-CB 3.42Å; H135-K139 PolarHBondContact O-N 3.34Å; L137-K139 PolarHBondContact O-N 3.01Å; K139-L143 HydrophobicContact CD-CD1 4.31Å; K139-L143 HydrophobicContact CG-CD1 3.6Å; K139-L143 HydrophobicContact CG-CG 4.22Å; K139-L143 VanDerWaalsContact O-CB 3.24Å; K139-L143 WeakPolarHBondContact O-CB 3.34Å; K139-L143 WeakPolarHBondContact O-CG 3.37Å; K139-L143 PolarHBondContact O-N 3.06Å
140R85.5Confident76.9Confident158 Ų15866.3 Ų66.360%0.59633%0.331SS*.Hα-helixtrans-69.8-34.5177.4-170.4168.5-176.8170.60.5113.4L136 L137 V138 N144L136-R140 VanDerWaalsContact O-CB 3.27Å; L136-R140 WeakPolarHBondContact O-CB 3.45Å; L136-R140 PolarHBondContact O-N 3.12Å; L137-R140 PolarHBondContact O-N 3.36Å; V138-R140 VanDerWaalsContact C-N 3.27Å; V138-R140 PolarHBondContact O-N 3.21Å; R140-N144 PolarHBondContact O-N 3.46Å
141I85.9Confident76.9Confident1 Ų167.2 Ų67.21%0.00533%0.332CS..Hα-helixtrans-65.2-47.3174.5-71.4163.1000110.5W98 L137 V138 W151 L155 L158W98-I141 HydrophobicContact CH2-CD1 4.37Å; W98-I141 HydrophobicContact CH2-CG1 3.6Å; W98-I141 HydrophobicContact CZ2-CG1 4.23Å; L137-I141 HydrophobicContact CD1-CD1 4.26Å; L137-I141 HydrophobicContact CG-CD1 4.03Å; L137-I141 WeakPolarHBondContact O-CG1 3.43Å; L137-I141 PolarHBondContact O-N 3.25Å; V138-I141 PolarHBondContact O-N 3.01Å; I141-W151 HydrophobicContact CG2-CB 3.99Å; I141-L155 HydrophobicContact CD1-CD2 4.2Å; I141-L155 HydrophobicContact CG2-CD1 4.2Å; I141-L155 HydrophobicContact CG2-CD2 4.2Å; I141-L155 HydrophobicContact CG2-CG 4.06Å; I141-L158 HydrophobicContact CD1-CD1 4Å
142I79.9Confident77.4Confident21 Ų2163 Ų6311%0.10831%0.312CS..Hα-helixtrans-74-36.1-175-65.4168.2000111.8V138 N144 L155 L170 L173 L175V138-I142 HydrophobicContact CG1-CD1 3.8Å; V138-I142 WeakPolarHBondContact O-CG1 3.27Å; V138-I142 PolarHBondContact O-N 3.47Å; I142-N144 VanDerWaalsContact C-N 3.29Å; I142-N144 PolarHBondContact O-N 3.43Å; I142-L155 HydrophobicContact CD1-CD1 4.44Å; I142-L155 HydrophobicContact CG1-CD1 4.11Å; I142-L170 HydrophobicContact CD1-CD2 3.96Å; I142-L173 HydrophobicContact CD1-CB 4.44Å; I142-L173 HydrophobicContact CD1-CD1 3.62Å; I142-L175 HydrophobicContact CD1-CD1 4.5Å; I142-L175 HydrophobicContact CD1-CD2 4.2Å
143L76.1Confident77.6Confident110 Ų11057.8 Ų57.858%0.57629%0.287SS*.THydrogen-bonded Turntrans-81.11.6179.5-66.8178.9000114.4K139 D145K139-L143 HydrophobicContact CD-CD1 4.31Å; K139-L143 HydrophobicContact CG-CD1 3.6Å; K139-L143 HydrophobicContact CG-CG 4.22Å; K139-L143 VanDerWaalsContact O-CB 3.24Å; K139-L143 WeakPolarHBondContact O-CB 3.34Å; K139-L143 WeakPolarHBondContact O-CG 3.37Å; K139-L143 PolarHBondContact O-N 3.06Å; L143-D145 PolarHBondContact O-N 2.93Å
144N71.3Confident77.8Confident57 Ų5755.8 Ų55.831%0.30528%0.278SS..  trans-80.1112.9178.7-162.7-20.3000110.2R140 I142 V146R140-N144 PolarHBondContact O-N 3.46Å; I142-N144 VanDerWaalsContact C-N 3.29Å; I142-N144 PolarHBondContact O-N 3.43Å; N144-V146 PolarHBondContact O-N 2.95Å; N144-V146 VanDerWaalsContact O-N 3.15Å; N144-V146 PolarHBondContact OD1-N 3.03Å
145D53.9Low77.9Confident167 Ų16755.6 Ų55.689%0.89328%0.277SS*.  trans-67.8-8.8-177.7-75.7-31.5000114L143L143-D145 PolarHBondContact O-N 2.93Å
146V54.1Low78.4Confident85 Ų8554 Ų5452%0.51527%0.27SS..SBendtrans-105.5104.4-171.5-169.70000112.3N102 N144N102-V146 PolarHBondContact ND2-O 3.27Å; N144-V146 PolarHBondContact O-N 2.95Å; N144-V146 VanDerWaalsContact O-N 3.15Å; N144-V146 PolarHBondContact OD1-N 3.03Å
147C53.4Low78.7Confident62 Ų6251.4 Ų51.442%0.41926%0.255SS..  trans66.7124.5167.6-1580000116.9N102N102-C147 WeakPolarHBondContact OD1-CB 3.27Å
148V66Low78.8Confident45 Ų4550.7 Ų50.727%0.27325%0.252SS..SBendtrans-84.7-68.8-159.9-148.60000108.9P150 W151 Y152 E188V148-P150 VanDerWaalsContact C-CD 3.46Å; V148-P150 WeakPolarHBondContact O-CD 3.31Å; V148-W151 HydrophobicContact CB-CZ2 4.2Å; V148-W151 HydrophobicContact CG1-CD2 4.14Å; V148-W151 HydrophobicContact CG1-CH2 3.67Å; V148-W151 HydrophobicContact CG1-CZ2 2.92Å; V148-W151 HydrophobicContact CG1-CZ3 4.49Å; V148-W151 VanDerWaalsContact CG1-NE1 3.27Å; V148-W151 WeakPolarHBondContact O-CB 3.45Å; V148-W151 PolarHBondContact O-N 2.68Å; V148-W151 PolarHBondContact O-NE1 3.4Å; V148-Y152 HydrophobicContact CG1-CE2 4.21Å; V148-E188 HydrophobicContact CB-CG 4.49Å; V148-E188 WeakPolarHBondContact CB-OE1 3.43Å; V148-E188 WeakPolarHBondContact CG1-OE2 3.44Å; V148-E188 VanDerWaalsContact CG2-OE1 3.25Å; V148-E188 WeakPolarHBondContact CG2-OE1 3.49Å
149K70.7Confident79Confident58 Ų5850.9 Ų50.925%0.25225%0.252SS..THydrogen-bonded Turntrans-29.8-54.5-169.6-60.8172.2-171.4173.90119.3W151 E187 E188K149-W151 VanDerWaalsContact C-N 3.25Å; K149-W151 PolarHBondContact O-N 3.3Å; K149-E187 WeakPolarHBondContact CE-O 3.29Å; K149-E187 IonicContact NZ-OE2 2.64Å; K149-E187 PolarHBondContact NZ-OE2 3.25Å; K149-E188 HydrophobicContact CG-CG 3.87Å
150P76.7Confident79.3Confident4 Ų450.6 Ų50.63%0.02626%0.261CS..Hα-helixtrans-60.9-30.2-177-19.431.8000114W101 R109 V148 Y152 K153 C154W101-P150 HydrophobicContact CE3-CB 4.09Å; W101-P150 WeakPolarHBondContact O-CG 3.44Å; R109-P150 HydrophobicContact CB-CG 4.38Å; R109-P150 HydrophobicContact CG-CG 4.29Å; V148-P150 VanDerWaalsContact C-CD 3.46Å; V148-P150 WeakPolarHBondContact O-CD 3.31Å; P150-Y152 VanDerWaalsContact C-N 3.34Å; P150-Y152 PolarHBondContact O-N 2.79Å; P150-K153 PolarHBondContact O-N 3.11Å; P150-C154 VanDerWaalsContact O-CB 3.28Å; P150-C154 WeakPolarHBondContact O-CB 3.25Å; P150-C154 PolarHBondContact O-N 2.97Å
151W81.5Confident79.4Confident38 Ų3845.2 Ų45.214%0.14424%0.243CC..Hα-helixtrans-62.4-38.5-174.470.9-14.7000113.3I141 V148 K149 C154 L155I141-W151 HydrophobicContact CG2-CB 3.99Å; V148-W151 HydrophobicContact CB-CZ2 4.2Å; V148-W151 HydrophobicContact CG1-CD2 4.14Å; V148-W151 HydrophobicContact CG1-CH2 3.67Å; V148-W151 HydrophobicContact CG1-CZ2 2.92Å; V148-W151 HydrophobicContact CG1-CZ3 4.49Å; V148-W151 VanDerWaalsContact CG1-NE1 3.27Å; V148-W151 WeakPolarHBondContact O-CB 3.45Å; V148-W151 PolarHBondContact O-N 2.68Å; V148-W151 PolarHBondContact O-NE1 3.4Å; K149-W151 VanDerWaalsContact C-N 3.25Å; K149-W151 PolarHBondContact O-N 3.3Å; W151-C154 PolarHBondContact O-N 3.15Å; W151-L155 WeakPolarHBondContact O-CB 3.48Å; W151-L155 VanDerWaalsContact O-CG 3.25Å; W151-L155 WeakPolarHBondContact O-CG 3.25Å; W151-L155 PolarHBondContact O-N 3.03Å
152Y87.2Confident79.6Confident5 Ų545.4 Ų45.42%0.0224%0.244CC..Hα-helixtrans-71.7-44.1-174.2-73.3-44.4000107.8V148 P150 E156 A182 E188 H191 A192 L195V148-Y152 HydrophobicContact CG1-CE2 4.21Å; P150-Y152 VanDerWaalsContact C-N 3.34Å; P150-Y152 PolarHBondContact O-N 2.79Å; Y152-E156 WeakPolarHBondContact O-CB 3.41Å; Y152-E156 PolarHBondContact O-N 3.38Å; Y152-A182 HydrophobicContact CE2-CB 3.84Å; Y152-A182 WeakPolarHBondContact OH-CB 3.29Å; Y152-E188 HydrophobicContact CE2-CB 4.24Å; Y152-H191 HydrophobicContact CD2-CB 4.24Å; Y152-A192 HydrophobicContact CD2-CB 4Å; Y152-A192 HydrophobicContact CE1-CB 4.38Å; Y152-A192 HydrophobicContact CE2-CB 3.76Å; Y152-A192 HydrophobicContact CG-CB 4.43Å; Y152-L195 HydrophobicContact CD1-CD2 3.67Å
153K86.7Confident79.8Confident58 Ų5850.2 Ų50.225%0.25227%0.266SS..Hα-helixtrans-68.6-42177.1-171.757.5179.5177.90111.9P150 E156 M157P150-K153 PolarHBondContact O-N 3.11Å; K153-E156 IonicContact NZ-OE1 3.68Å; K153-E156 PolarHBondContact NZ-OE1 3.43Å; K153-E156 IonicContact NZ-OE2 2.83Å; K153-E156 PolarHBondContact NZ-OE2 3.42Å; K153-E156 WeakPolarHBondContact O-CB 3.36Å; K153-E156 PolarHBondContact O-N 3.42Å; K153-M157 HydrophobicContact CD-CG 4.38Å; K153-M157 HydrophobicContact CD-SD 4.42Å; K153-M157 HydrophobicContact CG-SD 4.09Å; K153-M157 WeakPolarHBondContact O-CG 3.05Å; K153-M157 PolarHBondContact O-N 3.03Å
154C89.1Confident80.3Confident0 Ų051.3 Ų51.30%026%0.263CS..Hα-helixtrans-62.3-48.1178-169.60000111.4C113 P150 W151 E156 M157 L158C113-C154 HydrophobicContact CB-CB 4.18Å; P150-C154 VanDerWaalsContact O-CB 3.28Å; P150-C154 WeakPolarHBondContact O-CB 3.25Å; P150-C154 PolarHBondContact O-N 2.97Å; W151-C154 PolarHBondContact O-N 3.15Å; C154-E156 VanDerWaalsContact C-N 3.33Å; C154-E156 PolarHBondContact O-N 2.85Å; C154-M157 PolarHBondContact O-N 3.2Å; C154-L158 WeakPolarHBondContact O-CB 3.32Å; C154-L158 WeakPolarHBondContact O-CG 3.45Å; C154-L158 PolarHBondContact O-N 2.89Å
155L90.5Very high81Confident1 Ų150.6 Ų50.61%0.00526%0.262CS..Hα-helixtrans-62-40.1175.2-69.7172.8000111.7V138 I141 I142 W151 M157 L158 L159 L175 L195V138-L155 HydrophobicContact CG2-CD2 4.39Å; I141-L155 HydrophobicContact CD1-CD2 4.2Å; I141-L155 HydrophobicContact CG2-CD1 4.2Å; I141-L155 HydrophobicContact CG2-CD2 4.2Å; I141-L155 HydrophobicContact CG2-CG 4.06Å; I142-L155 HydrophobicContact CD1-CD1 4.44Å; I142-L155 HydrophobicContact CG1-CD1 4.11Å; W151-L155 WeakPolarHBondContact O-CB 3.48Å; W151-L155 VanDerWaalsContact O-CG 3.25Å; W151-L155 WeakPolarHBondContact O-CG 3.25Å; W151-L155 PolarHBondContact O-N 3.03Å; L155-M157 VanDerWaalsContact C-N 3.27Å; L155-M157 PolarHBondContact O-N 2.98Å; L155-L158 PolarHBondContact O-N 3.15Å; L155-L158 VanDerWaalsContact O-N 3.14Å; L155-L159 WeakPolarHBondContact O-CG 3.19Å; L155-L159 PolarHBondContact O-N 3.18Å; L155-L175 HydrophobicContact CD1-CD2 3.92Å; L155-L195 HydrophobicContact CB-CD1 3.93Å; L155-L195 HydrophobicContact CB-CD2 4.08Å; L155-L195 HydrophobicContact CD1-CD2 4.29Å
156E91.7Very high82.4Confident37 Ų3742.7 Ų42.717%0.17322%0.22CC..Hα-helixtrans-59.2-41.8176-176.1-155.912500110.8Y152 K153 C154 S194 L195 A198Y152-E156 WeakPolarHBondContact O-CB 3.41Å; Y152-E156 PolarHBondContact O-N 3.38Å; K153-E156 IonicContact NZ-OE1 3.68Å; K153-E156 PolarHBondContact NZ-OE1 3.43Å; K153-E156 IonicContact NZ-OE2 2.83Å; K153-E156 PolarHBondContact NZ-OE2 3.42Å; K153-E156 WeakPolarHBondContact O-CB 3.36Å; K153-E156 PolarHBondContact O-N 3.42Å; C154-E156 VanDerWaalsContact C-N 3.33Å; C154-E156 PolarHBondContact O-N 2.85Å; E156-S194 VanDerWaalsContact OE2-CB 3.27Å; E156-S194 WeakPolarHBondContact OE2-CB 3.41Å; E156-S194 PolarHBondContact OE2-OG 2.89Å; E156-L195 HydrophobicContact CB-CB 4.46Å; E156-L195 HydrophobicContact CB-CD1 3.97Å; E156-A198 HydrophobicContact CG-CB 4.03Å
157M92Very high84Confident60 Ų6038.6 Ų38.630%0.29620%0.195SC..Hα-helixtrans-76-23.2178.5-63.9173.567.100113.5C113 A114 V117 K153 C154 L155 P160C113-M157 HydrophobicContact CB-SD 3.9Å; A114-M157 HydrophobicContact CB-CE 3.99Å; V117-M157 HydrophobicContact CG2-CB 3.57Å; V117-M157 HydrophobicContact CG2-CE 4.39Å; K153-M157 HydrophobicContact CD-CG 4.38Å; K153-M157 HydrophobicContact CD-SD 4.42Å; K153-M157 HydrophobicContact CG-SD 4.09Å; K153-M157 WeakPolarHBondContact O-CG 3.05Å; K153-M157 PolarHBondContact O-N 3.03Å; C154-M157 PolarHBondContact O-N 3.2Å; L155-M157 VanDerWaalsContact C-N 3.27Å; L155-M157 PolarHBondContact O-N 2.98Å; M157-P160 WeakPolarHBondContact O-CD 3.39Å
158L91.8Very high85.6Confident0 Ų038.6 Ų38.60%019%0.191CC..Hα-helixtrans-84.2-26.3175.9-73.8170.6000113M116 V117 V120 I141 C154 L155 P160 L161 F162M116-L158 HydrophobicContact CG-CD1 4.46Å; V117-L158 HydrophobicContact CB-CD2 4.34Å; V117-L158 HydrophobicContact CG2-CD2 3.8Å; V117-L158 HydrophobicContact CG2-CG 3.96Å; V120-L158 HydrophobicContact CB-CD2 4.05Å; V120-L158 HydrophobicContact CG1-CD2 4.19Å; V120-L158 HydrophobicContact CG2-CD2 3.86Å; I141-L158 HydrophobicContact CD1-CD1 4Å; C154-L158 WeakPolarHBondContact O-CB 3.32Å; C154-L158 WeakPolarHBondContact O-CG 3.45Å; C154-L158 PolarHBondContact O-N 2.89Å; L155-L158 PolarHBondContact O-N 3.15Å; L155-L158 VanDerWaalsContact O-N 3.14Å; L158-P160 VanDerWaalsContact C-N 3.3Å; L158-P160 VanDerWaalsContact O-N 3.13Å; L158-L161 HydrophobicContact CD2-CD1 4.21Å; L158-L161 WeakPolarHBondContact O-CA 3.25Å; L158-L161 WeakPolarHBondContact O-CB 3.49Å; L158-L161 PolarHBondContact O-N 3.36Å; L158-F162 HydrophobicContact CB-CE1 3.81Å; L158-F162 HydrophobicContact CB-CE2 4.45Å; L158-F162 HydrophobicContact CB-CZ 3.65Å
159L91.5Very high86.4Confident5 Ų538.4 Ų38.43%0.02619%0.187CC..G310 helixtrans-47-40.3-179.4-87.8172000115.3L155 L161 F162 L167 L170 L195 A198 M199 K202L155-L159 WeakPolarHBondContact O-CG 3.19Å; L155-L159 PolarHBondContact O-N 3.18Å; L159-L161 PolarHBondContact O-N 2.95Å; L159-L161 VanDerWaalsContact O-N 3.16Å; L159-F162 HydrophobicContact CD2-CD2 3.93Å; L159-F162 HydrophobicContact CD2-CE2 4.47Å; L159-F162 PolarHBondContact O-N 3.49Å; L159-L167 HydrophobicContact CD2-CD1 4.22Å; L159-L170 HydrophobicContact CD2-CD1 4.16Å; L159-L195 HydrophobicContact CD1-CD1 3.73Å; L159-L195 HydrophobicContact CG-CD1 4.41Å; L159-A198 HydrophobicContact CD1-CB 3.54Å; L159-M199 HydrophobicContact CD1-CB 4.43Å; L159-M199 HydrophobicContact CD1-CG 3.75Å; L159-M199 HydrophobicContact CD2-CG 4.04Å; L159-M199 HydrophobicContact CG-CG 4.44Å; L159-K202 HydrophobicContact CD2-CB 4.46Å; L159-K202 HydrophobicContact CD2-CG 4.45Å; L159-K202 VanDerWaalsContact O-CE 3.31Å; L159-K202 WeakPolarHBondContact O-CE 3.24Å
160P89.9Confident87.1Confident91 Ų9135.7 Ų35.759%0.59118%0.175SC*.G310 helixtrans-58.5-27.1177.1-26.836.5000113.9M157 L158 K202M157-P160 WeakPolarHBondContact O-CD 3.39Å; L158-P160 VanDerWaalsContact C-N 3.3Å; L158-P160 VanDerWaalsContact O-N 3.13Å; P160-K202 PolarHBondContact O-NZ 3.41Å
161L88.2Confident87.6Confident44 Ų4437.3 Ų37.323%0.2318%0.182CC..G310 helixtrans-86.8-6.2179.4-52.4177.6000113.1V117 V120 K121 I124 L158 L159V117-L161 HydrophobicContact CG1-CD1 4.37Å; V120-L161 HydrophobicContact CB-CD1 4.31Å; V120-L161 HydrophobicContact CG1-CD1 3.78Å; K121-L161 HydrophobicContact CG-CD1 3.92Å; K121-L161 HydrophobicContact CG-CD2 4.09Å; I124-L161 HydrophobicContact CD1-CB 4.2Å; I124-L161 HydrophobicContact CD1-CD1 4.3Å; L158-L161 HydrophobicContact CD2-CD1 4.21Å; L158-L161 WeakPolarHBondContact O-CA 3.25Å; L158-L161 WeakPolarHBondContact O-CB 3.49Å; L158-L161 PolarHBondContact O-N 3.36Å; L159-L161 PolarHBondContact O-N 2.95Å; L159-L161 VanDerWaalsContact O-N 3.16Å
162F89Confident87.8Confident5 Ų543 Ų432%0.02221%0.21CC..  trans-86.8133.9-176.7-67-5.7000111.8L134 V138 L158 L159 T166 L170 K202L134-F162 HydrophobicContact CD2-CE1 4.34Å; V138-F162 HydrophobicContact CG2-CE1 4.16Å; V138-F162 HydrophobicContact CG2-CE2 4Å; V138-F162 HydrophobicContact CG2-CZ 3.47Å; V138-F162 VanDerWaalsContact CG2-CZ 3.47Å; L158-F162 HydrophobicContact CB-CE1 3.81Å; L158-F162 HydrophobicContact CB-CE2 4.45Å; L158-F162 HydrophobicContact CB-CZ 3.65Å; L159-F162 HydrophobicContact CD2-CD2 3.93Å; L159-F162 HydrophobicContact CD2-CE2 4.47Å; L159-F162 PolarHBondContact O-N 3.49Å; F162-T166 HydrophobicContact CB-CG2 4.26Å; F162-T166 HydrophobicContact CD1-CG2 3.81Å; F162-T166 HydrophobicContact CD2-CG2 3.98Å; F162-T166 HydrophobicContact CE1-CG2 4.11Å; F162-T166 HydrophobicContact CE2-CG2 4.29Å; F162-T166 HydrophobicContact CG-CG2 3.75Å; F162-T166 HydrophobicContact CZ-CG2 4.35Å; F162-L170 HydrophobicContact CD2-CD1 3.99Å; F162-L170 HydrophobicContact CE2-CD1 3.93Å; F162-K202 VanDerWaalsContact O-CE 3.23Å; F162-K202 WeakPolarHBondContact O-CE 3.37Å
163E85.6Confident87.7Confident123 Ų12345.5 Ų45.558%0.57522%0.223SC*.  trans-87.2176.2167.7-62.1-170-178.800111S165 T166 L167E163-S165 VanDerWaalsContact C-N 3.27Å; E163-S165 PolarHBondContact O-N 3.46Å; E163-T166 PolarHBondContact O-N 3.28Å; E163-L167 PolarHBondContact O-N 3.07Å
164R86Confident87.7Confident133 Ų13349.3 Ų49.350%0.50224%0.24SC..Hα-helixtrans-58.9-38.3-178-175.9179.1177.5-176.85112.2L167 L168 L206 K207 A208R164-L167 PolarHBondContact O-N 3.03Å; R164-L168 HydrophobicContact CG-CD1 4.26Å; R164-L168 WeakPolarHBondContact O-CG 3.47Å; R164-L168 PolarHBondContact O-N 2.9Å; R164-L206 HydrophobicContact CB-CD1 4.46Å; R164-K207 PolarHBondContact NH2-O 3.13Å; R164-A208 HydrophobicContact CG-CB 4.03Å
165S84.8Confident87.7Confident41 Ų4149.3 Ų49.329%0.28724%0.24SC..Hα-helixtrans-58.9-51.2177.549.70000111.3E131 E163 L167 L168 Q169E131-S165 WeakPolarHBondContact OE1-CB 3.24Å; E131-S165 PolarHBondContact OE1-OG 2.87Å; E163-S165 VanDerWaalsContact C-N 3.27Å; E163-S165 PolarHBondContact O-N 3.46Å; S165-L167 PolarHBondContact O-N 3.32Å; S165-L168 PolarHBondContact O-N 2.89Å; S165-Q169 WeakPolarHBondContact O-CG 3.42Å; S165-Q169 PolarHBondContact O-N 3.08Å
166T85.1Confident87.7Confident1 Ų149.7 Ų49.71%0.00624%0.242CC..Hα-helixtrans-65.8-37178.7-44.60000112.6L134 V138 F162 E163 Q169 L170L134-T166 HydrophobicContact CB-CG2 4.41Å; V138-T166 HydrophobicContact CG2-CG2 4.3Å; F162-T166 HydrophobicContact CB-CG2 4.26Å; F162-T166 HydrophobicContact CD1-CG2 3.81Å; F162-T166 HydrophobicContact CD2-CG2 3.98Å; F162-T166 HydrophobicContact CE1-CG2 4.11Å; F162-T166 HydrophobicContact CE2-CG2 4.29Å; F162-T166 HydrophobicContact CG-CG2 3.75Å; F162-T166 HydrophobicContact CZ-CG2 4.35Å; E163-T166 PolarHBondContact O-N 3.28Å; T166-Q169 WeakPolarHBondContact O-CB 3.3Å; T166-Q169 PolarHBondContact O-N 3.29Å; T166-L170 PolarHBondContact O-N 3.41Å
167L87.4Confident87.5Confident0 Ų051.6 Ų51.60%025%0.254CS..Hα-helixtrans-66.1-42.4177.1-177.261.1000112.1L159 E163 R164 S165 Q169 L170 F171 K202 D203 L206 A208L159-L167 HydrophobicContact CD2-CD1 4.22Å; E163-L167 PolarHBondContact O-N 3.07Å; R164-L167 PolarHBondContact O-N 3.03Å; S165-L167 PolarHBondContact O-N 3.32Å; L167-Q169 PolarHBondContact O-N 3.44Å; L167-L170 HydrophobicContact CD1-CD1 4.07Å; L167-L170 WeakPolarHBondContact O-CB 3.18Å; L167-L170 PolarHBondContact O-N 3.14Å; L167-L170 VanDerWaalsContact O-N 3.11Å; L167-F171 HydrophobicContact CD1-CE1 3.74Å; L167-F171 HydrophobicContact CD1-CZ 3.81Å; L167-F171 HydrophobicContact CD2-CZ 4.05Å; L167-F171 HydrophobicContact CG-CE1 4.03Å; L167-F171 HydrophobicContact CG-CE2 4.22Å; L167-F171 HydrophobicContact CG-CZ 3.63Å; L167-F171 PolarHBondContact O-N 2.96Å; L167-K202 HydrophobicContact CD2-CB 4.4Å; L167-K202 HydrophobicContact CD2-CG 4.18Å; L167-D203 HydrophobicContact CD2-CB 4.09Å; L167-L206 HydrophobicContact CD2-CD1 4.11Å; L167-A208 HydrophobicContact CD2-CB 3.86Å; L167-A208 HydrophobicContact CG-CB 4.33Å
168L87Confident87.3Confident62 Ų6251.3 Ų51.333%0.32525%0.253SS..Hα-helixtrans-60.4-33.5176-73.7173.2000112.1R164 S165 L170 F171 E172 A208R164-L168 HydrophobicContact CG-CD1 4.26Å; R164-L168 WeakPolarHBondContact O-CG 3.47Å; R164-L168 PolarHBondContact O-N 2.9Å; S165-L168 PolarHBondContact O-N 2.89Å; L168-L170 PolarHBondContact O-N 3.37Å; L168-F171 HydrophobicContact CD2-CD2 4.12Å; L168-F171 HydrophobicContact CD2-CE2 4.5Å; L168-F171 WeakPolarHBondContact O-CB 3.35Å; L168-F171 PolarHBondContact O-N 3.4Å; L168-F171 VanDerWaalsContact O-N 3.1Å; L168-E172 PolarHBondContact O-N 3.33Å; L168-A208 HydrophobicContact CD2-CB 3.96Å; L168-A208 HydrophobicContact CG-CB 4.23Å
169Q83.1Confident87.2Confident41 Ų4151.3 Ų51.319%0.19225%0.253CS..Hα-helixtrans-66.7-35.6175.7-66.1165.21.600112.6H135 S165 T166 L167 F171 E172 L173H135-Q169 PolarHBondContact ND1-NE2 3.36Å; H135-Q169 PolarHBondContact ND1-OE1 3.11Å; S165-Q169 WeakPolarHBondContact O-CG 3.42Å; S165-Q169 PolarHBondContact O-N 3.08Å; T166-Q169 WeakPolarHBondContact O-CB 3.3Å; T166-Q169 PolarHBondContact O-N 3.29Å; L167-Q169 PolarHBondContact O-N 3.44Å; Q169-F171 PolarHBondContact O-N 3.15Å; Q169-E172 PolarHBondContact O-N 3.47Å; Q169-L173 WeakPolarHBondContact O-CG 3.42Å; Q169-L173 PolarHBondContact O-N 3.18Å
170L85.4Confident87Confident0 Ų051.8 Ų51.80%026%0.255CS..Hα-helixtrans-60.9-33.9172.2-61.7177.8000111.3V138 I142 L159 F162 T166 L167 L168 K174 L175 M199V138-L170 HydrophobicContact CG1-CD2 3.3Å; V138-L170 HydrophobicContact CG1-CG 4.49Å; I142-L170 HydrophobicContact CD1-CD2 3.96Å; L159-L170 HydrophobicContact CD2-CD1 4.16Å; F162-L170 HydrophobicContact CD2-CD1 3.99Å; F162-L170 HydrophobicContact CE2-CD1 3.93Å; T166-L170 PolarHBondContact O-N 3.41Å; L167-L170 HydrophobicContact CD1-CD1 4.07Å; L167-L170 WeakPolarHBondContact O-CB 3.18Å; L167-L170 PolarHBondContact O-N 3.14Å; L167-L170 VanDerWaalsContact O-N 3.11Å; L168-L170 PolarHBondContact O-N 3.37Å; L170-K174 PolarHBondContact O-N 3.03Å; L170-L175 HydrophobicContact CB-CB 4.44Å; L170-L175 HydrophobicContact CB-CD2 4.21Å; L170-L175 HydrophobicContact CD1-CD2 4.37Å; L170-L175 HydrophobicContact CD2-CD2 3.79Å; L170-L175 HydrophobicContact CG-CD2 4.36Å; L170-L175 VanDerWaalsContact O-CB 3.29Å; L170-L175 WeakPolarHBondContact O-CB 3.11Å; L170-L175 PolarHBondContact O-N 2.67Å; L170-L175 VanDerWaalsContact O-N 3.09Å; L170-M199 HydrophobicContact CD1-SD 4.24Å
171F86.8Confident86.8Confident39 Ų3952.9 Ų52.917%0.17125%0.253CS..Hα-helixtrans-74.2-40.7177-55.6-13.9000111.6L167 L168 Q169 L173 K174 P176 D203 A208 W216L167-F171 HydrophobicContact CD1-CE1 3.74Å; L167-F171 HydrophobicContact CD1-CZ 3.81Å; L167-F171 HydrophobicContact CD2-CZ 4.05Å; L167-F171 HydrophobicContact CG-CE1 4.03Å; L167-F171 HydrophobicContact CG-CE2 4.22Å; L167-F171 HydrophobicContact CG-CZ 3.63Å; L167-F171 PolarHBondContact O-N 2.96Å; L168-F171 HydrophobicContact CD2-CD2 4.12Å; L168-F171 HydrophobicContact CD2-CE2 4.5Å; L168-F171 WeakPolarHBondContact O-CB 3.35Å; L168-F171 PolarHBondContact O-N 3.4Å; L168-F171 VanDerWaalsContact O-N 3.1Å; Q169-F171 PolarHBondContact O-N 3.15Å; F171-L173 PolarHBondContact O-N 3.03Å; F171-K174 WeakPolarHBondContact O-CA 3.47Å; F171-K174 PolarHBondContact O-N 3.34Å; F171-P176 HydrophobicContact CD1-CG 3.99Å; F171-P176 HydrophobicContact CE1-CG 4.41Å; F171-D203 HydrophobicContact CZ-CB 4.02Å; F171-A208 HydrophobicContact CE2-CB 4.09Å; F171-W216 HydrophobicContact CD1-CZ2 4.47Å; F171-W216 AromaticContact CE1-CH2 3.93Å; F171-W216 HydrophobicContact CE1-CH2 3.93Å; F171-W216 AromaticContact CE1-CZ2 3.49Å; F171-W216 HydrophobicContact CE1-CZ2 3.49Å; F171-W216 VanDerWaalsContact CE1-CZ2 3.49Å; F171-W216 AromaticContact CZ-CZ2 3.65Å; F171-W216 HydrophobicContact CZ-CZ2 3.65Å
172E84.4Confident86.6Confident156 Ų15651 Ų5173%0.72924%0.244SC*.Hα-helixtrans-58.6-35.6172.5-71.9-179.8174.300112L168 Q169 K174L168-E172 PolarHBondContact O-N 3.33Å; Q169-E172 PolarHBondContact O-N 3.47Å; E172-K174 PolarHBondContact O-N 3.48Å
173L85.3Confident86.3Confident59 Ų5951 Ų5131%0.30924%0.244SC..THydrogen-bonded Turntrans-77.44.7174-65.8173.7000113.9V138 I142 Q169 F171 L175V138-L173 HydrophobicContact CG1-CD1 4.35Å; I142-L173 HydrophobicContact CD1-CB 4.44Å; I142-L173 HydrophobicContact CD1-CD1 3.62Å; Q169-L173 WeakPolarHBondContact O-CG 3.42Å; Q169-L173 PolarHBondContact O-N 3.18Å; F171-L173 PolarHBondContact O-N 3.03Å; L173-L175 PolarHBondContact O-N 2.92Å
174K86.9Confident85.9Confident137 Ų13749.1 Ų49.160%0.59624%0.235SC*.THydrogen-bonded Turntrans54.431-178.4-57.9-173.8177.7-176.50114.3L170 F171 E172 P176 D177 L178L170-K174 PolarHBondContact O-N 3.03Å; F171-K174 WeakPolarHBondContact O-CA 3.47Å; F171-K174 PolarHBondContact O-N 3.34Å; E172-K174 PolarHBondContact O-N 3.48Å; K174-P176 VanDerWaalsContact C-CD 3.45Å; K174-D177 PolarHBondContact O-N 2.86Å; K174-D177 VanDerWaalsContact O-N 3.14Å; K174-L178 PolarHBondContact O-N 3.47Å
175L88.3Confident85.2Confident1 Ų147.2 Ų47.21%0.00524%0.235CC..Hα-helixtrans-58.9-37.6-179.2-17361.1000114.1I142 L155 L170 L173 D177 L178 C179 L195 M199I142-L175 HydrophobicContact CD1-CD1 4.5Å; I142-L175 HydrophobicContact CD1-CD2 4.2Å; L155-L175 HydrophobicContact CD1-CD2 3.92Å; L170-L175 HydrophobicContact CB-CB 4.44Å; L170-L175 HydrophobicContact CB-CD2 4.21Å; L170-L175 HydrophobicContact CD1-CD2 4.37Å; L170-L175 HydrophobicContact CD2-CD2 3.79Å; L170-L175 HydrophobicContact CG-CD2 4.36Å; L170-L175 VanDerWaalsContact O-CB 3.29Å; L170-L175 WeakPolarHBondContact O-CB 3.11Å; L170-L175 PolarHBondContact O-N 2.67Å; L170-L175 VanDerWaalsContact O-N 3.09Å; L173-L175 PolarHBondContact O-N 2.92Å; L175-D177 VanDerWaalsContact C-N 3.3Å; L175-D177 PolarHBondContact O-N 3.45Å; L175-L178 HydrophobicContact CD1-CB 4.43Å; L175-L178 HydrophobicContact CD1-CD1 4.38Å; L175-L178 PolarHBondContact O-N 2.66Å; L175-C179 PolarHBondContact O-N 3.42Å; L175-C179 PolarHBondContact O-SG 2.91Å; L175-L195 HydrophobicContact CD2-CD2 4.17Å; L175-M199 HydrophobicContact CD2-CE 4.36Å; L175-M199 HydrophobicContact CD2-SD 3.72Å; L175-M199 HydrophobicContact CG-CE 4.13Å; L175-M199 HydrophobicContact CG-SD 4.09Å
176P90.5Very high84.3Confident8 Ų851.6 Ų51.65%0.05226%0.264CS..Hα-helixtrans-56.2-42.2174.1-26.536000113.1F171 K174 C179 L180 F196 M199 T215 W216F171-P176 HydrophobicContact CD1-CG 3.99Å; F171-P176 HydrophobicContact CE1-CG 4.41Å; K174-P176 VanDerWaalsContact C-CD 3.45Å; P176-C179 WeakPolarHBondContact O-CB 3.21Å; P176-C179 PolarHBondContact O-N 3.18Å; P176-L180 WeakPolarHBondContact O-CG 3.4Å; P176-L180 PolarHBondContact O-N 3.24Å; P176-L180 VanDerWaalsContact O-N 3.11Å; P176-F196 HydrophobicContact CB-CE2 4.04Å; P176-M199 HydrophobicContact CG-CE 4.44Å; P176-T215 HydrophobicContact CG-CG2 4.36Å; P176-W216 HydrophobicContact CB-CH2 4.16Å; P176-W216 HydrophobicContact CB-CZ3 4Å; P176-W216 HydrophobicContact CG-CH2 3.72Å; P176-W216 HydrophobicContact CG-CZ2 4.4Å; P176-W216 HydrophobicContact CG-CZ3 4.09Å
177D88.8Confident83.6Confident77 Ų7758.3 Ų58.341%0.41230%0.295SS..Hα-helixtrans-67.6-40.1178.4-64.4-32.3000111.6K174 L175 C179 L180 Q181K174-D177 PolarHBondContact O-N 2.86Å; K174-D177 VanDerWaalsContact O-N 3.14Å; L175-D177 VanDerWaalsContact C-N 3.3Å; L175-D177 PolarHBondContact O-N 3.45Å; D177-C179 VanDerWaalsContact C-N 3.32Å; D177-C179 PolarHBondContact O-N 3.34Å; D177-L180 PolarHBondContact O-N 3.3Å; D177-Q181 WeakPolarHBondContact O-CG 3.27Å; D177-Q181 PolarHBondContact O-N 2.92Å
178L87.2Confident82.9Confident55 Ų5559.7 Ų59.729%0.28830%0.302SS..Hα-helixtrans-62.1-39.3175.1-68174.4000111.8K174 L175 Q181 A182K174-L178 PolarHBondContact O-N 3.47Å; L175-L178 HydrophobicContact CD1-CB 4.43Å; L175-L178 HydrophobicContact CD1-CD1 4.38Å; L175-L178 PolarHBondContact O-N 2.66Å; L178-Q181 PolarHBondContact O-N 2.84Å; L178-A182 PolarHBondContact O-N 3.37Å
179C89.4Confident82.6Confident0 Ų057.6 Ų57.60%029%0.293CS..Hα-helixtrans-62.7-42.2173.4-72.60000111.6L175 P176 D177 A182 V183 F196L175-C179 PolarHBondContact O-N 3.42Å; L175-C179 PolarHBondContact O-SG 2.91Å; P176-C179 WeakPolarHBondContact O-CB 3.21Å; P176-C179 PolarHBondContact O-N 3.18Å; D177-C179 VanDerWaalsContact C-N 3.32Å; D177-C179 PolarHBondContact O-N 3.34Å; C179-A182 PolarHBondContact O-N 3.21Å; C179-V183 VanDerWaalsContact O-CG2 3.3Å; C179-V183 WeakPolarHBondContact O-CG2 3.43Å; C179-V183 PolarHBondContact O-N 3.34Å; C179-F196 HydrophobicContact CB-CB 4.16Å; C179-F196 HydrophobicContact CB-CD2 3.83Å; C179-F196 HydrophobicContact CB-CG 4.49Å
180L88.3Confident82.6Confident14 Ų1458.9 Ų58.97%0.07331%0.311CS..Hα-helixtrans-66-37.5178.1-66179.3000112.7P176 D177 V183 F196 P219 V220 F235 L238P176-L180 WeakPolarHBondContact O-CG 3.4Å; P176-L180 PolarHBondContact O-N 3.24Å; P176-L180 VanDerWaalsContact O-N 3.11Å; D177-L180 PolarHBondContact O-N 3.3Å; L180-V183 PolarHBondContact O-N 3.19Å; L180-F196 HydrophobicContact CD1-CE2 4.06Å; L180-F196 HydrophobicContact CD1-CZ 4.28Å; L180-F196 HydrophobicContact CD2-CD2 4.1Å; L180-F196 HydrophobicContact CD2-CE1 4.41Å; L180-F196 HydrophobicContact CD2-CE2 3.65Å; L180-F196 HydrophobicContact CD2-CZ 3.82Å; L180-F196 HydrophobicContact CG-CD2 4.25Å; L180-F196 HydrophobicContact CG-CE2 3.66Å; L180-F196 HydrophobicContact CG-CZ 4.17Å; L180-P219 HydrophobicContact CD1-CB 3.75Å; L180-V220 HydrophobicContact CD1-CG2 4.46Å; L180-V220 HydrophobicContact CD2-CG2 3.8Å; L180-F235 HydrophobicContact CD2-CE1 4.41Å; L180-L238 HydrophobicContact CD2-CD2 3.7Å
181Q84.4Confident82.6Confident115 Ų11560.8 Ų60.854%0.53732%0.32SS..Hα-helixtrans-62.9-42.5172.3-69.4173.615.900111.3D177 L178 V183 E184D177-Q181 WeakPolarHBondContact O-CG 3.27Å; D177-Q181 PolarHBondContact O-N 2.92Å; L178-Q181 PolarHBondContact O-N 2.84Å; Q181-V183 VanDerWaalsContact C-N 3.35Å; Q181-V183 PolarHBondContact O-N 3.5Å; Q181-E184 WeakPolarHBondContact O-CB 3.48Å; Q181-E184 PolarHBondContact O-N 3.33Å
182A83.9Confident82.7Confident5 Ų558.9 Ų58.94%0.04131%0.312CS..Hα-helixtrans-72.6-23.7178.500000114.2Y152 L178 C179 E184 N185 E188 A192Y152-A182 HydrophobicContact CE2-CB 3.84Å; Y152-A182 WeakPolarHBondContact OH-CB 3.29Å; L178-A182 PolarHBondContact O-N 3.37Å; C179-A182 PolarHBondContact O-N 3.21Å; A182-E184 PolarHBondContact O-N 2.96Å; A182-N185 PolarHBondContact O-N 3.4Å; A182-N185 VanDerWaalsContact O-O 3.13Å; A182-E188 HydrophobicContact CB-CB 4.36Å; A182-A192 HydrophobicContact CB-CB 3.78Å
183V83.6Confident82.9Confident3 Ų351.9 Ų51.92%0.01828%0.28CS..Hα-helixtrans-65.2-23.5170.9169.60000112.1C179 L180 Q181 N185 A192 A193 P234 F235C179-V183 VanDerWaalsContact O-CG2 3.3Å; C179-V183 WeakPolarHBondContact O-CG2 3.43Å; C179-V183 PolarHBondContact O-N 3.34Å; L180-V183 PolarHBondContact O-N 3.19Å; Q181-V183 VanDerWaalsContact C-N 3.35Å; Q181-V183 PolarHBondContact O-N 3.5Å; V183-N185 VanDerWaalsContact C-N 3.27Å; V183-N185 PolarHBondContact O-N 3.17Å; V183-A192 HydrophobicContact CG2-CB 4.01Å; V183-A193 HydrophobicContact CG2-CB 4.1Å; V183-P234 HydrophobicContact CG1-CB 3.79Å; V183-F235 HydrophobicContact CB-CE1 4.17Å; V183-F235 HydrophobicContact CG1-CD1 4Å; V183-F235 HydrophobicContact CG1-CE1 3.75Å; V183-F235 HydrophobicContact CG1-CZ 4.3Å
184E76.9Confident83.2Confident85 Ų8551 Ų5140%0.39728%0.279SS..THydrogen-bonded Turntrans-69.8-24.8170.6-58.2-170.4113.600112.6Q181 A182 K223 F235Q181-E184 WeakPolarHBondContact O-CB 3.48Å; Q181-E184 PolarHBondContact O-N 3.33Å; A182-E184 PolarHBondContact O-N 2.96Å; E184-K223 WeakPolarHBondContact OE1-CE 3.1Å; E184-K223 IonicContact OE1-NZ 3.59Å; E184-K223 PolarHBondContact OE1-NZ 2.76Å; E184-K223 WeakPolarHBondContact OE2-CE 3.24Å; E184-K223 IonicContact OE2-NZ 2.77Å; E184-K223 PolarHBondContact OE2-NZ 3.46Å; E184-F235 HydrophobicContact CG-CE2 4.17Å; E184-F235 HydrophobicContact CG-CZ 3.67Å
185N71.5Confident83.5Confident93 Ų9344.4 Ų44.450%0.49725%0.25SS..SBendtrans-91.7116.9-178.7-69-26.7000111.2A182 V183 E187 E188 A189A182-N185 PolarHBondContact O-N 3.4Å; A182-N185 VanDerWaalsContact O-O 3.13Å; V183-N185 VanDerWaalsContact C-N 3.27Å; V183-N185 PolarHBondContact O-N 3.17Å; N185-E187 PolarHBondContact O-N 3.32Å; N185-E188 PolarHBondContact O-N 2.9Å; N185-E188 VanDerWaalsContact O-N 3.16Å; N185-A189 WeakPolarHBondContact O-CB 3.3Å; N185-A189 PolarHBondContact O-N 3.46Å; N185-A189 VanDerWaalsContact O-N 3.1Å
186C65.7Low83.8Confident132 Ų13244.4 Ų44.489%0.89225%0.25SC*.THydrogen-bonded Turntrans-55.4-28.2-175.7-66.70000114.9
187E70.9Confident84Confident143 Ų14345 Ų4567%0.66825%0.254SS*.THydrogen-bonded Turntrans-76.6-24.2-176.4-69.8-158.7-170.100114.6K149 N185K149-E187 WeakPolarHBondContact CE-O 3.29Å; K149-E187 IonicContact NZ-OE2 2.64Å; K149-E187 PolarHBondContact NZ-OE2 3.25Å; N185-E187 PolarHBondContact O-N 3.32Å
188E72Confident84.2Confident28 Ų2842.8 Ų42.813%0.13125%0.246CC..THydrogen-bonded Turntrans-119.2-14.7-170.7-70.4167.9-162.200113V148 K149 Y152 A182 N185 A190 H191 A192V148-E188 HydrophobicContact CB-CG 4.49Å; V148-E188 WeakPolarHBondContact CB-OE1 3.43Å; V148-E188 WeakPolarHBondContact CG1-OE2 3.44Å; V148-E188 VanDerWaalsContact CG2-OE1 3.25Å; V148-E188 WeakPolarHBondContact CG2-OE1 3.49Å; K149-E188 HydrophobicContact CG-CG 3.87Å; Y152-E188 HydrophobicContact CE2-CB 4.24Å; A182-E188 HydrophobicContact CB-CB 4.36Å; N185-E188 PolarHBondContact O-N 2.9Å; N185-E188 VanDerWaalsContact O-N 3.16Å; E188-A190 VanDerWaalsContact C-N 3.25Å; E188-A190 PolarHBondContact O-N 3.48Å; E188-A190 VanDerWaalsContact O-N 3.09Å; E188-H191 PolarHBondContact O-N 2.99Å; E188-A192 PolarHBondContact O-N 3.44Å
189A80.6Confident84.5Confident18 Ų1840.1 Ų40.115%0.14923%0.232CC..Hα-helixtrans-51.3-40.2-171.900000114.1N185 A193N185-A189 WeakPolarHBondContact O-CB 3.3Å; N185-A189 PolarHBondContact O-N 3.46Å; N185-A189 VanDerWaalsContact O-N 3.1Å; A189-A193 WeakPolarHBondContact O-CB 3.27Å; A189-A193 PolarHBondContact O-N 3.34Å
190A83.4Confident84.8Confident68 Ų6840.1 Ų40.156%0.56223%0.232SC*.Hα-helixtrans-64.3-43.5-179.300000112.9E188 S194E188-A190 VanDerWaalsContact C-N 3.25Å; E188-A190 PolarHBondContact O-N 3.48Å; E188-A190 VanDerWaalsContact O-N 3.09Å; A190-S194 WeakPolarHBondContact O-CB 3.42Å; A190-S194 PolarHBondContact O-N 2.86Å; A190-S194 VanDerWaalsContact O-N 3.12Å
191H85.3Confident85Confident40 Ų4041.8 Ų41.819%0.18524%0.243CC..Hα-helixtrans-77.2-41.2-178.8-58.5-58.5000111.5Y152 E188 S194 L195Y152-H191 HydrophobicContact CD2-CB 4.24Å; E188-H191 PolarHBondContact O-N 2.99Å; H191-S194 WeakPolarHBondContact O-CB 3.36Å; H191-S194 PolarHBondContact O-N 3.1Å; H191-L195 PolarHBondContact O-N 3.4Å
192A88.5Confident85.4Confident0 Ų037.9 Ų37.90%022%0.224CC..Hα-helixtrans-61.1-45.117500000111.5Y152 A182 V183 E188 S194 L195 F196Y152-A192 HydrophobicContact CD2-CB 4Å; Y152-A192 HydrophobicContact CE1-CB 4.38Å; Y152-A192 HydrophobicContact CE2-CB 3.76Å; Y152-A192 HydrophobicContact CG-CB 4.43Å; A182-A192 HydrophobicContact CB-CB 3.78Å; V183-A192 HydrophobicContact CG2-CB 4.01Å; E188-A192 PolarHBondContact O-N 3.44Å; A192-S194 VanDerWaalsContact C-N 3.35Å; A192-S194 PolarHBondContact O-N 3.29Å; A192-L195 PolarHBondContact O-N 3.39Å; A192-F196 WeakPolarHBondContact O-CB 3.49Å; A192-F196 PolarHBondContact O-N 3.36Å
193A90.4Very high85.9Confident8 Ų837.7 Ų37.77%0.06622%0.222CC..Hα-helixtrans-62.7-40.1175.500000112.4V183 A189 F196 V197 L238V183-A193 HydrophobicContact CG2-CB 4.1Å; A189-A193 WeakPolarHBondContact O-CB 3.27Å; A189-A193 PolarHBondContact O-N 3.34Å; A193-F196 PolarHBondContact O-N 2.68Å; A193-V197 VanDerWaalsContact O-CG2 3.26Å; A193-V197 WeakPolarHBondContact O-CG2 3.28Å; A193-V197 PolarHBondContact O-N 3.47Å; A193-L238 HydrophobicContact CB-CD1 3.85Å
194S90.9Very high86.2Confident40 Ų4041.4 Ų41.428%0.2824%0.24SC..Hα-helixtrans-62.5-48.2177.5-171.10000111.4E156 A190 H191 A192 V197 A198E156-S194 VanDerWaalsContact OE2-CB 3.27Å; E156-S194 WeakPolarHBondContact OE2-CB 3.41Å; E156-S194 PolarHBondContact OE2-OG 2.89Å; A190-S194 WeakPolarHBondContact O-CB 3.42Å; A190-S194 PolarHBondContact O-N 2.86Å; A190-S194 VanDerWaalsContact O-N 3.12Å; H191-S194 WeakPolarHBondContact O-CB 3.36Å; H191-S194 PolarHBondContact O-N 3.1Å; A192-S194 VanDerWaalsContact C-N 3.35Å; A192-S194 PolarHBondContact O-N 3.29Å; S194-V197 PolarHBondContact O-N 3.41Å; S194-A198 WeakPolarHBondContact O-CB 3.41Å; S194-A198 PolarHBondContact O-N 3.39Å
195L92.7Very high86.8Confident0 Ų043.5 Ų43.50%025%0.25CC..Hα-helixtrans-61.7-45.3175.1178.164.1000111.5Y152 L155 E156 L159 L175 H191 A192 V197 A198 M199Y152-L195 HydrophobicContact CD1-CD2 3.67Å; L155-L195 HydrophobicContact CB-CD1 3.93Å; L155-L195 HydrophobicContact CB-CD2 4.08Å; L155-L195 HydrophobicContact CD1-CD2 4.29Å; E156-L195 HydrophobicContact CB-CB 4.46Å; E156-L195 HydrophobicContact CB-CD1 3.97Å; L159-L195 HydrophobicContact CD1-CD1 3.73Å; L159-L195 HydrophobicContact CG-CD1 4.41Å; L175-L195 HydrophobicContact CD2-CD2 4.17Å; H191-L195 PolarHBondContact O-N 3.4Å; A192-L195 PolarHBondContact O-N 3.39Å; L195-V197 VanDerWaalsContact C-N 3.33Å; L195-V197 PolarHBondContact O-N 3.35Å; L195-A198 PolarHBondContact O-N 3.21Å; L195-M199 HydrophobicContact CD1-CG 3.91Å; L195-M199 HydrophobicContact CD1-SD 4.36Å; L195-M199 HydrophobicContact CD2-CE 4.4Å; L195-M199 HydrophobicContact CG-CE 4.03Å; L195-M199 HydrophobicContact CG-CG 4.14Å; L195-M199 HydrophobicContact CG-SD 4.21Å; L195-M199 WeakPolarHBondContact O-CB 3.35Å; L195-M199 VanDerWaalsContact O-CG 3.32Å; L195-M199 WeakPolarHBondContact O-CG 3.26Å; L195-M199 PolarHBondContact O-N 3.34Å
196F94.2Very high87.7Confident0 Ų041.7 Ų41.70%024%0.24CC..Hα-helixtrans-56-47.1179.1-169.7-88.8000111.7P176 C179 L180 A192 A193 M199 A200 W216 V220 L238 L242P176-F196 HydrophobicContact CB-CE2 4.04Å; C179-F196 HydrophobicContact CB-CB 4.16Å; C179-F196 HydrophobicContact CB-CD2 3.83Å; C179-F196 HydrophobicContact CB-CG 4.49Å; L180-F196 HydrophobicContact CD1-CE2 4.06Å; L180-F196 HydrophobicContact CD1-CZ 4.28Å; L180-F196 HydrophobicContact CD2-CD2 4.1Å; L180-F196 HydrophobicContact CD2-CE1 4.41Å; L180-F196 HydrophobicContact CD2-CE2 3.65Å; L180-F196 HydrophobicContact CD2-CZ 3.82Å; L180-F196 HydrophobicContact CG-CD2 4.25Å; L180-F196 HydrophobicContact CG-CE2 3.66Å; L180-F196 HydrophobicContact CG-CZ 4.17Å; A192-F196 WeakPolarHBondContact O-CB 3.49Å; A192-F196 PolarHBondContact O-N 3.36Å; A193-F196 PolarHBondContact O-N 2.68Å; F196-M199 PolarHBondContact O-N 2.91Å; F196-A200 WeakPolarHBondContact O-CB 3.25Å; F196-A200 PolarHBondContact O-N 2.81Å; F196-W216 AromaticContact CD1-CE3 3.93Å; F196-W216 HydrophobicContact CD1-CE3 3.93Å; F196-W216 HydrophobicContact CD1-CZ3 4.24Å; F196-W216 HydrophobicContact CD2-CE3 4.08Å; F196-W216 AromaticContact CD2-CZ3 3.79Å; F196-W216 HydrophobicContact CD2-CZ3 3.79Å; F196-W216 AromaticContact CE1-CE3 3.58Å; F196-W216 HydrophobicContact CE1-CE3 3.58Å; F196-W216 HydrophobicContact CE1-CZ3 4.25Å; F196-W216 AromaticContact CE2-CE3 3.74Å; F196-W216 HydrophobicContact CE2-CE3 3.74Å; F196-W216 AromaticContact CE2-CZ3 3.79Å; F196-W216 HydrophobicContact CE2-CZ3 3.79Å; F196-W216 HydrophobicContact CG-CE3 4.18Å; F196-W216 HydrophobicContact CG-CZ3 4.03Å; F196-W216 AromaticContact CZ-CE3 3.49Å; F196-W216 HydrophobicContact CZ-CE3 3.49Å; F196-W216 VanDerWaalsContact CZ-CE3 3.49Å; F196-W216 HydrophobicContact CZ-CZ3 4.04Å; F196-W216 WeakPolarHBondContact O-CZ3 3.33Å; F196-V220 HydrophobicContact CE1-CG2 3.9Å; F196-V220 HydrophobicContact CZ-CG2 3.87Å; F196-L238 HydrophobicContact CB-CD1 4.34Å; F196-L238 HydrophobicContact CD1-CD1 3.91Å; F196-L238 HydrophobicContact CD1-CD2 4.06Å; F196-L238 HydrophobicContact CD1-CG 4.31Å; F196-L238 HydrophobicContact CE1-CD2 4.26Å; F196-L238 HydrophobicContact CG-CD1 4.43Å; F196-L238 HydrophobicContact CG-CD2 4.49Å; F196-L242 HydrophobicContact CD1-CD1 4.27Å; F196-L242 HydrophobicContact CD1-CD2 4.34Å; F196-L242 HydrophobicContact CE1-CD1 3.87Å; F196-L242 HydrophobicContact CE1-CD2 4.4Å
197V94.5Very high88.7Confident22 Ų2243.1 Ų43.113%0.13323%0.231CC..Hα-helixtrans-66.6-41.1177.8174.80000111.6A193 S194 L195 A200 T201 L238 K241 L242 V245A193-V197 VanDerWaalsContact O-CG2 3.26Å; A193-V197 WeakPolarHBondContact O-CG2 3.28Å; A193-V197 PolarHBondContact O-N 3.47Å; S194-V197 PolarHBondContact O-N 3.41Å; L195-V197 VanDerWaalsContact C-N 3.33Å; L195-V197 PolarHBondContact O-N 3.35Å; V197-A200 PolarHBondContact O-N 3.26Å; V197-T201 WeakPolarHBondContact O-CB 3.22Å; V197-T201 PolarHBondContact O-N 2.78Å; V197-T201 PolarHBondContact O-OG1 2.86Å; V197-L238 HydrophobicContact CG2-CD1 3.77Å; V197-K241 HydrophobicContact CG1-CB 4.41Å; V197-K241 HydrophobicContact CG2-CB 3.64Å; V197-K241 HydrophobicContact CG2-CD 4.46Å; V197-L242 HydrophobicContact CB-CD2 4.49Å; V197-L242 HydrophobicContact CG2-CD2 4.03Å; V197-L242 HydrophobicContact CG2-CG 4.2Å; V197-V245 HydrophobicContact CG1-CG2 4.38Å
198A93.4Very high89.1Confident29 Ų2936.6 Ų36.624%0.2420%0.202CC..Hα-helixtrans-64-42.8177.400000111.8E156 L159 S194 L195 T201 K202E156-A198 HydrophobicContact CG-CB 4.03Å; L159-A198 HydrophobicContact CD1-CB 3.54Å; S194-A198 WeakPolarHBondContact O-CB 3.41Å; S194-A198 PolarHBondContact O-N 3.39Å; L195-A198 PolarHBondContact O-N 3.21Å; A198-T201 PolarHBondContact O-N 3.3Å; A198-K202 WeakPolarHBondContact O-CB 3.44Å; A198-K202 PolarHBondContact O-N 2.83Å
199M94.4Very high89.7Confident0 Ų036.4 Ų36.40%020%0.203CC..Hα-helixtrans-63.9-43.8174.6-69.1-169.3-64.800111.3L159 L170 L175 P176 L195 F196 T201 K202 D203 W216L159-M199 HydrophobicContact CD1-CB 4.43Å; L159-M199 HydrophobicContact CD1-CG 3.75Å; L159-M199 HydrophobicContact CD2-CG 4.04Å; L159-M199 HydrophobicContact CG-CG 4.44Å; L170-M199 HydrophobicContact CD1-SD 4.24Å; L175-M199 HydrophobicContact CD2-CE 4.36Å; L175-M199 HydrophobicContact CD2-SD 3.72Å; L175-M199 HydrophobicContact CG-CE 4.13Å; L175-M199 HydrophobicContact CG-SD 4.09Å; P176-M199 HydrophobicContact CG-CE 4.44Å; L195-M199 HydrophobicContact CD1-CG 3.91Å; L195-M199 HydrophobicContact CD1-SD 4.36Å; L195-M199 HydrophobicContact CD2-CE 4.4Å; L195-M199 HydrophobicContact CG-CE 4.03Å; L195-M199 HydrophobicContact CG-CG 4.14Å; L195-M199 HydrophobicContact CG-SD 4.21Å; L195-M199 WeakPolarHBondContact O-CB 3.35Å; L195-M199 VanDerWaalsContact O-CG 3.32Å; L195-M199 WeakPolarHBondContact O-CG 3.26Å; L195-M199 PolarHBondContact O-N 3.34Å; F196-M199 PolarHBondContact O-N 2.91Å; M199-T201 VanDerWaalsContact C-N 3.28Å; M199-T201 PolarHBondContact O-N 3.09Å; M199-K202 PolarHBondContact O-N 3.47Å; M199-D203 WeakPolarHBondContact O-CB 3.39Å; M199-D203 PolarHBondContact O-N 2.91Å; M199-W216 HydrophobicContact CB-CH2 3.26Å; M199-W216 HydrophobicContact CB-CZ2 3.95Å; M199-W216 HydrophobicContact CB-CZ3 3.88Å; M199-W216 HydrophobicContact CE-CH2 3.92Å; M199-W216 HydrophobicContact CE-CZ3 4.02Å; M199-W216 HydrophobicContact CG-CH2 4.32Å; M199-W216 HydrophobicContact SD-CH2 4.27Å
200A94.3Very high89.8Confident0 Ų041.8 Ų41.80%024%0.235CC..Hα-helixtrans-60.8-39.5176.800000111.7F196 V197 M204 W212 W216 L242F196-A200 WeakPolarHBondContact O-CB 3.25Å; F196-A200 PolarHBondContact O-N 2.81Å; V197-A200 PolarHBondContact O-N 3.26Å; A200-M204 PolarHBondContact O-N 3.15Å; A200-W212 HydrophobicContact CB-CH2 4.5Å; A200-W212 HydrophobicContact CB-CZ2 3.62Å; A200-W212 PolarHBondContact O-NE1 3.48Å; A200-W216 HydrophobicContact CB-CB 4.17Å; A200-W216 HydrophobicContact CB-CD2 3.45Å; A200-W216 VanDerWaalsContact CB-CD2 3.45Å; A200-W216 HydrophobicContact CB-CE3 3.57Å; A200-W216 HydrophobicContact CB-CG 3.71Å; A200-W216 HydrophobicContact CB-CZ3 4.2Å; A200-L242 HydrophobicContact CB-CD2 3.73Å
201T93.9Very high89.9Confident49 Ų4944.8 Ų44.830%0.30124%0.235SC..Hα-helixtrans-65.1-48.4175.3-53.50000111.1V197 A198 M199 D203 M204 E205 V245V197-T201 WeakPolarHBondContact O-CB 3.22Å; V197-T201 PolarHBondContact O-N 2.78Å; V197-T201 PolarHBondContact O-OG1 2.86Å; A198-T201 PolarHBondContact O-N 3.3Å; M199-T201 VanDerWaalsContact C-N 3.28Å; M199-T201 PolarHBondContact O-N 3.09Å; T201-D203 VanDerWaalsContact C-N 3.32Å; T201-D203 PolarHBondContact O-N 3.3Å; T201-M204 WeakPolarHBondContact O-CB 3.45Å; T201-M204 PolarHBondContact O-N 2.83Å; T201-M204 VanDerWaalsContact O-N 3.14Å; T201-E205 WeakPolarHBondContact O-CG 3.29Å; T201-E205 PolarHBondContact O-N 2.97Å; T201-V245 WeakPolarHBondContact OG1-CG2 3.45Å
202K92.9Very high90.2Very high33 Ų3343.7 Ų43.714%0.14323%0.229CC..Hα-helixtrans-63.5-36.7178.7-166.466.1173.21800112.4L159 P160 F162 L167 A198 M199 E205 L206L159-K202 HydrophobicContact CD2-CB 4.46Å; L159-K202 HydrophobicContact CD2-CG 4.45Å; L159-K202 VanDerWaalsContact O-CE 3.31Å; L159-K202 WeakPolarHBondContact O-CE 3.24Å; P160-K202 PolarHBondContact O-NZ 3.41Å; F162-K202 VanDerWaalsContact O-CE 3.23Å; F162-K202 WeakPolarHBondContact O-CE 3.37Å; L167-K202 HydrophobicContact CD2-CB 4.4Å; L167-K202 HydrophobicContact CD2-CG 4.18Å; A198-K202 WeakPolarHBondContact O-CB 3.44Å; A198-K202 PolarHBondContact O-N 2.83Å; M199-K202 PolarHBondContact O-N 3.47Å; K202-E205 IonicContact NZ-OE2 3.29Å; K202-E205 PolarHBondContact O-N 3.17Å; K202-L206 HydrophobicContact CD-CD1 4.34Å; K202-L206 HydrophobicContact CG-CD1 4.09Å; K202-L206 WeakPolarHBondContact O-CB 3.4Å; K202-L206 WeakPolarHBondContact O-CG 3.39Å; K202-L206 PolarHBondContact O-N 3.12Å
203D93.6Very high90.3Very high1 Ų145.5 Ų45.51%0.00524%0.238CC..Hα-helixtrans-64.6-40.7173.6-173.524.4000111.8L167 F171 M199 T201 E205 L206 K207 A208 S209 W216L167-D203 HydrophobicContact CD2-CB 4.09Å; F171-D203 HydrophobicContact CZ-CB 4.02Å; M199-D203 WeakPolarHBondContact O-CB 3.39Å; M199-D203 PolarHBondContact O-N 2.91Å; T201-D203 VanDerWaalsContact C-N 3.32Å; T201-D203 PolarHBondContact O-N 3.3Å; D203-E205 VanDerWaalsContact C-N 3.31Å; D203-E205 PolarHBondContact O-N 3.49Å; D203-L206 PolarHBondContact O-N 3.07Å; D203-K207 WeakPolarHBondContact O-CA 3.41Å; D203-K207 PolarHBondContact O-N 3.14Å; D203-A208 PolarHBondContact O-N 3.4Å; D203-A208 VanDerWaalsContact OD1-CA 3.31Å; D203-A208 WeakPolarHBondContact OD1-CA 3.34Å; D203-A208 VanDerWaalsContact OD1-CB 3.22Å; D203-A208 WeakPolarHBondContact OD1-CB 3.42Å; D203-A208 PolarHBondContact OD1-N 2.81Å; D203-S209 PolarHBondContact OD1-N 3.48Å; D203-S209 PolarHBondContact OD1-OG 2.78Å; D203-S209 VanDerWaalsContact OD2-CB 3.24Å; D203-S209 WeakPolarHBondContact OD2-CB 3.47Å; D203-S209 PolarHBondContact OD2-OG 3.36Å; D203-W216 HydrophobicContact CB-CZ2 4.24Å; D203-W216 PolarHBondContact OD2-NE1 3.29Å
204M90.8Very high90.3Very high80 Ų8047.2 Ų47.239%0.39425%0.253SS..Hα-helixtrans-64.8-36.3176-162.367.8-17900112A200 T201 W212 V245A200-M204 PolarHBondContact O-N 3.15Å; T201-M204 WeakPolarHBondContact O-CB 3.45Å; T201-M204 PolarHBondContact O-N 2.83Å; T201-M204 VanDerWaalsContact O-N 3.14Å; M204-W212 HydrophobicContact SD-CD2 4.3Å; M204-W212 HydrophobicContact SD-CG 4.05Å; M204-V245 HydrophobicContact CB-CG1 4.1Å; M204-V245 HydrophobicContact CG-CG1 4.41Å
205E88.6Confident90.2Very high129 Ų12947.3 Ų47.360%0.60325%0.251SS*.Hα-helixtrans-67.5-47.6174.8-70.6174.3-175.800112.3T201 K202 D203T201-E205 WeakPolarHBondContact O-CG 3.29Å; T201-E205 PolarHBondContact O-N 2.97Å; K202-E205 IonicContact NZ-OE2 3.29Å; K202-E205 PolarHBondContact O-N 3.17Å; D203-E205 VanDerWaalsContact C-N 3.31Å; D203-E205 PolarHBondContact O-N 3.49Å
206L90Very high90.3Very high55 Ų5547.3 Ų47.329%0.28825%0.251SS..Hα-helixtrans-88.8-10.9-174.5-64.3-179.5000114.1R164 L167 K202 D203 A208R164-L206 HydrophobicContact CB-CD1 4.46Å; L167-L206 HydrophobicContact CD2-CD1 4.11Å; K202-L206 HydrophobicContact CD-CD1 4.34Å; K202-L206 HydrophobicContact CG-CD1 4.09Å; K202-L206 WeakPolarHBondContact O-CB 3.4Å; K202-L206 WeakPolarHBondContact O-CG 3.39Å; K202-L206 PolarHBondContact O-N 3.12Å; D203-L206 PolarHBondContact O-N 3.07Å; L206-A208 VanDerWaalsContact C-N 3.29Å; L206-A208 PolarHBondContact O-N 3.22Å
207K86.7Confident90.2Very high162 Ų16247.3 Ų47.370%0.70425%0.251SS*.THydrogen-bonded Turntrans47.850.5-171.7-56.8-178-177.81780111.5R164 D203R164-K207 PolarHBondContact NH2-O 3.13Å; D203-K207 WeakPolarHBondContact O-CA 3.41Å; D203-K207 PolarHBondContact O-N 3.14Å
208A81Confident90.1Very high6 Ų649.6 Ų49.65%0.0526%0.26CS..  trans-74.3-46.2-175.100000110.9R164 L167 L168 F171 D203 L206R164-A208 HydrophobicContact CG-CB 4.03Å; L167-A208 HydrophobicContact CD2-CB 3.86Å; L167-A208 HydrophobicContact CG-CB 4.33Å; L168-A208 HydrophobicContact CD2-CB 3.96Å; L168-A208 HydrophobicContact CG-CB 4.23Å; F171-A208 HydrophobicContact CE2-CB 4.09Å; D203-A208 PolarHBondContact O-N 3.4Å; D203-A208 VanDerWaalsContact OD1-CA 3.31Å; D203-A208 WeakPolarHBondContact OD1-CA 3.34Å; D203-A208 VanDerWaalsContact OD1-CB 3.22Å; D203-A208 WeakPolarHBondContact OD1-CB 3.42Å; D203-A208 PolarHBondContact OD1-N 2.81Å; L206-A208 VanDerWaalsContact C-N 3.29Å; L206-A208 PolarHBondContact O-N 3.22Å
209S84.5Confident90Very high24 Ų2449.6 Ų49.617%0.16826%0.257CS..SBendtrans-77.8147.3173.168.40000112.7D203 W212D203-S209 PolarHBondContact OD1-N 3.48Å; D203-S209 PolarHBondContact OD1-OG 2.78Å; D203-S209 VanDerWaalsContact OD2-CB 3.24Å; D203-S209 WeakPolarHBondContact OD2-CB 3.47Å; D203-S209 PolarHBondContact OD2-OG 3.36Å; S209-W212 WeakPolarHBondContact OG-CA 3.2Å
210T80.9Confident89.9Confident132 Ų13249.6 Ų49.681%0.8126%0.257SS*.SBendtrans-76-36176.447.40000112.5
211F86.3Confident89.5Confident130 Ų13049.7 Ų49.757%0.5726%0.257SS*.SBendtrans-13088.7177.4-61.7-76.3000109.9E213 A214F211-E213 PolarHBondContact O-N 2.8Å; F211-A214 HydrophobicContact CB-CB 3.9Å; F211-A214 WeakPolarHBondContact O-CB 3.37Å; F211-A214 PolarHBondContact O-N 3.39Å
212W92.2Very high89.2Confident17 Ų1752.7 Ų52.76%0.06427%0.268CS..Hα-helixtrans-54-39.6-175.7-17294.3000112.8A200 M204 S209 A214 T215 W216 L217 L242 V245 L249A200-W212 HydrophobicContact CB-CH2 4.5Å; A200-W212 HydrophobicContact CB-CZ2 3.62Å; A200-W212 PolarHBondContact O-NE1 3.48Å; M204-W212 HydrophobicContact SD-CD2 4.3Å; M204-W212 HydrophobicContact SD-CG 4.05Å; S209-W212 WeakPolarHBondContact OG-CA 3.2Å; W212-A214 VanDerWaalsContact C-N 3.26Å; W212-A214 PolarHBondContact O-N 3.05Å; W212-T215 PolarHBondContact O-N 3.39Å; W212-W216 AromaticContact CD1-CD1 3.42Å; W212-W216 VanDerWaalsContact CD1-CD1 3.42Å; W212-W216 AromaticContact CD1-NE1 3.76Å; W212-W216 HydrophobicContact CD2-CB 4.18Å; W212-W216 AromaticContact CD2-CD1 3.61Å; W212-W216 HydrophobicContact CD2-CG 4.22Å; W212-W216 AromaticContact CE2-CD1 3.42Å; W212-W216 VanDerWaalsContact CE2-CD1 3.42Å; W212-W216 AromaticContact CE2-CG 3.87Å; W212-W216 HydrophobicContact CE3-CB 4.19Å; W212-W216 AromaticContact CG-CD1 3.64Å; W212-W216 HydrophobicContact CH2-CB 4Å; W212-W216 HydrophobicContact CZ2-CB 3.95Å; W212-W216 HydrophobicContact CZ2-CG 4.1Å; W212-W216 HydrophobicContact CZ3-CB 4.14Å; W212-W216 AromaticContact NE1-CD1 3.28Å; W212-W216 VanDerWaalsContact NE1-CD1 3.28Å; W212-W216 AromaticContact NE1-NE1 3.66Å; W212-W216 PolarHBondContact O-N 3.49Å; W212-L217 HydrophobicContact CE3-CD1 4.34Å; W212-L217 HydrophobicContact CE3-CG 4.25Å; W212-L217 HydrophobicContact CH2-CD2 4.42Å; W212-L217 HydrophobicContact CH2-CG 4.34Å; W212-L217 HydrophobicContact CZ3-CD1 3.72Å; W212-L217 HydrophobicContact CZ3-CD2 4.04Å; W212-L217 HydrophobicContact CZ3-CG 3.54Å; W212-L242 HydrophobicContact CH2-CD2 4.47Å; W212-V245 HydrophobicContact CH2-CB 4.3Å; W212-V245 HydrophobicContact CH2-CG1 4.15Å; W212-V245 HydrophobicContact CZ2-CB 4.19Å; W212-V245 HydrophobicContact CZ2-CG1 3.59Å; W212-L249 HydrophobicContact CB-CD2 4.34Å; W212-L249 HydrophobicContact CD2-CD2 4.37Å; W212-L249 HydrophobicContact CE3-CD2 3.58Å; W212-L249 HydrophobicContact CZ3-CD2 4.28Å
213E90.2Very high88.7Confident38 Ų3854 Ų5418%0.17827%0.274CS..Hα-helixtrans-66-27.517973.7-79.1-172.600113.7F211 T215 L217 K218 L249 I253F211-E213 PolarHBondContact O-N 2.8Å; E213-T215 VanDerWaalsContact C-N 3.31Å; E213-L217 HydrophobicContact CB-CB 4.38Å; E213-L217 HydrophobicContact CB-CD1 4.32Å; E213-L217 PolarHBondContact O-N 2.84Å; E213-L217 VanDerWaalsContact O-N 3.16Å; E213-K218 WeakPolarHBondContact O-CG 3.37Å; E213-K218 PolarHBondContact O-N 3.12Å; E213-L249 HydrophobicContact CB-CD1 4.26Å; E213-L249 HydrophobicContact CB-CD2 4.09Å; E213-L249 HydrophobicContact CB-CG 4.15Å; E213-I253 HydrophobicContact CB-CD1 4.08Å; E213-I253 HydrophobicContact CB-CG1 3.94Å; E213-I253 HydrophobicContact CG-CD1 3.81Å; E213-I253 HydrophobicContact CG-CG1 4.25Å
214A90.2Very high88.1Confident45 Ų4554.6 Ų54.637%0.37228%0.276SS..Hα-helixtrans-72.3-30.2179.900000111.4F211 W212 P219F211-A214 HydrophobicContact CB-CB 3.9Å; F211-A214 WeakPolarHBondContact O-CB 3.37Å; F211-A214 PolarHBondContact O-N 3.39Å; W212-A214 VanDerWaalsContact C-N 3.26Å; W212-A214 PolarHBondContact O-N 3.05Å; A214-P219 WeakPolarHBondContact O-CD 3.3Å; A214-P219 WeakPolarHBondContact O-CG 3.43Å
215T89.7Confident87.3Confident42 Ų4258 Ų5826%0.25829%0.285SS..Hα-helixtrans-87.1-42.3178.1-48.90000112.1P176 W212 E213P176-T215 HydrophobicContact CG-CG2 4.36Å; W212-T215 PolarHBondContact O-N 3.39Å; E213-T215 VanDerWaalsContact C-N 3.31Å
216W94.1Very high86.4Confident0 Ų056.2 Ų56.20%029%0.286CS..Hα-helixtrans-109.7-26.4-164.9-57.3107.5000115.7F171 P176 F196 M199 A200 D203 W212 V220F171-W216 HydrophobicContact CD1-CZ2 4.47Å; F171-W216 AromaticContact CE1-CH2 3.93Å; F171-W216 HydrophobicContact CE1-CH2 3.93Å; F171-W216 AromaticContact CE1-CZ2 3.49Å; F171-W216 HydrophobicContact CE1-CZ2 3.49Å; F171-W216 VanDerWaalsContact CE1-CZ2 3.49Å; F171-W216 AromaticContact CZ-CZ2 3.65Å; F171-W216 HydrophobicContact CZ-CZ2 3.65Å; P176-W216 HydrophobicContact CB-CH2 4.16Å; P176-W216 HydrophobicContact CB-CZ3 4Å; P176-W216 HydrophobicContact CG-CH2 3.72Å; P176-W216 HydrophobicContact CG-CZ2 4.4Å; P176-W216 HydrophobicContact CG-CZ3 4.09Å; F196-W216 AromaticContact CD1-CE3 3.93Å; F196-W216 HydrophobicContact CD1-CE3 3.93Å; F196-W216 HydrophobicContact CD1-CZ3 4.24Å; F196-W216 HydrophobicContact CD2-CE3 4.08Å; F196-W216 AromaticContact CD2-CZ3 3.79Å; F196-W216 HydrophobicContact CD2-CZ3 3.79Å; F196-W216 AromaticContact CE1-CE3 3.58Å; F196-W216 HydrophobicContact CE1-CE3 3.58Å; F196-W216 HydrophobicContact CE1-CZ3 4.25Å; F196-W216 AromaticContact CE2-CE3 3.74Å; F196-W216 HydrophobicContact CE2-CE3 3.74Å; F196-W216 AromaticContact CE2-CZ3 3.79Å; F196-W216 HydrophobicContact CE2-CZ3 3.79Å; F196-W216 HydrophobicContact CG-CE3 4.18Å; F196-W216 HydrophobicContact CG-CZ3 4.03Å; F196-W216 AromaticContact CZ-CE3 3.49Å; F196-W216 HydrophobicContact CZ-CE3 3.49Å; F196-W216 VanDerWaalsContact CZ-CE3 3.49Å; F196-W216 HydrophobicContact CZ-CZ3 4.04Å; F196-W216 WeakPolarHBondContact O-CZ3 3.33Å; M199-W216 HydrophobicContact CB-CH2 3.26Å; M199-W216 HydrophobicContact CB-CZ2 3.95Å; M199-W216 HydrophobicContact CB-CZ3 3.88Å; M199-W216 HydrophobicContact CE-CH2 3.92Å; M199-W216 HydrophobicContact CE-CZ3 4.02Å; M199-W216 HydrophobicContact CG-CH2 4.32Å; M199-W216 HydrophobicContact SD-CH2 4.27Å; A200-W216 HydrophobicContact CB-CB 4.17Å; A200-W216 HydrophobicContact CB-CD2 3.45Å; A200-W216 VanDerWaalsContact CB-CD2 3.45Å; A200-W216 HydrophobicContact CB-CE3 3.57Å; A200-W216 HydrophobicContact CB-CG 3.71Å; A200-W216 HydrophobicContact CB-CZ3 4.2Å; D203-W216 HydrophobicContact CB-CZ2 4.24Å; D203-W216 PolarHBondContact OD2-NE1 3.29Å; W212-W216 AromaticContact CD1-CD1 3.42Å; W212-W216 VanDerWaalsContact CD1-CD1 3.42Å; W212-W216 AromaticContact CD1-NE1 3.76Å; W212-W216 HydrophobicContact CD2-CB 4.18Å; W212-W216 AromaticContact CD2-CD1 3.61Å; W212-W216 HydrophobicContact CD2-CG 4.22Å; W212-W216 AromaticContact CE2-CD1 3.42Å; W212-W216 VanDerWaalsContact CE2-CD1 3.42Å; W212-W216 AromaticContact CE2-CG 3.87Å; W212-W216 HydrophobicContact CE3-CB 4.19Å; W212-W216 AromaticContact CG-CD1 3.64Å; W212-W216 HydrophobicContact CH2-CB 4Å; W212-W216 HydrophobicContact CZ2-CB 3.95Å; W212-W216 HydrophobicContact CZ2-CG 4.1Å; W212-W216 HydrophobicContact CZ3-CB 4.14Å; W212-W216 AromaticContact NE1-CD1 3.28Å; W212-W216 VanDerWaalsContact NE1-CD1 3.28Å; W212-W216 AromaticContact NE1-NE1 3.66Å; W212-W216 PolarHBondContact O-N 3.49Å; W216-V220 VanDerWaalsContact O-CG2 3.32Å; W216-V220 WeakPolarHBondContact O-CG2 3.2Å
217L92.8Very high85.1Confident0 Ų054.7 Ų54.70%028%0.28CS..THydrogen-bonded Turntrans-106.9-53.9-176.5-67.8-179.9000113.1W212 E213 V220 F221 L239 L242 L249 F250 I253W212-L217 HydrophobicContact CE3-CD1 4.34Å; W212-L217 HydrophobicContact CE3-CG 4.25Å; W212-L217 HydrophobicContact CH2-CD2 4.42Å; W212-L217 HydrophobicContact CH2-CG 4.34Å; W212-L217 HydrophobicContact CZ3-CD1 3.72Å; W212-L217 HydrophobicContact CZ3-CD2 4.04Å; W212-L217 HydrophobicContact CZ3-CG 3.54Å; E213-L217 HydrophobicContact CB-CB 4.38Å; E213-L217 HydrophobicContact CB-CD1 4.32Å; E213-L217 PolarHBondContact O-N 2.84Å; E213-L217 VanDerWaalsContact O-N 3.16Å; L217-V220 PolarHBondContact O-N 3.03Å; L217-V220 VanDerWaalsContact O-N 3.15Å; L217-F221 HydrophobicContact CB-CD2 4.32Å; L217-F221 HydrophobicContact CB-CE2 4.37Å; L217-F221 VanDerWaalsContact O-CD2 3.31Å; L217-F221 WeakPolarHBondContact O-CD2 3.36Å; L217-F221 PolarHBondContact O-N 2.88Å; L217-L239 HydrophobicContact CD2-CD2 4.34Å; L217-L242 HydrophobicContact CD2-CB 4.27Å; L217-L242 HydrophobicContact CD2-CD1 4.27Å; L217-L249 HydrophobicContact CD1-CG 4.34Å; L217-F250 HydrophobicContact CD1-CB 4.48Å; L217-F250 HydrophobicContact CD2-CD2 3.72Å; L217-F250 HydrophobicContact CD2-CE2 4.19Å; L217-I253 HydrophobicContact CB-CG2 4.27Å; L217-I253 HydrophobicContact CD1-CB 4.23Å; L217-I253 HydrophobicContact CD1-CG1 4.19Å
218K92.1Very high83.5Confident70 Ų7049.2 Ų49.230%0.30427%0.27SS..Hα-helixtrans-56.2-46.1-175.7-67.6-179.5-171.4165.50112.3E213 V220 F221 E222E213-K218 WeakPolarHBondContact O-CG 3.37Å; E213-K218 PolarHBondContact O-N 3.12Å; K218-V220 VanDerWaalsContact C-N 3.27Å; K218-V220 PolarHBondContact O-N 2.84Å; K218-F221 PolarHBondContact O-N 3.12Å; K218-E222 WeakPolarHBondContact O-CB 3.5Å; K218-E222 VanDerWaalsContact O-CG 3.27Å; K218-E222 WeakPolarHBondContact O-CG 3.32Å; K218-E222 PolarHBondContact O-N 3.2Å
219P91.2Very high82Confident28 Ų2854.1 Ų54.118%0.18230%0.303CS..Hα-helixtrans-61.8-35.7179.9-24.436.8000112.6L180 A214 K223L180-P219 HydrophobicContact CD1-CB 3.75Å; A214-P219 WeakPolarHBondContact O-CD 3.3Å; A214-P219 WeakPolarHBondContact O-CG 3.43Å; P219-K223 WeakPolarHBondContact O-CB 3.47Å; P219-K223 PolarHBondContact O-N 3.39Å
220V91.2Very high80.5Confident0 Ų058.4 Ų58.40%033%0.333CS..Hα-helixtrans-71.2-44.5179.2-171.10000111.3L180 F196 W216 L217 K218 K223 M224 F235 L238 L239 L242L180-V220 HydrophobicContact CD1-CG2 4.46Å; L180-V220 HydrophobicContact CD2-CG2 3.8Å; F196-V220 HydrophobicContact CE1-CG2 3.9Å; F196-V220 HydrophobicContact CZ-CG2 3.87Å; W216-V220 VanDerWaalsContact O-CG2 3.32Å; W216-V220 WeakPolarHBondContact O-CG2 3.2Å; L217-V220 PolarHBondContact O-N 3.03Å; L217-V220 VanDerWaalsContact O-N 3.15Å; K218-V220 VanDerWaalsContact C-N 3.27Å; K218-V220 PolarHBondContact O-N 2.84Å; V220-K223 PolarHBondContact O-N 2.85Å; V220-M224 WeakPolarHBondContact O-CB 3.5Å; V220-M224 PolarHBondContact O-N 3.04Å; V220-F235 HydrophobicContact CG1-CB 4.2Å; V220-F235 HydrophobicContact CG1-CD1 4.18Å; V220-L238 HydrophobicContact CG1-CD2 4.07Å; V220-L238 HydrophobicContact CG1-CG 4.46Å; V220-L238 HydrophobicContact CG2-CD2 4.08Å; V220-L239 HydrophobicContact CB-CD2 3.94Å; V220-L239 HydrophobicContact CB-CG 4.38Å; V220-L239 HydrophobicContact CG1-CD1 4.15Å; V220-L239 HydrophobicContact CG1-CD2 3.72Å; V220-L239 HydrophobicContact CG1-CG 3.61Å; V220-L242 HydrophobicContact CG2-CD1 4.43Å
221F87.7Confident79.3Confident3 Ų353.5 Ų53.51%0.01330%0.304CS..Hα-helixtrans-63.7-42.1175-81.7-68.4000112.3L217 K218 M224 R225 L239 F250 I253 A254 Y257L217-F221 HydrophobicContact CB-CD2 4.32Å; L217-F221 HydrophobicContact CB-CE2 4.37Å; L217-F221 VanDerWaalsContact O-CD2 3.31Å; L217-F221 WeakPolarHBondContact O-CD2 3.36Å; L217-F221 PolarHBondContact O-N 2.88Å; K218-F221 PolarHBondContact O-N 3.12Å; F221-M224 PolarHBondContact O-N 3.17Å; F221-R225 WeakPolarHBondContact O-CB 3.4Å; F221-R225 PolarHBondContact O-N 3.36Å; F221-L239 HydrophobicContact CD1-CD1 3.89Å; F221-L239 HydrophobicContact CD2-CD2 4.15Å; F221-L239 HydrophobicContact CE1-CD1 3.75Å; F221-L239 HydrophobicContact CE1-CD2 4.39Å; F221-L239 HydrophobicContact CE2-CD2 3.87Å; F221-L239 HydrophobicContact CG-CD1 4.41Å; F221-L239 HydrophobicContact CZ-CD1 4.15Å; F221-L239 HydrophobicContact CZ-CD2 4Å; F221-F250 HydrophobicContact CE2-CE2 4.38Å; F221-F250 HydrophobicContact CZ-CE1 4.2Å; F221-F250 HydrophobicContact CZ-CE2 4.09Å; F221-F250 AromaticContact CZ-CZ 3.78Å; F221-F250 HydrophobicContact CZ-CZ 3.78Å; F221-I253 HydrophobicContact CD2-CG2 3.94Å; F221-I253 HydrophobicContact CE2-CG2 3.94Å; F221-A254 HydrophobicContact CE1-CB 4.38Å; F221-A254 HydrophobicContact CZ-CB 3.83Å; F221-Y257 HydrophobicContact CB-CD1 4.03Å; F221-Y257 HydrophobicContact CB-CD2 3.88Å; F221-Y257 HydrophobicContact CB-CE1 3.69Å; F221-Y257 HydrophobicContact CB-CE2 3.53Å; F221-Y257 HydrophobicContact CB-CG 4.13Å; F221-Y257 VanDerWaalsContact CB-CZ 3.43Å; F221-Y257 AromaticContact CD1-CD2 3.94Å; F221-Y257 HydrophobicContact CD1-CD2 3.94Å; F221-Y257 HydrophobicContact CD1-CE2 4.4Å; F221-Y257 HydrophobicContact CD1-CG 4.08Å; F221-Y257 AromaticContact CD2-CD2 3.96Å; F221-Y257 HydrophobicContact CD2-CD2 3.96Å; F221-Y257 AromaticContact CD2-CE2 3.79Å; F221-Y257 HydrophobicContact CD2-CE2 3.79Å; F221-Y257 HydrophobicContact CE1-CD2 4.47Å; F221-Y257 HydrophobicContact CE2-CD2 4.49Å; F221-Y257 AromaticContact CG-CD2 3.67Å; F221-Y257 HydrophobicContact CG-CD2 3.67Å; F221-Y257 AromaticContact CG-CE2 3.67Å; F221-Y257 HydrophobicContact CG-CE2 3.67Å; F221-Y257 HydrophobicContact CG-CG 4.13Å
222E86.6Confident78.2Confident111 Ų11148.4 Ų48.452%0.51928%0.284SS..Hα-helixtrans-63.1-44.2175.9-74.1168.7-174.400111K218 R225 S226K218-E222 WeakPolarHBondContact O-CB 3.5Å; K218-E222 VanDerWaalsContact O-CG 3.27Å; K218-E222 WeakPolarHBondContact O-CG 3.32Å; K218-E222 PolarHBondContact O-N 3.2Å; E222-R225 PolarHBondContact O-N 2.79Å; E222-S226 WeakPolarHBondContact O-CB 3.5Å; E222-S226 PolarHBondContact O-N 3.4Å; E222-S226 PolarHBondContact O-OG 3.27Å
223K83Confident77.4Confident62 Ų6251.6 Ų51.627%0.2731%0.305SS..Hα-helixtrans-60.8-48.7176.3-163.968.1172.9-179.70110.8E184 P219 V220 R225 S226 S227 F235E184-K223 WeakPolarHBondContact OE1-CE 3.1Å; E184-K223 IonicContact OE1-NZ 3.59Å; E184-K223 PolarHBondContact OE1-NZ 2.76Å; E184-K223 WeakPolarHBondContact OE2-CE 3.24Å; E184-K223 IonicContact OE2-NZ 2.77Å; E184-K223 PolarHBondContact OE2-NZ 3.46Å; P219-K223 WeakPolarHBondContact O-CB 3.47Å; P219-K223 PolarHBondContact O-N 3.39Å; V220-K223 PolarHBondContact O-N 2.85Å; K223-R225 VanDerWaalsContact C-N 3.28Å; K223-R225 PolarHBondContact O-N 2.87Å; K223-S226 WeakPolarHBondContact CA-OG 3.37Å; K223-S226 PolarHBondContact O-N 2.92Å; K223-S226 VanDerWaalsContact O-N 3.11Å; K223-S226 PolarHBondContact O-OG 3.36Å; K223-S227 WeakPolarHBondContact O-CB 3.37Å; K223-S227 PolarHBondContact O-N 2.99Å; K223-S227 PolarHBondContact O-OG 3.27Å; K223-F235 HydrophobicContact CB-CE1 4.39Å; K223-F235 HydrophobicContact CB-CE2 4.5Å; K223-F235 HydrophobicContact CB-CZ 4.36Å; K223-F235 HydrophobicContact CD-CZ 4.4Å; K223-F235 HydrophobicContact CG-CD1 4.38Å; K223-F235 HydrophobicContact CG-CD2 4.15Å; K223-F235 HydrophobicContact CG-CE1 3.81Å; K223-F235 HydrophobicContact CG-CE2 3.57Å; K223-F235 HydrophobicContact CG-CZ 3.37Å
224M80.1Confident76.9Confident12 Ų1251.8 Ų51.86%0.05931%0.309CS..Hα-helixtrans-57.7-35.6175.9-174.7-174.4149.900112.9V220 F221 S227 V232 F235 L239 C268 I269 L272V220-M224 WeakPolarHBondContact O-CB 3.5Å; V220-M224 PolarHBondContact O-N 3.04Å; F221-M224 PolarHBondContact O-N 3.17Å; M224-S227 WeakPolarHBondContact CA-OG 3.36Å; M224-S227 PolarHBondContact O-OG 2.9Å; M224-V232 HydrophobicContact CE-CG1 4.05Å; M224-V232 HydrophobicContact CG-CG1 4.04Å; M224-F235 HydrophobicContact CB-CB 4.21Å; M224-L239 HydrophobicContact SD-CD1 3.81Å; M224-C268 HydrophobicContact CE-CB 3.56Å; M224-I269 HydrophobicContact CE-CD1 4.17Å; M224-I269 HydrophobicContact CE-CG1 3.4Å; M224-I269 VanDerWaalsContact CE-CG1 3.4Å; M224-I269 HydrophobicContact SD-CG1 4.38Å; M224-L272 HydrophobicContact SD-CD1 4.32Å
225R73.6Confident76.7Confident153 Ų15349.7 Ų49.758%0.57729%0.292SS*.Hα-helixtrans-76.5-32.2176.7-166177.4-173163.36.5112.9F221 E222 K223F221-R225 WeakPolarHBondContact O-CB 3.4Å; F221-R225 PolarHBondContact O-N 3.36Å; E222-R225 PolarHBondContact O-N 2.79Å; K223-R225 VanDerWaalsContact C-N 3.28Å; K223-R225 PolarHBondContact O-N 2.87Å
226S71.1Confident76.4Confident90 Ų9048.4 Ų48.463%0.62929%0.285SS*.Hα-helixtrans-82.1-18.8179.770.60000114.2E222 K223E222-S226 WeakPolarHBondContact O-CB 3.5Å; E222-S226 PolarHBondContact O-N 3.4Å; E222-S226 PolarHBondContact O-OG 3.27Å; K223-S226 WeakPolarHBondContact CA-OG 3.37Å; K223-S226 PolarHBondContact O-N 2.92Å; K223-S226 VanDerWaalsContact O-N 3.11Å; K223-S226 PolarHBondContact O-OG 3.36Å
227S61.5Low75.9Confident23 Ų2353.6 Ų53.616%0.16131%0.31CS..SBendtrans-83.3144.5-173.615.10000112.8K223 M224 S231K223-S227 WeakPolarHBondContact O-CB 3.37Å; K223-S227 PolarHBondContact O-N 2.99Å; K223-S227 PolarHBondContact O-OG 3.27Å; M224-S227 WeakPolarHBondContact CA-OG 3.36Å; M224-S227 PolarHBondContact O-OG 2.9Å; S227-S231 WeakPolarHBondContact CB-OG 3.47Å
228G53.8Low75.8Confident48 Ų4853.6 Ų53.650%0.49531%0.31SS..  trans-67.4167.5167.700000112.6S230 S231G228-S230 PolarHBondContact O-N 3.5Å; G228-S231 PolarHBondContact O-N 3.44Å; G228-S231 PolarHBondContact O-OG 3.34Å
229C49.7Very low75.7Confident109 Ų10950.3 Ų50.374%0.73630%0.295SS*.G310 helixtrans-53-32.8-168.6-157.10000115.2S231C229-S231 VanDerWaalsContact C-N 3.33Å; C229-S231 PolarHBondContact O-N 2.84Å
230S52.6Low75.5Confident113 Ų11352.9 Ų52.979%0.7931%0.307SS*.G310 helixtrans-71.7-22.7-179.549.30000114.3G228G228-S230 PolarHBondContact O-N 3.5Å
231S55.4Low75.4Confident30 Ų3057.5 Ų57.521%0.2133%0.328CS..G310 helixtrans-100.9-1.8-174.736.10000114.6S227 G228 C229 P234 F235S227-S231 WeakPolarHBondContact CB-OG 3.47Å; G228-S231 PolarHBondContact O-N 3.44Å; G228-S231 PolarHBondContact O-OG 3.34Å; C229-S231 VanDerWaalsContact C-N 3.33Å; C229-S231 PolarHBondContact O-N 2.84Å; S231-P234 WeakPolarHBondContact O-CD 3.48Å; S231-F235 WeakPolarHBondContact O-CD2 3.44Å
232V64.3Low75.6Confident23 Ų2357.4 Ų57.414%0.13933%0.327CS..Hα-helixtrans-69.8-35.9-178.5179.10000111.9M224 F235 A236M224-V232 HydrophobicContact CE-CG1 4.05Å; M224-V232 HydrophobicContact CG-CG1 4.04Å; V232-F235 PolarHBondContact O-N 2.94Å; V232-A236 WeakPolarHBondContact O-CB 3.48Å; V232-A236 PolarHBondContact O-N 3.02Å
233T74.6Confident75.8Confident84 Ų8452.2 Ų52.252%0.51530%0.303SS..Hα-helixtrans-63.4-48.8-171.6-420000114.2F235 A236 E237T233-F235 VanDerWaalsContact C-N 3.3Å; T233-F235 PolarHBondContact O-N 2.87Å; T233-A236 PolarHBondContact O-N 3.43Å; T233-E237 WeakPolarHBondContact O-CG 3.4Å; T233-E237 PolarHBondContact O-N 3.49Å
234P80.3Confident75.9Confident41 Ų4153.3 Ų53.327%0.26632%0.316SS..Hα-helixtrans-60-38.2179.2-23.334.3000113.1V183 S231 E237 L238V183-P234 HydrophobicContact CG1-CB 3.79Å; S231-P234 WeakPolarHBondContact O-CD 3.48Å; P234-E237 PolarHBondContact O-N 3.37Å; P234-L238 WeakPolarHBondContact O-CB 3.46Å; P234-L238 PolarHBondContact O-N 3.06Å
235F85.7Confident76.4Confident1 Ų154.2 Ų54.20%0.00432%0.322CS..Hα-helixtrans-74.1-35.6177.8-64-62.4000112.5L180 V183 E184 V220 K223 M224 S231 V232 T233 E237 L238 L239L180-F235 HydrophobicContact CD2-CE1 4.41Å; V183-F235 HydrophobicContact CB-CE1 4.17Å; V183-F235 HydrophobicContact CG1-CD1 4Å; V183-F235 HydrophobicContact CG1-CE1 3.75Å; V183-F235 HydrophobicContact CG1-CZ 4.3Å; E184-F235 HydrophobicContact CG-CE2 4.17Å; E184-F235 HydrophobicContact CG-CZ 3.67Å; V220-F235 HydrophobicContact CG1-CB 4.2Å; V220-F235 HydrophobicContact CG1-CD1 4.18Å; K223-F235 HydrophobicContact CB-CE1 4.39Å; K223-F235 HydrophobicContact CB-CE2 4.5Å; K223-F235 HydrophobicContact CB-CZ 4.36Å; K223-F235 HydrophobicContact CD-CZ 4.4Å; K223-F235 HydrophobicContact CG-CD1 4.38Å; K223-F235 HydrophobicContact CG-CD2 4.15Å; K223-F235 HydrophobicContact CG-CE1 3.81Å; K223-F235 HydrophobicContact CG-CE2 3.57Å; K223-F235 HydrophobicContact CG-CZ 3.37Å; M224-F235 HydrophobicContact CB-CB 4.21Å; S231-F235 WeakPolarHBondContact O-CD2 3.44Å; V232-F235 PolarHBondContact O-N 2.94Å; T233-F235 VanDerWaalsContact C-N 3.3Å; T233-F235 PolarHBondContact O-N 2.87Å; F235-E237 VanDerWaalsContact C-N 3.35Å; F235-L238 PolarHBondContact O-N 2.94Å; F235-L239 WeakPolarHBondContact O-CG 3.44Å; F235-L239 PolarHBondContact O-N 3.28Å
236A82.9Confident76.9Confident15 Ų1547.7 Ų47.712%0.12430%0.3CS..Hα-helixtrans-63-41.717200000111.5V232 T233 L239 L240V232-A236 WeakPolarHBondContact O-CB 3.48Å; V232-A236 PolarHBondContact O-N 3.02Å; T233-A236 PolarHBondContact O-N 3.43Å; A236-L239 PolarHBondContact O-N 3.3Å; A236-L240 WeakPolarHBondContact O-CG 3.47Å; A236-L240 PolarHBondContact O-N 3.27Å
237E84.7Confident77.4Confident109 Ų10943.9 Ų43.951%0.50927%0.274SS..Hα-helixtrans-63.9-39.5173.4-72.6-178.6-172.300112.5T233 P234 F235 L240 K241T233-E237 WeakPolarHBondContact O-CG 3.4Å; T233-E237 PolarHBondContact O-N 3.49Å; P234-E237 PolarHBondContact O-N 3.37Å; F235-E237 VanDerWaalsContact C-N 3.35Å; E237-L240 PolarHBondContact O-N 3.46Å; E237-K241 WeakPolarHBondContact O-CG 3.48Å; E237-K241 PolarHBondContact O-N 3.47Å; E237-K241 VanDerWaalsContact O-N 3.17Å
238L89.5Confident78.3Confident1 Ų147.2 Ų47.21%0.00529%0.287CS..Hα-helixtrans-62.3-46174.3-178.760.5000111.3L180 A193 F196 V197 V220 P234 F235 L240 K241 L242L180-L238 HydrophobicContact CD2-CD2 3.7Å; A193-L238 HydrophobicContact CB-CD1 3.85Å; F196-L238 HydrophobicContact CB-CD1 4.34Å; F196-L238 HydrophobicContact CD1-CD1 3.91Å; F196-L238 HydrophobicContact CD1-CD2 4.06Å; F196-L238 HydrophobicContact CD1-CG 4.31Å; F196-L238 HydrophobicContact CE1-CD2 4.26Å; F196-L238 HydrophobicContact CG-CD1 4.43Å; F196-L238 HydrophobicContact CG-CD2 4.49Å; V197-L238 HydrophobicContact CG2-CD1 3.77Å; V220-L238 HydrophobicContact CG1-CD2 4.07Å; V220-L238 HydrophobicContact CG1-CG 4.46Å; V220-L238 HydrophobicContact CG2-CD2 4.08Å; P234-L238 WeakPolarHBondContact O-CB 3.46Å; P234-L238 PolarHBondContact O-N 3.06Å; F235-L238 PolarHBondContact O-N 2.94Å; L238-L240 PolarHBondContact O-N 3.35Å; L238-K241 PolarHBondContact O-N 3.4Å; L238-K241 VanDerWaalsContact O-N 3.14Å; L238-L242 HydrophobicContact CG-CD1 4.21Å; L238-L242 WeakPolarHBondContact O-CG 3.44Å; L238-L242 PolarHBondContact O-N 2.94Å; L238-L242 VanDerWaalsContact O-N 3.08Å
239L90Very high79.8Confident0 Ų047 Ų470%027%0.274CS..Hα-helixtrans-60.8-42.6176-74.1170.6000111.5L217 V220 F221 M224 F235 A236 K241 L242 I243 F250 L272L217-L239 HydrophobicContact CD2-CD2 4.34Å; V220-L239 HydrophobicContact CB-CD2 3.94Å; V220-L239 HydrophobicContact CB-CG 4.38Å; V220-L239 HydrophobicContact CG1-CD1 4.15Å; V220-L239 HydrophobicContact CG1-CD2 3.72Å; V220-L239 HydrophobicContact CG1-CG 3.61Å; F221-L239 HydrophobicContact CD1-CD1 3.89Å; F221-L239 HydrophobicContact CD2-CD2 4.15Å; F221-L239 HydrophobicContact CE1-CD1 3.75Å; F221-L239 HydrophobicContact CE1-CD2 4.39Å; F221-L239 HydrophobicContact CE2-CD2 3.87Å; F221-L239 HydrophobicContact CG-CD1 4.41Å; F221-L239 HydrophobicContact CZ-CD1 4.15Å; F221-L239 HydrophobicContact CZ-CD2 4Å; M224-L239 HydrophobicContact SD-CD1 3.81Å; F235-L239 WeakPolarHBondContact O-CG 3.44Å; F235-L239 PolarHBondContact O-N 3.28Å; A236-L239 PolarHBondContact O-N 3.3Å; L239-K241 VanDerWaalsContact C-N 3.25Å; L239-K241 PolarHBondContact O-N 2.85Å; L239-L242 PolarHBondContact O-N 3.09Å; L239-I243 WeakPolarHBondContact O-CG1 3.33Å; L239-I243 PolarHBondContact O-N 3.08Å; L239-I243 VanDerWaalsContact O-N 3.09Å; L239-F250 HydrophobicContact CB-CE2 3.95Å; L239-F250 HydrophobicContact CB-CZ 4.08Å; L239-F250 HydrophobicContact CD2-CE2 3.79Å; L239-F250 HydrophobicContact CD2-CZ 4.36Å; L239-F250 HydrophobicContact CG-CE2 4.44Å; L239-L272 HydrophobicContact CB-CD1 3.89Å; L239-L272 HydrophobicContact CB-CD2 3.87Å; L239-L272 HydrophobicContact CD1-CD1 3.64Å; L239-L272 HydrophobicContact CG-CD1 4.41Å
240L87.1Confident81.7Confident82 Ų8241.9 Ų41.943%0.42924%0.239SC..Hα-helixtrans-55.2-40.7174-79.3171.5000112.2A236 E237 L238 L242 I243 P244 L272A236-L240 WeakPolarHBondContact O-CG 3.47Å; A236-L240 PolarHBondContact O-N 3.27Å; E237-L240 PolarHBondContact O-N 3.46Å; L238-L240 PolarHBondContact O-N 3.35Å; L240-L242 VanDerWaalsContact C-N 3.34Å; L240-I243 HydrophobicContact CD2-CD1 4.01Å; L240-P244 WeakPolarHBondContact O-CD 3.26Å; L240-L272 HydrophobicContact CB-CD2 4.36Å; L240-L272 HydrophobicContact CD2-CD2 3.66Å; L240-L272 HydrophobicContact CG-CD2 3.54Å
241K89.6Confident83.2Confident98 Ų9837.3 Ų37.343%0.42621%0.205SC..Hα-helixtrans-73.8-22.2177.6-66.8175.4-177.3175.10113.6V197 E237 L238 L239 P244V197-K241 HydrophobicContact CG1-CB 4.41Å; V197-K241 HydrophobicContact CG2-CB 3.64Å; V197-K241 HydrophobicContact CG2-CD 4.46Å; E237-K241 WeakPolarHBondContact O-CG 3.48Å; E237-K241 PolarHBondContact O-N 3.47Å; E237-K241 VanDerWaalsContact O-N 3.17Å; L238-K241 PolarHBondContact O-N 3.4Å; L238-K241 VanDerWaalsContact O-N 3.14Å; L239-K241 VanDerWaalsContact C-N 3.25Å; L239-K241 PolarHBondContact O-N 2.85Å; K241-P244 WeakPolarHBondContact O-CD 3.45Å
242L92.1Very high84.6Confident1 Ų137.3 Ų37.31%0.00521%0.208CC..Hα-helixtrans-83.6-21.8175.9-70.1166.8000113F196 V197 A200 W212 L217 V220 L238 L239 L240 V245F196-L242 HydrophobicContact CD1-CD1 4.27Å; F196-L242 HydrophobicContact CD1-CD2 4.34Å; F196-L242 HydrophobicContact CE1-CD1 3.87Å; F196-L242 HydrophobicContact CE1-CD2 4.4Å; V197-L242 HydrophobicContact CB-CD2 4.49Å; V197-L242 HydrophobicContact CG2-CD2 4.03Å; V197-L242 HydrophobicContact CG2-CG 4.2Å; A200-L242 HydrophobicContact CB-CD2 3.73Å; W212-L242 HydrophobicContact CH2-CD2 4.47Å; L217-L242 HydrophobicContact CD2-CB 4.27Å; L217-L242 HydrophobicContact CD2-CD1 4.27Å; V220-L242 HydrophobicContact CG2-CD1 4.43Å; L238-L242 HydrophobicContact CG-CD1 4.21Å; L238-L242 WeakPolarHBondContact O-CG 3.44Å; L238-L242 PolarHBondContact O-N 2.94Å; L238-L242 VanDerWaalsContact O-N 3.08Å; L239-L242 PolarHBondContact O-N 3.09Å; L240-L242 VanDerWaalsContact C-N 3.34Å; L242-V245 WeakPolarHBondContact O-CB 3.49Å; L242-V245 PolarHBondContact O-N 3.03Å; L242-V245 VanDerWaalsContact O-N 3.11Å
243I89.1Confident85.6Confident2 Ų236.5 Ų36.51%0.0120%0.202CC..THydrogen-bonded Turntrans-52.4-49.3178.3-68.4168.9000112.2L239 L240 V245 S246 P247 F250 L272 A276 I279L239-I243 WeakPolarHBondContact O-CG1 3.33Å; L239-I243 PolarHBondContact O-N 3.08Å; L239-I243 VanDerWaalsContact O-N 3.09Å; L240-I243 HydrophobicContact CD2-CD1 4.01Å; I243-V245 PolarHBondContact O-N 3.3Å; I243-S246 CarbonylContact O-C 3.27Å; I243-S246 PolarHBondContact O-N 3.11Å; I243-P247 WeakPolarHBondContact O-CA 3.46Å; I243-P247 WeakPolarHBondContact O-CD 3.3Å; I243-P247 VanDerWaalsContact O-CG 3.25Å; I243-P247 WeakPolarHBondContact O-CG 3.37Å; I243-F250 HydrophobicContact CD1-CE1 4.1Å; I243-F250 HydrophobicContact CD1-CZ 4.08Å; I243-F250 HydrophobicContact CG1-CD1 3.88Å; I243-F250 HydrophobicContact CG1-CD2 3.78Å; I243-F250 HydrophobicContact CG1-CE1 3.76Å; I243-F250 HydrophobicContact CG1-CE2 3.64Å; I243-F250 HydrophobicContact CG1-CG 3.9Å; I243-F250 HydrophobicContact CG1-CZ 3.64Å; I243-L272 HydrophobicContact CD1-CD2 4.3Å; I243-A276 HydrophobicContact CD1-CB 4.04Å; I243-A276 HydrophobicContact CG1-CB 4.07Å; I243-A276 HydrophobicContact CG2-CB 3.83Å; I243-I279 HydrophobicContact CG2-CD1 3.62Å
244P87Confident86.2Confident85 Ų8532.5 Ų32.555%0.55218%0.178SC*.THydrogen-bonded Turntrans-63.4-23.4-178.6-23.235.2000114.4L240 K241L240-P244 WeakPolarHBondContact O-CD 3.26Å; K241-P244 WeakPolarHBondContact O-CD 3.45Å
245V88.6Confident86.3Confident30 Ų3032 Ų3218%0.18218%0.178CC..THydrogen-bonded Turntrans-67.3-47.2-178.2-174.30000110.7V197 T201 M204 W212 L242 I243V197-V245 HydrophobicContact CG1-CG2 4.38Å; T201-V245 WeakPolarHBondContact OG1-CG2 3.45Å; M204-V245 HydrophobicContact CB-CG1 4.1Å; M204-V245 HydrophobicContact CG-CG1 4.41Å; W212-V245 HydrophobicContact CH2-CB 4.3Å; W212-V245 HydrophobicContact CH2-CG1 4.15Å; W212-V245 HydrophobicContact CZ2-CB 4.19Å; W212-V245 HydrophobicContact CZ2-CG1 3.59Å; L242-V245 WeakPolarHBondContact O-CB 3.49Å; L242-V245 PolarHBondContact O-N 3.03Å; L242-V245 VanDerWaalsContact O-N 3.11Å; I243-V245 PolarHBondContact O-N 3.3Å
246S84.8Confident86.2Confident17 Ų1739 Ų3912%0.11921%0.208CC..  trans-151.287.9171.7-173.80000111.1I243 E248 L249 F250I243-S246 CarbonylContact O-C 3.27Å; I243-S246 PolarHBondContact O-N 3.11Å; S246-E248 PolarHBondContact O-N 3.21Å; S246-L249 PolarHBondContact O-N 2.8Å; S246-L249 VanDerWaalsContact OG-CB 3.27Å; S246-L249 WeakPolarHBondContact OG-CB 3.36Å; S246-F250 VanDerWaalsContact O-CB 3.3Å; S246-F250 WeakPolarHBondContact O-CB 3.07Å; S246-F250 PolarHBondContact O-N 3.41Å
247P82.5Confident86.1Confident10 Ų1040.1 Ų40.17%0.06521%0.209CC..Hα-helixtrans-60.6-34.4-178.6-22.530.3000112.9I243 L251 I279I243-P247 WeakPolarHBondContact O-CA 3.46Å; I243-P247 WeakPolarHBondContact O-CD 3.3Å; I243-P247 VanDerWaalsContact O-CG 3.25Å; I243-P247 WeakPolarHBondContact O-CG 3.37Å; P247-L251 WeakPolarHBondContact O-CB 3.32Å; P247-L251 VanDerWaalsContact O-CG 3.29Å; P247-L251 WeakPolarHBondContact O-CG 3.49Å; P247-L251 PolarHBondContact O-N 2.91Å; P247-I279 HydrophobicContact CB-CG2 4.21Å; P247-I279 HydrophobicContact CG-CG2 3.74Å
248E79.6Confident85.7Confident93 Ų9335.5 Ų35.544%0.43519%0.188SC..Hα-helixtrans-69.9-47.8-177.5-62-176.3179.500111.9S246 F250 L251 A252S246-E248 PolarHBondContact O-N 3.21Å; E248-F250 VanDerWaalsContact C-N 3.34Å; E248-L251 PolarHBondContact O-N 3.03Å; E248-A252 PolarHBondContact O-N 2.92Å
249L85.7Confident84.3Confident44 Ų4444.8 Ų44.823%0.2322%0.224CC..Hα-helixtrans-67.1-39.5176.6-171.759.6000110.3W212 E213 L217 S246 L251 A252 I253W212-L249 HydrophobicContact CB-CD2 4.34Å; W212-L249 HydrophobicContact CD2-CD2 4.37Å; W212-L249 HydrophobicContact CE3-CD2 3.58Å; W212-L249 HydrophobicContact CZ3-CD2 4.28Å; E213-L249 HydrophobicContact CB-CD1 4.26Å; E213-L249 HydrophobicContact CB-CD2 4.09Å; E213-L249 HydrophobicContact CB-CG 4.15Å; L217-L249 HydrophobicContact CD1-CG 4.34Å; S246-L249 PolarHBondContact O-N 2.8Å; S246-L249 VanDerWaalsContact OG-CB 3.27Å; S246-L249 WeakPolarHBondContact OG-CB 3.36Å; L249-L251 PolarHBondContact O-N 3.31Å; L249-A252 PolarHBondContact O-N 3.45Å; L249-I253 HydrophobicContact CD1-CG1 4.36Å; L249-I253 WeakPolarHBondContact O-CB 3.45Å; L249-I253 VanDerWaalsContact O-CG1 3.24Å; L249-I253 WeakPolarHBondContact O-CG1 3.31Å; L249-I253 PolarHBondContact O-N 3.42Å
250F88.8Confident82.5Confident1 Ų147.8 Ų47.80%0.00424%0.244CC..Hα-helixtrans-57.1-49.9173.4-170.3-78.3000111.5L217 F221 L239 I243 S246 E248 A252 I253 A254 L272 A276L217-F250 HydrophobicContact CD1-CB 4.48Å; L217-F250 HydrophobicContact CD2-CD2 3.72Å; L217-F250 HydrophobicContact CD2-CE2 4.19Å; F221-F250 HydrophobicContact CE2-CE2 4.38Å; F221-F250 HydrophobicContact CZ-CE1 4.2Å; F221-F250 HydrophobicContact CZ-CE2 4.09Å; F221-F250 AromaticContact CZ-CZ 3.78Å; F221-F250 HydrophobicContact CZ-CZ 3.78Å; L239-F250 HydrophobicContact CB-CE2 3.95Å; L239-F250 HydrophobicContact CB-CZ 4.08Å; L239-F250 HydrophobicContact CD2-CE2 3.79Å; L239-F250 HydrophobicContact CD2-CZ 4.36Å; L239-F250 HydrophobicContact CG-CE2 4.44Å; I243-F250 HydrophobicContact CD1-CE1 4.1Å; I243-F250 HydrophobicContact CD1-CZ 4.08Å; I243-F250 HydrophobicContact CG1-CD1 3.88Å; I243-F250 HydrophobicContact CG1-CD2 3.78Å; I243-F250 HydrophobicContact CG1-CE1 3.76Å; I243-F250 HydrophobicContact CG1-CE2 3.64Å; I243-F250 HydrophobicContact CG1-CG 3.9Å; I243-F250 HydrophobicContact CG1-CZ 3.64Å; S246-F250 VanDerWaalsContact O-CB 3.3Å; S246-F250 WeakPolarHBondContact O-CB 3.07Å; S246-F250 PolarHBondContact O-N 3.41Å; E248-F250 VanDerWaalsContact C-N 3.34Å; F250-A252 PolarHBondContact O-N 3.32Å; F250-I253 PolarHBondContact O-N 2.95Å; F250-A254 HydrophobicContact CD1-CB 4.11Å; F250-A254 HydrophobicContact CE1-CB 3.96Å; F250-A254 WeakPolarHBondContact O-CB 3.23Å; F250-A254 PolarHBondContact O-N 3.23Å; F250-L272 HydrophobicContact CE1-CB 4.25Å; F250-L272 HydrophobicContact CZ-CB 4.15Å; F250-L272 HydrophobicContact CZ-CD2 4.4Å; F250-A276 HydrophobicContact CD1-CB 3.47Å; F250-A276 VanDerWaalsContact CD1-CB 3.47Å; F250-A276 HydrophobicContact CE1-CB 3.89Å; F250-A276 HydrophobicContact CG-CB 4.37Å
251L85.2Confident80.6Confident16 Ų1647.3 Ų47.38%0.08424%0.24CC..Hα-helixtrans-58.9-45.9178-81170.6000112.4P247 E248 L249 I253 A255 Y273 A276 A277P247-L251 WeakPolarHBondContact O-CB 3.32Å; P247-L251 VanDerWaalsContact O-CG 3.29Å; P247-L251 WeakPolarHBondContact O-CG 3.49Å; P247-L251 PolarHBondContact O-N 2.91Å; E248-L251 PolarHBondContact O-N 3.03Å; L249-L251 PolarHBondContact O-N 3.31Å; L251-I253 VanDerWaalsContact C-N 3.27Å; L251-I253 PolarHBondContact O-N 3.27Å; L251-A255 VanDerWaalsContact O-CB 3.31Å; L251-A255 WeakPolarHBondContact O-CB 3.35Å; L251-A255 PolarHBondContact O-N 2.88Å; L251-Y273 HydrophobicContact CD2-CD2 3.89Å; L251-Y273 HydrophobicContact CD2-CE1 4.41Å; L251-Y273 HydrophobicContact CD2-CE2 3.72Å; L251-Y273 HydrophobicContact CD2-CG 4.31Å; L251-A276 HydrophobicContact CD2-CB 3.84Å; L251-A276 HydrophobicContact CG-CB 3.95Å; L251-A277 HydrophobicContact CD2-CB 4.08Å
252A83.8Confident78.7Confident31 Ų3146 Ų4626%0.25626%0.255SS..Hα-helixtrans-63.5-33.4179.900000112.7E248 L249 F250E248-A252 PolarHBondContact O-N 2.92Å; L249-A252 PolarHBondContact O-N 3.45Å; F250-A252 PolarHBondContact O-N 3.32Å
253I86.8Confident76.5Confident5 Ų551 Ų513%0.02628%0.278CS..Hα-helixtrans-82.6-47.4178.6-62.5-61.6000111.2E213 L217 F221 L249 F250 L251 A255 K256 Y257E213-I253 HydrophobicContact CB-CD1 4.08Å; E213-I253 HydrophobicContact CB-CG1 3.94Å; E213-I253 HydrophobicContact CG-CD1 3.81Å; E213-I253 HydrophobicContact CG-CG1 4.25Å; L217-I253 HydrophobicContact CB-CG2 4.27Å; L217-I253 HydrophobicContact CD1-CB 4.23Å; L217-I253 HydrophobicContact CD1-CG1 4.19Å; F221-I253 HydrophobicContact CD2-CG2 3.94Å; F221-I253 HydrophobicContact CE2-CG2 3.94Å; L249-I253 HydrophobicContact CD1-CG1 4.36Å; L249-I253 WeakPolarHBondContact O-CB 3.45Å; L249-I253 VanDerWaalsContact O-CG1 3.24Å; L249-I253 WeakPolarHBondContact O-CG1 3.31Å; L249-I253 PolarHBondContact O-N 3.42Å; F250-I253 PolarHBondContact O-N 2.95Å; L251-I253 VanDerWaalsContact C-N 3.27Å; L251-I253 PolarHBondContact O-N 3.27Å; I253-A255 PolarHBondContact O-N 3.3Å; I253-K256 HydrophobicContact CD1-CD 4.42Å; I253-K256 VanDerWaalsContact O-CB 3.31Å; I253-K256 WeakPolarHBondContact O-CB 3.4Å; I253-K256 PolarHBondContact O-N 3.14Å; I253-Y257 HydrophobicContact CG2-CD2 4.16Å; I253-Y257 HydrophobicContact CG2-CE2 3.69Å; I253-Y257 VanDerWaalsContact O-CD2 3.25Å; I253-Y257 WeakPolarHBondContact O-CD2 3.46Å
254A86.4Confident74.5Confident0 Ų059.3 Ų59.30%031%0.309CS..Hα-helixtrans-56.6-36.3176.200000112.2F221 F250 K256 Y257 L258 Y273F221-A254 HydrophobicContact CE1-CB 4.38Å; F221-A254 HydrophobicContact CZ-CB 3.83Å; F250-A254 HydrophobicContact CD1-CB 4.11Å; F250-A254 HydrophobicContact CE1-CB 3.96Å; F250-A254 WeakPolarHBondContact O-CB 3.23Å; F250-A254 PolarHBondContact O-N 3.23Å; A254-K256 PolarHBondContact O-N 2.76Å; A254-Y257 PolarHBondContact O-N 2.98Å; A254-L258 PolarHBondContact O-N 3.36Å; A254-L258 VanDerWaalsContact O-N 3.16Å; A254-Y273 HydrophobicContact CB-CD2 3.92Å
255A82Confident73Confident32 Ų3257.2 Ų57.226%0.26430%0.303SS..Hα-helixtrans-55.4-35.1172.500000113.4L251 I253 Y257 L258 Y273L251-A255 VanDerWaalsContact O-CB 3.31Å; L251-A255 WeakPolarHBondContact O-CB 3.35Å; L251-A255 PolarHBondContact O-N 2.88Å; I253-A255 PolarHBondContact O-N 3.3Å; A255-Y257 VanDerWaalsContact C-N 3.28Å; A255-Y257 PolarHBondContact O-N 2.97Å; A255-L258 PolarHBondContact O-N 3.5Å; A255-Y273 HydrophobicContact CB-CE2 4.08Å
256K84Confident72.1Confident147 Ų14756.4 Ų56.464%0.63930%0.299SS*.Hα-helixtrans-71.8-23.2177.8-59.8177.4-177.8179.40112.6I253 A254I253-K256 HydrophobicContact CD1-CD 4.42Å; I253-K256 VanDerWaalsContact O-CB 3.31Å; I253-K256 WeakPolarHBondContact O-CB 3.4Å; I253-K256 PolarHBondContact O-N 3.14Å; A254-K256 PolarHBondContact O-N 2.76Å
257Y81.9Confident71.7Confident38 Ų3858.3 Ų58.315%0.14931%0.307CS..Hα-helixtrans-94.4-9.1179-68.3-83.1000113.7F221 I253 A254 A255F221-Y257 HydrophobicContact CB-CD1 4.03Å; F221-Y257 HydrophobicContact CB-CD2 3.88Å; F221-Y257 HydrophobicContact CB-CE1 3.69Å; F221-Y257 HydrophobicContact CB-CE2 3.53Å; F221-Y257 HydrophobicContact CB-CG 4.13Å; F221-Y257 VanDerWaalsContact CB-CZ 3.43Å; F221-Y257 AromaticContact CD1-CD2 3.94Å; F221-Y257 HydrophobicContact CD1-CD2 3.94Å; F221-Y257 HydrophobicContact CD1-CE2 4.4Å; F221-Y257 HydrophobicContact CD1-CG 4.08Å; F221-Y257 AromaticContact CD2-CD2 3.96Å; F221-Y257 HydrophobicContact CD2-CD2 3.96Å; F221-Y257 AromaticContact CD2-CE2 3.79Å; F221-Y257 HydrophobicContact CD2-CE2 3.79Å; F221-Y257 HydrophobicContact CE1-CD2 4.47Å; F221-Y257 HydrophobicContact CE2-CD2 4.49Å; F221-Y257 AromaticContact CG-CD2 3.67Å; F221-Y257 HydrophobicContact CG-CD2 3.67Å; F221-Y257 AromaticContact CG-CE2 3.67Å; F221-Y257 HydrophobicContact CG-CE2 3.67Å; F221-Y257 HydrophobicContact CG-CG 4.13Å; I253-Y257 HydrophobicContact CG2-CD2 4.16Å; I253-Y257 HydrophobicContact CG2-CE2 3.69Å; I253-Y257 VanDerWaalsContact O-CD2 3.25Å; I253-Y257 WeakPolarHBondContact O-CD2 3.46Å; A254-Y257 PolarHBondContact O-N 2.98Å; A255-Y257 VanDerWaalsContact C-N 3.28Å; A255-Y257 PolarHBondContact O-N 2.97Å
258L76.6Confident71.5Confident12 Ų1259.9 Ų59.96%0.06332%0.318CS..SBendtrans-75.1-25.8176.6-88.4159.3000113.7A254 A255 P260 M261 I269 I270 Y273 T296A254-L258 PolarHBondContact O-N 3.36Å; A254-L258 VanDerWaalsContact O-N 3.16Å; A255-L258 PolarHBondContact O-N 3.5Å; L258-P260 CarbonylContact O-C 3.56Å; L258-M261 HydrophobicContact CD2-CE 4.33Å; L258-M261 HydrophobicContact CD2-SD 3.93Å; L258-M261 PolarHBondContact O-N 3.26Å; L258-I269 HydrophobicContact CD2-CG2 4.44Å; L258-I269 HydrophobicContact CG-CG2 4.16Å; L258-I270 HydrophobicContact CD2-CB 4.42Å; L258-I270 HydrophobicContact CD2-CG1 3.45Å; L258-I270 VanDerWaalsContact CD2-CG1 3.45Å; L258-Y273 HydrophobicContact CD1-CD1 4.04Å; L258-Y273 HydrophobicContact CD1-CD2 3.4Å; L258-Y273 VanDerWaalsContact CD1-CD2 3.4Å; L258-Y273 HydrophobicContact CD1-CE1 4.37Å; L258-Y273 HydrophobicContact CD1-CE2 3.78Å; L258-Y273 HydrophobicContact CD1-CG 3.54Å; L258-T296 HydrophobicContact CD1-CG2 4.34Å
259Y59.8Low71.7Confident196 Ų19656.3 Ų56.377%0.76930%0.302SS*.PPolyproline II helixtrans-101.4127.3-173.1-161.2-97.6000112.1
260P51.4Low71.6Confident64 Ų6454.3 Ų54.342%0.41629%0.291SS..SBendcis-85.7135.14.9-2.421.3000113.8L258 G262L258-P260 CarbonylContact O-C 3.56Å; P260-G262 PolarHBondContact O-N 2.9Å
261M48.1Very low71.4Confident71 Ų7157.9 Ų57.935%0.3531%0.308SS..THydrogen-bonded Turntrans-58.9129.7172.3-73.1-76.7-130.800110.4L258 I270 T296 Q299L258-M261 HydrophobicContact CD2-CE 4.33Å; L258-M261 HydrophobicContact CD2-SD 3.93Å; L258-M261 PolarHBondContact O-N 3.26Å; M261-I270 HydrophobicContact CE-CD1 4.41Å; M261-I270 HydrophobicContact SD-CD1 3.94Å; M261-I270 HydrophobicContact SD-CG1 4.24Å; M261-T296 HydrophobicContact CE-CG2 4.21Å; M261-Q299 HydrophobicContact CE-CB 4.3Å
262G48.4Very low71.4Confident71 Ų7157.4 Ų57.473%0.73231%0.305SS*.THydrogen-bonded Turntrans114.9317500000116.6P260P260-G262 PolarHBondContact O-N 2.9Å
263Q45.9Very low71.5Confident107 Ų10756.1 Ų56.150%0.529%0.294SS..SBendtrans-84.7148.2170.2-69.5-169.1-13.400111.8G265 T266Q263-G265 PolarHBondContact O-N 2.92Å; Q263-T266 HydrophobicContact CB-CG2 4.44Å; Q263-T266 WeakPolarHBondContact O-CB 3.47Å; Q263-T266 VanDerWaalsContact O-CG2 3.31Å; Q263-T266 WeakPolarHBondContact O-CG2 3.43Å; Q263-T266 PolarHBondContact O-N 3.39Å; Q263-T266 VanDerWaalsContact O-N 3.15Å; Q263-T266 PolarHBondContact O-OG1 3.33Å
264R46.9Very low71.5Confident175 Ų17556.1 Ų56.166%0.6629%0.294SS*.THydrogen-bonded Turntrans-53.1131.8176.5-69.6-170.7-168.3-176.59.6110.5N1284 K1285 G1286R264-N1284 PolarHBondContact NH2-O 2.83Å; R264-K1285 VanDerWaalsContact NH2-N 3.2Å; R264-K1285 PolarHBondContact NH2-O 3.33Å; R264-G1286 VanDerWaalsContact CZ-N 3.31Å
265G56.9Low71.4Confident41 Ų4158.2 Ų58.242%0.42331%0.308SS..THydrogen-bonded Turntrans94.8-6.7-178.400000115.3Q263 D267Q263-G265 PolarHBondContact O-N 2.92Å; G265-D267 VanDerWaalsContact C-N 3.29Å; G265-D267 PolarHBondContact O-N 3.03Å
266T68.2Low71.4Confident14 Ų1456.7 Ų56.79%0.08630%0.296CS..Hα-helixtrans-65.5-29.7176.1500000113.1Q263 C268 I269 I270Q263-T266 HydrophobicContact CB-CG2 4.44Å; Q263-T266 WeakPolarHBondContact O-CB 3.47Å; Q263-T266 VanDerWaalsContact O-CG2 3.31Å; Q263-T266 WeakPolarHBondContact O-CG2 3.43Å; Q263-T266 PolarHBondContact O-N 3.39Å; Q263-T266 VanDerWaalsContact O-N 3.15Å; Q263-T266 PolarHBondContact O-OG1 3.33Å; T266-C268 PolarHBondContact O-N 2.93Å; T266-I269 CarbonylContact O-C 3.56Å; T266-I269 WeakPolarHBondContact O-CA 3.41Å; T266-I269 WeakPolarHBondContact O-CB 3.2Å; T266-I269 PolarHBondContact O-N 2.93Å; T266-I270 VanDerWaalsContact O-CG1 3.26Å; T266-I270 WeakPolarHBondContact O-CG1 3.25Å; T266-I270 PolarHBondContact O-N 3.07Å
267D76.2Confident71.4Confident57 Ų5749.7 Ų49.731%0.30527%0.265SS..Hα-helixtrans-57.3-44.6-179.3-80.131.6000112.8G265 I269 I270 Q271 H303 N305 I308G265-D267 VanDerWaalsContact C-N 3.29Å; G265-D267 PolarHBondContact O-N 3.03Å; D267-I269 VanDerWaalsContact C-N 3.32Å; D267-I269 PolarHBondContact O-N 3.4Å; D267-I270 PolarHBondContact O-N 3.43Å; D267-Q271 WeakPolarHBondContact O-CB 3.5Å; D267-Q271 WeakPolarHBondContact O-CG 3.34Å; D267-Q271 PolarHBondContact O-N 3.04Å; D267-H303 IonicContact OD1-CE1 3.12Å; D267-H303 IonicContact OD1-NE2 2.9Å; D267-H303 IonicContact OD2-CE1 3.34Å; D267-N305 PolarHBondContact OD2-ND2 3.35Å; D267-I308 HydrophobicContact CB-CD1 3.91Å
268C79.2Confident71.3Confident42 Ų4250.4 Ų50.428%0.28428%0.276SS..Hα-helixtrans-63.1-40.5175.9-66.90000111.2M224 T266 Q271 L272M224-C268 HydrophobicContact CE-CB 3.56Å; T266-C268 PolarHBondContact O-N 2.93Å; C268-Q271 PolarHBondContact O-N 3.42Å; C268-L272 WeakPolarHBondContact O-CB 3.46Å; C268-L272 WeakPolarHBondContact O-CG 3.43Å; C268-L272 PolarHBondContact O-N 3.49Å
269I82.9Confident71.3Confident18 Ų1853.1 Ų53.19%0.09229%0.29CS..Hα-helixtrans-67-39.7177.1-56.6178.3000110.5M224 L258 T266 D267 L272 Y273M224-I269 HydrophobicContact CE-CD1 4.17Å; M224-I269 HydrophobicContact CE-CG1 3.4Å; M224-I269 VanDerWaalsContact CE-CG1 3.4Å; M224-I269 HydrophobicContact SD-CG1 4.38Å; L258-I269 HydrophobicContact CD2-CG2 4.44Å; L258-I269 HydrophobicContact CG-CG2 4.16Å; T266-I269 CarbonylContact O-C 3.56Å; T266-I269 WeakPolarHBondContact O-CA 3.41Å; T266-I269 WeakPolarHBondContact O-CB 3.2Å; T266-I269 PolarHBondContact O-N 2.93Å; D267-I269 VanDerWaalsContact C-N 3.32Å; D267-I269 PolarHBondContact O-N 3.4Å; I269-L272 PolarHBondContact O-N 3.2Å; I269-Y273 VanDerWaalsContact O-CB 3.22Å; I269-Y273 WeakPolarHBondContact O-CB 3.5Å; I269-Y273 PolarHBondContact O-N 3.38Å
270I84.1Confident71.7Confident2 Ų244.3 Ų44.31%0.0126%0.259CS..Hα-helixtrans-62.6-46.8175-67.7163.3000109.9L258 M261 T266 D267 L272 Y273 L274 C300 I308L258-I270 HydrophobicContact CD2-CB 4.42Å; L258-I270 HydrophobicContact CD2-CG1 3.45Å; L258-I270 VanDerWaalsContact CD2-CG1 3.45Å; M261-I270 HydrophobicContact CE-CD1 4.41Å; M261-I270 HydrophobicContact SD-CD1 3.94Å; M261-I270 HydrophobicContact SD-CG1 4.24Å; T266-I270 VanDerWaalsContact O-CG1 3.26Å; T266-I270 WeakPolarHBondContact O-CG1 3.25Å; T266-I270 PolarHBondContact O-N 3.07Å; D267-I270 PolarHBondContact O-N 3.43Å; I270-L272 PolarHBondContact O-N 3.17Å; I270-Y273 WeakPolarHBondContact O-CB 3.48Å; I270-Y273 PolarHBondContact O-N 3.44Å; I270-L274 HydrophobicContact CG2-CD1 3.9Å; I270-L274 HydrophobicContact CG2-CG 4.23Å; I270-L274 WeakPolarHBondContact O-CB 3.25Å; I270-L274 VanDerWaalsContact O-CG 3.28Å; I270-L274 WeakPolarHBondContact O-CG 3.15Å; I270-L274 PolarHBondContact O-N 3.48Å; I270-C300 VanDerWaalsContact CG2-SG 3.58Å; I270-I308 HydrophobicContact CB-CD1 4.18Å; I270-I308 HydrophobicContact CG2-CD1 3.99Å; I270-I308 HydrophobicContact CG2-CG1 4.2Å; I270-I308 HydrophobicContact CG2-CG2 3.58Å
271Q85.1Confident72.3Confident77 Ų7743.3 Ų43.336%0.3625%0.247SC..Hα-helixtrans-62-43.2177-73.2177.4-3.400112.1D267 C268 Y273 L274 S275 I308D267-Q271 WeakPolarHBondContact O-CB 3.5Å; D267-Q271 WeakPolarHBondContact O-CG 3.34Å; D267-Q271 PolarHBondContact O-N 3.04Å; C268-Q271 PolarHBondContact O-N 3.42Å; Q271-Y273 VanDerWaalsContact C-N 3.35Å; Q271-L274 PolarHBondContact O-N 2.9Å; Q271-S275 VanDerWaalsContact O-CB 3.31Å; Q271-S275 WeakPolarHBondContact O-CB 3.44Å; Q271-S275 PolarHBondContact O-N 2.82Å; Q271-S275 PolarHBondContact O-OG 2.69Å; Q271-I308 HydrophobicContact CG-CD1 4.27Å; Q271-I308 HydrophobicContact CG-CG1 3.79Å
272L85.3Confident72.9Confident5 Ų546 Ų463%0.02626%0.259CS..Hα-helixtrans-61.2-43.8173.6-75.2169.4000111.4M224 L239 L240 I243 F250 C268 I269 I270 S275 A276M224-L272 HydrophobicContact SD-CD1 4.32Å; L239-L272 HydrophobicContact CB-CD1 3.89Å; L239-L272 HydrophobicContact CB-CD2 3.87Å; L239-L272 HydrophobicContact CD1-CD1 3.64Å; L239-L272 HydrophobicContact CG-CD1 4.41Å; L240-L272 HydrophobicContact CB-CD2 4.36Å; L240-L272 HydrophobicContact CD2-CD2 3.66Å; L240-L272 HydrophobicContact CG-CD2 3.54Å; I243-L272 HydrophobicContact CD1-CD2 4.3Å; F250-L272 HydrophobicContact CE1-CB 4.25Å; F250-L272 HydrophobicContact CZ-CB 4.15Å; F250-L272 HydrophobicContact CZ-CD2 4.4Å; C268-L272 WeakPolarHBondContact O-CB 3.46Å; C268-L272 WeakPolarHBondContact O-CG 3.43Å; C268-L272 PolarHBondContact O-N 3.49Å; I269-L272 PolarHBondContact O-N 3.2Å; I270-L272 PolarHBondContact O-N 3.17Å; L272-S275 PolarHBondContact O-N 3.49Å; L272-A276 WeakPolarHBondContact O-CB 3.35Å; L272-A276 PolarHBondContact O-N 2.97Å
273Y86.5Confident73.4Confident4 Ų451.6 Ų51.62%0.01626%0.257CS..Hα-helixtrans-63.8-46.3177.7-175.5-90000111.8L251 A254 A255 L258 I269 I270 Q271 S275 A276 A277 V293 T296L251-Y273 HydrophobicContact CD2-CD2 3.89Å; L251-Y273 HydrophobicContact CD2-CE1 4.41Å; L251-Y273 HydrophobicContact CD2-CE2 3.72Å; L251-Y273 HydrophobicContact CD2-CG 4.31Å; A254-Y273 HydrophobicContact CB-CD2 3.92Å; A255-Y273 HydrophobicContact CB-CE2 4.08Å; L258-Y273 HydrophobicContact CD1-CD1 4.04Å; L258-Y273 HydrophobicContact CD1-CD2 3.4Å; L258-Y273 VanDerWaalsContact CD1-CD2 3.4Å; L258-Y273 HydrophobicContact CD1-CE1 4.37Å; L258-Y273 HydrophobicContact CD1-CE2 3.78Å; L258-Y273 HydrophobicContact CD1-CG 3.54Å; I269-Y273 VanDerWaalsContact O-CB 3.22Å; I269-Y273 WeakPolarHBondContact O-CB 3.5Å; I269-Y273 PolarHBondContact O-N 3.38Å; I270-Y273 WeakPolarHBondContact O-CB 3.48Å; I270-Y273 PolarHBondContact O-N 3.44Å; Q271-Y273 VanDerWaalsContact C-N 3.35Å; Y273-S275 VanDerWaalsContact C-N 3.33Å; Y273-S275 PolarHBondContact O-N 3.41Å; Y273-A276 PolarHBondContact O-N 2.94Å; Y273-A277 VanDerWaalsContact O-CB 3.25Å; Y273-A277 WeakPolarHBondContact O-CB 3.3Å; Y273-A277 PolarHBondContact O-N 3.46Å; Y273-V293 HydrophobicContact CE1-CG2 4.22Å; Y273-V293 VanDerWaalsContact OH-CG2 3.29Å; Y273-V293 WeakPolarHBondContact OH-CG2 3.48Å; Y273-T296 HydrophobicContact CD1-CG2 3.85Å; Y273-T296 HydrophobicContact CE1-CG2 3.76Å
274L86.4Confident73.8Confident6 Ų655.1 Ų55.13%0.03127%0.266CS..Hα-helixtrans-65.3-36.7177.2-68.4177000111.6I270 Q271 A277 S278 V297 C300 I308 A311 A312I270-L274 HydrophobicContact CG2-CD1 3.9Å; I270-L274 HydrophobicContact CG2-CG 4.23Å; I270-L274 WeakPolarHBondContact O-CB 3.25Å; I270-L274 VanDerWaalsContact O-CG 3.28Å; I270-L274 WeakPolarHBondContact O-CG 3.15Å; I270-L274 PolarHBondContact O-N 3.48Å; Q271-L274 PolarHBondContact O-N 2.9Å; L274-A277 PolarHBondContact O-N 3.42Å; L274-S278 PolarHBondContact O-N 3.25Å; L274-V297 HydrophobicContact CD2-CG2 4Å; L274-C300 HydrophobicContact CD1-CB 4.45Å; L274-I308 HydrophobicContact CD1-CG2 4.03Å; L274-A311 HydrophobicContact CB-CB 4.43Å; L274-A311 HydrophobicContact CD1-CB 3.91Å; L274-A312 HydrophobicContact CD1-CB 4.46Å
275S83.5Confident73.9Confident43 Ų4352.3 Ų52.330%0.30126%0.255SS..Hα-helixtrans-64.9-47.7173.8-600000111.7Q271 L272 Y273 A277 S278 I279Q271-S275 VanDerWaalsContact O-CB 3.31Å; Q271-S275 WeakPolarHBondContact O-CB 3.44Å; Q271-S275 PolarHBondContact O-N 2.82Å; Q271-S275 PolarHBondContact O-OG 2.69Å; L272-S275 PolarHBondContact O-N 3.49Å; Y273-S275 VanDerWaalsContact C-N 3.33Å; Y273-S275 PolarHBondContact O-N 3.41Å; S275-A277 VanDerWaalsContact C-N 3.29Å; S275-A277 PolarHBondContact O-N 2.96Å; S275-S278 PolarHBondContact O-N 2.88Å; S275-S278 PolarHBondContact O-OG 3.43Å; S275-I279 PolarHBondContact O-N 3.28Å
276A82.8Confident73.7Confident0 Ų058.1 Ų58.10%028%0.277CS..Hα-helixtrans-62.5-38.5174.600000111.8I243 F250 L251 L272 Y273 S278 I279 G280I243-A276 HydrophobicContact CD1-CB 4.04Å; I243-A276 HydrophobicContact CG1-CB 4.07Å; I243-A276 HydrophobicContact CG2-CB 3.83Å; F250-A276 HydrophobicContact CD1-CB 3.47Å; F250-A276 VanDerWaalsContact CD1-CB 3.47Å; F250-A276 HydrophobicContact CE1-CB 3.89Å; F250-A276 HydrophobicContact CG-CB 4.37Å; L251-A276 HydrophobicContact CD2-CB 3.84Å; L251-A276 HydrophobicContact CG-CB 3.95Å; L272-A276 WeakPolarHBondContact O-CB 3.35Å; L272-A276 PolarHBondContact O-N 2.97Å; Y273-A276 PolarHBondContact O-N 2.94Å; A276-S278 VanDerWaalsContact C-N 3.35Å; A276-S278 PolarHBondContact O-N 3.22Å; A276-I279 PolarHBondContact O-N 2.91Å; A276-G280 PolarHBondContact O-N 3.37Å
277A82.7Confident73.3Confident0 Ų059.7 Ų59.70%029%0.285CS..Hα-helixtrans-61.9-44.3174.600000109.9L251 Y273 L274 S275 I279 G280 W281 V293 L315L251-A277 HydrophobicContact CD2-CB 4.08Å; Y273-A277 VanDerWaalsContact O-CB 3.25Å; Y273-A277 WeakPolarHBondContact O-CB 3.3Å; Y273-A277 PolarHBondContact O-N 3.46Å; L274-A277 PolarHBondContact O-N 3.42Å; S275-A277 VanDerWaalsContact C-N 3.29Å; S275-A277 PolarHBondContact O-N 2.96Å; A277-I279 PolarHBondContact O-N 3.46Å; A277-G280 PolarHBondContact O-N 3.43Å; A277-W281 WeakPolarHBondContact O-CA 3.4Å; A277-W281 WeakPolarHBondContact O-CB 3.44Å; A277-W281 PolarHBondContact O-N 3.42Å; A277-V293 HydrophobicContact CB-CG1 4.12Å; A277-L315 HydrophobicContact CB-CD1 3.9Å; A277-L315 HydrophobicContact CB-CD2 3.96Å
278S80.1Confident72.4Confident54 Ų5462.1 Ų62.138%0.37830%0.304SS..Hα-helixtrans-59.2-34.3179.278.40000113.7L274 S275 A276 L315L274-S278 PolarHBondContact O-N 3.25Å; S275-S278 PolarHBondContact O-N 2.88Å; S275-S278 PolarHBondContact O-OG 3.43Å; A276-S278 VanDerWaalsContact C-N 3.35Å; A276-S278 PolarHBondContact O-N 3.22Å; S278-L315 VanDerWaalsContact N-CD1 3.29Å
279I77Confident71.4Confident68 Ų6863 Ų6335%0.34931%0.305SS..Hα-helixtrans-81.3-44.7178.9-65.3165.9000111.1I243 P247 S275 A276 A277I243-I279 HydrophobicContact CG2-CD1 3.62Å; P247-I279 HydrophobicContact CB-CG2 4.21Å; P247-I279 HydrophobicContact CG-CG2 3.74Å; S275-I279 PolarHBondContact O-N 3.28Å; A276-I279 PolarHBondContact O-N 2.91Å; A277-I279 PolarHBondContact O-N 3.46Å
280G67.6Low70.5Confident11 Ų1163.5 Ų63.511%0.11331%0.311CS..Hα-helixtrans-81.4-35.6-174.900000114.6A276 A277 Q282 R283A276-G280 PolarHBondContact O-N 3.37Å; A277-G280 PolarHBondContact O-N 3.43Å; G280-Q282 VanDerWaalsContact C-N 3.27Å; G280-Q282 PolarHBondContact O-N 3.16Å; G280-R283 PolarHBondContact O-N 3.1Å
281W64.5Low69.8Low44 Ų4470.2 Ų70.217%0.16734%0.344CS..THydrogen-bonded Turntrans-62.7-32.9-177.2-176.6-89.6000112.6A277 R283 V293 V294A277-W281 WeakPolarHBondContact O-CA 3.4Å; A277-W281 WeakPolarHBondContact O-CB 3.44Å; A277-W281 PolarHBondContact O-N 3.42Å; W281-R283 PolarHBondContact O-N 3.01Å; W281-V293 HydrophobicContact CD2-CG1 4.43Å; W281-V293 HydrophobicContact CE3-CB 3.86Å; W281-V293 HydrophobicContact CE3-CG1 3.47Å; W281-V293 VanDerWaalsContact CE3-CG1 3.47Å; W281-V293 HydrophobicContact CE3-CG2 4.26Å; W281-V293 HydrophobicContact CH2-CG1 4.47Å; W281-V293 HydrophobicContact CZ3-CB 3.57Å; W281-V293 HydrophobicContact CZ3-CG1 3.51Å; W281-V293 HydrophobicContact CZ3-CG2 4.32Å; W281-V294 HydrophobicContact CH2-CG2 3.62Å; W281-V294 HydrophobicContact CZ2-CG2 4.49Å; W281-V294 HydrophobicContact CZ3-CG2 4.34Å
282Q60.6Low69.2Low128 Ų12872.9 Ų72.960%0.59835%0.354SS*.THydrogen-bonded Turntrans-61.9-22.9175.3-67.8-176.9-4.300112.7G280G280-Q282 VanDerWaalsContact C-N 3.27Å; G280-Q282 PolarHBondContact O-N 3.16Å
283R59.2Low68.8Low187 Ų18773 Ų7371%0.70636%0.355SS*.THydrogen-bonded Turntrans-89.4-31.9-173-70.3-175.7175.8176.10.1115G280 W281G280-R283 PolarHBondContact O-N 3.1Å; W281-R283 PolarHBondContact O-N 3.01Å
284R53.1Low68.3Low182 Ų18275.1 Ų75.169%0.68737%0.369SS*.  trans-156.4121179.7-70.1-168.3176.51800.2114.6
285R49.1Very low67.9Low115 Ų11578 Ų7843%0.43439%0.388SS..SBendtrans-86.4-25.2174.8-152.8175179.6172.1-4.9114.6N287 S290 E327R285-N287 VanDerWaalsContact C-N 3.27Å; R285-N287 PolarHBondContact O-N 3.03Å; R285-S290 PolarHBondContact O-OG 3.37Å; R285-E327 IonicContact CZ-OE1 3.56Å; R285-E327 IonicContact NH1-OE1 3.97Å; R285-E327 IonicContact NH2-OE1 3.87Å; R285-E327 PolarHBondContact NH2-OE1 3.34Å; R285-E327 IonicContact NH2-OE2 3.02Å
286N53Low67.8Low164 Ų16476.7 Ų76.788%0.87738%0.378SS*.SBendtrans-86.213.6-174.2-65.9-0.8000114.2
287N61.2Low67.7Low46 Ų4676.9 Ų76.925%0.24638%0.379CS..SBendtrans-85.9135.4179-171.1-33000109.7R285 L289 S290R285-N287 VanDerWaalsContact C-N 3.27Å; R285-N287 PolarHBondContact O-N 3.03Å; N287-L289 PolarHBondContact O-N 3.09Å; N287-L289 VanDerWaalsContact O-N 3.1Å; N287-L289 PolarHBondContact OD1-N 2.9Å; N287-S290 WeakPolarHBondContact O-CB 3.12Å; N287-S290 PolarHBondContact O-N 2.97Å; N287-S290 PolarHBondContact O-OG 3.14Å
288P56.3Low67.7Low109 Ų10979.7 Ų79.771%0.70840%0.395SS*.THydrogen-bonded Turntrans-52.5-26.6172.317-30.4000114.4S290 M291P288-S290 PolarHBondContact O-N 3.05Å; P288-S290 VanDerWaalsContact O-N 3.15Å; P288-M291 PolarHBondContact O-N 2.98Å
289L57.3Low67.7Low59 Ų5982.8 Ų82.831%0.30940%0.403SS..Hα-helixtrans-60.1-20.6171.8-68.8171.8000113.5N287 M291 F292 V293N287-L289 PolarHBondContact O-N 3.09Å; N287-L289 VanDerWaalsContact O-N 3.1Å; N287-L289 PolarHBondContact OD1-N 2.9Å; L289-M291 VanDerWaalsContact C-N 3.25Å; L289-M291 PolarHBondContact O-N 3.04Å; L289-F292 PolarHBondContact O-N 2.91Å; L289-V293 PolarHBondContact O-N 3.42Å
290S65.6Low68.1Low30 Ų3079.6 Ų79.621%0.2139%0.387CS..Hα-helixtrans-61.3-34.217863.80000112.6R285 N287 P288 V293 V294R285-S290 PolarHBondContact O-OG 3.37Å; N287-S290 WeakPolarHBondContact O-CB 3.12Å; N287-S290 PolarHBondContact O-N 2.97Å; N287-S290 PolarHBondContact O-OG 3.14Å; P288-S290 PolarHBondContact O-N 3.05Å; P288-S290 VanDerWaalsContact O-N 3.15Å; S290-V293 PolarHBondContact O-N 2.91Å; S290-V294 VanDerWaalsContact O-CG2 3.3Å; S290-V294 WeakPolarHBondContact O-CG2 3.18Å; S290-V294 PolarHBondContact O-N 3.23Å
291M69.6Low68.9Low142 Ų14279.3 Ų79.370%0.738%0.383SS*.Hα-helixtrans-65.8-43179-166.5170.3-133.200111.2P288 L289 V294 C295P288-M291 PolarHBondContact O-N 2.98Å; L289-M291 VanDerWaalsContact C-N 3.25Å; L289-M291 PolarHBondContact O-N 3.04Å; M291-V294 PolarHBondContact O-N 3.16Å; M291-C295 PolarHBondContact O-N 2.87Å; M291-C295 PolarHBondContact O-SG 3.18Å
292F71.3Confident69.7Low134 Ų13480.8 Ų80.859%0.58839%0.393SS*.Hα-helixtrans-61.7-45.4175.3-80.7-82.6000111.9L289 V294 C295 T296L289-F292 PolarHBondContact O-N 2.91Å; F292-V294 VanDerWaalsContact C-N 3.34Å; F292-V294 PolarHBondContact O-N 3.06Å; F292-C295 PolarHBondContact O-N 3.44Å; F292-T296 PolarHBondContact O-N 3.35Å; F292-T296 PolarHBondContact O-OG1 2.89Å
293V76.5Confident70.6Confident6 Ų676.8 Ų76.84%0.03638%0.375CS..Hα-helixtrans-61.6-43.2177.3173.40000110.8Y273 A277 W281 L289 S290 C295 T296 V297 L315Y273-V293 HydrophobicContact CE1-CG2 4.22Å; Y273-V293 VanDerWaalsContact OH-CG2 3.29Å; Y273-V293 WeakPolarHBondContact OH-CG2 3.48Å; A277-V293 HydrophobicContact CB-CG1 4.12Å; W281-V293 HydrophobicContact CD2-CG1 4.43Å; W281-V293 HydrophobicContact CE3-CB 3.86Å; W281-V293 HydrophobicContact CE3-CG1 3.47Å; W281-V293 VanDerWaalsContact CE3-CG1 3.47Å; W281-V293 HydrophobicContact CE3-CG2 4.26Å; W281-V293 HydrophobicContact CH2-CG1 4.47Å; W281-V293 HydrophobicContact CZ3-CB 3.57Å; W281-V293 HydrophobicContact CZ3-CG1 3.51Å; W281-V293 HydrophobicContact CZ3-CG2 4.32Å; L289-V293 PolarHBondContact O-N 3.42Å; S290-V293 PolarHBondContact O-N 2.91Å; V293-C295 PolarHBondContact O-N 3.33Å; V293-T296 PolarHBondContact O-N 3.4Å; V293-V297 HydrophobicContact CG1-CG2 4.2Å; V293-V297 WeakPolarHBondContact O-CB 3.42Å; V293-V297 VanDerWaalsContact O-CG2 3.3Å; V293-V297 WeakPolarHBondContact O-CG2 3.48Å; V293-V297 PolarHBondContact O-N 3.13Å; V293-L315 HydrophobicContact CG1-CD2 3.68Å
294V75.9Confident71.1Confident50 Ų5075 Ų7530%0.30337%0.374SS..Hα-helixtrans-61-43.6176.5173.20000111.4W281 S290 M291 F292 V297 N298W281-V294 HydrophobicContact CH2-CG2 3.62Å; W281-V294 HydrophobicContact CZ2-CG2 4.49Å; W281-V294 HydrophobicContact CZ3-CG2 4.34Å; S290-V294 VanDerWaalsContact O-CG2 3.3Å; S290-V294 WeakPolarHBondContact O-CG2 3.18Å; S290-V294 PolarHBondContact O-N 3.23Å; M291-V294 PolarHBondContact O-N 3.16Å; F292-V294 VanDerWaalsContact C-N 3.34Å; F292-V294 PolarHBondContact O-N 3.06Å; V294-V297 PolarHBondContact O-N 3.48Å; V294-N298 WeakPolarHBondContact O-CB 3.37Å; V294-N298 PolarHBondContact O-N 3.4Å; V294-N298 PolarHBondContact O-ND2 3.04Å
295C79.8Confident72.2Confident65 Ų6568.5 Ų68.544%0.43935%0.353SS..Hα-helixtrans-61.1-47.3176-710000111.9M291 F292 V293 N298 Q299M291-C295 PolarHBondContact O-N 2.87Å; M291-C295 PolarHBondContact O-SG 3.18Å; F292-C295 PolarHBondContact O-N 3.44Å; V293-C295 PolarHBondContact O-N 3.33Å; C295-N298 PolarHBondContact O-N 3Å; C295-Q299 WeakPolarHBondContact O-CG 3.47Å; C295-Q299 PolarHBondContact O-N 3.1Å; C295-Q299 VanDerWaalsContact O-N 3.17Å
296T80.1Confident73.7Confident16 Ų1663.9 Ų63.910%0.09834%0.338CS..Hα-helixtrans-62.6-46177.7-55.70000111.4L258 M261 Y273 F292 V293 N298 Q299 C300L258-T296 HydrophobicContact CD1-CG2 4.34Å; M261-T296 HydrophobicContact CE-CG2 4.21Å; Y273-T296 HydrophobicContact CD1-CG2 3.85Å; Y273-T296 HydrophobicContact CE1-CG2 3.76Å; F292-T296 PolarHBondContact O-N 3.35Å; F292-T296 PolarHBondContact O-OG1 2.89Å; V293-T296 PolarHBondContact O-N 3.4Å; T296-N298 VanDerWaalsContact C-N 3.32Å; T296-N298 PolarHBondContact O-N 3Å; T296-Q299 PolarHBondContact O-N 3.36Å; T296-C300 WeakPolarHBondContact O-CB 3.1Å; T296-C300 PolarHBondContact O-N 3.27Å; T296-C300 PolarHBondContact O-SG 3.35Å
297V81.7Confident75.3Confident4 Ų460 Ų602%0.02432%0.315CS..Hα-helixtrans-59.1-43.6176.8164.70000111.3L274 V293 V294 Q299 C300 L301 A312 L315 M316L274-V297 HydrophobicContact CD2-CG2 4Å; V293-V297 HydrophobicContact CG1-CG2 4.2Å; V293-V297 WeakPolarHBondContact O-CB 3.42Å; V293-V297 VanDerWaalsContact O-CG2 3.3Å; V293-V297 WeakPolarHBondContact O-CG2 3.48Å; V293-V297 PolarHBondContact O-N 3.13Å; V294-V297 PolarHBondContact O-N 3.48Å; V297-Q299 VanDerWaalsContact C-N 3.3Å; V297-Q299 PolarHBondContact O-N 3.29Å; V297-C300 CarbonylContact O-C 3.02Å; V297-C300 WeakPolarHBondContact O-CA 3.46Å; V297-C300 PolarHBondContact O-N 3.39Å; V297-L301 WeakPolarHBondContact O-CG 3.41Å; V297-L301 PolarHBondContact O-N 3.31Å; V297-A312 HydrophobicContact CG1-CB 4.14Å; V297-L315 HydrophobicContact CG2-CD2 3.44Å; V297-L315 VanDerWaalsContact CG2-CD2 3.44Å; V297-M316 HydrophobicContact CG1-CG 3.51Å; V297-M316 HydrophobicContact CG1-SD 3.37Å; V297-M316 WeakPolarHBondContact CG1-SD 3.45Å
298N81.3Confident76.5Confident60 Ų6057.8 Ų57.832%0.32130%0.303SS..Hα-helixtrans-60.4-39.7178.2-74.1-16.2000112.8V294 C295 T296 C300 R333V294-N298 WeakPolarHBondContact O-CB 3.37Å; V294-N298 PolarHBondContact O-N 3.4Å; V294-N298 PolarHBondContact O-ND2 3.04Å; C295-N298 PolarHBondContact O-N 3Å; T296-N298 VanDerWaalsContact C-N 3.32Å; T296-N298 PolarHBondContact O-N 3Å; N298-C300 VanDerWaalsContact C-N 3.3Å; N298-R333 PolarHBondContact ND2-NH1 3.36Å; N298-R333 WeakPolarHBondContact OD1-CD 3.37Å; N298-R333 PolarHBondContact OD1-NH1 3.32Å
299Q81.6Confident77.9Confident119 Ų11952.6 Ų52.656%0.55627%0.269SS*.Hα-helixtrans-68.1-32.5174.3-68.1175-8.800111.8M261 C295 T296 V297M261-Q299 HydrophobicContact CE-CB 4.3Å; C295-Q299 WeakPolarHBondContact O-CG 3.47Å; C295-Q299 PolarHBondContact O-N 3.1Å; C295-Q299 VanDerWaalsContact O-N 3.17Å; T296-Q299 PolarHBondContact O-N 3.36Å; V297-Q299 VanDerWaalsContact C-N 3.3Å; V297-Q299 PolarHBondContact O-N 3.29Å
300C85.8Confident79.6Confident0 Ų049.9 Ų49.90%026%0.255CS..Hα-helixtrans-79.5-23.9-178.4-65.50000114.1I270 L274 T296 V297 N298 L302 H303 I308 A309 A312I270-C300 VanDerWaalsContact CG2-SG 3.58Å; L274-C300 HydrophobicContact CD1-CB 4.45Å; T296-C300 WeakPolarHBondContact O-CB 3.1Å; T296-C300 PolarHBondContact O-N 3.27Å; T296-C300 PolarHBondContact O-SG 3.35Å; V297-C300 CarbonylContact O-C 3.02Å; V297-C300 WeakPolarHBondContact O-CA 3.46Å; V297-C300 PolarHBondContact O-N 3.39Å; N298-C300 VanDerWaalsContact C-N 3.3Å; C300-L302 PolarHBondContact O-N 3.05Å; C300-L302 VanDerWaalsContact O-N 3.17Å; C300-H303 WeakPolarHBondContact O-CB 3.47Å; C300-H303 PolarHBondContact O-N 3.24Å; C300-I308 HydrophobicContact CB-CG2 3.76Å; C300-A309 VanDerWaalsContact O-CA 3.28Å; C300-A309 WeakPolarHBondContact O-CA 3.26Å; C300-A312 HydrophobicContact CB-CB 3.6Å
301L83.1Confident80.7Confident6 Ų650 Ų503%0.03126%0.258CS..THydrogen-bonded Turntrans-58-29.9-178.9-77.1174.2000113.8V297 A312 L313 M316 R333 F337 N341V297-L301 WeakPolarHBondContact O-CG 3.41Å; V297-L301 PolarHBondContact O-N 3.31Å; L301-A312 HydrophobicContact CD2-CB 4.21Å; L301-L313 HydrophobicContact CD2-CB 4.12Å; L301-L313 HydrophobicContact CD2-CD1 4.26Å; L301-M316 HydrophobicContact CD1-CE 4.25Å; L301-M316 HydrophobicContact CD1-SD 3.72Å; L301-M316 HydrophobicContact CD2-SD 3.85Å; L301-M316 HydrophobicContact CG-SD 4.1Å; L301-R333 HydrophobicContact CD1-CB 3.94Å; L301-R333 HydrophobicContact CD1-CG 4.12Å; L301-F337 HydrophobicContact CB-CD2 4.32Å; L301-F337 HydrophobicContact CD2-CD2 3.89Å; L301-F337 WeakPolarHBondContact O-CD2 3.5Å; L301-F337 WeakPolarHBondContact O-CE2 3.28Å; L301-N341 PolarHBondContact O-ND2 3.5Å
302L81.1Confident81.6Confident74 Ų7443.2 Ų43.239%0.38722%0.224SC..THydrogen-bonded Turntrans-111.322.7179.3-54.4-178.6000111.5C300 L336 F340C300-L302 PolarHBondContact O-N 3.05Å; C300-L302 VanDerWaalsContact O-N 3.17Å; L302-L336 HydrophobicContact CD1-CD2 4.15Å; L302-L336 HydrophobicContact CD1-CG 4.43Å; L302-L336 HydrophobicContact CD2-CG 4.43Å; L302-F340 HydrophobicContact CD1-CD2 4.34Å; L302-F340 HydrophobicContact CD1-CE2 4.38Å; L302-F340 HydrophobicContact CD2-CB 3.79Å; L302-F340 HydrophobicContact CD2-CD2 3.74Å; L302-F340 HydrophobicContact CD2-CG 3.83Å
303H79.3Confident82.6Confident45 Ų4536.8 Ų36.821%0.20820%0.196CC..  trans-68142.2179.5-161-90.2000110.7D267 C300 N305 I308D267-H303 IonicContact OD1-CE1 3.12Å; D267-H303 IonicContact OD1-NE2 2.9Å; D267-H303 IonicContact OD2-CE1 3.34Å; C300-H303 WeakPolarHBondContact O-CB 3.47Å; C300-H303 PolarHBondContact O-N 3.24Å; H303-N305 WeakPolarHBondContact ND1-CB 3.42Å; H303-N305 PolarHBondContact ND1-N 3.37Å; H303-N305 VanDerWaalsContact ND1-N 3.13Å; H303-N305 PolarHBondContact O-N 2.99Å; H303-I308 HydrophobicContact CB-CB 4.21Å; H303-I308 HydrophobicContact CB-CG2 3.74Å
304Q69.5Low83.2Confident148 Ų14840.9 Ų40.969%0.69221%0.211SC*.SBendtrans-61.7-31.4179.9-65.3179.3-4.500112.6C306Q304-C306 PolarHBondContact O-N 2.95Å
305N76.7Confident83.7Confident46 Ų4639.2 Ų39.225%0.24620%0.2CC..SBendtrans-77.5109172.4-170.4-28000110.6D267 H303 Q307 I308 A309D267-N305 PolarHBondContact OD2-ND2 3.35Å; H303-N305 WeakPolarHBondContact ND1-CB 3.42Å; H303-N305 PolarHBondContact ND1-N 3.37Å; H303-N305 VanDerWaalsContact ND1-N 3.13Å; H303-N305 PolarHBondContact O-N 2.99Å; N305-Q307 PolarHBondContact O-N 3.32Å; N305-Q307 VanDerWaalsContact O-N 3.16Å; N305-Q307 WeakPolarHBondContact OD1-CB 3.49Å; N305-Q307 PolarHBondContact OD1-N 2.8Å; N305-I308 HydrophobicContact CB-CB 4.26Å; N305-I308 HydrophobicContact CB-CD1 4.03Å; N305-I308 HydrophobicContact CB-CG1 4.19Å; N305-I308 WeakPolarHBondContact O-CB 3.45Å; N305-I308 PolarHBondContact O-N 3.43Å; N305-A309 PolarHBondContact O-N 3.21Å
306C80.9Confident83.8Confident18 Ų1837 Ų3712%0.12218%0.184CC..Hα-helixtrans-55.4-32.7-179.965.70000112.9Q304 I308 A309 I310 E344 F349Q304-C306 PolarHBondContact O-N 2.95Å; C306-I308 PolarHBondContact O-N 3.2Å; C306-A309 PolarHBondContact O-N 3.02Å; C306-I310 WeakPolarHBondContact O-CB 3.16Å; C306-I310 WeakPolarHBondContact O-CG2 3.49Å; C306-I310 PolarHBondContact O-N 3.3Å; C306-E344 HydrophobicContact CB-CG 4.43Å; C306-F349 HydrophobicContact CB-CD2 3.76Å; C306-F349 HydrophobicContact CB-CE2 3.64Å; C306-F349 HydrophobicContact CB-CG 4.45Å; C306-F349 HydrophobicContact CB-CZ 4.23Å; C306-F349 VanDerWaalsContact O-CE2 3.32Å; C306-F349 WeakPolarHBondContact O-CE2 3.35Å
307Q86Confident84Confident83 Ų8336.4 Ų36.439%0.38818%0.18SC..Hα-helixtrans-67.9-35.6177.8-63.6-61.8-36.600112.5N305 I310 A311N305-Q307 PolarHBondContact O-N 3.32Å; N305-Q307 VanDerWaalsContact O-N 3.16Å; N305-Q307 WeakPolarHBondContact OD1-CB 3.49Å; N305-Q307 PolarHBondContact OD1-N 2.8Å; Q307-I310 WeakPolarHBondContact O-CG2 3.42Å; Q307-A311 WeakPolarHBondContact O-CB 3.42Å; Q307-A311 PolarHBondContact O-N 3.35Å; Q307-A311 VanDerWaalsContact O-N 3.1Å
308I86.3Confident84Confident0 Ų039.2 Ų39.20%020%0.195CC..Hα-helixtrans-71.6-44.6174.6-69.8175.4000109.8D267 I270 Q271 L274 C300 H303 N305 C306 I310 A311 A312D267-I308 HydrophobicContact CB-CD1 3.91Å; I270-I308 HydrophobicContact CB-CD1 4.18Å; I270-I308 HydrophobicContact CG2-CD1 3.99Å; I270-I308 HydrophobicContact CG2-CG1 4.2Å; I270-I308 HydrophobicContact CG2-CG2 3.58Å; Q271-I308 HydrophobicContact CG-CD1 4.27Å; Q271-I308 HydrophobicContact CG-CG1 3.79Å; L274-I308 HydrophobicContact CD1-CG2 4.03Å; C300-I308 HydrophobicContact CB-CG2 3.76Å; H303-I308 HydrophobicContact CB-CB 4.21Å; H303-I308 HydrophobicContact CB-CG2 3.74Å; N305-I308 HydrophobicContact CB-CB 4.26Å; N305-I308 HydrophobicContact CB-CD1 4.03Å; N305-I308 HydrophobicContact CB-CG1 4.19Å; N305-I308 WeakPolarHBondContact O-CB 3.45Å; N305-I308 PolarHBondContact O-N 3.43Å; C306-I308 PolarHBondContact O-N 3.2Å; I308-I310 PolarHBondContact O-N 3.18Å; I308-A311 PolarHBondContact O-N 2.96Å; I308-A312 WeakPolarHBondContact O-CB 3.29Å; I308-A312 PolarHBondContact O-N 3.45Å
309A87.6Confident83.6Confident0 Ų038.1 Ų38.10%019%0.188CC..Hα-helixtrans-59.8-46.5178.900000112.1C300 N305 C306 A312 L313 F337C300-A309 VanDerWaalsContact O-CA 3.28Å; C300-A309 WeakPolarHBondContact O-CA 3.26Å; N305-A309 PolarHBondContact O-N 3.21Å; C306-A309 PolarHBondContact O-N 3.02Å; A309-A312 PolarHBondContact O-N 3.24Å; A309-L313 PolarHBondContact O-N 3.45Å; A309-F337 HydrophobicContact CB-CE2 3.89Å; A309-F337 HydrophobicContact CB-CZ 4.44Å; A309-F337 WeakPolarHBondContact O-CE2 3.36Å
310I91.4Very high83Confident1 Ų137 Ų371%0.00519%0.191CC..Hα-helixtrans-71.2-35.4178.7-161.761.5000112.7C306 Q307 I308 A312 L313 R314 F337 F349 D352 I353C306-I310 WeakPolarHBondContact O-CB 3.16Å; C306-I310 WeakPolarHBondContact O-CG2 3.49Å; C306-I310 PolarHBondContact O-N 3.3Å; Q307-I310 WeakPolarHBondContact O-CG2 3.42Å; I308-I310 PolarHBondContact O-N 3.18Å; I310-A312 VanDerWaalsContact C-N 3.32Å; I310-A312 PolarHBondContact O-N 2.98Å; I310-L313 HydrophobicContact CD1-CD2 4.15Å; I310-L313 PolarHBondContact O-N 3.33Å; I310-R314 WeakPolarHBondContact O-CB 3.33Å; I310-R314 VanDerWaalsContact O-CG 3.28Å; I310-R314 WeakPolarHBondContact O-CG 3.45Å; I310-R314 PolarHBondContact O-N 3.39Å; I310-F337 HydrophobicContact CD1-CZ 4.44Å; I310-F349 HydrophobicContact CB-CD2 4.17Å; I310-F349 HydrophobicContact CB-CE2 3.79Å; I310-F349 HydrophobicContact CD1-CE2 4.42Å; I310-F349 HydrophobicContact CG1-CE2 4.43Å; I310-D352 HydrophobicContact CD1-CB 3.7Å; I310-D352 HydrophobicContact CG1-CB 3.53Å; I310-I353 HydrophobicContact CD1-CG1 4.21Å
311A88.7Confident82.6Confident32 Ų3244 Ų4426%0.26422%0.222SC..Hα-helixtrans-63.1-41174.500000111.2L274 Q307 I308 R314 L315L274-A311 HydrophobicContact CB-CB 4.43Å; L274-A311 HydrophobicContact CD1-CB 3.91Å; Q307-A311 WeakPolarHBondContact O-CB 3.42Å; Q307-A311 PolarHBondContact O-N 3.35Å; Q307-A311 VanDerWaalsContact O-N 3.1Å; I308-A311 PolarHBondContact O-N 2.96Å; A311-R314 PolarHBondContact O-N 2.84Å; A311-L315 PolarHBondContact O-N 3.44Å
312A89.7Confident82.2Confident0 Ų048.1 Ų48.10%024%0.239CC..Hα-helixtrans-62.3-45.4173.600000111.8L274 V297 C300 L301 I308 A309 I310 L315 M316L274-A312 HydrophobicContact CD1-CB 4.46Å; V297-A312 HydrophobicContact CG1-CB 4.14Å; C300-A312 HydrophobicContact CB-CB 3.6Å; L301-A312 HydrophobicContact CD2-CB 4.21Å; I308-A312 WeakPolarHBondContact O-CB 3.29Å; I308-A312 PolarHBondContact O-N 3.45Å; A309-A312 PolarHBondContact O-N 3.24Å; I310-A312 VanDerWaalsContact C-N 3.32Å; I310-A312 PolarHBondContact O-N 2.98Å; A312-L315 PolarHBondContact O-N 2.86Å; A312-M316 PolarHBondContact O-N 3.41Å
313L91.6Very high82.1Confident0 Ų047.3 Ų47.30%024%0.239CC..Hα-helixtrans-63-43.8176.5-175.964.4000112.2L301 A309 I310 L315 M316 A317 L334 F337 C356L301-L313 HydrophobicContact CD2-CB 4.12Å; L301-L313 HydrophobicContact CD2-CD1 4.26Å; A309-L313 PolarHBondContact O-N 3.45Å; I310-L313 HydrophobicContact CD1-CD2 4.15Å; I310-L313 PolarHBondContact O-N 3.33Å; L313-L315 VanDerWaalsContact C-N 3.33Å; L313-L315 PolarHBondContact O-N 2.92Å; L313-M316 PolarHBondContact O-N 3.26Å; L313-M316 VanDerWaalsContact O-N 3.1Å; L313-A317 WeakPolarHBondContact O-CB 3.5Å; L313-A317 PolarHBondContact O-N 3.16Å; L313-L334 HydrophobicContact CD1-CD1 3.91Å; L313-L334 HydrophobicContact CD2-CD1 4.28Å; L313-F337 HydrophobicContact CB-CD2 4.36Å; L313-F337 HydrophobicContact CB-CE2 4.09Å; L313-F337 HydrophobicContact CB-CZ 4.39Å; L313-F337 HydrophobicContact CD1-CG 4.44Å; L313-F337 HydrophobicContact CD2-CD1 3.79Å; L313-F337 HydrophobicContact CD2-CD2 4.42Å; L313-F337 HydrophobicContact CD2-CE1 3.68Å; L313-F337 HydrophobicContact CD2-CE2 4.28Å; L313-F337 HydrophobicContact CD2-CG 4.19Å; L313-F337 HydrophobicContact CD2-CZ 3.93Å; L313-C356 HydrophobicContact CD2-CB 3.78Å; L313-C356 HydrophobicContact CG-CB 4.02Å
314R89.1Confident82.2Confident92 Ų9249.1 Ų49.135%0.34725%0.25SC..Hα-helixtrans-58.9-42.9177.1-78.4173.6174.5173.4-1.2111.6I310 A311 M316 A317 D318 D352 C356I310-R314 WeakPolarHBondContact O-CB 3.33Å; I310-R314 VanDerWaalsContact O-CG 3.28Å; I310-R314 WeakPolarHBondContact O-CG 3.45Å; I310-R314 PolarHBondContact O-N 3.39Å; A311-R314 PolarHBondContact O-N 2.84Å; R314-M316 PolarHBondContact O-N 2.85Å; R314-A317 PolarHBondContact O-N 3.47Å; R314-D318 WeakPolarHBondContact O-CB 3.28Å; R314-D318 PolarHBondContact O-N 3.29Å; R314-D352 IonicContact CZ-OD1 3.03Å; R314-D352 IonicContact CZ-OD2 2.84Å; R314-D352 IonicContact NH2-OD1 2.75Å; R314-D352 PolarHBondContact NH2-OD1 3.48Å; R314-D352 IonicContact NH2-OD2 2.68Å; R314-D352 PolarHBondContact NH2-OD2 3.5Å; R314-C356 VanDerWaalsContact CG-SG 3.59Å
315L85.5Confident82.8Confident14 Ų1443.7 Ų43.77%0.07323%0.228CC..Hα-helixtrans-58-36.3176.4-161.486.6000112A277 S278 V293 V297 A311 A312 L313A277-L315 HydrophobicContact CB-CD1 3.9Å; A277-L315 HydrophobicContact CB-CD2 3.96Å; S278-L315 VanDerWaalsContact N-CD1 3.29Å; V293-L315 HydrophobicContact CG1-CD2 3.68Å; V297-L315 HydrophobicContact CG2-CD2 3.44Å; V297-L315 VanDerWaalsContact CG2-CD2 3.44Å; A311-L315 PolarHBondContact O-N 3.44Å; A312-L315 PolarHBondContact O-N 2.86Å; L313-L315 VanDerWaalsContact C-N 3.33Å; L313-L315 PolarHBondContact O-N 2.92Å
316M83.3Confident83.4Confident20 Ų2041.9 Ų41.910%0.09922%0.218CC..Hα-helixtrans-79-37.4178.1-61.7175.255.900112.5V297 L301 A312 L313 R314 Q319 Y330 R333 R363V297-M316 HydrophobicContact CG1-CG 3.51Å; V297-M316 HydrophobicContact CG1-SD 3.37Å; V297-M316 WeakPolarHBondContact CG1-SD 3.45Å; L301-M316 HydrophobicContact CD1-CE 4.25Å; L301-M316 HydrophobicContact CD1-SD 3.72Å; L301-M316 HydrophobicContact CD2-SD 3.85Å; L301-M316 HydrophobicContact CG-SD 4.1Å; A312-M316 PolarHBondContact O-N 3.41Å; L313-M316 PolarHBondContact O-N 3.26Å; L313-M316 VanDerWaalsContact O-N 3.1Å; R314-M316 PolarHBondContact O-N 2.85Å; M316-Q319 PolarHBondContact O-NE2 3.5Å; M316-Y330 HydrophobicContact CB-CD2 3.68Å; M316-Y330 HydrophobicContact CB-CE2 3.36Å; M316-Y330 HydrophobicContact CE-CD2 3.35Å; M316-Y330 HydrophobicContact CE-CE2 3.9Å; M316-Y330 HydrophobicContact CE-CG 4.33Å; M316-R333 HydrophobicContact CE-CB 3.91Å; M316-R363 PolarHBondContact O-NH1 3.13Å
317A84.7Confident83.5Confident2 Ų245.9 Ų45.92%0.01724%0.235CC..Hα-helixtrans-69.2-41179.800000112.4L313 R314 Q319 Y330 C356 R363L313-A317 WeakPolarHBondContact O-CB 3.5Å; L313-A317 PolarHBondContact O-N 3.16Å; R314-A317 PolarHBondContact O-N 3.47Å; A317-Q319 PolarHBondContact O-N 2.8Å; A317-Y330 WeakPolarHBondContact CA-OH 3.42Å; A317-C356 HydrophobicContact CB-CB 4.13Å; A317-R363 PolarHBondContact O-NH1 3.35Å
318D81.1Confident83.5Confident64 Ų6444.8 Ų44.834%0.34224%0.237SC..  trans-73.5105.2-179.9-78.4-28.4000111.8R314 K359R314-D318 WeakPolarHBondContact O-CB 3.28Å; R314-D318 PolarHBondContact O-N 3.29Å; D318-K359 WeakPolarHBondContact OD1-CD 3.38Å; D318-K359 WeakPolarHBondContact OD1-CE 3.41Å; D318-K359 IonicContact OD1-NZ 3.97Å; D318-K359 PolarHBondContact OD1-NZ 3.13Å; D318-K359 IonicContact OD2-NZ 3.93Å; D318-K359 PolarHBondContact OD2-NZ 2.99Å
319Q73.3Confident83.5Confident36 Ų3646.2 Ų46.217%0.16825%0.252CS..  trans-122.9132.6174.1-63.6-62.8-42.500111.4M316 A317 K321M316-Q319 PolarHBondContact O-NE2 3.5Å; A317-Q319 PolarHBondContact O-N 2.8Å; Q319-K321 VanDerWaalsContact C-N 3.28Å; Q319-K321 PolarHBondContact O-N 3.31Å
320P69.1Low83.5Confident97 Ų9746.9 Ų46.963%0.6325%0.254SS*.SBendtrans-68.5-27.9178.225.7-32.5000112.6
321K76Confident83.5Confident147 Ų14746.9 Ų46.964%0.63925%0.254SS*.  trans-105.786.7178.4-66.1-177.6179-177.10110.6Q319 C323 L324Q319-K321 VanDerWaalsContact C-N 3.28Å; Q319-K321 PolarHBondContact O-N 3.31Å; K321-C323 PolarHBondContact O-N 3.49Å; K321-L324 HydrophobicContact CB-CD1 3.76Å; K321-L324 HydrophobicContact CB-CG 3.91Å; K321-L324 HydrophobicContact CD-CD1 3.72Å; K321-L324 HydrophobicContact CD-CG 4.27Å; K321-L324 HydrophobicContact CG-CD1 4.38Å; K321-L324 PolarHBondContact O-N 3.25Å
322K74.7Confident83.7Confident91 Ų9148.5 Ų48.540%0.39626%0.258SS..THydrogen-bonded Turntrans-62.6-26.1-179.2-63.5-169.5178-1670114.3L324 E362 R363 D366K322-L324 VanDerWaalsContact C-N 3.35Å; K322-L324 PolarHBondContact O-N 2.95Å; K322-E362 IonicContact NZ-OE2 2.76Å; K322-E362 PolarHBondContact NZ-OE2 3.01Å; K322-E362 VanDerWaalsContact NZ-OE2 3.16Å; K322-R363 HydrophobicContact CB-CG 4.47Å; K322-D366 HydrophobicContact CB-CB 4.19Å; K322-D366 WeakPolarHBondContact CD-OD2 3.36Å
323C79.3Confident83.7Confident58 Ų5851.5 Ų51.539%0.39227%0.27SS..THydrogen-bonded Turntrans-82.1-5.6-177.8-48.70000114.6K321 S367 W370K321-C323 PolarHBondContact O-N 3.49Å; C323-S367 WeakPolarHBondContact O-CA 3.09Å; C323-S367 WeakPolarHBondContact O-CB 3.31Å; C323-W370 HydrophobicContact CB-CB 3.92Å; C323-W370 HydrophobicContact CB-CG 3.91Å
324L81.7Confident83.7Confident82 Ų8251.5 Ų51.543%0.42927%0.27SS..SBendtrans-75.7140.6175.7-75.1178.2000110.6K321 K322 V326K321-L324 HydrophobicContact CB-CD1 3.76Å; K321-L324 HydrophobicContact CB-CG 3.91Å; K321-L324 HydrophobicContact CD-CD1 3.72Å; K321-L324 HydrophobicContact CD-CG 4.27Å; K321-L324 HydrophobicContact CG-CD1 4.38Å; K321-L324 PolarHBondContact O-N 3.25Å; K322-L324 VanDerWaalsContact C-N 3.35Å; K322-L324 PolarHBondContact O-N 2.95Å; L324-V326 PolarHBondContact O-N 3.43Å
325P82.8Confident83.9Confident35 Ų3547.9 Ų47.923%0.22726%0.257CS..PPolyproline II helixtrans-51.7136.4173.3-27.635.5000112.2V382 Y386P325-V382 HydrophobicContact CB-CG1 4.09Å; P325-V382 HydrophobicContact CB-CG2 4.32Å; P325-Y386 WeakPolarHBondContact CA-OH 3.43Å
326V87.8Confident84Confident7 Ų751 Ų514%0.04227%0.274CS..PPolyproline II helixtrans-78.4125.3175.3-173.20000108.1L324 Y330 L331 R363 V364 Y386L324-V326 PolarHBondContact O-N 3.43Å; V326-Y330 HydrophobicContact CG1-CD1 3.34Å; V326-Y330 HydrophobicContact CG1-CE1 3.97Å; V326-Y330 HydrophobicContact CG1-CG 4.21Å; V326-L331 HydrophobicContact CG1-CD1 4.48Å; V326-L331 HydrophobicContact CG1-CD2 3.75Å; V326-L331 HydrophobicContact CG1-CG 3.93Å; V326-R363 HydrophobicContact CG2-CB 3.82Å; V326-V364 HydrophobicContact CG2-CG2 4.18Å; V326-Y386 HydrophobicContact CB-CE1 3.9Å; V326-Y386 HydrophobicContact CG2-CE1 4.46Å; V326-Y386 PolarHBondContact N-OH 3.32Å
327E84.5Confident84.4Confident102 Ų10250.1 Ų50.148%0.47727%0.269SS..PPolyproline II helixtrans-63.9135.4179.1-71.2164.5-155.100111.1R285 G329 Y330 L331R285-E327 IonicContact CZ-OE1 3.56Å; R285-E327 IonicContact NH1-OE1 3.97Å; R285-E327 IonicContact NH2-OE1 3.87Å; R285-E327 PolarHBondContact NH2-OE1 3.34Å; R285-E327 IonicContact NH2-OE2 3.02Å; E327-G329 VanDerWaalsContact C-N 3.26Å; E327-G329 PolarHBondContact O-N 2.68Å; E327-Y330 WeakPolarHBondContact O-CB 3.39Å; E327-Y330 PolarHBondContact O-N 2.94Å; E327-L331 PolarHBondContact O-N 3.04Å
328S86Confident84.7Confident61 Ų6150.1 Ų50.143%0.42727%0.269SS..Hα-helixtrans-54.6-42.3178.8-172.50000112.1Y330 L331 D332 S385S328-Y330 PolarHBondContact O-N 3.42Å; S328-L331 WeakPolarHBondContact O-CB 3.19Å; S328-L331 PolarHBondContact O-N 3.17Å; S328-D332 PolarHBondContact O-N 3.47Å; S328-S385 WeakPolarHBondContact CB-OG 3.35Å; S328-S385 PolarHBondContact OG-OG 2.93Å
329G84.9Confident84.8Confident30 Ų3050.2 Ų50.231%0.30927%0.274SS..Hα-helixtrans-65.4-19.4177.400000115.3E327 R333E327-G329 VanDerWaalsContact C-N 3.26Å; E327-G329 PolarHBondContact O-N 2.68Å; G329-R333 WeakPolarHBondContact O-CG 3.22Å; G329-R333 PolarHBondContact O-N 2.64Å; G329-R333 PolarHBondContact O-NE 3.2Å
330Y88Confident85Confident13 Ų1354.3 Ų54.35%0.05129%0.292CS..Hα-helixtrans-75-43.7169.1164.8-93000110.7M316 A317 V326 E327 S328 D332 R333 L334 T360M316-Y330 HydrophobicContact CB-CD2 3.68Å; M316-Y330 HydrophobicContact CB-CE2 3.36Å; M316-Y330 HydrophobicContact CE-CD2 3.35Å; M316-Y330 HydrophobicContact CE-CE2 3.9Å; M316-Y330 HydrophobicContact CE-CG 4.33Å; A317-Y330 WeakPolarHBondContact CA-OH 3.42Å; V326-Y330 HydrophobicContact CG1-CD1 3.34Å; V326-Y330 HydrophobicContact CG1-CE1 3.97Å; V326-Y330 HydrophobicContact CG1-CG 4.21Å; E327-Y330 WeakPolarHBondContact O-CB 3.39Å; E327-Y330 PolarHBondContact O-N 2.94Å; S328-Y330 PolarHBondContact O-N 3.42Å; Y330-D332 VanDerWaalsContact C-N 3.33Å; Y330-D332 PolarHBondContact O-N 3.27Å; Y330-R333 PolarHBondContact O-N 2.87Å; Y330-L334 PolarHBondContact O-N 3.26Å; Y330-T360 HydrophobicContact CE1-CG2 3.68Å; Y330-T360 PolarHBondContact OH-OG1 2.94Å
331L92.4Very high85.7Confident2 Ų250.5 Ų50.51%0.0127%0.266CS..Hα-helixtrans-61.9-41.6179-62.9175.1000111.3V326 E327 S328 R333 L334 L335 T360 Y386 F389V326-L331 HydrophobicContact CG1-CD1 4.48Å; V326-L331 HydrophobicContact CG1-CD2 3.75Å; V326-L331 HydrophobicContact CG1-CG 3.93Å; E327-L331 PolarHBondContact O-N 3.04Å; S328-L331 WeakPolarHBondContact O-CB 3.19Å; S328-L331 PolarHBondContact O-N 3.17Å; L331-R333 PolarHBondContact O-N 3.39Å; L331-L334 PolarHBondContact O-N 2.95Å; L331-L335 PolarHBondContact O-N 3.01Å; L331-L335 VanDerWaalsContact O-N 3.07Å; L331-T360 HydrophobicContact CD2-CG2 3.99Å; L331-Y386 HydrophobicContact CD1-CD1 3.9Å; L331-Y386 HydrophobicContact CD1-CE1 4.23Å; L331-F389 HydrophobicContact CB-CB 4.14Å; L331-F389 HydrophobicContact CB-CD2 3.61Å; L331-F389 HydrophobicContact CB-CE2 4.18Å; L331-F389 HydrophobicContact CB-CG 3.9Å; L331-F389 HydrophobicContact CD1-CB 3.86Å; L331-F389 HydrophobicContact CD1-CD1 4.37Å; L331-F389 HydrophobicContact CD1-CG 4.02Å; L331-F389 HydrophobicContact CD2-CD1 3.85Å; L331-F389 HydrophobicContact CD2-CD2 4Å; L331-F389 HydrophobicContact CD2-CE1 3.92Å; L331-F389 HydrophobicContact CD2-CE2 4.07Å; L331-F389 HydrophobicContact CD2-CG 3.88Å; L331-F389 HydrophobicContact CD2-CZ 4.03Å; L331-F389 HydrophobicContact CG-CB 4.42Å; L331-F389 HydrophobicContact CG-CD2 4.26Å; L331-F389 HydrophobicContact CG-CG 4.14Å
332D91.6Very high86Confident65 Ų6543.9 Ų43.935%0.34824%0.239SC..Hα-helixtrans-62.4-40.8174-71.2-40000112.7S328 Y330 L334 L335 L336 R392S328-D332 PolarHBondContact O-N 3.47Å; Y330-D332 VanDerWaalsContact C-N 3.33Å; Y330-D332 PolarHBondContact O-N 3.27Å; D332-L334 VanDerWaalsContact C-N 3.35Å; D332-L335 PolarHBondContact O-N 2.9Å; D332-L336 WeakPolarHBondContact O-CB 3.46Å; D332-L336 PolarHBondContact O-N 3.29Å; D332-R392 IonicContact OD1-CZ 3.78Å; D332-R392 IonicContact OD1-NH1 3.52Å; D332-R392 PolarHBondContact OD1-NH1 3.5Å; D332-R392 IonicContact OD1-NH2 3.66Å
333R89.5Confident86.1Confident64 Ų6442 Ų4224%0.24223%0.233CC..Hα-helixtrans-66.9-34.9176.7-84178.7-91.8173.6-11.9112.4N298 L301 M316 G329 Y330 L331 L336 F337N298-R333 PolarHBondContact ND2-NH1 3.36Å; N298-R333 WeakPolarHBondContact OD1-CD 3.37Å; N298-R333 PolarHBondContact OD1-NH1 3.32Å; L301-R333 HydrophobicContact CD1-CB 3.94Å; L301-R333 HydrophobicContact CD1-CG 4.12Å; M316-R333 HydrophobicContact CE-CB 3.91Å; G329-R333 WeakPolarHBondContact O-CG 3.22Å; G329-R333 PolarHBondContact O-N 2.64Å; G329-R333 PolarHBondContact O-NE 3.2Å; Y330-R333 PolarHBondContact O-N 2.87Å; L331-R333 PolarHBondContact O-N 3.39Å; R333-L336 PolarHBondContact O-N 3.03Å; R333-F337 VanDerWaalsContact O-CB 3.32Å; R333-F337 WeakPolarHBondContact O-CB 3.49Å; R333-F337 PolarHBondContact O-N 3.5Å
334L93.4Very high85.9Confident0 Ų042.2 Ų42.20%023%0.229CC..Hα-helixtrans-65.6-43.7173.1175.662.7000111.3L313 Y330 L331 D332 L336 F337 L338 V357 T360 F389L313-L334 HydrophobicContact CD1-CD1 3.91Å; L313-L334 HydrophobicContact CD2-CD1 4.28Å; Y330-L334 PolarHBondContact O-N 3.26Å; L331-L334 PolarHBondContact O-N 2.95Å; D332-L334 VanDerWaalsContact C-N 3.35Å; L334-L336 VanDerWaalsContact C-N 3.33Å; L334-L336 PolarHBondContact O-N 2.95Å; L334-F337 WeakPolarHBondContact O-CB 3.36Å; L334-F337 PolarHBondContact O-N 3.4Å; L334-L338 HydrophobicContact CD1-CD1 4.46Å; L334-L338 HydrophobicContact CD1-CG 4.39Å; L334-L338 HydrophobicContact CG-CD1 4.4Å; L334-L338 WeakPolarHBondContact O-CG 3.22Å; L334-L338 PolarHBondContact O-N 3.35Å; L334-V357 HydrophobicContact CD1-CG2 4.21Å; L334-T360 HydrophobicContact CD2-CG2 3.96Å; L334-F389 HydrophobicContact CD2-CE2 4.09Å; L334-F389 HydrophobicContact CD2-CZ 3.82Å
335L93.3Very high85.5Confident16 Ų1644.2 Ų44.28%0.08424%0.236CC..Hα-helixtrans-60.6-44.3174.6-70.3172.3000111.5L331 D332 L338 S339 F389 R392 L393L331-L335 PolarHBondContact O-N 3.01Å; L331-L335 VanDerWaalsContact O-N 3.07Å; D332-L335 PolarHBondContact O-N 2.9Å; L335-L338 PolarHBondContact O-N 3.07Å; L335-S339 PolarHBondContact O-N 3.31Å; L335-F389 HydrophobicContact CD1-CD2 3.96Å; L335-F389 HydrophobicContact CD1-CE2 4.48Å; L335-F389 HydrophobicContact CD2-CD2 4.28Å; L335-F389 HydrophobicContact CD2-CE2 4.1Å; L335-F389 HydrophobicContact CG-CD2 3.95Å; L335-F389 HydrophobicContact CG-CE2 3.96Å; L335-R392 HydrophobicContact CD1-CB 3.85Å; L335-L393 HydrophobicContact CD2-CB 3.89Å; L335-L393 HydrophobicContact CD2-CD1 3.84Å; L335-L393 HydrophobicContact CD2-CG 4.47Å
336L87.3Confident85Confident80 Ų8046.7 Ų46.742%0.41924%0.244SC..Hα-helixtrans-60.4-48.1175.4-172.766.2000111L302 D332 R333 L334 L338 S339 F340L302-L336 HydrophobicContact CD1-CD2 4.15Å; L302-L336 HydrophobicContact CD1-CG 4.43Å; L302-L336 HydrophobicContact CD2-CG 4.43Å; D332-L336 WeakPolarHBondContact O-CB 3.46Å; D332-L336 PolarHBondContact O-N 3.29Å; R333-L336 PolarHBondContact O-N 3.03Å; L334-L336 VanDerWaalsContact C-N 3.33Å; L334-L336 PolarHBondContact O-N 2.95Å; L336-L338 VanDerWaalsContact C-N 3.31Å; L336-L338 PolarHBondContact O-N 3.34Å; L336-S339 PolarHBondContact O-N 3.19Å; L336-S339 VanDerWaalsContact O-N 3.16Å; L336-S339 PolarHBondContact O-OG 3.19Å; L336-F340 HydrophobicContact CD1-CD2 3.99Å; L336-F340 HydrophobicContact CD1-CE2 3.64Å; L336-F340 HydrophobicContact CG-CD2 4.28Å; L336-F340 HydrophobicContact CG-CE2 4.33Å; L336-F340 WeakPolarHBondContact O-CD2 3.42Å; L336-F340 PolarHBondContact O-N 2.88Å
337F90.8Very high84.5Confident1 Ų149.5 Ų49.50%0.00426%0.264CS..Hα-helixtrans-54.6-47.3177.3179.8-80.8000111.8L301 A309 I310 L313 R333 L334 S339 F340 N341 F349 I353L301-F337 HydrophobicContact CB-CD2 4.32Å; L301-F337 HydrophobicContact CD2-CD2 3.89Å; L301-F337 WeakPolarHBondContact O-CD2 3.5Å; L301-F337 WeakPolarHBondContact O-CE2 3.28Å; A309-F337 HydrophobicContact CB-CE2 3.89Å; A309-F337 HydrophobicContact CB-CZ 4.44Å; A309-F337 WeakPolarHBondContact O-CE2 3.36Å; I310-F337 HydrophobicContact CD1-CZ 4.44Å; L313-F337 HydrophobicContact CB-CD2 4.36Å; L313-F337 HydrophobicContact CB-CE2 4.09Å; L313-F337 HydrophobicContact CB-CZ 4.39Å; L313-F337 HydrophobicContact CD1-CG 4.44Å; L313-F337 HydrophobicContact CD2-CD1 3.79Å; L313-F337 HydrophobicContact CD2-CD2 4.42Å; L313-F337 HydrophobicContact CD2-CE1 3.68Å; L313-F337 HydrophobicContact CD2-CE2 4.28Å; L313-F337 HydrophobicContact CD2-CG 4.19Å; L313-F337 HydrophobicContact CD2-CZ 3.93Å; R333-F337 VanDerWaalsContact O-CB 3.32Å; R333-F337 WeakPolarHBondContact O-CB 3.49Å; R333-F337 PolarHBondContact O-N 3.5Å; L334-F337 WeakPolarHBondContact O-CB 3.36Å; L334-F337 PolarHBondContact O-N 3.4Å; F337-S339 VanDerWaalsContact C-N 3.35Å; F337-S339 PolarHBondContact O-N 3.01Å; F337-F340 PolarHBondContact O-N 3.39Å; F337-N341 HydrophobicContact CD1-CB 4.28Å; F337-N341 HydrophobicContact CE1-CB 3.83Å; F337-N341 HydrophobicContact CZ-CB 4Å; F337-N341 WeakPolarHBondContact O-CB 3.24Å; F337-N341 PolarHBondContact O-N 2.94Å; F337-N341 PolarHBondContact O-ND2 3.39Å; F337-F349 HydrophobicContact CE1-CZ 4.28Å; F337-F349 HydrophobicContact CZ-CE2 4.42Å; F337-F349 AromaticContact CZ-CZ 3.78Å; F337-F349 HydrophobicContact CZ-CZ 3.78Å; F337-I353 HydrophobicContact CE1-CD1 3.93Å; F337-I353 HydrophobicContact CE1-CG1 3.85Å
338L90.8Very high84.4Confident1 Ų148 Ų481%0.00527%0.265CS..Hα-helixtrans-63-40.7179.5-70.9172000112L334 L335 L336 F340 A342 I353 L393 W396 I416L334-L338 HydrophobicContact CD1-CD1 4.46Å; L334-L338 HydrophobicContact CD1-CG 4.39Å; L334-L338 HydrophobicContact CG-CD1 4.4Å; L334-L338 WeakPolarHBondContact O-CG 3.22Å; L334-L338 PolarHBondContact O-N 3.35Å; L335-L338 PolarHBondContact O-N 3.07Å; L336-L338 VanDerWaalsContact C-N 3.31Å; L336-L338 PolarHBondContact O-N 3.34Å; L338-F340 PolarHBondContact O-N 3.04Å; L338-A342 WeakPolarHBondContact O-CB 3.43Å; L338-A342 PolarHBondContact O-N 3.48Å; L338-A342 VanDerWaalsContact O-N 3.12Å; L338-I353 HydrophobicContact CD2-CG2 3.5Å; L338-L393 HydrophobicContact CD1-CD1 3.48Å; L338-L393 VanDerWaalsContact CD1-CD1 3.48Å; L338-W396 HydrophobicContact CB-CH2 4.16Å; L338-W396 HydrophobicContact CB-CZ2 3.86Å; L338-W396 HydrophobicContact CD1-CH2 4.47Å; L338-W396 HydrophobicContact CD1-CZ3 4.28Å; L338-W396 HydrophobicContact CD2-CH2 4.3Å; L338-I416 HydrophobicContact CD1-CD1 4.06Å; L338-I416 HydrophobicContact CD2-CD1 3.84Å
339S83.1Confident84.4Confident66 Ų6645.1 Ų45.146%0.46225%0.245SC..Hα-helixtrans-62.8-26.8179.271.40000113.8L335 L336 F337L335-S339 PolarHBondContact O-N 3.31Å; L336-S339 PolarHBondContact O-N 3.19Å; L336-S339 VanDerWaalsContact O-N 3.16Å; L336-S339 PolarHBondContact O-OG 3.19Å; F337-S339 VanDerWaalsContact C-N 3.35Å; F337-S339 PolarHBondContact O-N 3.01Å
340F79Confident84.5Confident123 Ų12344.1 Ų44.154%0.53923%0.233SC..Hα-helixtrans-97.2-33.3179.9-82.3-85.9000114L302 L336 F337 L338 N343L302-F340 HydrophobicContact CD1-CD2 4.34Å; L302-F340 HydrophobicContact CD1-CE2 4.38Å; L302-F340 HydrophobicContact CD2-CB 3.79Å; L302-F340 HydrophobicContact CD2-CD2 3.74Å; L302-F340 HydrophobicContact CD2-CG 3.83Å; L336-F340 HydrophobicContact CD1-CD2 3.99Å; L336-F340 HydrophobicContact CD1-CE2 3.64Å; L336-F340 HydrophobicContact CG-CD2 4.28Å; L336-F340 HydrophobicContact CG-CE2 4.33Å; L336-F340 WeakPolarHBondContact O-CD2 3.42Å; L336-F340 PolarHBondContact O-N 2.88Å; F337-F340 PolarHBondContact O-N 3.39Å; L338-F340 PolarHBondContact O-N 3.04Å; F340-N343 PolarHBondContact O-OD1 3.5Å
341N83.1Confident84.7Confident16 Ų1647.1 Ų47.19%0.08625%0.247CC..Hα-helixtrans-112.4-11.6-166.4-62.9-84.5000114.7L301 F337 N343 E344 F349L301-N341 PolarHBondContact O-ND2 3.5Å; F337-N341 HydrophobicContact CD1-CB 4.28Å; F337-N341 HydrophobicContact CE1-CB 3.83Å; F337-N341 HydrophobicContact CZ-CB 4Å; F337-N341 WeakPolarHBondContact O-CB 3.24Å; F337-N341 PolarHBondContact O-N 2.94Å; F337-N341 PolarHBondContact O-ND2 3.39Å; N341-N343 PolarHBondContact O-N 2.91Å; N341-N343 VanDerWaalsContact O-N 3.11Å; N341-E344 WeakPolarHBondContact O-CB 3.16Å; N341-E344 PolarHBondContact O-N 3.44Å; N341-E344 VanDerWaalsContact O-N 3.15Å; N341-F349 HydrophobicContact CB-CE1 3.83Å; N341-F349 HydrophobicContact CB-CZ 3.85Å; N341-F349 WeakPolarHBondContact O-CE1 3.41Å
342A82Confident84.7Confident8 Ų848.6 Ų48.67%0.06626%0.255CS..THydrogen-bonded Turntrans-67-13.2-175.300000114.5L338 W396 S408 S409 C412L338-A342 WeakPolarHBondContact O-CB 3.43Å; L338-A342 PolarHBondContact O-N 3.48Å; L338-A342 VanDerWaalsContact O-N 3.12Å; A342-W396 HydrophobicContact CB-CH2 4.01Å; A342-W396 HydrophobicContact CB-CZ2 3.61Å; A342-S408 CarbonylContact O-C 3.48Å; A342-S409 VanDerWaalsContact O-CA 3.23Å; A342-S409 WeakPolarHBondContact O-CA 3.28Å; A342-S409 PolarHBondContact O-N 3.36Å; A342-S409 PolarHBondContact O-OG 2.86Å; A342-C412 HydrophobicContact CB-CB 4.38Å
343N76.1Confident84.8Confident53 Ų5345.6 Ų45.628%0.28324%0.239SC..THydrogen-bonded Turntrans-83.5-7.6175.861-15.6000114.4F340 N341 Q345 S408 S409F340-N343 PolarHBondContact O-OD1 3.5Å; N341-N343 PolarHBondContact O-N 2.91Å; N341-N343 VanDerWaalsContact O-N 3.11Å; N343-Q345 PolarHBondContact O-N 2.82Å; N343-S408 PolarHBondContact O-OG 2.77Å; N343-S409 WeakPolarHBondContact CA-OG 3.34Å; N343-S409 WeakPolarHBondContact CB-OG 3.29Å; N343-S409 PolarHBondContact N-OG 2.9Å
344E76.7Confident85.1Confident62 Ų6243 Ų4329%0.2923%0.23SC..  trans-54.7132.6-179.6-170.253.7-111.100111.6C306 N341 E346 F349 S408C306-E344 HydrophobicContact CB-CG 4.43Å; N341-E344 WeakPolarHBondContact O-CB 3.16Å; N341-E344 PolarHBondContact O-N 3.44Å; N341-E344 VanDerWaalsContact O-N 3.15Å; E344-E346 VanDerWaalsContact C-N 3.33Å; E344-E346 HydrophobicContact CG-CB 4.49Å; E344-E346 PolarHBondContact O-N 2.98Å; E344-F349 HydrophobicContact CB-CD1 3.49Å; E344-F349 VanDerWaalsContact CB-CD1 3.49Å; E344-F349 HydrophobicContact CB-CE1 3.73Å; E344-F349 HydrophobicContact CB-CG 4.32Å; E344-F349 HydrophobicContact CG-CB 4.27Å; E344-F349 HydrophobicContact CG-CD1 3.7Å; E344-F349 HydrophobicContact CG-CE1 4.13Å; E344-F349 HydrophobicContact CG-CG 4.03Å; E344-S408 WeakPolarHBondContact O-CB 2.87Å
345Q72.9Confident85.2Confident123 Ų12346 Ų4658%0.57525%0.248SC*.  trans-80.4-17.2-169.4-65.9-176.1-6.800112.6N343 S347N343-Q345 PolarHBondContact O-N 2.82Å; Q345-S347 PolarHBondContact O-N 3.44Å
346E72.7Confident85.2Confident88 Ų8845.3 Ų45.341%0.41124%0.244SC..  trans-68.4113.9178.1-67.7-164.1161.400111.9E344 S348 F349 C350E344-E346 VanDerWaalsContact C-N 3.33Å; E344-E346 HydrophobicContact CG-CB 4.49Å; E344-E346 PolarHBondContact O-N 2.98Å; E346-S348 PolarHBondContact O-N 3.07Å; E346-S348 VanDerWaalsContact O-N 3.17Å; E346-F349 HydrophobicContact CB-CB 4.04Å; E346-F349 WeakPolarHBondContact O-CB 3.41Å; E346-F349 PolarHBondContact O-N 3.39Å; E346-C350 PolarHBondContact O-N 3.35Å
347S76.3Confident85.6Confident66 Ų6641.5 Ų41.546%0.46222%0.224SC..Hα-helixtrans-59.2-30.5178.3-175.40000113.2Q345 E351Q345-S347 PolarHBondContact O-N 3.44Å; S347-E351 PolarHBondContact O-N 3.16Å
348S81.7Confident85.8Confident69 Ų6945.9 Ų45.948%0.48324%0.243SC..Hα-helixtrans-65.1-38.7175.840.50000112.2E346 E351 D352E346-S348 PolarHBondContact O-N 3.07Å; E346-S348 VanDerWaalsContact O-N 3.17Å; S348-E351 PolarHBondContact O-N 3Å; S348-D352 PolarHBondContact O-N 3.48Å
349F86.4Confident85.9Confident2 Ų249 Ų491%0.00926%0.257CS..Hα-helixtrans-67.3-40.4179.9-177.2-99.8000111.5C306 I310 F337 N341 E344 E346 E351 D352 I353C306-F349 HydrophobicContact CB-CD2 3.76Å; C306-F349 HydrophobicContact CB-CE2 3.64Å; C306-F349 HydrophobicContact CB-CG 4.45Å; C306-F349 HydrophobicContact CB-CZ 4.23Å; C306-F349 VanDerWaalsContact O-CE2 3.32Å; C306-F349 WeakPolarHBondContact O-CE2 3.35Å; I310-F349 HydrophobicContact CB-CD2 4.17Å; I310-F349 HydrophobicContact CB-CE2 3.79Å; I310-F349 HydrophobicContact CD1-CE2 4.42Å; I310-F349 HydrophobicContact CG1-CE2 4.43Å; F337-F349 HydrophobicContact CE1-CZ 4.28Å; F337-F349 HydrophobicContact CZ-CE2 4.42Å; F337-F349 AromaticContact CZ-CZ 3.78Å; F337-F349 HydrophobicContact CZ-CZ 3.78Å; N341-F349 HydrophobicContact CB-CE1 3.83Å; N341-F349 HydrophobicContact CB-CZ 3.85Å; N341-F349 WeakPolarHBondContact O-CE1 3.41Å; E344-F349 HydrophobicContact CB-CD1 3.49Å; E344-F349 VanDerWaalsContact CB-CD1 3.49Å; E344-F349 HydrophobicContact CB-CE1 3.73Å; E344-F349 HydrophobicContact CB-CG 4.32Å; E344-F349 HydrophobicContact CG-CB 4.27Å; E344-F349 HydrophobicContact CG-CD1 3.7Å; E344-F349 HydrophobicContact CG-CE1 4.13Å; E344-F349 HydrophobicContact CG-CG 4.03Å; E346-F349 HydrophobicContact CB-CB 4.04Å; E346-F349 WeakPolarHBondContact O-CB 3.41Å; E346-F349 PolarHBondContact O-N 3.39Å; F349-E351 VanDerWaalsContact C-N 3.35Å; F349-E351 PolarHBondContact O-N 3.17Å; F349-D352 PolarHBondContact O-N 3.49Å; F349-I353 HydrophobicContact CD1-CD1 3.76Å; F349-I353 HydrophobicContact CD1-CG1 4.36Å; F349-I353 HydrophobicContact CE1-CD1 3.44Å; F349-I353 VanDerWaalsContact CE1-CD1 3.44Å; F349-I353 HydrophobicContact CE1-CG1 4.15Å; F349-I353 HydrophobicContact CZ-CD1 4.17Å; F349-I353 WeakPolarHBondContact O-CG1 3.33Å; F349-I353 PolarHBondContact O-N 2.93Å
350C88.3Confident86.4Confident9 Ų945.8 Ų45.86%0.06124%0.235CC..Hα-helixtrans-57.7-46.6171.3-177.60000111.3E346 D352 I353 I354E346-C350 PolarHBondContact O-N 3.35Å; C350-D352 VanDerWaalsContact C-N 3.27Å; C350-D352 PolarHBondContact O-N 3.04Å; C350-I353 WeakPolarHBondContact O-CB 3.37Å; C350-I353 PolarHBondContact O-N 2.88Å; C350-I354 VanDerWaalsContact O-CG1 3.3Å; C350-I354 WeakPolarHBondContact O-CG1 3.41Å; C350-I354 PolarHBondContact O-N 3.21Å
351E92Very high87.2Confident75 Ų7540 Ų4035%0.3521%0.209SC..Hα-helixtrans-60.5-38177.5-69.6-60.4147.300112S347 S348 F349 I354 V355S347-E351 PolarHBondContact O-N 3.16Å; S348-E351 PolarHBondContact O-N 3Å; F349-E351 VanDerWaalsContact C-N 3.35Å; F349-E351 PolarHBondContact O-N 3.17Å; E351-I354 PolarHBondContact O-N 3.39Å; E351-V355 WeakPolarHBondContact O-CG2 3.39Å; E351-V355 PolarHBondContact O-N 2.88Å
352D92.3Very high87.6Confident34 Ų3441 Ų4118%0.18221%0.214CC..Hα-helixtrans-66.4-38.1176.2-71.5-31.5000113.3I310 R314 S348 F349 C350 V355 C356I310-D352 HydrophobicContact CD1-CB 3.7Å; I310-D352 HydrophobicContact CG1-CB 3.53Å; R314-D352 IonicContact CZ-OD1 3.03Å; R314-D352 IonicContact CZ-OD2 2.84Å; R314-D352 IonicContact NH2-OD1 2.75Å; R314-D352 PolarHBondContact NH2-OD1 3.48Å; R314-D352 IonicContact NH2-OD2 2.68Å; R314-D352 PolarHBondContact NH2-OD2 3.5Å; S348-D352 PolarHBondContact O-N 3.48Å; F349-D352 PolarHBondContact O-N 3.49Å; C350-D352 VanDerWaalsContact C-N 3.27Å; C350-D352 PolarHBondContact O-N 3.04Å; D352-V355 PolarHBondContact O-N 2.89Å; D352-C356 PolarHBondContact O-N 3.4Å; D352-C356 VanDerWaalsContact O-N 3.09Å; D352-C356 PolarHBondContact O-SG 3.46Å
353I93.8Very high88Confident1 Ų141.5 Ų41.51%0.00521%0.214CC..Hα-helixtrans-59.4-49.6170.7-69.1173.9000109.7I310 F337 L338 F349 C350 V355 C356 V357I310-I353 HydrophobicContact CD1-CG1 4.21Å; F337-I353 HydrophobicContact CE1-CD1 3.93Å; F337-I353 HydrophobicContact CE1-CG1 3.85Å; L338-I353 HydrophobicContact CD2-CG2 3.5Å; F349-I353 HydrophobicContact CD1-CD1 3.76Å; F349-I353 HydrophobicContact CD1-CG1 4.36Å; F349-I353 HydrophobicContact CE1-CD1 3.44Å; F349-I353 VanDerWaalsContact CE1-CD1 3.44Å; F349-I353 HydrophobicContact CE1-CG1 4.15Å; F349-I353 HydrophobicContact CZ-CD1 4.17Å; F349-I353 WeakPolarHBondContact O-CG1 3.33Å; F349-I353 PolarHBondContact O-N 2.93Å; C350-I353 WeakPolarHBondContact O-CB 3.37Å; C350-I353 PolarHBondContact O-N 2.88Å; I353-V355 VanDerWaalsContact C-N 3.27Å; I353-V355 PolarHBondContact O-N 3.17Å; I353-C356 PolarHBondContact O-N 2.77Å; I353-V357 HydrophobicContact CG2-CG2 4.08Å; I353-V357 WeakPolarHBondContact O-CG2 3.48Å; I353-V357 PolarHBondContact O-N 3.32Å
354I95.2Very high88.7Confident10 Ų1039 Ų395%0.05120%0.2CC..Hα-helixtrans-59.8-39.1-178.7-64.7-49.1000111.1C350 E351 K358 R415 I416 L419C350-I354 VanDerWaalsContact O-CG1 3.3Å; C350-I354 WeakPolarHBondContact O-CG1 3.41Å; C350-I354 PolarHBondContact O-N 3.21Å; E351-I354 PolarHBondContact O-N 3.39Å; I354-K358 VanDerWaalsContact O-CB 3.26Å; I354-K358 WeakPolarHBondContact O-CB 3.49Å; I354-K358 PolarHBondContact O-N 3.43Å; I354-R415 HydrophobicContact CD1-CB 3.47Å; I354-R415 VanDerWaalsContact CD1-CB 3.47Å; I354-R415 HydrophobicContact CG1-CB 3.86Å; I354-I416 HydrophobicContact CD1-CD1 4.43Å; I354-I416 HydrophobicContact CD1-CG1 3.63Å; I354-L419 HydrophobicContact CG2-CD1 3.77Å
355V94.8Very high89.3Confident64 Ų6437.9 Ų37.939%0.38819%0.194SC..Hα-helixtrans-61.7-44.2173.6170.80000111.6E351 D352 I353 K358 K359E351-V355 WeakPolarHBondContact O-CG2 3.39Å; E351-V355 PolarHBondContact O-N 2.88Å; D352-V355 PolarHBondContact O-N 2.89Å; I353-V355 VanDerWaalsContact C-N 3.27Å; I353-V355 PolarHBondContact O-N 3.17Å; V355-K358 PolarHBondContact O-N 3.33Å; V355-K359 HydrophobicContact CG1-CD 4.46Å; V355-K359 WeakPolarHBondContact O-CG 3.36Å; V355-K359 PolarHBondContact O-N 3.48Å
356C94.1Very high90Very high0 Ų033.3 Ų33.30%017%0.173CC..Hα-helixtrans-68.1-41.4179.4-64.40000112.6L313 R314 A317 D352 I353 K359 T360L313-C356 HydrophobicContact CD2-CB 3.78Å; L313-C356 HydrophobicContact CG-CB 4.02Å; R314-C356 VanDerWaalsContact CG-SG 3.59Å; A317-C356 HydrophobicContact CB-CB 4.13Å; D352-C356 PolarHBondContact O-N 3.4Å; D352-C356 VanDerWaalsContact O-N 3.09Å; D352-C356 PolarHBondContact O-SG 3.46Å; I353-C356 PolarHBondContact O-N 2.77Å; C356-K359 PolarHBondContact O-N 3.31Å; C356-T360 PolarHBondContact O-N 3.3Å; C356-T360 PolarHBondContact O-OG1 2.77Å
357V95.4Very high90.7Very high0 Ų029.1 Ų29.10%015%0.154CC..Hα-helixtrans-64-44.9175.4173.20000110.3L334 I353 K359 T360 F361 I416L334-V357 HydrophobicContact CD1-CG2 4.21Å; I353-V357 HydrophobicContact CG2-CG2 4.08Å; I353-V357 WeakPolarHBondContact O-CG2 3.48Å; I353-V357 PolarHBondContact O-N 3.32Å; V357-K359 PolarHBondContact O-N 3.17Å; V357-T360 WeakPolarHBondContact O-CA 3.49Å; V357-T360 VanDerWaalsContact O-CB 3.29Å; V357-T360 WeakPolarHBondContact O-CB 3.49Å; V357-T360 PolarHBondContact O-N 3.05Å; V357-T360 VanDerWaalsContact O-N 3.08Å; V357-F361 HydrophobicContact CG1-CD1 4.29Å; V357-F361 HydrophobicContact CG1-CD2 4.28Å; V357-F361 HydrophobicContact CG1-CE1 3.83Å; V357-F361 HydrophobicContact CG1-CE2 3.82Å; V357-F361 HydrophobicContact CG1-CG 4.5Å; V357-F361 HydrophobicContact CG1-CZ 3.59Å; V357-F361 PolarHBondContact O-N 3.47Å; V357-I416 HydrophobicContact CG1-CG1 4.28Å; V357-I416 HydrophobicContact CG1-CG2 4.4Å; V357-I416 HydrophobicContact CG2-CD1 4.26Å; V357-I416 HydrophobicContact CG2-CG1 4.39Å
358K95.3Very high91Very high93 Ų9326 Ų2640%0.40413%0.132SC..Hα-helixtrans-58.4-47.2175.6-175-178.9175.7-176.20111.8I354 V355 T360 F361 E362 L419 M425I354-K358 VanDerWaalsContact O-CB 3.26Å; I354-K358 WeakPolarHBondContact O-CB 3.49Å; I354-K358 PolarHBondContact O-N 3.43Å; V355-K358 PolarHBondContact O-N 3.33Å; K358-T360 PolarHBondContact O-N 3.3Å; K358-F361 PolarHBondContact O-N 3.43Å; K358-E362 WeakPolarHBondContact CE-OE1 3.49Å; K358-E362 WeakPolarHBondContact O-CG 3.38Å; K358-E362 PolarHBondContact O-N 2.9Å; K358-L419 HydrophobicContact CB-CD1 3.94Å; K358-L419 HydrophobicContact CD-CD2 4.45Å; K358-L419 HydrophobicContact CG-CD2 4.43Å; K358-M425 HydrophobicContact CG-CE 4.45Å
359K93.1Very high91Very high66 Ų6623.3 Ų23.329%0.28711%0.112SC..Hα-helixtrans-58.9-37.7174.9-75.3178179.31800112D318 V355 C356 V357 E362 R363D318-K359 WeakPolarHBondContact OD1-CD 3.38Å; D318-K359 WeakPolarHBondContact OD1-CE 3.41Å; D318-K359 IonicContact OD1-NZ 3.97Å; D318-K359 PolarHBondContact OD1-NZ 3.13Å; D318-K359 IonicContact OD2-NZ 3.93Å; D318-K359 PolarHBondContact OD2-NZ 2.99Å; V355-K359 HydrophobicContact CG1-CD 4.46Å; V355-K359 WeakPolarHBondContact O-CG 3.36Å; V355-K359 PolarHBondContact O-N 3.48Å; C356-K359 PolarHBondContact O-N 3.31Å; V357-K359 PolarHBondContact O-N 3.17Å; K359-E362 PolarHBondContact O-N 3.24Å; K359-R363 WeakPolarHBondContact O-CG 3.47Å; K359-R363 PolarHBondContact O-N 2.75Å
360T93.3Very high90.5Very high0 Ų027.4 Ų27.40%013%0.128CC..Hα-helixtrans-63.8-47.9175-59.40000111.5Y330 L331 L334 C356 V357 K358 E362 R363 V364Y330-T360 HydrophobicContact CE1-CG2 3.68Å; Y330-T360 PolarHBondContact OH-OG1 2.94Å; L331-T360 HydrophobicContact CD2-CG2 3.99Å; L334-T360 HydrophobicContact CD2-CG2 3.96Å; C356-T360 PolarHBondContact O-N 3.3Å; C356-T360 PolarHBondContact O-OG1 2.77Å; V357-T360 WeakPolarHBondContact O-CA 3.49Å; V357-T360 VanDerWaalsContact O-CB 3.29Å; V357-T360 WeakPolarHBondContact O-CB 3.49Å; V357-T360 PolarHBondContact O-N 3.05Å; V357-T360 VanDerWaalsContact O-N 3.08Å; K358-T360 PolarHBondContact O-N 3.3Å; T360-E362 VanDerWaalsContact C-N 3.34Å; T360-E362 PolarHBondContact O-N 3.35Å; T360-R363 WeakPolarHBondContact O-CB 3.09Å; T360-R363 PolarHBondContact O-N 3.21Å; T360-V364 WeakPolarHBondContact O-CG2 3.23Å; T360-V364 PolarHBondContact O-N 3.4Å
361F94.7Very high89.7Confident0 Ų027.4 Ų27.40%013%0.128CC..Hα-helixtrans-62.9-39.9176.7-68-6.5000112V357 K358 R363 V364 R365 F389 L390 L393 I416 L419 M420 M425 W426V357-F361 HydrophobicContact CG1-CD1 4.29Å; V357-F361 HydrophobicContact CG1-CD2 4.28Å; V357-F361 HydrophobicContact CG1-CE1 3.83Å; V357-F361 HydrophobicContact CG1-CE2 3.82Å; V357-F361 HydrophobicContact CG1-CG 4.5Å; V357-F361 HydrophobicContact CG1-CZ 3.59Å; V357-F361 PolarHBondContact O-N 3.47Å; K358-F361 PolarHBondContact O-N 3.43Å; F361-R363 VanDerWaalsContact C-N 3.29Å; F361-R363 PolarHBondContact O-N 3.46Å; F361-V364 PolarHBondContact O-N 3.11Å; F361-R365 WeakPolarHBondContact O-CB 3.22Å; F361-R365 PolarHBondContact O-N 3.47Å; F361-F389 HydrophobicContact CD1-CE1 4.42Å; F361-F389 AromaticContact CE1-CE1 3.96Å; F361-F389 HydrophobicContact CE1-CE1 3.96Å; F361-F389 HydrophobicContact CE1-CZ 4.3Å; F361-L390 HydrophobicContact CD1-CD2 4.49Å; F361-L390 HydrophobicContact CE1-CD2 3.95Å; F361-L390 HydrophobicContact CZ-CD2 4.41Å; F361-L393 HydrophobicContact CE1-CD2 3.67Å; F361-L393 HydrophobicContact CZ-CD2 3.56Å; F361-I416 HydrophobicContact CZ-CG2 4.41Å; F361-L419 HydrophobicContact CD2-CB 4.08Å; F361-L419 HydrophobicContact CE2-CB 3.9Å; F361-M420 HydrophobicContact CE2-CB 3.89Å; F361-M420 HydrophobicContact CZ-CB 4.12Å; F361-M420 HydrophobicContact CZ-CG 4.49Å; F361-M425 HydrophobicContact CB-CE 3.33Å; F361-M425 HydrophobicContact CB-CG 4.25Å; F361-M425 HydrophobicContact CB-SD 4.38Å; F361-M425 HydrophobicContact CD2-CG 4.33Å; F361-W426 HydrophobicContact CB-CH2 3.8Å; F361-W426 HydrophobicContact CB-CZ2 4.41Å; F361-W426 HydrophobicContact CB-CZ3 4.25Å; F361-W426 AromaticContact CD1-CH2 3.9Å; F361-W426 HydrophobicContact CD1-CH2 3.9Å; F361-W426 HydrophobicContact CD1-CZ2 4.44Å; F361-W426 HydrophobicContact CD2-CH2 4.24Å; F361-W426 HydrophobicContact CD2-CZ2 4.13Å; F361-W426 HydrophobicContact CE2-CZ2 4.5Å; F361-W426 AromaticContact CG-CH2 3.73Å; F361-W426 HydrophobicContact CG-CH2 3.73Å; F361-W426 HydrophobicContact CG-CZ2 4.1Å
362E91.6Very high88.4Confident38 Ų3825.7 Ų25.718%0.17812%0.12CC..Hα-helixtrans-58.5-41.6173.7-73.9178.3-174.100111.3K322 K358 K359 T360 R365 D366 M425K322-E362 IonicContact NZ-OE2 2.76Å; K322-E362 PolarHBondContact NZ-OE2 3.01Å; K322-E362 VanDerWaalsContact NZ-OE2 3.16Å; K358-E362 WeakPolarHBondContact CE-OE1 3.49Å; K358-E362 WeakPolarHBondContact O-CG 3.38Å; K358-E362 PolarHBondContact O-N 2.9Å; K359-E362 PolarHBondContact O-N 3.24Å; T360-E362 VanDerWaalsContact C-N 3.34Å; T360-E362 PolarHBondContact O-N 3.35Å; E362-R365 PolarHBondContact O-N 2.96Å; E362-D366 VanDerWaalsContact O-CB 3.28Å; E362-D366 WeakPolarHBondContact O-CB 3.45Å; E362-D366 PolarHBondContact O-N 2.96Å; E362-M425 HydrophobicContact CB-CE 4.22Å; E362-M425 HydrophobicContact CG-CE 3.53Å; E362-M425 VanDerWaalsContact N-CE 3.27Å
363R90.3Very high87.2Confident19 Ų1927.8 Ų27.87%0.07213%0.134CC..Hα-helixtrans-68.1-41176-71172.257.4-161-7.8112.8M316 A317 K322 V326 K359 T360 F361 R365 D366 S367M316-R363 PolarHBondContact O-NH1 3.13Å; A317-R363 PolarHBondContact O-NH1 3.35Å; K322-R363 HydrophobicContact CB-CG 4.47Å; V326-R363 HydrophobicContact CG2-CB 3.82Å; K359-R363 WeakPolarHBondContact O-CG 3.47Å; K359-R363 PolarHBondContact O-N 2.75Å; T360-R363 WeakPolarHBondContact O-CB 3.09Å; T360-R363 PolarHBondContact O-N 3.21Å; F361-R363 VanDerWaalsContact C-N 3.29Å; F361-R363 PolarHBondContact O-N 3.46Å; R363-R365 VanDerWaalsContact C-N 3.33Å; R363-D366 PolarHBondContact O-N 2.85Å; R363-S367 VanDerWaalsContact O-CB 3.28Å; R363-S367 WeakPolarHBondContact O-CB 3.25Å; R363-S367 PolarHBondContact O-N 3.46Å; R363-S367 PolarHBondContact O-OG 2.78Å
364V91.6Very high85.7Confident0 Ų035.4 Ų35.40%016%0.163CC..Hα-helixtrans-59-47.1174.1168.60000110V326 T360 F361 S367 G368 Y386 W426 L453V326-V364 HydrophobicContact CG2-CG2 4.18Å; T360-V364 WeakPolarHBondContact O-CG2 3.23Å; T360-V364 PolarHBondContact O-N 3.4Å; F361-V364 PolarHBondContact O-N 3.11Å; V364-S367 PolarHBondContact O-OG 3.29Å; V364-S367 VanDerWaalsContact O-OG 3.09Å; V364-G368 PolarHBondContact O-N 3.18Å; V364-Y386 HydrophobicContact CB-CE2 4.41Å; V364-Y386 HydrophobicContact CG1-CD2 3.62Å; V364-Y386 HydrophobicContact CG1-CE2 3.94Å; V364-Y386 HydrophobicContact CG1-CG 3.94Å; V364-Y386 HydrophobicContact CG2-CD1 4.4Å; V364-Y386 HydrophobicContact CG2-CE1 4.35Å; V364-W426 HydrophobicContact CB-CZ3 4.12Å; V364-W426 HydrophobicContact CG1-CH2 4.38Å; V364-W426 HydrophobicContact CG1-CZ3 3.74Å; V364-L453 HydrophobicContact CG1-CD1 4.35Å
365R89.5Confident84Confident39 Ų3943.7 Ų43.715%0.14721%0.205CC..Hα-helixtrans-59.9-56.4174.2178-157.359.5-1460.3111.7F361 E362 R363 S367 G368 C369 M425 W426 R427 L449F361-R365 WeakPolarHBondContact O-CB 3.22Å; F361-R365 PolarHBondContact O-N 3.47Å; E362-R365 PolarHBondContact O-N 2.96Å; R363-R365 VanDerWaalsContact C-N 3.33Å; R365-S367 VanDerWaalsContact C-N 3.33Å; R365-S367 PolarHBondContact O-N 3.4Å; R365-G368 PolarHBondContact O-N 3.06Å; R365-G368 VanDerWaalsContact O-N 3.08Å; R365-C369 PolarHBondContact O-N 3.23Å; R365-C369 PolarHBondContact O-SG 3.23Å; R365-M425 VanDerWaalsContact CD-O 3.32Å; R365-M425 WeakPolarHBondContact CD-O 3.13Å; R365-W426 HydrophobicContact CB-CE3 4.31Å; R365-R427 WeakPolarHBondContact CD-O 3.4Å; R365-L449 HydrophobicContact CB-CD2 4.49Å; R365-L449 HydrophobicContact CG-CD2 4.49Å
366D87.3Confident82.6Confident26 Ų2644.9 Ų44.914%0.13920%0.203CC..Hα-helixtrans-63.6-39.4-171.7-68-12.2000111.5K322 E362 R363 W370K322-D366 HydrophobicContact CB-CB 4.19Å; K322-D366 WeakPolarHBondContact CD-OD2 3.36Å; E362-D366 VanDerWaalsContact O-CB 3.28Å; E362-D366 WeakPolarHBondContact O-CB 3.45Å; E362-D366 PolarHBondContact O-N 2.96Å; R363-D366 PolarHBondContact O-N 2.85Å; D366-W370 WeakPolarHBondContact O-CB 3.35Å; D366-W370 PolarHBondContact O-N 2.97Å
367S86.6Confident81.5Confident1 Ų149.3 Ų49.31%0.00724%0.24CC..Hα-helixtrans-66.1-39.3172.961.30000112.4C323 R363 V364 R365 W370 V371 Y386C323-S367 WeakPolarHBondContact O-CA 3.09Å; C323-S367 WeakPolarHBondContact O-CB 3.31Å; R363-S367 VanDerWaalsContact O-CB 3.28Å; R363-S367 WeakPolarHBondContact O-CB 3.25Å; R363-S367 PolarHBondContact O-N 3.46Å; R363-S367 PolarHBondContact O-OG 2.78Å; V364-S367 PolarHBondContact O-OG 3.29Å; V364-S367 VanDerWaalsContact O-OG 3.09Å; R365-S367 VanDerWaalsContact C-N 3.33Å; R365-S367 PolarHBondContact O-N 3.4Å; S367-W370 PolarHBondContact O-N 2.85Å; S367-V371 WeakPolarHBondContact O-CG2 3.44Å; S367-V371 PolarHBondContact O-N 3.26Å; S367-V371 VanDerWaalsContact O-N 3.16Å; S367-Y386 PolarHBondContact OG-OH 2.91Å
368G83.8Confident80.6Confident0 Ų053.4 Ų53.40%026%0.261CS..Hα-helixtrans-67.1-42.7175.900000114V364 R365 W370 V371 Q372V364-G368 PolarHBondContact O-N 3.18Å; R365-G368 PolarHBondContact O-N 3.06Å; R365-G368 VanDerWaalsContact O-N 3.08Å; G368-W370 VanDerWaalsContact C-N 3.34Å; G368-W370 PolarHBondContact O-N 3.17Å; G368-V371 PolarHBondContact O-N 2.77Å; G368-Q372 PolarHBondContact O-N 3Å
369C80.7Confident79.8Confident12 Ų1250.6 Ų50.68%0.08125%0.249CC..Hα-helixtrans-64.5-38.7174.9-61.30000111.8R365 V371 Q372 C428R365-C369 PolarHBondContact O-N 3.23Å; R365-C369 PolarHBondContact O-SG 3.23Å; C369-V371 PolarHBondContact O-N 2.91Å; C369-Q372 PolarHBondContact O-N 3.25Å; C369-C428 HydrophobicContact CB-CB 3.9Å; C369-C428 WeakPolarHBondContact CB-SG 3.4Å; C369-C428 WeakPolarHBondContact SG-CA 3.44Å; C369-C428 WeakPolarHBondContact SG-CB 3.12Å; C369-C428 CovalentContact SG-SG 2.04Å; C369-C428 PolarHBondContact SG-SG 3.21Å
370W76.6Confident79.3Confident88 Ų8855.8 Ų55.833%0.33327%0.271SS..Hα-helixtrans-61.4-43.8176.5-17884000111.9C323 D366 S367 G368 Q372 T373 R374 Y376C323-W370 HydrophobicContact CB-CB 3.92Å; C323-W370 HydrophobicContact CB-CG 3.91Å; D366-W370 WeakPolarHBondContact O-CB 3.35Å; D366-W370 PolarHBondContact O-N 2.97Å; S367-W370 PolarHBondContact O-N 2.85Å; G368-W370 VanDerWaalsContact C-N 3.34Å; G368-W370 PolarHBondContact O-N 3.17Å; W370-Q372 VanDerWaalsContact C-N 3.35Å; W370-Q372 PolarHBondContact O-N 3.45Å; W370-T373 PolarHBondContact O-N 3.28Å; W370-T373 VanDerWaalsContact O-N 3.09Å; W370-T373 PolarHBondContact O-OG1 3.45Å; W370-R374 PolarHBondContact O-N 3.12Å; W370-Y376 HydrophobicContact CZ3-CD2 4.19Å
371V70.8Confident78.9Confident9 Ų962.6 Ų62.66%0.05530%0.303CS..Hα-helixtrans-66.4-34.5178.6173.50000112.6S367 G368 C369 T373 R374 Y376 W379S367-V371 WeakPolarHBondContact O-CG2 3.44Å; S367-V371 PolarHBondContact O-N 3.26Å; S367-V371 VanDerWaalsContact O-N 3.16Å; G368-V371 PolarHBondContact O-N 2.77Å; C369-V371 PolarHBondContact O-N 2.91Å; V371-T373 PolarHBondContact O-N 3.47Å; V371-T373 VanDerWaalsContact O-N 3.12Å; V371-R374 CarbonylContact O-C 3.57Å; V371-R374 PolarHBondContact O-N 3.34Å; V371-R374 VanDerWaalsContact O-N 3.12Å; V371-Y376 HydrophobicContact CG2-CD1 4.4Å; V371-Y376 HydrophobicContact CG2-CG 4.18Å; V371-W379 HydrophobicContact CB-CD2 3.89Å; V371-W379 HydrophobicContact CB-CE3 3.7Å; V371-W379 HydrophobicContact CB-CG 4.41Å; V371-W379 HydrophobicContact CB-CZ3 4.12Å; V371-W379 HydrophobicContact CG1-CB 3.66Å; V371-W379 HydrophobicContact CG1-CD2 3.35Å; V371-W379 HydrophobicContact CG1-CE3 3.6Å; V371-W379 HydrophobicContact CG1-CG 3.37Å; V371-W379 HydrophobicContact CG1-CZ3 4.47Å; V371-W379 HydrophobicContact CG2-CD2 4.3Å; V371-W379 HydrophobicContact CG2-CE3 3.64Å; V371-W379 HydrophobicContact CG2-CZ3 4.02Å
372Q66.1Low78.5Confident40 Ų4063.6 Ų63.619%0.18731%0.309CS..Hα-helixtrans-58.8-25.4173.1-71.3-178.5-1.500112.8G368 C369 W370 K447 D452G368-Q372 PolarHBondContact O-N 3Å; C369-Q372 PolarHBondContact O-N 3.25Å; W370-Q372 VanDerWaalsContact C-N 3.35Å; W370-Q372 PolarHBondContact O-N 3.45Å; Q372-K447 PolarHBondContact NE2-O 3.31Å; Q372-K447 PolarHBondContact OE1-O 3.42Å; Q372-D452 PolarHBondContact NE2-OD2 3.48Å
373T66.7Low78.3Confident78 Ų7862.7 Ų62.748%0.47931%0.306SS..Hα-helixtrans-88.4-19177.668.10000114.5W370 V371 F446W370-T373 PolarHBondContact O-N 3.28Å; W370-T373 VanDerWaalsContact O-N 3.09Å; W370-T373 PolarHBondContact O-OG1 3.45Å; V371-T373 PolarHBondContact O-N 3.47Å; V371-T373 VanDerWaalsContact O-N 3.12Å; T373-F446 HydrophobicContact CG2-CE1 3.58Å; T373-F446 HydrophobicContact CG2-CZ 4.1Å
374R61.6Low78.3Confident161 Ų16166 Ų6661%0.60832%0.322SS*.SBendtrans-144.3116.6-174.1-72.2179.5176.3176.5-0.9109.7W370 V371 Y376W370-R374 PolarHBondContact O-N 3.12Å; V371-R374 CarbonylContact O-C 3.57Å; V371-R374 PolarHBondContact O-N 3.34Å; V371-R374 VanDerWaalsContact O-N 3.12Å; R374-Y376 PolarHBondContact O-N 3.47Å
375I59.2Low78.3Confident184 Ų18467.3 Ų67.394%0.94433%0.331SS*.  trans-50.498.7-179.3-53.7174000110
376Y65.6Low78.5Confident89 Ų8965.6 Ų65.635%0.34932%0.324SS..  trans-97.5118176.1-174.6-102.9000109.2W370 V371 R374 N378 W379 V382W370-Y376 HydrophobicContact CZ3-CD2 4.19Å; V371-Y376 HydrophobicContact CG2-CD1 4.4Å; V371-Y376 HydrophobicContact CG2-CG 4.18Å; R374-Y376 PolarHBondContact O-N 3.47Å; Y376-N378 VanDerWaalsContact C-N 3.25Å; Y376-N378 HydrophobicContact CD1-CB 4.31Å; Y376-N378 HydrophobicContact CE1-CB 3.75Å; Y376-N378 PolarHBondContact O-N 3.36Å; Y376-N378 VanDerWaalsContact O-N 3.15Å; Y376-W379 HydrophobicContact CD1-CB 4.3Å; Y376-W379 WeakPolarHBondContact O-CB 3.4Å; Y376-W379 PolarHBondContact O-N 2.75Å; Y376-V382 HydrophobicContact CE1-CG2 4.12Å
377A70.7Confident78.9Confident93 Ų9365.9 Ų65.977%0.76933%0.325SS*.THydrogen-bonded Turntrans-57.1-33.2-170.900000114.3
378N76.9Confident79.3Confident85 Ų8569.5 Ų69.546%0.45534%0.344SS..THydrogen-bonded Turntrans-100.915.9-175.1-63-9.3000113.7Y376 F380 Q381 V382Y376-N378 VanDerWaalsContact C-N 3.25Å; Y376-N378 HydrophobicContact CD1-CB 4.31Å; Y376-N378 HydrophobicContact CE1-CB 3.75Å; Y376-N378 PolarHBondContact O-N 3.36Å; Y376-N378 VanDerWaalsContact O-N 3.15Å; N378-F380 VanDerWaalsContact C-N 3.32Å; N378-F380 PolarHBondContact O-N 2.99Å; N378-Q381 PolarHBondContact O-N 2.88Å; N378-Q381 VanDerWaalsContact O-N 3.15Å; N378-V382 PolarHBondContact O-N 3Å
379W79.9Confident79.9Confident35 Ų3569.7 Ų69.713%0.13335%0.345CS..Hα-helixtrans-58.1-41.3-173.1178.6-123.6000113.6V371 Y376 Q381 V382 I383 Y386V371-W379 HydrophobicContact CB-CD2 3.89Å; V371-W379 HydrophobicContact CB-CE3 3.7Å; V371-W379 HydrophobicContact CB-CG 4.41Å; V371-W379 HydrophobicContact CB-CZ3 4.12Å; V371-W379 HydrophobicContact CG1-CB 3.66Å; V371-W379 HydrophobicContact CG1-CD2 3.35Å; V371-W379 HydrophobicContact CG1-CE3 3.6Å; V371-W379 HydrophobicContact CG1-CG 3.37Å; V371-W379 HydrophobicContact CG1-CZ3 4.47Å; V371-W379 HydrophobicContact CG2-CD2 4.3Å; V371-W379 HydrophobicContact CG2-CE3 3.64Å; V371-W379 HydrophobicContact CG2-CZ3 4.02Å; Y376-W379 HydrophobicContact CD1-CB 4.3Å; Y376-W379 WeakPolarHBondContact O-CB 3.4Å; Y376-W379 PolarHBondContact O-N 2.75Å; W379-Q381 PolarHBondContact O-N 3.24Å; W379-V382 HydrophobicContact CE3-CB 4.07Å; W379-V382 HydrophobicContact CE3-CG1 4.1Å; W379-V382 HydrophobicContact CZ3-CB 4.28Å; W379-V382 HydrophobicContact CZ3-CG1 3.83Å; W379-V382 PolarHBondContact O-N 2.84Å; W379-V382 VanDerWaalsContact O-N 3.11Å; W379-I383 HydrophobicContact CD2-CB 4.41Å; W379-I383 HydrophobicContact CH2-CB 4.25Å; W379-I383 HydrophobicContact CH2-CD1 4.3Å; W379-I383 HydrophobicContact CH2-CG1 4.31Å; W379-I383 HydrophobicContact CZ2-CB 3.95Å; W379-I383 HydrophobicContact CZ2-CD1 3.46Å; W379-I383 VanDerWaalsContact CZ2-CD1 3.46Å; W379-I383 HydrophobicContact CZ2-CG1 3.91Å; W379-I383 WeakPolarHBondContact O-CG2 3.17Å; W379-I383 PolarHBondContact O-N 3.45Å; W379-Y386 HydrophobicContact CH2-CE2 4.41Å; W379-Y386 HydrophobicContact CZ3-CE2 4.33Å
380F82.4Confident80.7Confident174 Ų17469.1 Ų69.176%0.76334%0.341SS*.Hα-helixtrans-57.7-35.6179.3-70.5-77.5000112.8N378 I383 E384N378-F380 VanDerWaalsContact C-N 3.32Å; N378-F380 PolarHBondContact O-N 2.99Å; F380-I383 WeakPolarHBondContact O-CG2 3.45Å; F380-E384 WeakPolarHBondContact O-CB 3.46Å; F380-E384 PolarHBondContact O-N 3.34Å
381Q84.4Confident81.6Confident143 Ų14369.4 Ų69.467%0.66834%0.342SS*.Hα-helixtrans-74.6-40.6176.4-66.3176.6-7.600111.7N378 W379 S385N378-Q381 PolarHBondContact O-N 2.88Å; N378-Q381 VanDerWaalsContact O-N 3.15Å; W379-Q381 PolarHBondContact O-N 3.24Å; Q381-S385 PolarHBondContact O-N 2.98Å
382V86.4Confident82.9Confident22 Ų2274.1 Ų74.113%0.13336%0.359CS..Hα-helixtrans-63.9-46178.2175.50000110.7P325 Y376 N378 W379 S385 Y386P325-V382 HydrophobicContact CB-CG1 4.09Å; P325-V382 HydrophobicContact CB-CG2 4.32Å; Y376-V382 HydrophobicContact CE1-CG2 4.12Å; N378-V382 PolarHBondContact O-N 3Å; W379-V382 HydrophobicContact CE3-CB 4.07Å; W379-V382 HydrophobicContact CE3-CG1 4.1Å; W379-V382 HydrophobicContact CZ3-CB 4.28Å; W379-V382 HydrophobicContact CZ3-CG1 3.83Å; W379-V382 PolarHBondContact O-N 2.84Å; W379-V382 VanDerWaalsContact O-N 3.11Å; V382-S385 WeakPolarHBondContact O-CB 3.44Å; V382-S385 PolarHBondContact O-N 2.69Å; V382-Y386 HydrophobicContact CG1-CD1 4.43Å; V382-Y386 HydrophobicContact CG1-CD2 4.25Å; V382-Y386 HydrophobicContact CG1-CE1 3.89Å; V382-Y386 HydrophobicContact CG1-CE2 3.74Å; V382-Y386 WeakPolarHBondContact O-CD1 3.5Å; V382-Y386 PolarHBondContact O-N 2.96Å
383I88Confident84.4Confident19 Ų1972.2 Ų72.210%0.09735%0.35CS..Hα-helixtrans-67.7-37.8-178.7-159.1167.2000112W379 F380 S385 Y386 K387 D452 L453W379-I383 HydrophobicContact CD2-CB 4.41Å; W379-I383 HydrophobicContact CH2-CB 4.25Å; W379-I383 HydrophobicContact CH2-CD1 4.3Å; W379-I383 HydrophobicContact CH2-CG1 4.31Å; W379-I383 HydrophobicContact CZ2-CB 3.95Å; W379-I383 HydrophobicContact CZ2-CD1 3.46Å; W379-I383 VanDerWaalsContact CZ2-CD1 3.46Å; W379-I383 HydrophobicContact CZ2-CG1 3.91Å; W379-I383 WeakPolarHBondContact O-CG2 3.17Å; W379-I383 PolarHBondContact O-N 3.45Å; F380-I383 WeakPolarHBondContact O-CG2 3.45Å; I383-S385 VanDerWaalsContact C-N 3.32Å; I383-S385 PolarHBondContact O-N 3.19Å; I383-Y386 PolarHBondContact O-N 3.45Å; I383-K387 WeakPolarHBondContact O-CG 3.43Å; I383-K387 PolarHBondContact O-N 2.98Å; I383-D452 HydrophobicContact CD1-CB 3.75Å; I383-D452 WeakPolarHBondContact CD1-O 3.49Å; I383-L453 HydrophobicContact CG1-CD2 4.21Å
384E90.2Very high85.8Confident88 Ų8868.6 Ų68.641%0.41133%0.328SS..Hα-helixtrans-66.9-36.1174.3-167.156.6-14300111.3F380 Y386 K387 N388 R391F380-E384 WeakPolarHBondContact O-CB 3.46Å; F380-E384 PolarHBondContact O-N 3.34Å; E384-Y386 VanDerWaalsContact C-N 3.31Å; E384-Y386 PolarHBondContact O-N 2.92Å; E384-K387 PolarHBondContact O-N 3.3Å; E384-N388 VanDerWaalsContact O-CB 3.3Å; E384-N388 WeakPolarHBondContact O-CB 3.45Å; E384-N388 PolarHBondContact O-N 2.65Å; E384-R391 IonicContact OE1-CZ 3.86Å; E384-R391 IonicContact OE1-NH1 2.87Å; E384-R391 PolarHBondContact OE1-NH1 3.49Å; E384-R391 IonicContact OE1-NH2 3.25Å
385S91Very high87.4Confident28 Ų2863.2 Ų63.220%0.19632%0.317CS..Hα-helixtrans-61.9-38.4171.3-175.30000112.1S328 Q381 V382 I383 F389S328-S385 WeakPolarHBondContact CB-OG 3.35Å; S328-S385 PolarHBondContact OG-OG 2.93Å; Q381-S385 PolarHBondContact O-N 2.98Å; V382-S385 WeakPolarHBondContact O-CB 3.44Å; V382-S385 PolarHBondContact O-N 2.69Å; I383-S385 VanDerWaalsContact C-N 3.32Å; I383-S385 PolarHBondContact O-N 3.19Å; S385-F389 WeakPolarHBondContact O-CB 3.4Å; S385-F389 PolarHBondContact O-N 3.35Å
386Y94Very high89.1Confident2 Ų256.3 Ų56.31%0.00828%0.279CS..Hα-helixtrans-69.4-44.7176.5-67.1-9.8000111.9P325 V326 L331 V364 S367 W379 V382 I383 E384 N388 F389 L390P325-Y386 WeakPolarHBondContact CA-OH 3.43Å; V326-Y386 HydrophobicContact CB-CE1 3.9Å; V326-Y386 HydrophobicContact CG2-CE1 4.46Å; V326-Y386 PolarHBondContact N-OH 3.32Å; L331-Y386 HydrophobicContact CD1-CD1 3.9Å; L331-Y386 HydrophobicContact CD1-CE1 4.23Å; V364-Y386 HydrophobicContact CB-CE2 4.41Å; V364-Y386 HydrophobicContact CG1-CD2 3.62Å; V364-Y386 HydrophobicContact CG1-CE2 3.94Å; V364-Y386 HydrophobicContact CG1-CG 3.94Å; V364-Y386 HydrophobicContact CG2-CD1 4.4Å; V364-Y386 HydrophobicContact CG2-CE1 4.35Å; S367-Y386 PolarHBondContact OG-OH 2.91Å; W379-Y386 HydrophobicContact CH2-CE2 4.41Å; W379-Y386 HydrophobicContact CZ3-CE2 4.33Å; V382-Y386 HydrophobicContact CG1-CD1 4.43Å; V382-Y386 HydrophobicContact CG1-CD2 4.25Å; V382-Y386 HydrophobicContact CG1-CE1 3.89Å; V382-Y386 HydrophobicContact CG1-CE2 3.74Å; V382-Y386 WeakPolarHBondContact O-CD1 3.5Å; V382-Y386 PolarHBondContact O-N 2.96Å; I383-Y386 PolarHBondContact O-N 3.45Å; E384-Y386 VanDerWaalsContact C-N 3.31Å; E384-Y386 PolarHBondContact O-N 2.92Å; Y386-N388 VanDerWaalsContact C-N 3.35Å; Y386-N388 PolarHBondContact O-N 3.16Å; Y386-F389 PolarHBondContact O-N 2.86Å; Y386-L390 WeakPolarHBondContact O-CG 3.35Å; Y386-L390 PolarHBondContact O-N 3.25Å
387K94.4Very high90.4Very high33 Ų3352 Ų5214%0.14326%0.263CS..Hα-helixtrans-56.6-48.6173.6-75.7179.7168.1-142.60111.3I383 E384 F389 L390 R391 D452 L453 D454I383-K387 WeakPolarHBondContact O-CG 3.43Å; I383-K387 PolarHBondContact O-N 2.98Å; E384-K387 PolarHBondContact O-N 3.3Å; K387-F389 PolarHBondContact O-N 3.04Å; K387-L390 PolarHBondContact O-N 2.84Å; K387-R391 WeakPolarHBondContact O-CB 3.17Å; K387-R391 VanDerWaalsContact O-CG 3.3Å; K387-R391 WeakPolarHBondContact O-CG 3.44Å; K387-R391 PolarHBondContact O-N 3.37Å; K387-D452 WeakPolarHBondContact CE-O 3.46Å; K387-L453 HydrophobicContact CG-CD2 4.49Å; K387-D454 WeakPolarHBondContact CE-OD2 3.47Å; K387-D454 IonicContact NZ-OD1 2.98Å; K387-D454 PolarHBondContact NZ-OD1 3.23Å; K387-D454 IonicContact NZ-OD2 3.8Å; K387-D454 PolarHBondContact NZ-OD2 3.24Å
388N95.4Very high91.5Very high77 Ų7749 Ų4941%0.41223%0.233SC..Hα-helixtrans-60.5-44.9178.4-172.918.4000111.9E384 Y386 L390 R391 R392E384-N388 VanDerWaalsContact O-CB 3.3Å; E384-N388 WeakPolarHBondContact O-CB 3.45Å; E384-N388 PolarHBondContact O-N 2.65Å; Y386-N388 VanDerWaalsContact C-N 3.35Å; Y386-N388 PolarHBondContact O-N 3.16Å; N388-L390 PolarHBondContact O-N 3.21Å; N388-R391 PolarHBondContact O-N 3.1Å; N388-R392 WeakPolarHBondContact O-CB 3.27Å; N388-R392 WeakPolarHBondContact O-CG 3.39Å; N388-R392 PolarHBondContact O-N 3.49Å; N388-R392 WeakPolarHBondContact OD1-CD 3.48Å
389F96.4Very high91.9Very high4 Ų448.5 Ų48.52%0.01823%0.23CC..Hα-helixtrans-57.8-48.9174.2163.1-106.5000112.3L331 L334 L335 F361 S385 Y386 K387 R392 L393L331-F389 HydrophobicContact CB-CB 4.14Å; L331-F389 HydrophobicContact CB-CD2 3.61Å; L331-F389 HydrophobicContact CB-CE2 4.18Å; L331-F389 HydrophobicContact CB-CG 3.9Å; L331-F389 HydrophobicContact CD1-CB 3.86Å; L331-F389 HydrophobicContact CD1-CD1 4.37Å; L331-F389 HydrophobicContact CD1-CG 4.02Å; L331-F389 HydrophobicContact CD2-CD1 3.85Å; L331-F389 HydrophobicContact CD2-CD2 4Å; L331-F389 HydrophobicContact CD2-CE1 3.92Å; L331-F389 HydrophobicContact CD2-CE2 4.07Å; L331-F389 HydrophobicContact CD2-CG 3.88Å; L331-F389 HydrophobicContact CD2-CZ 4.03Å; L331-F389 HydrophobicContact CG-CB 4.42Å; L331-F389 HydrophobicContact CG-CD2 4.26Å; L331-F389 HydrophobicContact CG-CG 4.14Å; L334-F389 HydrophobicContact CD2-CE2 4.09Å; L334-F389 HydrophobicContact CD2-CZ 3.82Å; L335-F389 HydrophobicContact CD1-CD2 3.96Å; L335-F389 HydrophobicContact CD1-CE2 4.48Å; L335-F389 HydrophobicContact CD2-CD2 4.28Å; L335-F389 HydrophobicContact CD2-CE2 4.1Å; L335-F389 HydrophobicContact CG-CD2 3.95Å; L335-F389 HydrophobicContact CG-CE2 3.96Å; F361-F389 HydrophobicContact CD1-CE1 4.42Å; F361-F389 AromaticContact CE1-CE1 3.96Å; F361-F389 HydrophobicContact CE1-CE1 3.96Å; F361-F389 HydrophobicContact CE1-CZ 4.3Å; S385-F389 WeakPolarHBondContact O-CB 3.4Å; S385-F389 PolarHBondContact O-N 3.35Å; Y386-F389 PolarHBondContact O-N 2.86Å; K387-F389 PolarHBondContact O-N 3.04Å; F389-R392 PolarHBondContact O-N 3.31Å; F389-L393 HydrophobicContact CE1-CD2 4.25Å; F389-L393 HydrophobicContact CE2-CD2 4.48Å; F389-L393 HydrophobicContact CZ-CD2 3.87Å; F389-L393 WeakPolarHBondContact O-CB 3.26Å; F389-L393 PolarHBondContact O-N 2.74Å
390L97.1Very high92.3Very high0 Ų047.1 Ų47.10%023%0.226CC..Hα-helixtrans-66.4-39.3-179.3-67.8174.9000112.4F361 Y386 K387 N388 L393 N394 M420 W426 L453 I455 L458F361-L390 HydrophobicContact CD1-CD2 4.49Å; F361-L390 HydrophobicContact CE1-CD2 3.95Å; F361-L390 HydrophobicContact CZ-CD2 4.41Å; Y386-L390 WeakPolarHBondContact O-CG 3.35Å; Y386-L390 PolarHBondContact O-N 3.25Å; K387-L390 PolarHBondContact O-N 2.84Å; N388-L390 PolarHBondContact O-N 3.21Å; L390-L393 PolarHBondContact O-N 3.37Å; L390-N394 VanDerWaalsContact O-CB 3.3Å; L390-N394 WeakPolarHBondContact O-CB 3.23Å; L390-N394 PolarHBondContact O-N 2.93Å; L390-M420 HydrophobicContact CD2-CG 4.44Å; L390-M420 HydrophobicContact CD2-SD 4.17Å; L390-W426 HydrophobicContact CD1-CH2 4.16Å; L390-W426 HydrophobicContact CD1-CZ2 4.3Å; L390-W426 HydrophobicContact CD2-CH2 4Å; L390-W426 HydrophobicContact CD2-CZ2 4.12Å; L390-L453 HydrophobicContact CD1-CB 4.09Å; L390-L453 HydrophobicContact CD1-CD1 4.14Å; L390-L453 HydrophobicContact CD1-CD2 4.24Å; L390-L453 HydrophobicContact CD1-CG 4.4Å; L390-I455 HydrophobicContact CD1-CD1 3.9Å; L390-L458 HydrophobicContact CB-CD1 3.81Å
391R97.6Very high92.5Very high93 Ų9339 Ų3935%0.35119%0.191SC..Hα-helixtrans-60.1-46.5173.6-72.2176.1-162.6135.60.1111.5E384 K387 N388 N394 A395 D454 L458E384-R391 IonicContact OE1-CZ 3.86Å; E384-R391 IonicContact OE1-NH1 2.87Å; E384-R391 PolarHBondContact OE1-NH1 3.49Å; E384-R391 IonicContact OE1-NH2 3.25Å; K387-R391 WeakPolarHBondContact O-CB 3.17Å; K387-R391 VanDerWaalsContact O-CG 3.3Å; K387-R391 WeakPolarHBondContact O-CG 3.44Å; K387-R391 PolarHBondContact O-N 3.37Å; N388-R391 PolarHBondContact O-N 3.1Å; R391-N394 PolarHBondContact O-N 3.03Å; R391-A395 WeakPolarHBondContact O-CB 3.42Å; R391-A395 PolarHBondContact O-N 3.16Å; R391-D454 IonicContact CZ-OD2 2.93Å; R391-D454 IonicContact NH2-OD2 2.73Å; R391-D454 PolarHBondContact NH2-OD2 3.15Å; R391-L458 HydrophobicContact CB-CD2 4.34Å; R391-L458 HydrophobicContact CG-CD2 3.81Å
392R97.3Very high92.3Very high108 Ų10836.6 Ų36.641%0.40819%0.185SC..Hα-helixtrans-66.8-39.6177.7-72.4172.462.8-156.3-2.3112.5D332 L335 N388 F389 N394 A395 W396D332-R392 IonicContact OD1-CZ 3.78Å; D332-R392 IonicContact OD1-NH1 3.52Å; D332-R392 PolarHBondContact OD1-NH1 3.5Å; D332-R392 IonicContact OD1-NH2 3.66Å; L335-R392 HydrophobicContact CD1-CB 3.85Å; N388-R392 WeakPolarHBondContact O-CB 3.27Å; N388-R392 WeakPolarHBondContact O-CG 3.39Å; N388-R392 PolarHBondContact O-N 3.49Å; N388-R392 WeakPolarHBondContact OD1-CD 3.48Å; F389-R392 PolarHBondContact O-N 3.31Å; R392-N394 VanDerWaalsContact C-N 3.32Å; R392-A395 PolarHBondContact O-N 3.15Å; R392-W396 WeakPolarHBondContact O-CB 3.33Å; R392-W396 PolarHBondContact O-N 3.25Å
393L97.1Very high91.5Very high0 Ų038.6 Ų38.60%019%0.193CC..Hα-helixtrans-63.9-40.6175-175.661.4000111.2L335 L338 F361 F389 L390 W396 A397 I416 M420L335-L393 HydrophobicContact CD2-CB 3.89Å; L335-L393 HydrophobicContact CD2-CD1 3.84Å; L335-L393 HydrophobicContact CD2-CG 4.47Å; L338-L393 HydrophobicContact CD1-CD1 3.48Å; L338-L393 VanDerWaalsContact CD1-CD1 3.48Å; F361-L393 HydrophobicContact CE1-CD2 3.67Å; F361-L393 HydrophobicContact CZ-CD2 3.56Å; F389-L393 HydrophobicContact CE1-CD2 4.25Å; F389-L393 HydrophobicContact CE2-CD2 4.48Å; F389-L393 HydrophobicContact CZ-CD2 3.87Å; F389-L393 WeakPolarHBondContact O-CB 3.26Å; F389-L393 PolarHBondContact O-N 2.74Å; L390-L393 PolarHBondContact O-N 3.37Å; L393-W396 HydrophobicContact CD1-CE3 3.94Å; L393-W396 HydrophobicContact CD1-CZ3 4.36Å; L393-A397 WeakPolarHBondContact O-CB 3.37Å; L393-A397 PolarHBondContact O-N 3.3Å; L393-I416 HydrophobicContact CD1-CG2 4.13Å; L393-I416 HydrophobicContact CD2-CG2 3.85Å; L393-I416 HydrophobicContact CG-CG2 3.99Å; L393-M420 HydrophobicContact CD2-SD 4.43Å
394N96.5Very high90.5Very high3 Ų339.4 Ų39.42%0.01620%0.198CC..Hα-helixtrans-65.2-47.2176.4-163.843.3000112.1L390 R391 R392 W396 A397 I398 M420 Y421 L458L390-N394 VanDerWaalsContact O-CB 3.3Å; L390-N394 WeakPolarHBondContact O-CB 3.23Å; L390-N394 PolarHBondContact O-N 2.93Å; R391-N394 PolarHBondContact O-N 3.03Å; R392-N394 VanDerWaalsContact C-N 3.32Å; N394-W396 VanDerWaalsContact C-N 3.35Å; N394-W396 PolarHBondContact O-N 2.96Å; N394-A397 PolarHBondContact O-N 3.12Å; N394-I398 VanDerWaalsContact O-CG1 3.31Å; N394-I398 WeakPolarHBondContact O-CG1 3.21Å; N394-I398 PolarHBondContact O-N 3.24Å; N394-M420 HydrophobicContact CB-CE 3.66Å; N394-M420 HydrophobicContact CB-SD 4.37Å; N394-M420 WeakPolarHBondContact OD1-CE 3.34Å; N394-Y421 PolarHBondContact ND2-OH 3.4Å; N394-Y421 PolarHBondContact OD1-OH 3.32Å; N394-L458 HydrophobicContact CB-CD2 4.02Å; N394-L458 PolarHBondContact ND2-O 3Å
395A94.8Very high89.3Confident47 Ų4736.2 Ų36.239%0.38818%0.184SC..Hα-helixtrans-57.7-47.1175.300000111.4R391 R392 A397 I398 D399R391-A395 WeakPolarHBondContact O-CB 3.42Å; R391-A395 PolarHBondContact O-N 3.16Å; R392-A395 PolarHBondContact O-N 3.15Å; A395-A397 VanDerWaalsContact C-N 3.33Å; A395-A397 PolarHBondContact O-N 3.45Å; A395-I398 PolarHBondContact O-N 2.95Å; A395-D399 WeakPolarHBondContact O-CB 3.5Å; A395-D399 PolarHBondContact O-N 3.39Å
396W94.3Very high88.3Confident39 Ų3936.4 Ų36.415%0.14818%0.181CC..Hα-helixtrans-57.7-43.6174.716882000112.5L338 A342 R392 L393 N394 D399 C400 A413 I416L338-W396 HydrophobicContact CB-CH2 4.16Å; L338-W396 HydrophobicContact CB-CZ2 3.86Å; L338-W396 HydrophobicContact CD1-CH2 4.47Å; L338-W396 HydrophobicContact CD1-CZ3 4.28Å; L338-W396 HydrophobicContact CD2-CH2 4.3Å; A342-W396 HydrophobicContact CB-CH2 4.01Å; A342-W396 HydrophobicContact CB-CZ2 3.61Å; R392-W396 WeakPolarHBondContact O-CB 3.33Å; R392-W396 PolarHBondContact O-N 3.25Å; L393-W396 HydrophobicContact CD1-CE3 3.94Å; L393-W396 HydrophobicContact CD1-CZ3 4.36Å; N394-W396 VanDerWaalsContact C-N 3.35Å; N394-W396 PolarHBondContact O-N 2.96Å; W396-D399 PolarHBondContact O-N 3.34Å; W396-C400 VanDerWaalsContact CZ2-SG 3.59Å; W396-C400 PolarHBondContact O-N 3.24Å; W396-C400 PolarHBondContact O-SG 3.41Å; W396-A413 HydrophobicContact CZ3-CB 4.38Å; W396-I416 HydrophobicContact CH2-CD1 3.98Å; W396-I416 HydrophobicContact CZ3-CD1 3.68Å
397A94.6Very high87.7Confident0 Ų039.5 Ų39.50%020%0.195CC..Hα-helixtrans-67-40179.500000111.1L393 N394 A395 C400 L401 A413 M417L393-A397 WeakPolarHBondContact O-CB 3.37Å; L393-A397 PolarHBondContact O-N 3.3Å; N394-A397 PolarHBondContact O-N 3.12Å; A395-A397 VanDerWaalsContact C-N 3.33Å; A395-A397 PolarHBondContact O-N 3.45Å; A397-C400 WeakPolarHBondContact O-CB 3.27Å; A397-C400 PolarHBondContact O-N 2.92Å; A397-L401 WeakPolarHBondContact O-CG 3.47Å; A397-L401 PolarHBondContact O-N 3.11Å; A397-L401 VanDerWaalsContact O-N 3.11Å; A397-A413 HydrophobicContact CB-CB 4.07Å; A397-M417 HydrophobicContact CB-CE 3.4Å; A397-M417 HydrophobicContact CB-CG 3.84Å; A397-M417 HydrophobicContact CB-SD 4.4Å
398I92.9Very high87.1Confident28 Ų2838.7 Ų38.714%0.14419%0.193CC..Hα-helixtrans-61.4-48.6174.3-70.8167.8000110N394 A395 C400 L401 V402 M417 D461 V465N394-I398 VanDerWaalsContact O-CG1 3.31Å; N394-I398 WeakPolarHBondContact O-CG1 3.21Å; N394-I398 PolarHBondContact O-N 3.24Å; A395-I398 PolarHBondContact O-N 2.95Å; I398-C400 PolarHBondContact O-N 3.48Å; I398-L401 PolarHBondContact O-N 3.5Å; I398-V402 HydrophobicContact CG2-CG2 4.31Å; I398-V402 WeakPolarHBondContact O-CG2 3.44Å; I398-V402 PolarHBondContact O-N 3.41Å; I398-M417 HydrophobicContact CB-CE 4.33Å; I398-M417 HydrophobicContact CG1-CE 3.6Å; I398-M417 VanDerWaalsContact N-CE 3.32Å; I398-D461 HydrophobicContact CD1-CB 4.34Å; I398-V465 HydrophobicContact CG2-CB 4.47Å; I398-V465 HydrophobicContact CG2-CG1 4.49Å; I398-V465 HydrophobicContact CG2-CG2 3.98Å
399D86.2Confident86.6Confident75 Ų7535.2 Ų35.240%0.40118%0.175SC..Hα-helixtrans-58.4-38.8176.5-75.2-30.9000111.3A395 W396 L401 V402 Q403A395-D399 WeakPolarHBondContact O-CB 3.5Å; A395-D399 PolarHBondContact O-N 3.39Å; W396-D399 PolarHBondContact O-N 3.34Å; D399-L401 VanDerWaalsContact C-N 3.32Å; D399-L401 PolarHBondContact O-N 2.9Å; D399-V402 PolarHBondContact O-N 3.26Å; D399-Q403 WeakPolarHBondContact O-CA 3.06Å; D399-Q403 WeakPolarHBondContact O-CB 3.02Å; D399-Q403 WeakPolarHBondContact O-CG 3.44Å; D399-Q403 PolarHBondContact O-N 3.29Å; D399-Q403 PolarHBondContact OD1-NE2 3.41Å
400C86.7Confident86.2Confident6 Ų635.4 Ų35.44%0.04118%0.176CC..Hα-helixtrans-62.4-38.4174.1-71.70000112.6W396 A397 I398 N404 A413W396-C400 VanDerWaalsContact CZ2-SG 3.59Å; W396-C400 PolarHBondContact O-N 3.24Å; W396-C400 PolarHBondContact O-SG 3.41Å; A397-C400 WeakPolarHBondContact O-CB 3.27Å; A397-C400 PolarHBondContact O-N 2.92Å; I398-C400 PolarHBondContact O-N 3.48Å; C400-N404 WeakPolarHBondContact CA-ND2 3.44Å; C400-N404 VanDerWaalsContact O-CB 3.25Å; C400-N404 WeakPolarHBondContact O-CB 3.35Å; C400-N404 PolarHBondContact O-N 3.27Å; C400-N404 VanDerWaalsContact O-N 3.1Å; C400-A413 HydrophobicContact CB-CB 3.73Å
401L87.5Confident85.9Confident5 Ų535.6 Ų35.63%0.02618%0.177CC..Hα-helixtrans-78.8-23.7180-62.8179.7000113.7A397 I398 D399 R410 A413 L414 M417 V465 L466A397-L401 WeakPolarHBondContact O-CG 3.47Å; A397-L401 PolarHBondContact O-N 3.11Å; A397-L401 VanDerWaalsContact O-N 3.11Å; I398-L401 PolarHBondContact O-N 3.5Å; D399-L401 VanDerWaalsContact C-N 3.32Å; D399-L401 PolarHBondContact O-N 2.9Å; L401-R410 HydrophobicContact CD2-CB 4Å; L401-R410 HydrophobicContact CD2-CG 4.32Å; L401-R410 PolarHBondContact O-NH1 3.29Å; L401-A413 HydrophobicContact CD2-CB 4.27Å; L401-A413 HydrophobicContact CG-CB 4.38Å; L401-L414 HydrophobicContact CD1-CD2 3.88Å; L401-L414 HydrophobicContact CD1-CG 4.36Å; L401-L414 HydrophobicContact CD2-CD1 4.39Å; L401-L414 HydrophobicContact CD2-CD2 4.19Å; L401-L414 HydrophobicContact CD2-CG 3.81Å; L401-M417 HydrophobicContact CD1-CE 3.77Å; L401-M417 HydrophobicContact CD1-SD 3.75Å; L401-V465 HydrophobicContact CB-CG1 3.58Å; L401-V465 HydrophobicContact CD1-CG1 4.31Å; L401-L466 HydrophobicContact CD1-CD2 4.18Å
402V79.7Confident85.7Confident91 Ų9131.2 Ų31.255%0.55216%0.161SC*.Hα-helixtrans-88.6-47.7176177.20000111I398 D399 V465I398-V402 HydrophobicContact CG2-CG2 4.31Å; I398-V402 WeakPolarHBondContact O-CG2 3.44Å; I398-V402 PolarHBondContact O-N 3.41Å; D399-V402 PolarHBondContact O-N 3.26Å; V402-V465 HydrophobicContact CG2-CB 4.36Å; V402-V465 HydrophobicContact CG2-CG1 3.69Å; V402-V465 HydrophobicContact CG2-CG2 3.68Å
403Q70Confident85.6Confident65 Ų6526.1 Ų26.130%0.30414%0.141SC..Hα-helixtrans-95.1-25.2-168.3-54.1-178.527.300113.4D399 H1395D399-Q403 WeakPolarHBondContact O-CA 3.06Å; D399-Q403 WeakPolarHBondContact O-CB 3.02Å; D399-Q403 WeakPolarHBondContact O-CG 3.44Å; D399-Q403 PolarHBondContact O-N 3.29Å; D399-Q403 PolarHBondContact OD1-NE2 3.41Å; Q403-H1395 PolarHBondContact O-CE1 2.95Å; Q403-H1395 PolarHBondContact O-ND1 2.54Å
404N67.2Low85.5Confident36 Ų3626.1 Ų26.119%0.19314%0.141CC..  trans-96.7135.5-179.4-65.5-49.7000112.3C400 R410C400-N404 WeakPolarHBondContact CA-ND2 3.44Å; C400-N404 VanDerWaalsContact O-CB 3.25Å; C400-N404 WeakPolarHBondContact O-CB 3.35Å; C400-N404 PolarHBondContact O-N 3.27Å; C400-N404 VanDerWaalsContact O-N 3.1Å; N404-R410 VanDerWaalsContact O-CD 3.28Å; N404-R410 WeakPolarHBondContact O-CD 3.35Å; N404-R410 PolarHBondContact O-NH1 3.08Å
405L65.6Low85.5Confident21 Ų2128.8 Ų28.811%0.1115%0.151CC..  trans-91.1-16.8171.3-66.4169.3000112.7L1350 R1391 I1392 H1395L405-L1350 HydrophobicContact CB-CB 4.47Å; L405-L1350 HydrophobicContact CB-CD2 4.26Å; L405-L1350 HydrophobicContact CD1-CD2 3.97Å; L405-L1350 HydrophobicContact CD2-CD2 4.5Å; L405-L1350 HydrophobicContact CG-CD2 4.48Å; L405-R1391 HydrophobicContact CD2-CB 4.46Å; L405-I1392 HydrophobicContact CD1-CG1 4.47Å; L405-I1392 HydrophobicContact CD2-CG1 4.23Å; L405-H1395 HydrophobicContact CD1-CB 4.37Å
406Q69.7Low85.6Confident31 Ų3126.5 Ų26.515%0.14513%0.132CC..  trans-71.2134.7-174.6-68.2-178-27.400113S408 R410 L1354Q406-S408 PolarHBondContact O-N 2.81Å; Q406-R410 WeakPolarHBondContact O-CD 3.33Å; Q406-R410 WeakPolarHBondContact O-CG 3.49Å; Q406-R410 PolarHBondContact O-N 3.48Å; Q406-L1354 HydrophobicContact CG-CD1 4.22Å
407F80.8Confident85.6Confident68 Ų6824.7 Ų24.730%0.29813%0.126SC..Hα-helixtrans-55.3-47.4177.3173.1-110.7000113.3R410 L411 Y474 K476F407-R410 PolarHBondContact O-N 2.84Å; F407-L411 HydrophobicContact CE1-CD2 3.91Å; F407-L411 HydrophobicContact CE2-CB 4.5Å; F407-L411 HydrophobicContact CE2-CD2 4.48Å; F407-L411 HydrophobicContact CZ-CD2 3.76Å; F407-L411 WeakPolarHBondContact O-CB 3.22Å; F407-L411 PolarHBondContact O-N 3.23Å; F407-Y474 HydrophobicContact CB-CD1 4.3Å; F407-Y474 HydrophobicContact CB-CD2 4Å; F407-Y474 HydrophobicContact CB-CE1 4.07Å; F407-Y474 HydrophobicContact CB-CE2 3.74Å; F407-Y474 HydrophobicContact CB-CG 4.27Å; F407-Y474 AromaticContact CD2-CD1 3.82Å; F407-Y474 HydrophobicContact CD2-CD1 3.82Å; F407-Y474 AromaticContact CD2-CD2 3.85Å; F407-Y474 HydrophobicContact CD2-CD2 3.85Å; F407-Y474 HydrophobicContact CD2-CE1 4.43Å; F407-Y474 HydrophobicContact CD2-CE2 4.45Å; F407-Y474 AromaticContact CD2-CG 3.5Å; F407-Y474 HydrophobicContact CD2-CG 3.5Å; F407-Y474 HydrophobicContact CE2-CG 4.26Å; F407-Y474 HydrophobicContact CG-CD1 4.28Å; F407-Y474 HydrophobicContact CG-CD2 4.4Å; F407-Y474 HydrophobicContact CG-CE1 4.46Å; F407-Y474 HydrophobicContact CG-CG 4.25Å; F407-K476 HydrophobicContact CE2-CB 4.25Å; F407-K476 HydrophobicContact CZ-CD 4.09Å
408S81.1Confident85.7Confident15 Ų1525.8 Ų25.811%0.10513%0.131CC..Hα-helixtrans-62.1-51.4-173.846.70000112.9A342 N343 E344 Q406 R410 L411 C412A342-S408 CarbonylContact O-C 3.48Å; N343-S408 PolarHBondContact O-OG 2.77Å; E344-S408 WeakPolarHBondContact O-CB 2.87Å; Q406-S408 PolarHBondContact O-N 2.81Å; S408-R410 PolarHBondContact O-N 3.32Å; S408-L411 PolarHBondContact O-N 3.5Å; S408-C412 WeakPolarHBondContact O-CB 3.28Å; S408-C412 PolarHBondContact O-N 2.98Å
409S84.5Confident85.8Confident5 Ų525.5 Ų25.54%0.03513%0.13CC..Hα-helixtrans-62.7-42.6179.6-54.50000112.3A342 N343 C412 A413A342-S409 VanDerWaalsContact O-CA 3.23Å; A342-S409 WeakPolarHBondContact O-CA 3.28Å; A342-S409 PolarHBondContact O-N 3.36Å; A342-S409 PolarHBondContact O-OG 2.86Å; N343-S409 WeakPolarHBondContact CA-OG 3.34Å; N343-S409 WeakPolarHBondContact CB-OG 3.29Å; N343-S409 PolarHBondContact N-OG 2.9Å; S409-C412 PolarHBondContact O-N 3.25Å; S409-A413 WeakPolarHBondContact O-CB 3.32Å; S409-A413 PolarHBondContact O-N 3.42Å
410R89Confident86.2Confident8 Ų822 Ų223%0.0311%0.111CC..Hα-helixtrans-66.7-43.2178.5-64172.373.174.112111.3L401 N404 Q406 F407 S408 A413 L414 D472L401-R410 HydrophobicContact CD2-CB 4Å; L401-R410 HydrophobicContact CD2-CG 4.32Å; L401-R410 PolarHBondContact O-NH1 3.29Å; N404-R410 VanDerWaalsContact O-CD 3.28Å; N404-R410 WeakPolarHBondContact O-CD 3.35Å; N404-R410 PolarHBondContact O-NH1 3.08Å; Q406-R410 WeakPolarHBondContact O-CD 3.33Å; Q406-R410 WeakPolarHBondContact O-CG 3.49Å; Q406-R410 PolarHBondContact O-N 3.48Å; F407-R410 PolarHBondContact O-N 2.84Å; S408-R410 PolarHBondContact O-N 3.32Å; R410-A413 PolarHBondContact O-N 2.99Å; R410-L414 WeakPolarHBondContact O-CB 3.48Å; R410-L414 WeakPolarHBondContact O-CG 3.33Å; R410-L414 PolarHBondContact O-N 2.87Å; R410-D472 IonicContact CZ-OD2 3.46Å; R410-D472 IonicContact NE-OD2 2.87Å; R410-D472 PolarHBondContact NE-OD2 3.39Å; R410-D472 IonicContact NH2-OD2 3.16Å; R410-D472 PolarHBondContact NH2-OD2 2.9Å
411L91.4Very high86.5Confident3 Ų321.8 Ų21.82%0.01611%0.11CC..Hα-helixtrans-60.1-46.7175.1177.764.9000110.8F407 S408 L414 R415 K476 I480F407-L411 HydrophobicContact CE1-CD2 3.91Å; F407-L411 HydrophobicContact CE2-CB 4.5Å; F407-L411 HydrophobicContact CE2-CD2 4.48Å; F407-L411 HydrophobicContact CZ-CD2 3.76Å; F407-L411 WeakPolarHBondContact O-CB 3.22Å; F407-L411 PolarHBondContact O-N 3.23Å; S408-L411 PolarHBondContact O-N 3.5Å; L411-L414 PolarHBondContact O-N 3.31Å; L411-R415 HydrophobicContact CD1-CG 4.07Å; L411-R415 HydrophobicContact CG-CG 4.37Å; L411-R415 WeakPolarHBondContact O-CB 3.41Å; L411-R415 WeakPolarHBondContact O-CG 3.36Å; L411-R415 PolarHBondContact O-N 3.4Å; L411-K476 HydrophobicContact CD1-CD 4.11Å; L411-K476 HydrophobicContact CD1-CG 4.24Å; L411-K476 HydrophobicContact CD2-CD 4.48Å; L411-I480 HydrophobicContact CD1-CD1 3.52Å
412C92.4Very high86.7Confident2 Ų222.6 Ų22.61%0.01412%0.117CC..Hα-helixtrans-60.9-48.1178.1-165.90000111.2A342 S408 S409 L414 R415 I416A342-C412 HydrophobicContact CB-CB 4.38Å; S408-C412 WeakPolarHBondContact O-CB 3.28Å; S408-C412 PolarHBondContact O-N 2.98Å; S409-C412 PolarHBondContact O-N 3.25Å; C412-L414 PolarHBondContact O-N 3.35Å; C412-R415 PolarHBondContact O-N 2.98Å; C412-I416 VanDerWaalsContact O-CG1 3.31Å; C412-I416 WeakPolarHBondContact O-CG1 3.44Å; C412-I416 PolarHBondContact O-N 3.04Å
413A94.9Very high87Confident0 Ų021.3 Ų21.30%011%0.107CC..Hα-helixtrans-58.9-47.9176.200000112.3W396 A397 C400 L401 S409 R410 R415 I416 M417W396-A413 HydrophobicContact CZ3-CB 4.38Å; A397-A413 HydrophobicContact CB-CB 4.07Å; C400-A413 HydrophobicContact CB-CB 3.73Å; L401-A413 HydrophobicContact CD2-CB 4.27Å; L401-A413 HydrophobicContact CG-CB 4.38Å; S409-A413 WeakPolarHBondContact O-CB 3.32Å; S409-A413 PolarHBondContact O-N 3.42Å; R410-A413 PolarHBondContact O-N 2.99Å; A413-R415 VanDerWaalsContact C-N 3.33Å; A413-R415 PolarHBondContact O-N 3.09Å; A413-I416 PolarHBondContact O-N 3.47Å; A413-M417 WeakPolarHBondContact O-CG 3.41Å; A413-M417 PolarHBondContact O-N 2.85Å
414L96.1Very high87.8Confident0 Ų021.7 Ų21.70%012%0.121CC..Hα-helixtrans-60.2-41.9176.4-77.9170.5000112.1L401 R410 L411 C412 M417 D418 L466 T469 N477 I480 A481 I484L401-L414 HydrophobicContact CD1-CD2 3.88Å; L401-L414 HydrophobicContact CD1-CG 4.36Å; L401-L414 HydrophobicContact CD2-CD1 4.39Å; L401-L414 HydrophobicContact CD2-CD2 4.19Å; L401-L414 HydrophobicContact CD2-CG 3.81Å; R410-L414 WeakPolarHBondContact O-CB 3.48Å; R410-L414 WeakPolarHBondContact O-CG 3.33Å; R410-L414 PolarHBondContact O-N 2.87Å; L411-L414 PolarHBondContact O-N 3.31Å; C412-L414 PolarHBondContact O-N 3.35Å; L414-M417 PolarHBondContact O-N 2.95Å; L414-D418 VanDerWaalsContact O-CB 3.23Å; L414-D418 WeakPolarHBondContact O-CB 3.46Å; L414-D418 PolarHBondContact O-N 3.32Å; L414-L466 HydrophobicContact CD2-CD2 3.59Å; L414-T469 HydrophobicContact CD1-CG2 4.08Å; L414-T469 HydrophobicContact CD2-CG2 4.14Å; L414-N477 HydrophobicContact CD1-CB 3.53Å; L414-N477 WeakPolarHBondContact CD1-O 3.48Å; L414-I480 HydrophobicContact CB-CB 4.39Å; L414-I480 HydrophobicContact CB-CG2 3.86Å; L414-A481 HydrophobicContact CD2-CB 4.04Å; L414-I484 HydrophobicContact CD2-CD1 4.4Å
415R95.8Very high88.9Confident59 Ų5920.8 Ų20.822%0.22312%0.116CC..Hα-helixtrans-69-34.7179.3-69.4-98.548.4-150.6-2.8112.2I354 L411 C412 A413 D418 L419 I480I354-R415 HydrophobicContact CD1-CB 3.47Å; I354-R415 VanDerWaalsContact CD1-CB 3.47Å; I354-R415 HydrophobicContact CG1-CB 3.86Å; L411-R415 HydrophobicContact CD1-CG 4.07Å; L411-R415 HydrophobicContact CG-CG 4.37Å; L411-R415 WeakPolarHBondContact O-CB 3.41Å; L411-R415 WeakPolarHBondContact O-CG 3.36Å; L411-R415 PolarHBondContact O-N 3.4Å; C412-R415 PolarHBondContact O-N 2.98Å; A413-R415 VanDerWaalsContact C-N 3.33Å; A413-R415 PolarHBondContact O-N 3.09Å; R415-D418 IonicContact CZ-OD2 3.52Å; R415-D418 IonicContact NE-OD2 3.23Å; R415-D418 IonicContact NH2-OD2 3.53Å; R415-D418 PolarHBondContact NH2-OD2 3.45Å; R415-L419 PolarHBondContact O-N 2.99Å; R415-I480 HydrophobicContact CG-CD1 4.01Å
416I96.4Very high90.1Very high0 Ų019.8 Ų19.80%011%0.111CC..Hα-helixtrans-68.9-46.4172.8-70.4169000110.6L338 I354 V357 F361 L393 W396 C412 A413 D418 L419 M420L338-I416 HydrophobicContact CD1-CD1 4.06Å; L338-I416 HydrophobicContact CD2-CD1 3.84Å; I354-I416 HydrophobicContact CD1-CD1 4.43Å; I354-I416 HydrophobicContact CD1-CG1 3.63Å; V357-I416 HydrophobicContact CG1-CG1 4.28Å; V357-I416 HydrophobicContact CG1-CG2 4.4Å; V357-I416 HydrophobicContact CG2-CD1 4.26Å; V357-I416 HydrophobicContact CG2-CG1 4.39Å; F361-I416 HydrophobicContact CZ-CG2 4.41Å; L393-I416 HydrophobicContact CD1-CG2 4.13Å; L393-I416 HydrophobicContact CD2-CG2 3.85Å; L393-I416 HydrophobicContact CG-CG2 3.99Å; W396-I416 HydrophobicContact CH2-CD1 3.98Å; W396-I416 HydrophobicContact CZ3-CD1 3.68Å; C412-I416 VanDerWaalsContact O-CG1 3.31Å; C412-I416 WeakPolarHBondContact O-CG1 3.44Å; C412-I416 PolarHBondContact O-N 3.04Å; A413-I416 PolarHBondContact O-N 3.47Å; I416-D418 VanDerWaalsContact C-N 3.29Å; I416-D418 PolarHBondContact O-N 3.47Å; I416-L419 PolarHBondContact O-N 3.35Å; I416-M420 VanDerWaalsContact O-CB 3.31Å; I416-M420 WeakPolarHBondContact O-CB 3.37Å; I416-M420 PolarHBondContact O-N 2.93Å
417M95.8Very high90.8Very high1 Ų126.2 Ų26.21%0.00513%0.134CC..Hα-helixtrans-58.6-41.3174.1-73.9-172.317800111.8A397 I398 L401 A413 L414 L419 M420 Y421 L466 I484A397-M417 HydrophobicContact CB-CE 3.4Å; A397-M417 HydrophobicContact CB-CG 3.84Å; A397-M417 HydrophobicContact CB-SD 4.4Å; I398-M417 HydrophobicContact CB-CE 4.33Å; I398-M417 HydrophobicContact CG1-CE 3.6Å; I398-M417 VanDerWaalsContact N-CE 3.32Å; L401-M417 HydrophobicContact CD1-CE 3.77Å; L401-M417 HydrophobicContact CD1-SD 3.75Å; A413-M417 WeakPolarHBondContact O-CG 3.41Å; A413-M417 PolarHBondContact O-N 2.85Å; L414-M417 PolarHBondContact O-N 2.95Å; M417-L419 PolarHBondContact O-N 3.46Å; M417-M420 PolarHBondContact O-N 3.49Å; M417-Y421 HydrophobicContact CB-CD2 4.46Å; M417-Y421 HydrophobicContact CB-CE2 4.31Å; M417-Y421 WeakPolarHBondContact O-CB 3.46Å; M417-Y421 PolarHBondContact O-N 3.21Å; M417-Y421 HydrophobicContact SD-CE2 4.47Å; M417-L466 HydrophobicContact SD-CD1 4.36Å; M417-L466 HydrophobicContact SD-CD2 3.9Å; M417-L466 HydrophobicContact SD-CG 4.16Å; M417-I484 HydrophobicContact CB-CD1 4.15Å
418D95.2Very high90.6Very high22 Ų2223.9 Ų23.912%0.11813%0.126CC..Hα-helixtrans-57.7-45.9177.1-178.530.8000112.1L414 R415 I416 A422 I480 I484 R487L414-D418 VanDerWaalsContact O-CB 3.23Å; L414-D418 WeakPolarHBondContact O-CB 3.46Å; L414-D418 PolarHBondContact O-N 3.32Å; R415-D418 IonicContact CZ-OD2 3.52Å; R415-D418 IonicContact NE-OD2 3.23Å; R415-D418 IonicContact NH2-OD2 3.53Å; R415-D418 PolarHBondContact NH2-OD2 3.45Å; I416-D418 VanDerWaalsContact C-N 3.29Å; I416-D418 PolarHBondContact O-N 3.47Å; D418-A422 WeakPolarHBondContact O-CB 3.33Å; D418-A422 PolarHBondContact O-N 2.94Å; D418-I480 HydrophobicContact CB-CG2 4.28Å; D418-I484 HydrophobicContact CB-CD1 3.96Å; D418-I484 HydrophobicContact CB-CG1 4.03Å; D418-R487 PolarHBondContact O-NH1 2.91Å; D418-R487 VanDerWaalsContact O-NH1 3.16Å; D418-R487 IonicContact OD1-CZ 3.5Å; D418-R487 IonicContact OD1-NH1 3.04Å; D418-R487 PolarHBondContact OD1-NH1 3.47Å; D418-R487 IonicContact OD1-NH2 2.69Å; D418-R487 PolarHBondContact OD1-NH2 3.43Å
419L95.7Very high90Very high23 Ų2326.2 Ų26.212%0.1214%0.141CC..Hα-helixtrans-66.4-44.8173.6-71.7176000112.2I354 K358 F361 R415 I416 M417 A422 M425I354-L419 HydrophobicContact CG2-CD1 3.77Å; K358-L419 HydrophobicContact CB-CD1 3.94Å; K358-L419 HydrophobicContact CD-CD2 4.45Å; K358-L419 HydrophobicContact CG-CD2 4.43Å; F361-L419 HydrophobicContact CD2-CB 4.08Å; F361-L419 HydrophobicContact CE2-CB 3.9Å; R415-L419 PolarHBondContact O-N 2.99Å; I416-L419 PolarHBondContact O-N 3.35Å; M417-L419 PolarHBondContact O-N 3.46Å; L419-A422 PolarHBondContact O-N 3.48Å; L419-M425 WeakPolarHBondContact O-CB 3.24Å
420M95Very high88.9Confident0 Ų031.3 Ų31.30%018%0.176CC..Hα-helixtrans-67.5-37.2-175.1-176168.361.900112.5F361 L390 L393 N394 I416 M417 W426 L458F361-M420 HydrophobicContact CE2-CB 3.89Å; F361-M420 HydrophobicContact CZ-CB 4.12Å; F361-M420 HydrophobicContact CZ-CG 4.49Å; L390-M420 HydrophobicContact CD2-CG 4.44Å; L390-M420 HydrophobicContact CD2-SD 4.17Å; L393-M420 HydrophobicContact CD2-SD 4.43Å; N394-M420 HydrophobicContact CB-CE 3.66Å; N394-M420 HydrophobicContact CB-SD 4.37Å; N394-M420 WeakPolarHBondContact OD1-CE 3.34Å; I416-M420 VanDerWaalsContact O-CB 3.31Å; I416-M420 WeakPolarHBondContact O-CB 3.37Å; I416-M420 PolarHBondContact O-N 2.93Å; M417-M420 PolarHBondContact O-N 3.49Å; M420-W426 PolarHBondContact O-NE1 2.95Å; M420-L458 HydrophobicContact SD-CD1 4.2Å
421Y93.2Very high87.4Confident2 Ų240.8 Ų40.81%0.00821%0.213CC..Hα-helixtrans-88-7.6-179-64.5-13.8000113.9N394 M417 N423 L458 R459 L466 I484N394-Y421 PolarHBondContact ND2-OH 3.4Å; N394-Y421 PolarHBondContact OD1-OH 3.32Å; M417-Y421 HydrophobicContact CB-CD2 4.46Å; M417-Y421 HydrophobicContact CB-CE2 4.31Å; M417-Y421 WeakPolarHBondContact O-CB 3.46Å; M417-Y421 PolarHBondContact O-N 3.21Å; M417-Y421 HydrophobicContact SD-CE2 4.47Å; Y421-N423 PolarHBondContact O-N 2.96Å; Y421-N423 VanDerWaalsContact O-N 3.16Å; Y421-L458 HydrophobicContact CE1-CB 3.9Å; Y421-L458 PolarHBondContact OH-O 3.29Å; Y421-R459 HydrophobicContact CD1-CB 4.36Å; Y421-R459 HydrophobicContact CD2-CG 4.21Å; Y421-R459 HydrophobicContact CE1-CB 4.4Å; Y421-R459 HydrophobicContact CE2-CG 4.43Å; Y421-R459 HydrophobicContact CG-CB 4.46Å; Y421-R459 HydrophobicContact CG-CG 4.41Å; Y421-R459 PolarHBondContact O-NH2 3.43Å; Y421-L466 HydrophobicContact CD2-CD1 4.25Å; Y421-L466 HydrophobicContact CE2-CD1 3.7Å; Y421-I484 HydrophobicContact CD2-CG2 3.7Å; Y421-I484 HydrophobicContact CE2-CG2 4.42Å
422A90.8Very high85.1Confident23 Ų2343.5 Ų43.519%0.1924%0.242CC..  trans-70108.9177.200000110.5D418 L419 A424 M425D418-A422 WeakPolarHBondContact O-CB 3.33Å; D418-A422 PolarHBondContact O-N 2.94Å; L419-A422 PolarHBondContact O-N 3.48Å; A422-A424 PolarHBondContact O-N 3.22Å; A422-M425 HydrophobicContact CB-CB 4.25Å; A422-M425 WeakPolarHBondContact O-CB 3.35Å; A422-M425 PolarHBondContact O-N 3.01Å
423N86.3Confident82.4Confident63 Ų6351.5 Ų51.534%0.33729%0.285SS..G310 helixtrans-52.1-34.5178.1-70-18.8000113.1Y421 M425 W426 R427 N450 R459Y421-N423 PolarHBondContact O-N 2.96Å; Y421-N423 VanDerWaalsContact O-N 3.16Å; N423-M425 PolarHBondContact O-N 3.15Å; N423-W426 PolarHBondContact O-N 3.41Å; N423-R427 WeakPolarHBondContact O-CG 3.42Å; N423-R427 PolarHBondContact O-N 3.27Å; N423-N450 PolarHBondContact O-ND2 2.96Å; N423-R459 PolarHBondContact OD1-NH2 2.85Å
424A86.8Confident79.8Confident73 Ų7357.8 Ų57.860%0.60332%0.323SS*.G310 helixtrans-64.3-26.6177.100000113.4A422 W426A422-A424 PolarHBondContact O-N 3.22Å; A424-W426 PolarHBondContact O-N 2.85Å
425M90.9Very high77.1Confident17 Ų1761.6 Ų61.68%0.08436%0.355CS..G310 helixtrans-62.9-32.2178.3-170.162.9-144.200111.9K358 F361 E362 R365 L419 A422 N423K358-M425 HydrophobicContact CG-CE 4.45Å; F361-M425 HydrophobicContact CB-CE 3.33Å; F361-M425 HydrophobicContact CB-CG 4.25Å; F361-M425 HydrophobicContact CB-SD 4.38Å; F361-M425 HydrophobicContact CD2-CG 4.33Å; E362-M425 HydrophobicContact CB-CE 4.22Å; E362-M425 HydrophobicContact CG-CE 3.53Å; E362-M425 VanDerWaalsContact N-CE 3.27Å; R365-M425 VanDerWaalsContact CD-O 3.32Å; R365-M425 WeakPolarHBondContact CD-O 3.13Å; L419-M425 WeakPolarHBondContact O-CB 3.24Å; A422-M425 HydrophobicContact CB-CB 4.25Å; A422-M425 WeakPolarHBondContact O-CB 3.35Å; A422-M425 PolarHBondContact O-N 3.01Å; N423-M425 PolarHBondContact O-N 3.15Å
426W89.8Confident74.4Confident0 Ų065.3 Ų65.30%038%0.379CS..G310 helixtrans-1085.1-173.2-50.8110.2000114F361 V364 R365 L390 M420 N423 A424 C428 L449 L453 I455F361-W426 HydrophobicContact CB-CH2 3.8Å; F361-W426 HydrophobicContact CB-CZ2 4.41Å; F361-W426 HydrophobicContact CB-CZ3 4.25Å; F361-W426 AromaticContact CD1-CH2 3.9Å; F361-W426 HydrophobicContact CD1-CH2 3.9Å; F361-W426 HydrophobicContact CD1-CZ2 4.44Å; F361-W426 HydrophobicContact CD2-CH2 4.24Å; F361-W426 HydrophobicContact CD2-CZ2 4.13Å; F361-W426 HydrophobicContact CE2-CZ2 4.5Å; F361-W426 AromaticContact CG-CH2 3.73Å; F361-W426 HydrophobicContact CG-CH2 3.73Å; F361-W426 HydrophobicContact CG-CZ2 4.1Å; V364-W426 HydrophobicContact CB-CZ3 4.12Å; V364-W426 HydrophobicContact CG1-CH2 4.38Å; V364-W426 HydrophobicContact CG1-CZ3 3.74Å; R365-W426 HydrophobicContact CB-CE3 4.31Å; L390-W426 HydrophobicContact CD1-CH2 4.16Å; L390-W426 HydrophobicContact CD1-CZ2 4.3Å; L390-W426 HydrophobicContact CD2-CH2 4Å; L390-W426 HydrophobicContact CD2-CZ2 4.12Å; M420-W426 PolarHBondContact O-NE1 2.95Å; N423-W426 PolarHBondContact O-N 3.41Å; A424-W426 PolarHBondContact O-N 2.85Å; W426-C428 PolarHBondContact O-N 3.25Å; W426-L449 HydrophobicContact CB-CB 4.48Å; W426-L449 WeakPolarHBondContact O-CB 3.44Å; W426-L453 HydrophobicContact CD2-CD1 4.12Å; W426-L453 HydrophobicContact CE3-CD1 3.61Å; W426-L453 HydrophobicContact CZ3-CD1 3.88Å; W426-I455 HydrophobicContact CD2-CD1 4.39Å; W426-I455 HydrophobicContact CG-CG1 4.26Å; W426-I455 HydrophobicContact CZ2-CD1 4.24Å
427R84Confident71.6Confident166 Ų16672.6 Ų72.663%0.62642%0.418SS*.PPolyproline II helixtrans-74.2126.3173.9-76.3178.9-176.9-177.1-1110.3R365 N423R365-R427 WeakPolarHBondContact CD-O 3.4Å; N423-R427 WeakPolarHBondContact O-CG 3.42Å; N423-R427 PolarHBondContact O-N 3.27Å
428C76.9Confident69.1Low20 Ų2077 Ų7714%0.13546%0.464CS..PPolyproline II helixtrans-63.9136168.7-65.30000110C369 W426 S430 F446C369-C428 HydrophobicContact CB-CB 3.9Å; C369-C428 WeakPolarHBondContact CB-SG 3.4Å; C369-C428 WeakPolarHBondContact SG-CA 3.44Å; C369-C428 WeakPolarHBondContact SG-CB 3.12Å; C369-C428 CovalentContact SG-SG 2.04Å; C369-C428 PolarHBondContact SG-SG 3.21Å; W426-C428 PolarHBondContact O-N 3.25Å; C428-S430 PolarHBondContact O-N 2.88Å; C428-F446 HydrophobicContact CB-CB 4.27Å; C428-F446 HydrophobicContact CB-CD1 4.17Å; C428-F446 HydrophobicContact CB-CG 4.33Å
429P69.6Low66.4Low64 Ų6480.3 Ų80.342%0.41650%0.495SS..PPolyproline II helixtrans-58123.7171.8-20.631000109.8Y431P429-Y431 PolarHBondContact O-N 3.43Å
430S61.6Low63.7Low111 Ų11188.8 Ų88.878%0.77653%0.53SS*.  trans-66.7102.7164.8-60.60000107.2C428 G432C428-S430 PolarHBondContact O-N 2.88Å; S430-G432 VanDerWaalsContact C-N 3.35Å; S430-G432 PolarHBondContact O-N 3.03Å
431Y55.9Low61Low207 Ų20797.8 Ų97.881%0.81257%0.57SS**  trans-63.2104.8164.7-80.3-84.9000106.6P429P429-Y431 PolarHBondContact O-N 3.43Å
432G43.1Very low58.4Low60 Ų60104.2 Ų104.262%0.61960%0.603SS**  trans-56.2139.6-174.300000111.1S430 T434S430-G432 VanDerWaalsContact C-N 3.35Å; S430-G432 PolarHBondContact O-N 3.03Å; G432-T434 PolarHBondContact O-N 2.95Å
433N36.8Very low55.8Low170 Ų170109.8 Ų109.891%0.90963%0.63SS**  trans-40.392149.5-71.7-34.7000109.3A435N433-A435 PolarHBondContact O-N 3.31Å
434T39.9Very low53.9Low132 Ų132113.8 Ų113.881%0.8164%0.644SS**  trans-66.9121.415047.10000105.3G432G432-T434 PolarHBondContact O-N 2.95Å
435A39.3Very low51.8Low80 Ų80114.5 Ų114.566%0.66165%0.65SS**SBendtrans-44.5153.7170.200000111.2N433N433-A435 PolarHBondContact O-N 3.31Å
436D38.9Very low50.1Low138 Ų138117.8 Ų117.874%0.73866%0.664SS**  trans7785.3171.7-53-21.7000116
437N38.2Very low48.7Very low152 Ų152124.5 Ų124.581%0.81369%0.694SS**  157.1100.1113.5-77.6-34.5000110.7A439N437-A439 PolarHBondContact O-N 2.94Å
438G43.4Very low48.1Very low94 Ų94120.2 Ų120.297%0.96968%0.683SS**  trans49.5-1.213700000122.8K440G438-K440 PolarHBondContact O-N 3.39Å
439A38.1Very low48.5Very low92 Ų92119.4 Ų119.476%0.7668%0.677SS**  trans-91.9104.7-176.800000109.7N437 K441N437-A439 PolarHBondContact O-N 2.94Å; A439-K441 PolarHBondContact O-N 2.97Å
440K39.3Very low49.3Very low200 Ų200116.6 Ų116.687%0.8766%0.659SS**  trans-4.8111.7164.5-72.4173.9175.8175.10113.9G438 L442G438-K440 PolarHBondContact O-N 3.39Å; K440-L442 VanDerWaalsContact C-N 3.28Å; K440-L442 PolarHBondContact O-N 3.48Å
441K37.9Very low50.4Low190 Ų190118.4 Ų118.483%0.82665%0.653SS**  trans-40.286.3162.6-75.8173.7171.6173.50111.4A439 N443A439-K441 PolarHBondContact O-N 2.97Å; K441-N443 PolarHBondContact O-N 3.14Å; K441-N443 VanDerWaalsContact O-N 3.12Å
442L39.1Very low51.8Low136 Ų136110.5 Ų110.571%0.71262%0.624SS**  trans-77.785.4151.1-87.6152.1000104.7K440 F444K440-L442 VanDerWaalsContact C-N 3.28Å; K440-L442 PolarHBondContact O-N 3.48Å; L442-F444 HydrophobicContact CB-CD2 4.04Å; L442-F444 HydrophobicContact CB-CE2 4.26Å; L442-F444 HydrophobicContact CD2-CD2 4.31Å; L442-F444 HydrophobicContact CD2-CE2 3.82Å; L442-F444 HydrophobicContact CD2-CZ 4.46Å; L442-F444 HydrophobicContact CG-CE2 4.46Å; L442-F444 PolarHBondContact O-N 3.47Å
443N36.8Very low54.1Low140 Ų140107.8 Ų107.875%0.74960%0.596SS**  trans-61.971161.7-82.1-10000107.8K441 A445K441-N443 PolarHBondContact O-N 3.14Å; K441-N443 VanDerWaalsContact O-N 3.12Å; N443-A445 PolarHBondContact O-N 3.43Å
444F44.9Very low56.6Low147 Ų147101.9 Ų101.965%0.64556%0.564SS**  trans-68.188.3152.9-81.2-76.8000104.8L442 F446L442-F444 HydrophobicContact CB-CD2 4.04Å; L442-F444 HydrophobicContact CB-CE2 4.26Å; L442-F444 HydrophobicContact CD2-CD2 4.31Å; L442-F444 HydrophobicContact CD2-CE2 3.82Å; L442-F444 HydrophobicContact CD2-CZ 4.46Å; L442-F444 HydrophobicContact CG-CE2 4.46Å; L442-F444 PolarHBondContact O-N 3.47Å; F444-F446 VanDerWaalsContact C-N 3.26Å; F444-F446 PolarHBondContact O-N 2.99Å
445A44Very low59.1Low88 Ų8895.6 Ų95.673%0.72753%0.526SS*.  trans-54.4103.4159.600000105.5N443 K447N443-A445 PolarHBondContact O-N 3.43Å; A445-K447 PolarHBondContact O-N 3.28Å
446F53.9Low61.3Low86 Ų8694.4 Ų94.438%0.37751%0.508SS..  trans-50.7117.5170.7-75-85.5000106.3T373 C428 F444 D448T373-F446 HydrophobicContact CG2-CE1 3.58Å; T373-F446 HydrophobicContact CG2-CZ 4.1Å; C428-F446 HydrophobicContact CB-CB 4.27Å; C428-F446 HydrophobicContact CB-CD1 4.17Å; C428-F446 HydrophobicContact CB-CG 4.33Å; F444-F446 VanDerWaalsContact C-N 3.26Å; F444-F446 PolarHBondContact O-N 2.99Å; F446-D448 PolarHBondContact O-N 3.15Å
447K61Low63.7Low142 Ų14292.1 Ų92.162%0.61749%0.493SS*.  trans-61.3136.5179.4-83.7-178176.6-176.70107.6Q372 A445 L449Q372-K447 PolarHBondContact NE2-O 3.31Å; Q372-K447 PolarHBondContact OE1-O 3.42Å; A445-K447 PolarHBondContact O-N 3.28Å; K447-L449 PolarHBondContact O-N 2.95Å
448D72.3Confident66.3Low76 Ų7685 Ų8541%0.40646%0.455SS..  trans-61.9107.8176.4-175.13.8000110F446 N450 K451 D452F446-D448 PolarHBondContact O-N 3.15Å; D448-N450 PolarHBondContact O-N 3.39Å; D448-N450 VanDerWaalsContact O-N 3.12Å; D448-N450 VanDerWaalsContact OD1-CB 3.28Å; D448-N450 WeakPolarHBondContact OD1-CB 3.5Å; D448-N450 PolarHBondContact OD1-N 2.96Å; D448-N450 PolarHBondContact OD1-ND2 3.32Å; D448-K451 PolarHBondContact O-N 3.33Å; D448-D452 PolarHBondContact O-N 3.39Å
449L84.2Confident68.5Low2 Ų281.9 Ų81.91%0.0141%0.414CS..Hα-helixtrans-62.4-20.3-179.2-144.478.7000111.7R365 W426 K447 K451 D452 L453R365-L449 HydrophobicContact CB-CD2 4.49Å; R365-L449 HydrophobicContact CG-CD2 4.49Å; W426-L449 HydrophobicContact CB-CB 4.48Å; W426-L449 WeakPolarHBondContact O-CB 3.44Å; K447-L449 PolarHBondContact O-N 2.95Å; L449-K451 VanDerWaalsContact C-N 3.28Å; L449-K451 PolarHBondContact O-N 3.23Å; L449-D452 PolarHBondContact O-N 3.01Å; L449-L453 HydrophobicContact CD2-CD1 3.72Å; L449-L453 HydrophobicContact CD2-CG 4.46Å; L449-L453 HydrophobicContact CG-CD1 3.91Å; L449-L453 HydrophobicContact CG-CG 4.18Å; L449-L453 VanDerWaalsContact O-CB 3.32Å; L449-L453 WeakPolarHBondContact O-CB 3.42Å; L449-L453 WeakPolarHBondContact O-CG 3.43Å; L449-L453 PolarHBondContact O-N 2.95Å
450N86.9Confident70.8Confident6 Ų681.2 Ų81.23%0.03239%0.394CS..Hα-helixtrans-59.9-39.9173.3-69.6-82.1000111.7N423 D448 D454 I455N423-N450 PolarHBondContact O-ND2 2.96Å; D448-N450 PolarHBondContact O-N 3.39Å; D448-N450 VanDerWaalsContact O-N 3.12Å; D448-N450 VanDerWaalsContact OD1-CB 3.28Å; D448-N450 WeakPolarHBondContact OD1-CB 3.5Å; D448-N450 PolarHBondContact OD1-N 2.96Å; D448-N450 PolarHBondContact OD1-ND2 3.32Å; N450-D454 PolarHBondContact O-N 2.85Å; N450-I455 HydrophobicContact CB-CB 4.28Å; N450-I455 HydrophobicContact CB-CG1 4.37Å; N450-I455 PolarHBondContact O-N 3.38Å
451K85.3Confident73.1Confident148 Ų14875.4 Ų75.464%0.64337%0.372SS*.Hα-helixtrans-72-44.8175.8-67.7-174178.7-176.80110.9D448 L449 L453 D454D448-K451 PolarHBondContact O-N 3.33Å; L449-K451 VanDerWaalsContact C-N 3.28Å; L449-K451 PolarHBondContact O-N 3.23Å; K451-L453 PolarHBondContact O-N 2.92Å; K451-D454 PolarHBondContact O-N 3.31Å
452D84.9Confident75.6Confident41 Ų4166.3 Ų66.322%0.21933%0.333CS..Hα-helixtrans-66.8-19.1-178.9-70.5-20.1000112.9Q372 I383 K387 D448 L449Q372-D452 PolarHBondContact NE2-OD2 3.48Å; I383-D452 HydrophobicContact CD1-CB 3.75Å; I383-D452 WeakPolarHBondContact CD1-O 3.49Å; K387-D452 WeakPolarHBondContact CE-O 3.46Å; D448-D452 PolarHBondContact O-N 3.39Å; L449-D452 PolarHBondContact O-N 3.01Å
453L90.3Very high77.8Confident3 Ų360.9 Ų60.92%0.01630%0.303CS..THydrogen-bonded Turntrans-107.38.1177-67173.6000113.6V364 I383 K387 L390 W426 L449 K451 I455V364-L453 HydrophobicContact CG1-CD1 4.35Å; I383-L453 HydrophobicContact CG1-CD2 4.21Å; K387-L453 HydrophobicContact CG-CD2 4.49Å; L390-L453 HydrophobicContact CD1-CB 4.09Å; L390-L453 HydrophobicContact CD1-CD1 4.14Å; L390-L453 HydrophobicContact CD1-CD2 4.24Å; L390-L453 HydrophobicContact CD1-CG 4.4Å; W426-L453 HydrophobicContact CD2-CD1 4.12Å; W426-L453 HydrophobicContact CE3-CD1 3.61Å; W426-L453 HydrophobicContact CZ3-CD1 3.88Å; L449-L453 HydrophobicContact CD2-CD1 3.72Å; L449-L453 HydrophobicContact CD2-CG 4.46Å; L449-L453 HydrophobicContact CG-CD1 3.91Å; L449-L453 HydrophobicContact CG-CG 4.18Å; L449-L453 VanDerWaalsContact O-CB 3.32Å; L449-L453 WeakPolarHBondContact O-CB 3.42Å; L449-L453 WeakPolarHBondContact O-CG 3.43Å; L449-L453 PolarHBondContact O-N 2.95Å; K451-L453 PolarHBondContact O-N 2.92Å; L453-I455 HydrophobicContact CB-CD1 3.86Å; L453-I455 HydrophobicContact CB-CG1 3.95Å; L453-I455 PolarHBondContact O-N 2.91Å
454D90.6Very high80.1Confident47 Ų4757.3 Ų57.325%0.25129%0.289SS..THydrogen-bonded Turntrans54.731-178.1-50.9-32000114.1K387 R391 N450 K451 D456 Q457 L458K387-D454 WeakPolarHBondContact CE-OD2 3.47Å; K387-D454 IonicContact NZ-OD1 2.98Å; K387-D454 PolarHBondContact NZ-OD1 3.23Å; K387-D454 IonicContact NZ-OD2 3.8Å; K387-D454 PolarHBondContact NZ-OD2 3.24Å; R391-D454 IonicContact CZ-OD2 2.93Å; R391-D454 IonicContact NH2-OD2 2.73Å; R391-D454 PolarHBondContact NH2-OD2 3.15Å; N450-D454 PolarHBondContact O-N 2.85Å; K451-D454 PolarHBondContact O-N 3.31Å; D454-D456 VanDerWaalsContact C-N 3.27Å; D454-D456 PolarHBondContact O-N 3.33Å; D454-Q457 HydrophobicContact CB-CB 4.22Å; D454-Q457 WeakPolarHBondContact O-CA 3.45Å; D454-Q457 WeakPolarHBondContact O-CB 3.5Å; D454-Q457 PolarHBondContact O-N 2.99Å; D454-L458 PolarHBondContact O-N 2.88Å; D454-L458 VanDerWaalsContact O-N 3.15Å
455I90.9Very high82.1Confident0 Ų051.3 Ų51.30%026%0.264CS..Hα-helixtrans-59.9-37.4-173.8-59.1-58.3000112.2L390 W426 N450 L453 Q457 L458 R459L390-I455 HydrophobicContact CD1-CD1 3.9Å; W426-I455 HydrophobicContact CD2-CD1 4.39Å; W426-I455 HydrophobicContact CG-CG1 4.26Å; W426-I455 HydrophobicContact CZ2-CD1 4.24Å; N450-I455 HydrophobicContact CB-CB 4.28Å; N450-I455 HydrophobicContact CB-CG1 4.37Å; N450-I455 PolarHBondContact O-N 3.38Å; L453-I455 HydrophobicContact CB-CD1 3.86Å; L453-I455 HydrophobicContact CB-CG1 3.95Å; L453-I455 PolarHBondContact O-N 2.91Å; I455-Q457 VanDerWaalsContact C-N 3.27Å; I455-Q457 PolarHBondContact O-N 2.94Å; I455-L458 HydrophobicContact CD1-CD1 4.1Å; I455-L458 PolarHBondContact O-N 2.93Å; I455-R459 PolarHBondContact O-N 3.31Å
456D87.2Confident84.3Confident54 Ų5447.2 Ų47.229%0.28923%0.23SC..Hα-helixtrans-64-33.6176.1-75.5-34.7000112D454 R459 K460D454-D456 VanDerWaalsContact C-N 3.27Å; D454-D456 PolarHBondContact O-N 3.33Å; D456-R459 PolarHBondContact O-N 3.02Å; D456-R459 IonicContact OD1-CZ 3.5Å; D456-R459 IonicContact OD1-NH1 2.75Å; D456-R459 PolarHBondContact OD1-NH1 2.99Å; D456-R459 IonicContact OD1-NH2 3.21Å; D456-K460 WeakPolarHBondContact O-CG 3.38Å; D456-K460 PolarHBondContact O-N 3.35Å
457Q88.9Confident85.9Confident90 Ų9043.3 Ų43.342%0.42121%0.213SC..Hα-helixtrans-67.7-46.8175.4-173.456.942.500110.8D454 I455 R459 K460 D461D454-Q457 HydrophobicContact CB-CB 4.22Å; D454-Q457 WeakPolarHBondContact O-CA 3.45Å; D454-Q457 WeakPolarHBondContact O-CB 3.5Å; D454-Q457 PolarHBondContact O-N 2.99Å; I455-Q457 VanDerWaalsContact C-N 3.27Å; I455-Q457 PolarHBondContact O-N 2.94Å; Q457-R459 PolarHBondContact O-N 3.47Å; Q457-K460 WeakPolarHBondContact O-CA 3.48Å; Q457-K460 WeakPolarHBondContact O-CB 3.49Å; Q457-K460 PolarHBondContact O-N 3.35Å; Q457-D461 PolarHBondContact NE2-OD1 3.33Å; Q457-D461 VanDerWaalsContact O-CG 3.24Å; Q457-D461 PolarHBondContact O-N 2.67Å
458L91.7Very high87Confident3 Ų339 Ų392%0.01620%0.195CC..Hα-helixtrans-55.5-42.3176.3-58.2178.2000111.3L390 R391 N394 M420 Y421 D454 I455 K460 D461 G462L390-L458 HydrophobicContact CB-CD1 3.81Å; R391-L458 HydrophobicContact CB-CD2 4.34Å; R391-L458 HydrophobicContact CG-CD2 3.81Å; N394-L458 HydrophobicContact CB-CD2 4.02Å; N394-L458 PolarHBondContact ND2-O 3Å; M420-L458 HydrophobicContact SD-CD1 4.2Å; Y421-L458 HydrophobicContact CE1-CB 3.9Å; Y421-L458 PolarHBondContact OH-O 3.29Å; D454-L458 PolarHBondContact O-N 2.88Å; D454-L458 VanDerWaalsContact O-N 3.15Å; I455-L458 HydrophobicContact CD1-CD1 4.1Å; I455-L458 PolarHBondContact O-N 2.93Å; L458-K460 VanDerWaalsContact C-N 3.31Å; L458-K460 PolarHBondContact O-N 3.02Å; L458-D461 PolarHBondContact O-N 3.3Å; L458-G462 PolarHBondContact O-N 2.93Å; L458-G462 VanDerWaalsContact O-N 3.13Å
459R89.6Confident87.8Confident28 Ų2835.5 Ų35.511%0.10618%0.176CC..Hα-helixtrans-60.5-38.5175.5-167.8-174.5-63.3128.16112.2Y421 N423 I455 D456 Q457 W463Y421-R459 HydrophobicContact CD1-CB 4.36Å; Y421-R459 HydrophobicContact CD2-CG 4.21Å; Y421-R459 HydrophobicContact CE1-CB 4.4Å; Y421-R459 HydrophobicContact CE2-CG 4.43Å; Y421-R459 HydrophobicContact CG-CB 4.46Å; Y421-R459 HydrophobicContact CG-CG 4.41Å; Y421-R459 PolarHBondContact O-NH2 3.43Å; N423-R459 PolarHBondContact OD1-NH2 2.85Å; I455-R459 PolarHBondContact O-N 3.31Å; D456-R459 PolarHBondContact O-N 3.02Å; D456-R459 IonicContact OD1-CZ 3.5Å; D456-R459 IonicContact OD1-NH1 2.75Å; D456-R459 PolarHBondContact OD1-NH1 2.99Å; D456-R459 IonicContact OD1-NH2 3.21Å; Q457-R459 PolarHBondContact O-N 3.47Å; R459-W463 WeakPolarHBondContact O-CB 3.48Å; R459-W463 PolarHBondContact O-N 3.3Å
460K86.9Confident88.1Confident79 Ų7935.4 Ų35.434%0.34318%0.176SC..Hα-helixtrans-63.3-46.6175.2-43.7-157.3177.5169.90110.9D456 Q457 L458 G462 W463 I491 F494D456-K460 WeakPolarHBondContact O-CG 3.38Å; D456-K460 PolarHBondContact O-N 3.35Å; Q457-K460 WeakPolarHBondContact O-CA 3.48Å; Q457-K460 WeakPolarHBondContact O-CB 3.49Å; Q457-K460 PolarHBondContact O-N 3.35Å; L458-K460 VanDerWaalsContact C-N 3.31Å; L458-K460 PolarHBondContact O-N 3.02Å; K460-G462 VanDerWaalsContact C-N 3.27Å; K460-G462 PolarHBondContact O-N 3.14Å; K460-W463 WeakPolarHBondContact O-CB 3.39Å; K460-W463 PolarHBondContact O-N 2.85Å; K460-W463 VanDerWaalsContact O-N 3.16Å; K460-I491 HydrophobicContact CB-CD1 4.09Å; K460-I491 HydrophobicContact CD-CD1 3.33Å; K460-I491 HydrophobicContact CD-CG1 3.92Å; K460-I491 HydrophobicContact CG-CD1 3.28Å; K460-I491 HydrophobicContact CG-CG1 4.39Å; K460-F494 HydrophobicContact CB-CZ 4.18Å
461D88.3Confident87.9Confident77 Ų7735.4 Ų35.441%0.41218%0.176SC..Hα-helixtrans-62.7-36.7-174.6-57.2-20.2000111.3I398 Q457 L458I398-D461 HydrophobicContact CD1-CB 4.34Å; Q457-D461 PolarHBondContact NE2-OD1 3.33Å; Q457-D461 VanDerWaalsContact O-CG 3.24Å; Q457-D461 PolarHBondContact O-N 2.67Å; L458-D461 PolarHBondContact O-N 3.3Å
462G89Confident87.7Confident0 Ų028.5 Ų28.50%015%0.147CC..THydrogen-bonded Turntrans-87.3-5.3178.200000115.6L458 K460 L466L458-G462 PolarHBondContact O-N 2.93Å; L458-G462 VanDerWaalsContact O-N 3.13Å; K460-G462 VanDerWaalsContact C-N 3.27Å; K460-G462 PolarHBondContact O-N 3.14Å; G462-L466 WeakPolarHBondContact O-CB 3.4Å; G462-L466 WeakPolarHBondContact O-CG 3.26Å; G462-L466 PolarHBondContact O-N 3.07Å
463W86.9Confident87.1Confident22 Ų2229.4 Ų29.48%0.08316%0.156CC..Hα-helixtrans-65.1-48.2-166.6-174.690000113.3R459 K460 V465 L466 F467 L485 F494 I498 I531R459-W463 WeakPolarHBondContact O-CB 3.48Å; R459-W463 PolarHBondContact O-N 3.3Å; K460-W463 WeakPolarHBondContact O-CB 3.39Å; K460-W463 PolarHBondContact O-N 2.85Å; K460-W463 VanDerWaalsContact O-N 3.16Å; W463-V465 PolarHBondContact O-N 3.36Å; W463-L466 PolarHBondContact O-N 3.49Å; W463-F467 HydrophobicContact CH2-CD2 4.37Å; W463-F467 HydrophobicContact CH2-CG 4.41Å; W463-F467 HydrophobicContact CZ2-CD2 4.26Å; W463-F467 HydrophobicContact CZ3-CB 4.49Å; W463-F467 PolarHBondContact O-N 3Å; W463-L485 HydrophobicContact CG-CD2 4.44Å; W463-F494 HydrophobicContact CB-CE2 4.23Å; W463-F494 HydrophobicContact CB-CZ 4.11Å; W463-F494 HydrophobicContact CD2-CB 4.36Å; W463-F494 HydrophobicContact CD2-CD1 4.25Å; W463-F494 AromaticContact CD2-CD2 3.94Å; W463-F494 HydrophobicContact CD2-CD2 3.94Å; W463-F494 HydrophobicContact CD2-CE2 4.24Å; W463-F494 AromaticContact CD2-CG 3.94Å; W463-F494 HydrophobicContact CD2-CG 3.94Å; W463-F494 HydrophobicContact CE3-CB 3.92Å; W463-F494 AromaticContact CE3-CD1 3.6Å; W463-F494 HydrophobicContact CE3-CD1 3.6Å; W463-F494 HydrophobicContact CE3-CD2 4.1Å; W463-F494 HydrophobicContact CE3-CE1 4.08Å; W463-F494 HydrophobicContact CE3-CE2 4.5Å; W463-F494 AromaticContact CE3-CG 3.61Å; W463-F494 HydrophobicContact CE3-CG 3.61Å; W463-F494 HydrophobicContact CG-CD2 4.24Å; W463-F494 HydrophobicContact CG-CE2 4.1Å; W463-F494 HydrophobicContact CG-CZ 4.39Å; W463-F494 HydrophobicContact CH2-CB 3.55Å; W463-F494 HydrophobicContact CH2-CG 4.17Å; W463-F494 HydrophobicContact CZ2-CB 4.11Å; W463-F494 HydrophobicContact CZ3-CB 3.5Å; W463-F494 VanDerWaalsContact CZ3-CB 3.5Å; W463-F494 AromaticContact CZ3-CD1 3.87Å; W463-F494 HydrophobicContact CZ3-CD1 3.87Å; W463-F494 AromaticContact CZ3-CG 3.74Å; W463-F494 HydrophobicContact CZ3-CG 3.74Å; W463-I498 HydrophobicContact CH2-CD1 4.46Å; W463-I498 HydrophobicContact CH2-CG2 3.31Å; W463-I498 HydrophobicContact CZ2-CG2 4.34Å; W463-I498 HydrophobicContact CZ3-CG2 3.86Å; W463-I531 HydrophobicContact CH2-CD1 4.45Å; W463-I531 HydrophobicContact CZ2-CD1 3.41Å; W463-I531 VanDerWaalsContact CZ2-CD1 3.41Å
464S84.2Confident86.7Confident64 Ų6432.4 Ų32.445%0.44817%0.167SC..Hα-helixtrans-61.4-44.3-178.654.90000111.8F467 E468S464-F467 PolarHBondContact O-N 3.47Å; S464-E468 WeakPolarHBondContact O-CG 3.19Å; S464-E468 PolarHBondContact O-N 3Å
465V87.3Confident86.1Confident22 Ų2236.4 Ų36.413%0.13318%0.184CC..Hα-helixtrans-67.6-37.8179.2176.20000111.7I398 L401 V402 W463 E468 T469I398-V465 HydrophobicContact CG2-CB 4.47Å; I398-V465 HydrophobicContact CG2-CG1 4.49Å; I398-V465 HydrophobicContact CG2-CG2 3.98Å; L401-V465 HydrophobicContact CB-CG1 3.58Å; L401-V465 HydrophobicContact CD1-CG1 4.31Å; V402-V465 HydrophobicContact CG2-CB 4.36Å; V402-V465 HydrophobicContact CG2-CG1 3.69Å; V402-V465 HydrophobicContact CG2-CG2 3.68Å; W463-V465 PolarHBondContact O-N 3.36Å; V465-E468 PolarHBondContact O-N 2.9Å; V465-T469 WeakPolarHBondContact O-CB 3.47Å; V465-T469 PolarHBondContact O-N 3.48Å; V465-T469 PolarHBondContact O-OG1 3.22Å
466L90.2Very high85.8Confident2 Ų240.9 Ų40.91%0.0120%0.204CC..Hα-helixtrans-64.6-42.2172.6-79.2171.8000112L401 L414 M417 Y421 G462 W463 E468 T469 L470 A481 I484 L485L401-L466 HydrophobicContact CD1-CD2 4.18Å; L414-L466 HydrophobicContact CD2-CD2 3.59Å; M417-L466 HydrophobicContact SD-CD1 4.36Å; M417-L466 HydrophobicContact SD-CD2 3.9Å; M417-L466 HydrophobicContact SD-CG 4.16Å; Y421-L466 HydrophobicContact CD2-CD1 4.25Å; Y421-L466 HydrophobicContact CE2-CD1 3.7Å; G462-L466 WeakPolarHBondContact O-CB 3.4Å; G462-L466 WeakPolarHBondContact O-CG 3.26Å; G462-L466 PolarHBondContact O-N 3.07Å; W463-L466 PolarHBondContact O-N 3.49Å; L466-E468 VanDerWaalsContact C-N 3.34Å; L466-T469 WeakPolarHBondContact O-CA 3.26Å; L466-T469 WeakPolarHBondContact O-CB 3.49Å; L466-T469 PolarHBondContact O-N 3.32Å; L466-T469 VanDerWaalsContact O-N 3.07Å; L466-L470 PolarHBondContact O-N 3.17Å; L466-A481 HydrophobicContact CD2-CB 4.4Å; L466-I484 HydrophobicContact CD1-CB 4.48Å; L466-I484 HydrophobicContact CD1-CG2 3.63Å; L466-I484 HydrophobicContact CD2-CD1 4.08Å; L466-L485 HydrophobicContact CB-CD1 4.34Å; L466-L485 HydrophobicContact CB-CD2 3.86Å; L466-L485 HydrophobicContact CB-CG 4.13Å
467F88.1Confident85.9Confident4 Ų438.3 Ų38.32%0.01819%0.19CC..Hα-helixtrans-61.7-44.4177.1-172.4-94.7000111.1W463 S464 T469 L470 L485 I498 R501 M524 V527W463-F467 HydrophobicContact CH2-CD2 4.37Å; W463-F467 HydrophobicContact CH2-CG 4.41Å; W463-F467 HydrophobicContact CZ2-CD2 4.26Å; W463-F467 HydrophobicContact CZ3-CB 4.49Å; W463-F467 PolarHBondContact O-N 3Å; S464-F467 PolarHBondContact O-N 3.47Å; F467-T469 VanDerWaalsContact C-N 3.29Å; F467-T469 PolarHBondContact O-N 3.43Å; F467-L470 HydrophobicContact CD2-CD1 4.08Å; F467-L470 HydrophobicContact CE2-CD1 4.21Å; F467-L470 VanDerWaalsContact O-CB 3.28Å; F467-L470 WeakPolarHBondContact O-CB 3.38Å; F467-L470 VanDerWaalsContact O-CG 3.3Å; F467-L470 WeakPolarHBondContact O-CG 3.32Å; F467-L470 PolarHBondContact O-N 2.97Å; F467-L485 HydrophobicContact CB-CD1 4.42Å; F467-L485 HydrophobicContact CD2-CD1 4.44Å; F467-I498 HydrophobicContact CD1-CG2 3.86Å; F467-I498 HydrophobicContact CD2-CG2 4.24Å; F467-I498 HydrophobicContact CE1-CB 4.26Å; F467-I498 HydrophobicContact CE1-CG2 3.62Å; F467-I498 HydrophobicContact CE2-CG2 4.03Å; F467-I498 HydrophobicContact CG-CG2 4.16Å; F467-I498 HydrophobicContact CZ-CB 4.12Å; F467-I498 HydrophobicContact CZ-CG2 3.71Å; F467-R501 HydrophobicContact CE1-CB 3.77Å; F467-R501 HydrophobicContact CE1-CG 4.16Å; F467-R501 HydrophobicContact CZ-CB 4.44Å; F467-M524 HydrophobicContact CE1-CG 4.21Å; F467-M524 HydrophobicContact CE1-SD 4.46Å; F467-M524 HydrophobicContact CE2-CG 4.44Å; F467-M524 HydrophobicContact CZ-CB 4.06Å; F467-M524 HydrophobicContact CZ-CG 3.9Å; F467-V527 HydrophobicContact CD2-CB 4.48Å; F467-V527 HydrophobicContact CD2-CG1 3.86Å; F467-V527 HydrophobicContact CE2-CB 4.1Å; F467-V527 HydrophobicContact CE2-CG1 3.81Å
468E83.9Confident85.9Confident52 Ų5234.2 Ų34.224%0.24317%0.171CC..Hα-helixtrans-58.4-42.9171.1-72.2-63.4155.500110.8S464 V465 L466 L470 A471 R501 R1391S464-E468 WeakPolarHBondContact O-CG 3.19Å; S464-E468 PolarHBondContact O-N 3Å; V465-E468 PolarHBondContact O-N 2.9Å; L466-E468 VanDerWaalsContact C-N 3.34Å; E468-L470 PolarHBondContact O-N 3.43Å; E468-A471 PolarHBondContact O-N 3.47Å; E468-R501 VanDerWaalsContact CD-NH2 3.3Å; E468-R501 IonicContact OE1-CZ 3.16Å; E468-R501 VanDerWaalsContact OE1-CZ 3.29Å; E468-R501 IonicContact OE1-NE 3.29Å; E468-R501 PolarHBondContact OE1-NE 2.85Å; E468-R501 IonicContact OE1-NH2 2.81Å; E468-R501 PolarHBondContact OE1-NH2 3.41Å; E468-R501 IonicContact OE2-CZ 2.74Å; E468-R501 IonicContact OE2-NE 3.57Å; E468-R501 IonicContact OE2-NH2 3.97Å; E468-R501 PolarHBondContact OE2-NH2 3.03Å; E468-R1391 PolarHBondContact O-NH2 2.89Å
469T89Confident85.8Confident2 Ų238 Ų381%0.01220%0.195CC..Hα-helixtrans-59.2-10.9179.9-56.30000113.9L414 V465 L466 F467 A471 D472 A481L414-T469 HydrophobicContact CD1-CG2 4.08Å; L414-T469 HydrophobicContact CD2-CG2 4.14Å; V465-T469 WeakPolarHBondContact O-CB 3.47Å; V465-T469 PolarHBondContact O-N 3.48Å; V465-T469 PolarHBondContact O-OG1 3.22Å; L466-T469 WeakPolarHBondContact O-CA 3.26Å; L466-T469 WeakPolarHBondContact O-CB 3.49Å; L466-T469 PolarHBondContact O-N 3.32Å; L466-T469 VanDerWaalsContact O-N 3.07Å; F467-T469 VanDerWaalsContact C-N 3.29Å; F467-T469 PolarHBondContact O-N 3.43Å; T469-A471 PolarHBondContact O-N 2.88Å; T469-D472 HydrophobicContact CG2-CB 4.22Å; T469-D472 WeakPolarHBondContact O-CB 3.18Å; T469-D472 PolarHBondContact O-N 3.25Å; T469-D472 VanDerWaalsContact O-N 3.1Å; T469-A481 HydrophobicContact CG2-CB 3.91Å
470L89.1Confident86Confident0 Ų038 Ų380%020%0.196CC..THydrogen-bonded Turntrans-61.7-23.7166.4-61.8179.5000113.5L466 F467 E468 Q478 A481 F482 L485 A520 C523 M524 V527L466-L470 PolarHBondContact O-N 3.17Å; F467-L470 HydrophobicContact CD2-CD1 4.08Å; F467-L470 HydrophobicContact CE2-CD1 4.21Å; F467-L470 VanDerWaalsContact O-CB 3.28Å; F467-L470 WeakPolarHBondContact O-CB 3.38Å; F467-L470 VanDerWaalsContact O-CG 3.3Å; F467-L470 WeakPolarHBondContact O-CG 3.32Å; F467-L470 PolarHBondContact O-N 2.97Å; E468-L470 PolarHBondContact O-N 3.43Å; L470-Q478 WeakPolarHBondContact O-CG 3.42Å; L470-Q478 PolarHBondContact O-NE2 2.86Å; L470-A481 HydrophobicContact CD2-CB 4.19Å; L470-F482 HydrophobicContact CD2-CB 3.76Å; L470-F482 HydrophobicContact CD2-CD2 4.43Å; L470-L485 HydrophobicContact CD1-CD1 3.87Å; L470-L485 HydrophobicContact CD2-CD1 3.99Å; L470-L485 HydrophobicContact CG-CD1 3.9Å; L470-A520 WeakPolarHBondContact O-CA 3.41Å; L470-A520 VanDerWaalsContact O-CB 3.26Å; L470-A520 WeakPolarHBondContact O-CB 2.62Å; L470-C523 HydrophobicContact CB-CB 4.36Å; L470-C523 HydrophobicContact CD1-CB 4.19Å; L470-C523 HydrophobicContact CD2-CB 3.96Å; L470-C523 HydrophobicContact CG-CB 4.41Å; L470-M524 HydrophobicContact CB-CE 4.2Å; L470-M524 HydrophobicContact CB-CG 4.09Å; L470-M524 HydrophobicContact CD1-CG 3.84Å; L470-V527 HydrophobicContact CD1-CB 4.49Å; L470-V527 HydrophobicContact CD1-CG2 4.07Å
471A82.9Confident86.3Confident5 Ų534.2 Ų34.24%0.04118%0.18CC..THydrogen-bonded Turntrans-93.519.6173.700000114E468 T469 A520 M524 I1387E468-A471 PolarHBondContact O-N 3.47Å; T469-A471 PolarHBondContact O-N 2.88Å; A471-A520 HydrophobicContact CB-CB 4.1Å; A471-M524 HydrophobicContact CB-CE 3.99Å; A471-I1387 HydrophobicContact CB-CG2 3.63Å
472D82.5Confident86.5Confident3 Ų331.7 Ų31.72%0.01617%0.165CC..  trans-60.2145.5175-161.8-63.8000112.4R410 T469 Y474 N477 Q478R410-D472 IonicContact CZ-OD2 3.46Å; R410-D472 IonicContact NE-OD2 2.87Å; R410-D472 PolarHBondContact NE-OD2 3.39Å; R410-D472 IonicContact NH2-OD2 3.16Å; R410-D472 PolarHBondContact NH2-OD2 2.9Å; T469-D472 HydrophobicContact CG2-CB 4.22Å; T469-D472 WeakPolarHBondContact O-CB 3.18Å; T469-D472 PolarHBondContact O-N 3.25Å; T469-D472 VanDerWaalsContact O-N 3.1Å; D472-Y474 PolarHBondContact O-N 3.06Å; D472-Y474 WeakPolarHBondContact OD1-CD2 3.41Å; D472-Y474 PolarHBondContact OD1-N 2.85Å; D472-N477 HydrophobicContact CB-CB 4.02Å; D472-N477 VanDerWaalsContact CG-CB 3.49Å; D472-N477 PolarHBondContact OD1-ND2 3.48Å; D472-N477 WeakPolarHBondContact OD2-CB 3.49Å; D472-N477 PolarHBondContact OD2-ND2 3.42Å; D472-Q478 HydrophobicContact CB-CG 4.01Å; D472-Q478 PolarHBondContact O-NE2 3.5Å
473C72.5Confident86.6Confident61 Ų6133.2 Ų33.241%0.41218%0.18SC..SBendtrans-65.5-21.1177.1-59.90000112.7
474Y80.2Confident86.8Confident66 Ų6632.6 Ų32.626%0.25918%0.179SC..SBendtrans-106.3117.5-177.7-56.3-79.1000111.9F407 D472 K476 N477 Q478F407-Y474 HydrophobicContact CB-CD1 4.3Å; F407-Y474 HydrophobicContact CB-CD2 4Å; F407-Y474 HydrophobicContact CB-CE1 4.07Å; F407-Y474 HydrophobicContact CB-CE2 3.74Å; F407-Y474 HydrophobicContact CB-CG 4.27Å; F407-Y474 AromaticContact CD2-CD1 3.82Å; F407-Y474 HydrophobicContact CD2-CD1 3.82Å; F407-Y474 AromaticContact CD2-CD2 3.85Å; F407-Y474 HydrophobicContact CD2-CD2 3.85Å; F407-Y474 HydrophobicContact CD2-CE1 4.43Å; F407-Y474 HydrophobicContact CD2-CE2 4.45Å; F407-Y474 AromaticContact CD2-CG 3.5Å; F407-Y474 HydrophobicContact CD2-CG 3.5Å; F407-Y474 HydrophobicContact CE2-CG 4.26Å; F407-Y474 HydrophobicContact CG-CD1 4.28Å; F407-Y474 HydrophobicContact CG-CD2 4.4Å; F407-Y474 HydrophobicContact CG-CE1 4.46Å; F407-Y474 HydrophobicContact CG-CG 4.25Å; D472-Y474 PolarHBondContact O-N 3.06Å; D472-Y474 WeakPolarHBondContact OD1-CD2 3.41Å; D472-Y474 PolarHBondContact OD1-N 2.85Å; Y474-K476 VanDerWaalsContact C-N 3.25Å; Y474-K476 PolarHBondContact O-N 3.48Å; Y474-K476 VanDerWaalsContact O-N 3.14Å; Y474-N477 WeakPolarHBondContact O-CB 3.33Å; Y474-N477 PolarHBondContact O-N 2.67Å; Y474-Q478 PolarHBondContact O-N 3.33Å
475E78.5Confident87Confident131 Ų13130.1 Ų30.161%0.61216%0.16SC*.Hα-helixtrans-54.6-35.3-178.1-173.2-178.3174.200113.8N477 Q478 T479E475-N477 VanDerWaalsContact C-N 3.31Å; E475-N477 PolarHBondContact O-N 3.16Å; E475-Q478 WeakPolarHBondContact O-CB 3.25Å; E475-Q478 PolarHBondContact O-N 3.36Å; E475-T479 WeakPolarHBondContact O-CB 3.07Å; E475-T479 PolarHBondContact O-N 3.25Å; E475-T479 PolarHBondContact O-OG1 3.28Å
476K85.1Confident86.8Confident94 Ų9433.8 Ų33.841%0.40917%0.172SC..Hα-helixtrans-63.7-36.9177.3-168.1176.8-177.5-176.50111.9F407 L411 Y474 T479 I480F407-K476 HydrophobicContact CE2-CB 4.25Å; F407-K476 HydrophobicContact CZ-CD 4.09Å; L411-K476 HydrophobicContact CD1-CD 4.11Å; L411-K476 HydrophobicContact CD1-CG 4.24Å; L411-K476 HydrophobicContact CD2-CD 4.48Å; Y474-K476 VanDerWaalsContact C-N 3.25Å; Y474-K476 PolarHBondContact O-N 3.48Å; Y474-K476 VanDerWaalsContact O-N 3.14Å; K476-T479 PolarHBondContact O-N 3.29Å; K476-I480 HydrophobicContact CG-CD1 4.44Å; K476-I480 WeakPolarHBondContact O-CG1 3.36Å; K476-I480 PolarHBondContact O-N 3.31Å
477N89.6Confident86.4Confident0 Ų038.6 Ų38.60%019%0.19CC..Hα-helixtrans-70.4-44.2176.6-69.2-8.8000110.6L414 D472 Y474 E475 T479 I480 A481L414-N477 HydrophobicContact CD1-CB 3.53Å; L414-N477 WeakPolarHBondContact CD1-O 3.48Å; D472-N477 HydrophobicContact CB-CB 4.02Å; D472-N477 VanDerWaalsContact CG-CB 3.49Å; D472-N477 PolarHBondContact OD1-ND2 3.48Å; D472-N477 WeakPolarHBondContact OD2-CB 3.49Å; D472-N477 PolarHBondContact OD2-ND2 3.42Å; Y474-N477 WeakPolarHBondContact O-CB 3.33Å; Y474-N477 PolarHBondContact O-N 2.67Å; E475-N477 VanDerWaalsContact C-N 3.31Å; E475-N477 PolarHBondContact O-N 3.16Å; N477-T479 VanDerWaalsContact C-N 3.28Å; N477-T479 PolarHBondContact O-N 3.05Å; N477-I480 PolarHBondContact O-N 2.84Å; N477-A481 WeakPolarHBondContact O-CB 3.41Å; N477-A481 PolarHBondContact O-N 3.19Å
478Q88.4Confident85.2Confident4 Ų447 Ų472%0.01923%0.226CC..Hα-helixtrans-55.4-45.1173.7-58.6-175.9-12.700111.3L470 D472 Y474 E475 I480 A481 F482 S519L470-Q478 WeakPolarHBondContact O-CG 3.42Å; L470-Q478 PolarHBondContact O-NE2 2.86Å; D472-Q478 HydrophobicContact CB-CG 4.01Å; D472-Q478 PolarHBondContact O-NE2 3.5Å; Y474-Q478 PolarHBondContact O-N 3.33Å; E475-Q478 WeakPolarHBondContact O-CB 3.25Å; E475-Q478 PolarHBondContact O-N 3.36Å; Q478-I480 PolarHBondContact O-N 2.99Å; Q478-A481 PolarHBondContact O-N 2.98Å; Q478-F482 WeakPolarHBondContact O-CB 3.47Å; Q478-F482 PolarHBondContact O-N 2.95Å; Q478-S519 VanDerWaalsContact OE1-CB 3.27Å; Q478-S519 PolarHBondContact OE1-OG 3.42Å
479T89.8Confident84Confident83 Ų8347.3 Ų47.351%0.50923%0.233SC..Hα-helixtrans-62.9-44.2-178.3-59.20000112.1E475 K476 N477 G483E475-T479 WeakPolarHBondContact O-CB 3.07Å; E475-T479 PolarHBondContact O-N 3.25Å; E475-T479 PolarHBondContact O-OG1 3.28Å; K476-T479 PolarHBondContact O-N 3.29Å; N477-T479 VanDerWaalsContact C-N 3.28Å; N477-T479 PolarHBondContact O-N 3.05Å; T479-G483 PolarHBondContact O-N 2.95Å
480I93.2Very high82.2Confident26 Ų2650.3 Ų50.313%0.13325%0.251CS..Hα-helixtrans-69.6-45.3178.7-63.1167.3000110.2L411 L414 R415 D418 K476 N477 Q478 F482 G483 I484L411-I480 HydrophobicContact CD1-CD1 3.52Å; L414-I480 HydrophobicContact CB-CB 4.39Å; L414-I480 HydrophobicContact CB-CG2 3.86Å; R415-I480 HydrophobicContact CG-CD1 4.01Å; D418-I480 HydrophobicContact CB-CG2 4.28Å; K476-I480 HydrophobicContact CG-CD1 4.44Å; K476-I480 WeakPolarHBondContact O-CG1 3.36Å; K476-I480 PolarHBondContact O-N 3.31Å; N477-I480 PolarHBondContact O-N 2.84Å; Q478-I480 PolarHBondContact O-N 2.99Å; I480-F482 VanDerWaalsContact C-N 3.33Å; I480-F482 PolarHBondContact O-N 3.49Å; I480-G483 PolarHBondContact O-N 3.45Å; I480-G483 VanDerWaalsContact O-N 3.12Å; I480-I484 HydrophobicContact CG2-CD1 4.02Å; I480-I484 HydrophobicContact CG2-CG1 4.43Å; I480-I484 WeakPolarHBondContact O-CG1 3.37Å; I480-I484 PolarHBondContact O-N 2.95Å
481A93.3Very high80.7Confident0 Ų052.4 Ų52.40%026%0.262CS..Hα-helixtrans-57.5-46.1176.200000111.5L414 L466 T469 L470 N477 Q478 G483 I484 L485L414-A481 HydrophobicContact CD2-CB 4.04Å; L466-A481 HydrophobicContact CD2-CB 4.4Å; T469-A481 HydrophobicContact CG2-CB 3.91Å; L470-A481 HydrophobicContact CD2-CB 4.19Å; N477-A481 WeakPolarHBondContact O-CB 3.41Å; N477-A481 PolarHBondContact O-N 3.19Å; Q478-A481 PolarHBondContact O-N 2.98Å; A481-G483 PolarHBondContact O-N 3.3Å; A481-I484 PolarHBondContact O-N 3.22Å; A481-L485 WeakPolarHBondContact O-CG 3.39Å; A481-L485 PolarHBondContact O-N 3.2Å
482F92.1Very high79.5Confident25 Ų2558.6 Ų58.611%0.1129%0.294CS..Hα-helixtrans-58.3-45.7173.7179.2-101.4000112.1L470 Q478 I480 I484 L485 R486 C523 R526 V527L470-F482 HydrophobicContact CD2-CB 3.76Å; L470-F482 HydrophobicContact CD2-CD2 4.43Å; Q478-F482 WeakPolarHBondContact O-CB 3.47Å; Q478-F482 PolarHBondContact O-N 2.95Å; I480-F482 VanDerWaalsContact C-N 3.33Å; I480-F482 PolarHBondContact O-N 3.49Å; F482-I484 VanDerWaalsContact C-N 3.31Å; F482-I484 PolarHBondContact O-N 2.89Å; F482-L485 PolarHBondContact O-N 3.1Å; F482-R486 WeakPolarHBondContact O-CB 3.38Å; F482-R486 PolarHBondContact O-N 3.27Å; F482-C523 HydrophobicContact CD2-CB 3.83Å; F482-C523 HydrophobicContact CE2-CB 4.46Å; F482-C523 HydrophobicContact CG-CB 4.49Å; F482-R526 HydrophobicContact CE2-CB 3.83Å; F482-R526 HydrophobicContact CZ-CB 4.17Å; F482-R526 VanDerWaalsContact CZ-NH1 3.35Å; F482-V527 HydrophobicContact CD2-CG2 3.82Å; F482-V527 HydrophobicContact CE2-CG2 3.88Å
483G91.2Very high78.2Confident31 Ų3162.1 Ų62.132%0.3232%0.324SS..Hα-helixtrans-62.4-34.2177.600000113.8T479 I480 A481T479-G483 PolarHBondContact O-N 2.95Å; I480-G483 PolarHBondContact O-N 3.45Å; I480-G483 VanDerWaalsContact O-N 3.12Å; A481-G483 PolarHBondContact O-N 3.3Å
484I91.6Very high78Confident9 Ų961.1 Ų61.15%0.04631%0.313CS..Hα-helixtrans-69.4-50.4174-65.7167.8000110.2L414 M417 D418 Y421 L466 I480 A481 F482 R486 R487L414-I484 HydrophobicContact CD2-CD1 4.4Å; M417-I484 HydrophobicContact CB-CD1 4.15Å; D418-I484 HydrophobicContact CB-CD1 3.96Å; D418-I484 HydrophobicContact CB-CG1 4.03Å; Y421-I484 HydrophobicContact CD2-CG2 3.7Å; Y421-I484 HydrophobicContact CE2-CG2 4.42Å; L466-I484 HydrophobicContact CD1-CB 4.48Å; L466-I484 HydrophobicContact CD1-CG2 3.63Å; L466-I484 HydrophobicContact CD2-CD1 4.08Å; I480-I484 HydrophobicContact CG2-CD1 4.02Å; I480-I484 HydrophobicContact CG2-CG1 4.43Å; I480-I484 WeakPolarHBondContact O-CG1 3.37Å; I480-I484 PolarHBondContact O-N 2.95Å; A481-I484 PolarHBondContact O-N 3.22Å; F482-I484 VanDerWaalsContact C-N 3.31Å; F482-I484 PolarHBondContact O-N 2.89Å; I484-R486 VanDerWaalsContact C-N 3.3Å; I484-R486 PolarHBondContact O-N 3.34Å; I484-R487 PolarHBondContact O-N 3.17Å
485L88.7Confident77.3Confident12 Ų1262.3 Ų62.36%0.06332%0.318CS..Hα-helixtrans-65.5-29.3-176.2-70.3166.7000113.4W463 L466 F467 L470 A481 F482 R487 V527W463-L485 HydrophobicContact CG-CD2 4.44Å; L466-L485 HydrophobicContact CB-CD1 4.34Å; L466-L485 HydrophobicContact CB-CD2 3.86Å; L466-L485 HydrophobicContact CB-CG 4.13Å; F467-L485 HydrophobicContact CB-CD1 4.42Å; F467-L485 HydrophobicContact CD2-CD1 4.44Å; L470-L485 HydrophobicContact CD1-CD1 3.87Å; L470-L485 HydrophobicContact CD2-CD1 3.99Å; L470-L485 HydrophobicContact CG-CD1 3.9Å; A481-L485 WeakPolarHBondContact O-CG 3.39Å; A481-L485 PolarHBondContact O-N 3.2Å; F482-L485 PolarHBondContact O-N 3.1Å; L485-R487 VanDerWaalsContact C-N 3.26Å; L485-R487 PolarHBondContact O-N 3.21Å; L485-V527 HydrophobicContact CB-CG1 4.27Å; L485-V527 HydrophobicContact CB-CG2 3.99Å; L485-V527 HydrophobicContact CD1-CG2 4.36Å
486R83.3Confident76.7Confident99 Ų9961 Ų6137%0.37432%0.322SS..THydrogen-bonded Turntrans-71.2-16.7178.5-168.1176175.4167.94.6113.4F482 I484 K488 D585 E589F482-R486 WeakPolarHBondContact O-CB 3.38Å; F482-R486 PolarHBondContact O-N 3.27Å; I484-R486 VanDerWaalsContact C-N 3.3Å; I484-R486 PolarHBondContact O-N 3.34Å; R486-K488 PolarHBondContact O-N 3.43Å; R486-D585 IonicContact CZ-OD1 2.65Å; R486-D585 IonicContact NH1-OD1 3.95Å; R486-D585 PolarHBondContact NH1-OD1 2.84Å; R486-D585 IonicContact NH2-OD1 2.73Å; R486-D585 PolarHBondContact NH2-OD1 3.39Å; R486-E589 IonicContact NH2-OE1 3.1Å; R486-E589 PolarHBondContact NH2-OE1 3.35Å
487R80.8Confident75.8Confident103 Ų10359.8 Ų59.839%0.38933%0.326SS..SBendtrans-72.7127.5178-64.7173.9-175.81556.5109.3D418 I484 L485D418-R487 PolarHBondContact O-NH1 2.91Å; D418-R487 VanDerWaalsContact O-NH1 3.16Å; D418-R487 IonicContact OD1-CZ 3.5Å; D418-R487 IonicContact OD1-NH1 3.04Å; D418-R487 PolarHBondContact OD1-NH1 3.47Å; D418-R487 IonicContact OD1-NH2 2.69Å; D418-R487 PolarHBondContact OD1-NH2 3.43Å; I484-R487 PolarHBondContact O-N 3.17Å; L485-R487 VanDerWaalsContact C-N 3.26Å; L485-R487 PolarHBondContact O-N 3.21Å
488K64.1Low75.2Confident181 Ų18159.8 Ų59.879%0.78733%0.326SS*.  trans-6104.2-177.1-91.4-165.8173.8-170.50113.9R486 T490R486-K488 PolarHBondContact O-N 3.43Å; K488-T490 PolarHBondContact O-N 3.29Å
489P58.9Low74.8Confident59 Ų5963.4 Ų63.438%0.38334%0.343SS..  trans-67.2101.6172.226.5-30.4000108.2I531P489-I531 HydrophobicContact CB-CG1 3.99Å; P489-I531 HydrophobicContact CG-CG1 4.12Å
490T51Low74.3Confident65 Ų6567 Ų6740%0.39935%0.354SS..  trans-65.7135.8148.429.80000105.3K488K488-T490 PolarHBondContact O-N 3.29Å
491I56.8Low73.8Confident43 Ų4368.3 Ų68.322%0.22136%0.357CS..  trans109.8110.8163.4-51.1139.3000115.8K460 A493 F494K460-I491 HydrophobicContact CB-CD1 4.09Å; K460-I491 HydrophobicContact CD-CD1 3.33Å; K460-I491 HydrophobicContact CD-CG1 3.92Å; K460-I491 HydrophobicContact CG-CD1 3.28Å; K460-I491 HydrophobicContact CG-CG1 4.39Å; I491-A493 HydrophobicContact CG2-CB 3.43Å; I491-A493 VanDerWaalsContact CG2-CB 3.43Å; I491-A493 VanDerWaalsContact CG2-N 3.25Å; I491-A493 PolarHBondContact O-N 3.35Å; I491-F494 HydrophobicContact CB-CD2 4.02Å; I491-F494 HydrophobicContact CB-CE2 3.87Å; I491-F494 HydrophobicContact CD1-CE2 3.65Å; I491-F494 HydrophobicContact CD1-CZ 4.43Å; I491-F494 HydrophobicContact CG1-CE2 4.33Å; I491-F494 HydrophobicContact CG2-CD2 3.69Å; I491-F494 HydrophobicContact CG2-CE2 3.6Å; I491-F494 HydrophobicContact CG2-CZ 4.42Å
492D58.1Low73.3Confident135 Ų13569.3 Ų69.372%0.72236%0.362SS*.G310 helixtrans-69.4-13.9167.6-64.9-50.3000114F494D492-F494 PolarHBondContact O-N 3.48Å
493A55.8Low73Confident78 Ų7874.2 Ų74.265%0.64538%0.384SS*.G310 helixtrans-81.21.5-164.900000116.4I491I491-A493 HydrophobicContact CG2-CB 3.43Å; I491-A493 VanDerWaalsContact CG2-CB 3.43Å; I491-A493 VanDerWaalsContact CG2-N 3.25Å; I491-A493 PolarHBondContact O-N 3.35Å
494F67.6Low72.8Confident39 Ų3975.6 Ų75.617%0.17138%0.379CS..G310 helixtrans-105.5-5.9-174.8-65.4-64.5000115.4K460 W463 I491 D492 S496 S497K460-F494 HydrophobicContact CB-CZ 4.18Å; W463-F494 HydrophobicContact CB-CE2 4.23Å; W463-F494 HydrophobicContact CB-CZ 4.11Å; W463-F494 HydrophobicContact CD2-CB 4.36Å; W463-F494 HydrophobicContact CD2-CD1 4.25Å; W463-F494 AromaticContact CD2-CD2 3.94Å; W463-F494 HydrophobicContact CD2-CD2 3.94Å; W463-F494 HydrophobicContact CD2-CE2 4.24Å; W463-F494 AromaticContact CD2-CG 3.94Å; W463-F494 HydrophobicContact CD2-CG 3.94Å; W463-F494 HydrophobicContact CE3-CB 3.92Å; W463-F494 AromaticContact CE3-CD1 3.6Å; W463-F494 HydrophobicContact CE3-CD1 3.6Å; W463-F494 HydrophobicContact CE3-CD2 4.1Å; W463-F494 HydrophobicContact CE3-CE1 4.08Å; W463-F494 HydrophobicContact CE3-CE2 4.5Å; W463-F494 AromaticContact CE3-CG 3.61Å; W463-F494 HydrophobicContact CE3-CG 3.61Å; W463-F494 HydrophobicContact CG-CD2 4.24Å; W463-F494 HydrophobicContact CG-CE2 4.1Å; W463-F494 HydrophobicContact CG-CZ 4.39Å; W463-F494 HydrophobicContact CH2-CB 3.55Å; W463-F494 HydrophobicContact CH2-CG 4.17Å; W463-F494 HydrophobicContact CZ2-CB 4.11Å; W463-F494 HydrophobicContact CZ3-CB 3.5Å; W463-F494 VanDerWaalsContact CZ3-CB 3.5Å; W463-F494 AromaticContact CZ3-CD1 3.87Å; W463-F494 HydrophobicContact CZ3-CD1 3.87Å; W463-F494 AromaticContact CZ3-CG 3.74Å; W463-F494 HydrophobicContact CZ3-CG 3.74Å; I491-F494 HydrophobicContact CB-CD2 4.02Å; I491-F494 HydrophobicContact CB-CE2 3.87Å; I491-F494 HydrophobicContact CD1-CE2 3.65Å; I491-F494 HydrophobicContact CD1-CZ 4.43Å; I491-F494 HydrophobicContact CG1-CE2 4.33Å; I491-F494 HydrophobicContact CG2-CD2 3.69Å; I491-F494 HydrophobicContact CG2-CE2 3.6Å; I491-F494 HydrophobicContact CG2-CZ 4.42Å; D492-F494 PolarHBondContact O-N 3.48Å; F494-S496 PolarHBondContact O-N 2.7Å; F494-S497 PolarHBondContact O-N 2.7Å; F494-S497 VanDerWaalsContact O-N 3.1Å; F494-S497 PolarHBondContact O-OG 3Å
495Y65.2Low72.7Confident92 Ų9275.1 Ų75.136%0.36138%0.377SS..Hα-helixtrans-59.3-44.3-172.1-175.8-99.7000113.8S497 I498 E499 T532Y495-S497 PolarHBondContact O-N 3.31Å; Y495-I498 HydrophobicContact CD2-CD1 4.48Å; Y495-I498 WeakPolarHBondContact O-CG1 3.23Å; Y495-I498 PolarHBondContact O-N 3.1Å; Y495-I498 VanDerWaalsContact O-N 3.13Å; Y495-E499 PolarHBondContact O-N 2.84Å; Y495-T532 HydrophobicContact CD2-CG2 4.2Å; Y495-T532 HydrophobicContact CE2-CG2 3.52Å; Y495-T532 WeakPolarHBondContact CE2-OG1 3.45Å
496S66.5Low72.8Confident102 Ų10279.8 Ų79.871%0.71339%0.394SS*.Hα-helixtrans-60.6-30.5179.3530000112.8F494 I498F494-S496 PolarHBondContact O-N 2.7Å; S496-I498 VanDerWaalsContact C-N 3.34Å
497S66.9Low72.9Confident69 Ų6977.4 Ų77.448%0.48339%0.392SS..Hα-helixtrans-76.5-16.7179.871.30000114.3F494 Y495F494-S497 PolarHBondContact O-N 2.7Å; F494-S497 VanDerWaalsContact O-N 3.1Å; F494-S497 PolarHBondContact O-OG 3Å; Y495-S497 PolarHBondContact O-N 3.31Å
498I76.9Confident73.1Confident1 Ų173.5 Ų73.51%0.00538%0.38CS..Hα-helixtrans-108.3-14.5-17856171.8000114.7W463 F467 Y495 S496 E500 R501 L502 I531W463-I498 HydrophobicContact CH2-CD1 4.46Å; W463-I498 HydrophobicContact CH2-CG2 3.31Å; W463-I498 HydrophobicContact CZ2-CG2 4.34Å; W463-I498 HydrophobicContact CZ3-CG2 3.86Å; F467-I498 HydrophobicContact CD1-CG2 3.86Å; F467-I498 HydrophobicContact CD2-CG2 4.24Å; F467-I498 HydrophobicContact CE1-CB 4.26Å; F467-I498 HydrophobicContact CE1-CG2 3.62Å; F467-I498 HydrophobicContact CE2-CG2 4.03Å; F467-I498 HydrophobicContact CG-CG2 4.16Å; F467-I498 HydrophobicContact CZ-CB 4.12Å; F467-I498 HydrophobicContact CZ-CG2 3.71Å; Y495-I498 HydrophobicContact CD2-CD1 4.48Å; Y495-I498 WeakPolarHBondContact O-CG1 3.23Å; Y495-I498 PolarHBondContact O-N 3.1Å; Y495-I498 VanDerWaalsContact O-N 3.13Å; S496-I498 VanDerWaalsContact C-N 3.34Å; I498-E500 VanDerWaalsContact C-N 3.26Å; I498-E500 PolarHBondContact O-N 2.89Å; I498-R501 PolarHBondContact O-N 3.44Å; I498-R501 VanDerWaalsContact O-N 3.08Å; I498-L502 HydrophobicContact CD1-CD1 4.04Å; I498-L502 HydrophobicContact CG1-CD1 4.2Å; I498-L502 WeakPolarHBondContact O-CG 3.31Å; I498-L502 PolarHBondContact O-N 3.32Å; I498-I531 HydrophobicContact CD1-CG2 4.34Å
499E78.7Confident74.3Confident79 Ų7965 Ų6537%0.36934%0.343SS..Hα-helixtrans-55-43.4-175.8-167.8-171.5150.700112Y495 L502 K503Y495-E499 PolarHBondContact O-N 2.84Å; E499-L502 PolarHBondContact O-N 2.89Å; E499-K503 WeakPolarHBondContact O-CG 3.43Å; E499-K503 PolarHBondContact O-N 3.37Å; E499-K503 VanDerWaalsContact OE1-CE 3.24Å; E499-K503 WeakPolarHBondContact OE1-CE 3.49Å; E499-K503 IonicContact OE1-NZ 3.3Å; E499-K503 PolarHBondContact OE1-NZ 3.04Å
500E80.1Confident75.6Confident160 Ų16063 Ų6375%0.74833%0.33SS*.Hα-helixtrans-64.3-44.6177.3-171.5175-173.500112.3I498 L502 K503 W504I498-E500 VanDerWaalsContact C-N 3.26Å; I498-E500 PolarHBondContact O-N 2.89Å; E500-L502 VanDerWaalsContact C-N 3.33Å; E500-L502 PolarHBondContact O-N 2.85Å; E500-K503 WeakPolarHBondContact O-CB 3.38Å; E500-K503 PolarHBondContact O-N 3.31Å; E500-W504 PolarHBondContact O-N 3.33Å
501R82.6Confident77.1Confident52 Ų5268.4 Ų68.420%0.19634%0.343CS..Hα-helixtrans-66.4-33.5177-68-65.5-163-161.80.2112.3F467 E468 I498 W504 A505 E1390F467-R501 HydrophobicContact CE1-CB 3.77Å; F467-R501 HydrophobicContact CE1-CG 4.16Å; F467-R501 HydrophobicContact CZ-CB 4.44Å; E468-R501 VanDerWaalsContact CD-NH2 3.3Å; E468-R501 IonicContact OE1-CZ 3.16Å; E468-R501 VanDerWaalsContact OE1-CZ 3.29Å; E468-R501 IonicContact OE1-NE 3.29Å; E468-R501 PolarHBondContact OE1-NE 2.85Å; E468-R501 IonicContact OE1-NH2 2.81Å; E468-R501 PolarHBondContact OE1-NH2 3.41Å; E468-R501 IonicContact OE2-CZ 2.74Å; E468-R501 IonicContact OE2-NE 3.57Å; E468-R501 IonicContact OE2-NH2 3.97Å; E468-R501 PolarHBondContact OE2-NH2 3.03Å; I498-R501 PolarHBondContact O-N 3.44Å; I498-R501 VanDerWaalsContact O-N 3.08Å; R501-W504 PolarHBondContact O-N 2.69Å; R501-A505 WeakPolarHBondContact O-CB 3.34Å; R501-A505 PolarHBondContact O-N 3.19Å; R501-E1390 IonicContact NH1-OE2 2.82Å; R501-E1390 IonicContact NH2-OE2 3.43Å
502L83.5Confident78.3Confident21 Ų2167.1 Ų67.111%0.1134%0.338CS..Hα-helixtrans-70-39.3174-69.3175.6000112.1I498 E499 E500 A505 R506 M524I498-L502 HydrophobicContact CD1-CD1 4.04Å; I498-L502 HydrophobicContact CG1-CD1 4.2Å; I498-L502 WeakPolarHBondContact O-CG 3.31Å; I498-L502 PolarHBondContact O-N 3.32Å; E499-L502 PolarHBondContact O-N 2.89Å; E500-L502 VanDerWaalsContact C-N 3.33Å; E500-L502 PolarHBondContact O-N 2.85Å; L502-A505 PolarHBondContact O-N 3.01Å; L502-R506 WeakPolarHBondContact O-CG 3.32Å; L502-R506 PolarHBondContact O-N 3.27Å; L502-M524 VanDerWaalsContact CD2-O 3.23Å; L502-M524 WeakPolarHBondContact CD2-O 3.42Å
503K85.6Confident79.3Confident128 Ų12863.3 Ų63.356%0.55732%0.317SS*.Hα-helixtrans-61.1-45.6171.3-74.6173.7-174.91660110.9E499 E500 R506 S507E499-K503 WeakPolarHBondContact O-CG 3.43Å; E499-K503 PolarHBondContact O-N 3.37Å; E499-K503 VanDerWaalsContact OE1-CE 3.24Å; E499-K503 WeakPolarHBondContact OE1-CE 3.49Å; E499-K503 IonicContact OE1-NZ 3.3Å; E499-K503 PolarHBondContact OE1-NZ 3.04Å; E500-K503 WeakPolarHBondContact O-CB 3.38Å; E500-K503 PolarHBondContact O-N 3.31Å; K503-R506 PolarHBondContact O-N 3.17Å; K503-S507 WeakPolarHBondContact O-CB 3.47Å; K503-S507 PolarHBondContact O-N 2.89Å
504W86.8Confident80.3Confident60 Ų6064.8 Ų64.823%0.22731%0.309CS..Hα-helixtrans-56.9-51.9173.5174.487.4000111.3E500 R501 R506 S507 V508 E517 A521 M524 I1387E500-W504 PolarHBondContact O-N 3.33Å; R501-W504 PolarHBondContact O-N 2.69Å; W504-R506 PolarHBondContact O-N 2.88Å; W504-S507 PolarHBondContact O-N 3.3Å; W504-S507 PolarHBondContact O-OG 2.98Å; W504-V508 HydrophobicContact CD2-CG2 4.04Å; W504-V508 VanDerWaalsContact CE2-CG2 3.47Å; W504-V508 HydrophobicContact CG-CG2 4.26Å; W504-V508 HydrophobicContact CH2-CG1 4.2Å; W504-V508 HydrophobicContact CZ2-CB 4.18Å; W504-V508 HydrophobicContact CZ2-CG1 3.96Å; W504-V508 HydrophobicContact CZ2-CG2 3.8Å; W504-V508 WeakPolarHBondContact O-CB 3.33Å; W504-V508 WeakPolarHBondContact O-CG2 3.32Å; W504-V508 PolarHBondContact O-N 3.41Å; W504-E517 HydrophobicContact CH2-CB 4.49Å; W504-A521 HydrophobicContact CZ3-CB 4.37Å; W504-M524 HydrophobicContact CE3-SD 4.09Å; W504-M524 HydrophobicContact CZ3-SD 3.9Å; W504-I1387 HydrophobicContact CD2-CD1 3.67Å; W504-I1387 HydrophobicContact CE3-CD1 3.85Å; W504-I1387 HydrophobicContact CG-CD1 4.44Å; W504-I1387 HydrophobicContact CH2-CD1 3.61Å; W504-I1387 HydrophobicContact CZ2-CD1 3.36Å; W504-I1387 HydrophobicContact CZ2-CG1 4.05Å; W504-I1387 HydrophobicContact CZ3-CD1 3.83Å
505A89.1Confident80.8Confident0 Ų066.7 Ų66.70%032%0.32CS..Hα-helixtrans-58.4-44.7-178.700000112.4R501 L502 S507 V508 L509 A521 M524 I525R501-A505 WeakPolarHBondContact O-CB 3.34Å; R501-A505 PolarHBondContact O-N 3.19Å; L502-A505 PolarHBondContact O-N 3.01Å; A505-S507 VanDerWaalsContact C-N 3.29Å; A505-S507 PolarHBondContact O-N 2.71Å; A505-V508 PolarHBondContact O-N 3.23Å; A505-L509 WeakPolarHBondContact O-CB 3.47Å; A505-L509 PolarHBondContact O-N 3Å; A505-A521 HydrophobicContact CB-CB 3.88Å; A505-M524 HydrophobicContact CB-CB 4.13Å; A505-I525 HydrophobicContact CB-CD1 4.26Å; A505-I525 HydrophobicContact CB-CG1 3.89Å
506R90Very high81.4Confident110 Ų11065 Ų6542%0.41532%0.319SS..Hα-helixtrans-64.1-32.2175.3-73.6-178.2176.6-168.2-0.9112.8L502 K503 W504 P510 I525 T542 W545L502-R506 WeakPolarHBondContact O-CG 3.32Å; L502-R506 PolarHBondContact O-N 3.27Å; K503-R506 PolarHBondContact O-N 3.17Å; W504-R506 PolarHBondContact O-N 2.88Å; R506-P510 WeakPolarHBondContact O-CD 3.47Å; R506-I525 HydrophobicContact CG-CD1 4.18Å; R506-I525 HydrophobicContact CG-CG1 4.29Å; R506-T542 PolarHBondContact NH2-OG1 3.37Å; R506-W545 HydrophobicContact CB-CH2 4.27Å; R506-W545 HydrophobicContact CB-CZ2 4.2Å; R506-W545 HydrophobicContact CG-CH2 4.26Å; R506-W545 HydrophobicContact CG-CZ2 4.44Å
507S86.7Confident82.2Confident49 Ų4961.9 Ų61.934%0.34329%0.294SS..Hα-helixtrans-77.7-33.8178.378.70000113.8K503 W504 A505 R511K503-S507 WeakPolarHBondContact O-CB 3.47Å; K503-S507 PolarHBondContact O-N 2.89Å; W504-S507 PolarHBondContact O-N 3.3Å; W504-S507 PolarHBondContact O-OG 2.98Å; A505-S507 VanDerWaalsContact C-N 3.29Å; A505-S507 PolarHBondContact O-N 2.71Å; S507-R511 WeakPolarHBondContact O-CD 3.48Å
508V85.1Confident83.1Confident21 Ų2158.6 Ų58.613%0.12727%0.271CS..Hα-helixtrans-85.3-40-173.5165.20000111.9W504 A505 R511 S512 E517W504-V508 HydrophobicContact CD2-CG2 4.04Å; W504-V508 VanDerWaalsContact CE2-CG2 3.47Å; W504-V508 HydrophobicContact CG-CG2 4.26Å; W504-V508 HydrophobicContact CH2-CG1 4.2Å; W504-V508 HydrophobicContact CZ2-CB 4.18Å; W504-V508 HydrophobicContact CZ2-CG1 3.96Å; W504-V508 HydrophobicContact CZ2-CG2 3.8Å; W504-V508 WeakPolarHBondContact O-CB 3.33Å; W504-V508 WeakPolarHBondContact O-CG2 3.32Å; W504-V508 PolarHBondContact O-N 3.41Å; A505-V508 PolarHBondContact O-N 3.23Å; V508-R511 PolarHBondContact O-N 3.05Å; V508-S512 PolarHBondContact O-N 3.31Å; V508-E517 HydrophobicContact CG1-CB 3.9Å
509L89Confident83.6Confident1 Ų159.6 Ų59.61%0.00528%0.278CS..THydrogen-bonded Turntrans-51.7-47.6-176.2-171.298.3000113.8A505 R511 I518 A521 A522 W545 S571 L578A505-L509 WeakPolarHBondContact O-CB 3.47Å; A505-L509 PolarHBondContact O-N 3Å; L509-R511 VanDerWaalsContact C-N 3.3Å; L509-R511 PolarHBondContact O-N 2.96Å; L509-I518 HydrophobicContact CD1-CG2 4.14Å; L509-A521 HydrophobicContact CB-CB 4.13Å; L509-A521 HydrophobicContact CD1-CB 3.99Å; L509-A522 HydrophobicContact CD1-CB 4.07Å; L509-W545 HydrophobicContact CD2-CH2 4.18Å; L509-W545 HydrophobicContact CD2-CZ3 4.32Å; L509-S571 WeakPolarHBondContact O-CB 3.28Å; L509-L578 HydrophobicContact CD1-CB 4.48Å; L509-L578 HydrophobicContact CD2-CB 3.86Å; L509-L578 HydrophobicContact CD2-CD2 3.38Å; L509-L578 HydrophobicContact CD2-CG 4.24Å
510P85.5Confident84Confident17 Ų1755.9 Ų55.911%0.1126%0.261CS..THydrogen-bonded Turntrans-78.2-7.218030.4-34.9000114.4R506 T570 S571 I575R506-P510 WeakPolarHBondContact O-CD 3.47Å; P510-T570 WeakPolarHBondContact O-CA 3.37Å; P510-S571 PolarHBondContact O-N 3.47Å; P510-I575 HydrophobicContact CB-CD1 4.06Å; P510-I575 HydrophobicContact CB-CG1 4.3Å
511R81.8Confident84.6Confident180 Ų18048.2 Ų48.268%0.67923%0.225SC*.THydrogen-bonded Turntrans-116.6-36.9-171-67.3179.6-178.9162.2-0.5114.5S507 V508 L509S507-R511 WeakPolarHBondContact O-CD 3.48Å; V508-R511 PolarHBondContact O-N 3.05Å; L509-R511 VanDerWaalsContact C-N 3.3Å; L509-R511 PolarHBondContact O-N 2.96Å
512S82Confident85Confident15 Ų1545.8 Ų45.811%0.10522%0.216CC..  trans-75.8139.3-173.8-178.60000111.5V508 K514 E517 I518 S571V508-S512 PolarHBondContact O-N 3.31Å; S512-K514 PolarHBondContact OG-N 2.99Å; S512-K514 VanDerWaalsContact OG-N 3.08Å; S512-E517 VanDerWaalsContact CB-OE2 3.3Å; S512-E517 WeakPolarHBondContact CB-OE2 3.4Å; S512-E517 PolarHBondContact OG-OE2 2.87Å; S512-I518 VanDerWaalsContact O-CD1 3.23Å; S512-I518 WeakPolarHBondContact O-CD1 3.4Å; S512-S571 WeakPolarHBondContact O-CB 3.43Å; S512-S571 PolarHBondContact O-OG 2.93Å
513L79.7Confident85.4Confident56 Ų5645.5 Ų45.529%0.29322%0.216SC..  trans-95.1-5.4170.1-58.4177.1000112.1F573 V651 R654L513-F573 HydrophobicContact CD2-CE1 4.29Å; L513-V651 HydrophobicContact CD2-CG1 4.49Å; L513-V651 HydrophobicContact CD2-CG2 4.27Å; L513-R654 PolarHBondContact O-NH1 2.78Å
514K76.6Confident85.6Confident108 Ų10839.4 Ų39.447%0.4719%0.189SC..  trans-80.5120.2180-65.3179-172.9170.10110.1S512 V516 E517 I518S512-K514 PolarHBondContact OG-N 2.99Å; S512-K514 VanDerWaalsContact OG-N 3.08Å; K514-V516 VanDerWaalsContact C-N 3.29Å; K514-V516 PolarHBondContact O-N 3.39Å; K514-E517 HydrophobicContact CB-CB 4.29Å; K514-E517 HydrophobicContact CB-CG 4.19Å; K514-E517 HydrophobicContact CD-CG 4.37Å; K514-E517 WeakPolarHBondContact CD-OE1 3.2Å; K514-E517 IonicContact NZ-OE1 2.93Å; K514-E517 PolarHBondContact NZ-OE1 3.27Å; K514-E517 PolarHBondContact O-N 3.29Å; K514-I518 WeakPolarHBondContact O-CD1 3.47Å; K514-I518 WeakPolarHBondContact O-CG1 3.37Å; K514-I518 PolarHBondContact O-N 3.41Å; K514-I518 VanDerWaalsContact O-N 3.14Å
515L79.5Confident85.8Confident79 Ų7936.7 Ų36.741%0.41418%0.179SC..Hα-helixtrans-60.2-38.4-176.3-17461.9000112.9I518 S519 F573L515-I518 PolarHBondContact O-N 3.33Å; L515-S519 WeakPolarHBondContact O-CB 3.2Å; L515-S519 PolarHBondContact O-N 3.19Å; L515-F573 HydrophobicContact CD1-CE2 4.31Å
516V77.3Confident85.8Confident56 Ų5638.1 Ų38.134%0.33918%0.184SC..Hα-helixtrans-61.9-45.2179.9176.40000111K514 A520K514-V516 VanDerWaalsContact C-N 3.29Å; K514-V516 PolarHBondContact O-N 3.39Å; V516-A520 VanDerWaalsContact O-CB 3.25Å; V516-A520 WeakPolarHBondContact O-CB 3.35Å; V516-A520 PolarHBondContact O-N 3.48Å
517E82.1Confident85.6Confident37 Ų3733 Ų3317%0.17317%0.166CC..Hα-helixtrans-67.2-40179.1-70.3176.3-177.900111.7W504 V508 S512 K514 A520 A521W504-E517 HydrophobicContact CH2-CB 4.49Å; V508-E517 HydrophobicContact CG1-CB 3.9Å; S512-E517 VanDerWaalsContact CB-OE2 3.3Å; S512-E517 WeakPolarHBondContact CB-OE2 3.4Å; S512-E517 PolarHBondContact OG-OE2 2.87Å; K514-E517 HydrophobicContact CB-CB 4.29Å; K514-E517 HydrophobicContact CB-CG 4.19Å; K514-E517 HydrophobicContact CD-CG 4.37Å; K514-E517 WeakPolarHBondContact CD-OE1 3.2Å; K514-E517 IonicContact NZ-OE1 2.93Å; K514-E517 PolarHBondContact NZ-OE1 3.27Å; K514-E517 PolarHBondContact O-N 3.29Å; E517-A520 PolarHBondContact O-N 2.73Å; E517-A521 WeakPolarHBondContact O-CB 3.44Å; E517-A521 PolarHBondContact O-N 2.97Å
518I86.9Confident85.5Confident0 Ų030.8 Ų30.80%015%0.15CC..Hα-helixtrans-65.9-45.6177.7-65.5163.2000111.2L509 S512 K514 L515 A521 A522 S571 F573 G574 M577L509-I518 HydrophobicContact CD1-CG2 4.14Å; S512-I518 VanDerWaalsContact O-CD1 3.23Å; S512-I518 WeakPolarHBondContact O-CD1 3.4Å; K514-I518 WeakPolarHBondContact O-CD1 3.47Å; K514-I518 WeakPolarHBondContact O-CG1 3.37Å; K514-I518 PolarHBondContact O-N 3.41Å; K514-I518 VanDerWaalsContact O-N 3.14Å; L515-I518 PolarHBondContact O-N 3.33Å; I518-A521 PolarHBondContact O-N 3.49Å; I518-A522 WeakPolarHBondContact O-CB 3.19Å; I518-A522 PolarHBondContact O-N 3.28Å; I518-S571 VanDerWaalsContact CD1-OG 3.22Å; I518-S571 WeakPolarHBondContact CD1-OG 3.35Å; I518-F573 HydrophobicContact CD1-CD2 4.16Å; I518-F573 HydrophobicContact CD1-CE1 4.15Å; I518-F573 HydrophobicContact CD1-CE2 3.15Å; I518-F573 HydrophobicContact CD1-CZ 3.14Å; I518-G574 VanDerWaalsContact CG2-CA 3.44Å; I518-M577 HydrophobicContact CG2-CE 3.6Å; I518-M577 HydrophobicContact CG2-SD 4.45Å
519S87.1Confident85.3Confident22 Ų2231.3 Ų31.315%0.15415%0.152CC..Hα-helixtrans-61.2-47.9176.4-176.20000110.8Q478 L515 A521 A522 C523Q478-S519 VanDerWaalsContact OE1-CB 3.27Å; Q478-S519 PolarHBondContact OE1-OG 3.42Å; L515-S519 WeakPolarHBondContact O-CB 3.2Å; L515-S519 PolarHBondContact O-N 3.19Å; S519-A521 PolarHBondContact O-N 3.43Å; S519-A522 PolarHBondContact O-N 3.16Å; S519-C523 WeakPolarHBondContact O-CB 3.16Å; S519-C523 PolarHBondContact O-N 2.92Å
520A88.2Confident84.6Confident1 Ų134.1 Ų34.11%0.00818%0.176CC..Hα-helixtrans-58.4-48.9176.100000111.8L470 A471 V516 E517 A522 C523 M524L470-A520 WeakPolarHBondContact O-CA 3.41Å; L470-A520 VanDerWaalsContact O-CB 3.26Å; L470-A520 WeakPolarHBondContact O-CB 2.62Å; A471-A520 HydrophobicContact CB-CB 4.1Å; V516-A520 VanDerWaalsContact O-CB 3.25Å; V516-A520 WeakPolarHBondContact O-CB 3.35Å; V516-A520 PolarHBondContact O-N 3.48Å; E517-A520 PolarHBondContact O-N 2.73Å; A520-A522 PolarHBondContact O-N 3.19Å; A520-C523 PolarHBondContact O-N 3.04Å; A520-M524 WeakPolarHBondContact O-CB 3.41Å; A520-M524 VanDerWaalsContact O-CG 3.25Å; A520-M524 WeakPolarHBondContact O-CG 3.25Å; A520-M524 PolarHBondContact O-N 3.28Å
521A90.8Very high84.1Confident0 Ų034.1 Ų34.10%018%0.175CC..Hα-helixtrans-60.2-44.8178.600000111.9W504 A505 L509 E517 I518 S519 M524 I525W504-A521 HydrophobicContact CZ3-CB 4.37Å; A505-A521 HydrophobicContact CB-CB 3.88Å; L509-A521 HydrophobicContact CB-CB 4.13Å; L509-A521 HydrophobicContact CD1-CB 3.99Å; E517-A521 WeakPolarHBondContact O-CB 3.44Å; E517-A521 PolarHBondContact O-N 2.97Å; I518-A521 PolarHBondContact O-N 3.49Å; S519-A521 PolarHBondContact O-N 3.43Å; A521-M524 PolarHBondContact O-N 2.99Å; A521-I525 WeakPolarHBondContact O-CB 3.35Å; A521-I525 WeakPolarHBondContact O-CD1 3.37Å; A521-I525 VanDerWaalsContact O-CG1 3.23Å; A521-I525 WeakPolarHBondContact O-CG1 2.96Å; A521-I525 PolarHBondContact O-N 3.25Å
522A92.3Very high83.6Confident1 Ų127 Ų271%0.00815%0.151CC..Hα-helixtrans-63.8-43.2177.500000112.2L509 I518 S519 A520 R526 M577 L578 L581L509-A522 HydrophobicContact CD1-CB 4.07Å; I518-A522 WeakPolarHBondContact O-CB 3.19Å; I518-A522 PolarHBondContact O-N 3.28Å; S519-A522 PolarHBondContact O-N 3.16Å; A520-A522 PolarHBondContact O-N 3.19Å; A522-R526 WeakPolarHBondContact O-CB 3.08Å; A522-R526 WeakPolarHBondContact O-CD 3.01Å; A522-R526 VanDerWaalsContact O-CG 3.23Å; A522-R526 WeakPolarHBondContact O-CG 2.64Å; A522-R526 PolarHBondContact O-N 3.06Å; A522-R526 VanDerWaalsContact O-N 3.13Å; A522-M577 HydrophobicContact CB-CE 3.34Å; A522-L578 HydrophobicContact CB-CD1 4.21Å; A522-L581 HydrophobicContact CB-CD1 4.34Å
523C90.9Very high82.4Confident15 Ų1530.4 Ų30.410%0.10117%0.172CC..Hα-helixtrans-63.4-45.5174.8-77.70000112.2L470 F482 S519 A520 R526 V527L470-C523 HydrophobicContact CB-CB 4.36Å; L470-C523 HydrophobicContact CD1-CB 4.19Å; L470-C523 HydrophobicContact CD2-CB 3.96Å; L470-C523 HydrophobicContact CG-CB 4.41Å; F482-C523 HydrophobicContact CD2-CB 3.83Å; F482-C523 HydrophobicContact CE2-CB 4.46Å; F482-C523 HydrophobicContact CG-CB 4.49Å; S519-C523 WeakPolarHBondContact O-CB 3.16Å; S519-C523 PolarHBondContact O-N 2.92Å; A520-C523 PolarHBondContact O-N 3.04Å; C523-R526 PolarHBondContact O-N 3.47Å; C523-V527 WeakPolarHBondContact O-CG2 3.49Å; C523-V527 PolarHBondContact O-N 3.37Å
524M89.9Confident81.1Confident0 Ų037 Ų370%020%0.199CC..Hα-helixtrans-62.2-45.6178.9-75.1177.6178.600111.7F467 L470 A471 L502 W504 A505 A520 A521 R526 V527 G528F467-M524 HydrophobicContact CE1-CG 4.21Å; F467-M524 HydrophobicContact CE1-SD 4.46Å; F467-M524 HydrophobicContact CE2-CG 4.44Å; F467-M524 HydrophobicContact CZ-CB 4.06Å; F467-M524 HydrophobicContact CZ-CG 3.9Å; L470-M524 HydrophobicContact CB-CE 4.2Å; L470-M524 HydrophobicContact CB-CG 4.09Å; L470-M524 HydrophobicContact CD1-CG 3.84Å; A471-M524 HydrophobicContact CB-CE 3.99Å; L502-M524 VanDerWaalsContact CD2-O 3.23Å; L502-M524 WeakPolarHBondContact CD2-O 3.42Å; W504-M524 HydrophobicContact CE3-SD 4.09Å; W504-M524 HydrophobicContact CZ3-SD 3.9Å; A505-M524 HydrophobicContact CB-CB 4.13Å; A520-M524 WeakPolarHBondContact O-CB 3.41Å; A520-M524 VanDerWaalsContact O-CG 3.25Å; A520-M524 WeakPolarHBondContact O-CG 3.25Å; A520-M524 PolarHBondContact O-N 3.28Å; A521-M524 PolarHBondContact O-N 2.99Å; M524-R526 VanDerWaalsContact C-N 3.32Å; M524-R526 PolarHBondContact O-N 2.97Å; M524-V527 PolarHBondContact O-N 3.33Å; M524-G528 PolarHBondContact O-N 3.06Å
525I90.8Very high79.9Confident3 Ų337 Ų372%0.01520%0.2CC..Hα-helixtrans-57.2-47.4175.7-72.3165.8000110.3A505 R506 A521 V527 G528 I529 T542 W545 L578A505-I525 HydrophobicContact CB-CD1 4.26Å; A505-I525 HydrophobicContact CB-CG1 3.89Å; R506-I525 HydrophobicContact CG-CD1 4.18Å; R506-I525 HydrophobicContact CG-CG1 4.29Å; A521-I525 WeakPolarHBondContact O-CB 3.35Å; A521-I525 WeakPolarHBondContact O-CD1 3.37Å; A521-I525 VanDerWaalsContact O-CG1 3.23Å; A521-I525 WeakPolarHBondContact O-CG1 2.96Å; A521-I525 PolarHBondContact O-N 3.25Å; I525-V527 PolarHBondContact O-N 3.06Å; I525-G528 PolarHBondContact O-N 2.88Å; I525-I529 HydrophobicContact CG2-CD1 3.92Å; I525-I529 VanDerWaalsContact O-CG1 3.26Å; I525-I529 WeakPolarHBondContact O-CG1 3.34Å; I525-I529 PolarHBondContact O-N 3.22Å; I525-T542 HydrophobicContact CG2-CG2 3.64Å; I525-W545 HydrophobicContact CD1-CZ3 4.32Å; I525-L578 HydrophobicContact CD1-CD2 3.93Å; I525-L578 HydrophobicContact CG2-CD1 4.34Å; I525-L578 HydrophobicContact CG2-CD2 4.38Å
526R89.2Confident78.5Confident29 Ų2942.8 Ų42.811%0.10923%0.225CC..Hα-helixtrans-64.5-40.1-179.3-71.5172.272-161.57.3113.1F482 A522 C523 M524 A530 L578 L582 D585F482-R526 HydrophobicContact CE2-CB 3.83Å; F482-R526 HydrophobicContact CZ-CB 4.17Å; F482-R526 VanDerWaalsContact CZ-NH1 3.35Å; A522-R526 WeakPolarHBondContact O-CB 3.08Å; A522-R526 WeakPolarHBondContact O-CD 3.01Å; A522-R526 VanDerWaalsContact O-CG 3.23Å; A522-R526 WeakPolarHBondContact O-CG 2.64Å; A522-R526 PolarHBondContact O-N 3.06Å; A522-R526 VanDerWaalsContact O-N 3.13Å; C523-R526 PolarHBondContact O-N 3.47Å; M524-R526 VanDerWaalsContact C-N 3.32Å; M524-R526 PolarHBondContact O-N 2.97Å; R526-A530 PolarHBondContact O-N 3.01Å; R526-L578 HydrophobicContact CG-CD1 4.42Å; R526-L582 HydrophobicContact CG-CD2 4.15Å; R526-D585 IonicContact CZ-OD1 2.84Å; R526-D585 IonicContact CZ-OD2 3.34Å; R526-D585 VanDerWaalsContact CZ-OD2 3.24Å; R526-D585 IonicContact NE-OD2 2.79Å; R526-D585 PolarHBondContact NE-OD2 2.86Å; R526-D585 IonicContact NH2-OD1 3.54Å; R526-D585 PolarHBondContact NH2-OD1 3.4Å; R526-D585 IonicContact NH2-OD2 3.39Å; R526-D585 PolarHBondContact NH2-OD2 3.43Å
527V86.5Confident78Confident4 Ų444.9 Ų44.92%0.02424%0.235CC..Hα-helixtrans-67.7-41.4173.7173.50000111.1F467 L470 F482 L485 C523 M524 I525 I529 A530 I531F467-V527 HydrophobicContact CD2-CB 4.48Å; F467-V527 HydrophobicContact CD2-CG1 3.86Å; F467-V527 HydrophobicContact CE2-CB 4.1Å; F467-V527 HydrophobicContact CE2-CG1 3.81Å; L470-V527 HydrophobicContact CD1-CB 4.49Å; L470-V527 HydrophobicContact CD1-CG2 4.07Å; F482-V527 HydrophobicContact CD2-CG2 3.82Å; F482-V527 HydrophobicContact CE2-CG2 3.88Å; L485-V527 HydrophobicContact CB-CG1 4.27Å; L485-V527 HydrophobicContact CB-CG2 3.99Å; L485-V527 HydrophobicContact CD1-CG2 4.36Å; C523-V527 WeakPolarHBondContact O-CG2 3.49Å; C523-V527 PolarHBondContact O-N 3.37Å; M524-V527 PolarHBondContact O-N 3.33Å; I525-V527 PolarHBondContact O-N 3.06Å; V527-I529 VanDerWaalsContact C-N 3.35Å; V527-I529 PolarHBondContact O-N 3.22Å; V527-A530 PolarHBondContact O-N 3.42Å; V527-A530 VanDerWaalsContact O-N 3.17Å; V527-I531 HydrophobicContact CG1-CD1 3.68Å; V527-I531 WeakPolarHBondContact O-CG1 3.43Å; V527-I531 PolarHBondContact O-N 3.44Å
528G83.5Confident77.8Confident2 Ų243.6 Ų43.62%0.02123%0.231CC..Hα-helixtrans-61.1-40.417800000113.5M524 I525 A530 I531 T532M524-G528 PolarHBondContact O-N 3.06Å; I525-G528 PolarHBondContact O-N 2.88Å; G528-A530 VanDerWaalsContact C-N 3.32Å; G528-A530 PolarHBondContact O-N 3.08Å; G528-I531 PolarHBondContact O-N 3.02Å; G528-T532 PolarHBondContact O-N 3.38Å; G528-T532 VanDerWaalsContact O-N 3.09Å; G528-T532 PolarHBondContact O-OG1 3.14Å
529I81.1Confident77.7Confident31 Ų3144.7 Ų44.716%0.15924%0.237CC..Hα-helixtrans-57.9-46.2173.7-68.6161.2000110.7I525 V527 I531 L539 T542 L582I525-I529 HydrophobicContact CG2-CD1 3.92Å; I525-I529 VanDerWaalsContact O-CG1 3.26Å; I525-I529 WeakPolarHBondContact O-CG1 3.34Å; I525-I529 PolarHBondContact O-N 3.22Å; V527-I529 VanDerWaalsContact C-N 3.35Å; V527-I529 PolarHBondContact O-N 3.22Å; I529-I531 PolarHBondContact O-N 3.41Å; I529-L539 HydrophobicContact CD1-CD1 4.04Å; I529-L539 HydrophobicContact CG2-CB 3.64Å; I529-L539 HydrophobicContact CG2-CD1 4.04Å; I529-L539 HydrophobicContact CG2-CG 4.38Å; I529-T542 HydrophobicContact CD1-CG2 3.8Å; I529-T542 HydrophobicContact CG1-CG2 4.43Å; I529-L582 HydrophobicContact CD1-CD2 3.62Å
530A75.8Confident77.4Confident61 Ų6149.3 Ų49.350%0.50425%0.251SS..Hα-helixtrans-67.5-19.8-176.700000114.2R526 V527 G528R526-A530 PolarHBondContact O-N 3.01Å; V527-A530 PolarHBondContact O-N 3.42Å; V527-A530 VanDerWaalsContact O-N 3.17Å; G528-A530 VanDerWaalsContact C-N 3.32Å; G528-A530 PolarHBondContact O-N 3.08Å
531I74.9Confident77.3Confident17 Ų1751.4 Ų51.49%0.08727%0.268CS..Hα-helixtrans-104.1-23.5-174.1-64.2174.8000112.3W463 P489 I498 V527 G528 I529 P533W463-I531 HydrophobicContact CH2-CD1 4.45Å; W463-I531 HydrophobicContact CZ2-CD1 3.41Å; W463-I531 VanDerWaalsContact CZ2-CD1 3.41Å; P489-I531 HydrophobicContact CB-CG1 3.99Å; P489-I531 HydrophobicContact CG-CG1 4.12Å; I498-I531 HydrophobicContact CD1-CG2 4.34Å; V527-I531 HydrophobicContact CG1-CD1 3.68Å; V527-I531 WeakPolarHBondContact O-CG1 3.43Å; V527-I531 PolarHBondContact O-N 3.44Å; G528-I531 PolarHBondContact O-N 3.02Å; I529-I531 PolarHBondContact O-N 3.41Å; I531-P533 WeakPolarHBondContact O-CD 3.08Å; I531-P533 VanDerWaalsContact O-N 3.15Å
532T70.1Confident77.3Confident31 Ų3151.5 Ų51.519%0.1927%0.269CS..  trans-70.9107.6-178.1-51.30000109.8Y495 G528 K534Y495-T532 HydrophobicContact CD2-CG2 4.2Å; Y495-T532 HydrophobicContact CE2-CG2 3.52Å; Y495-T532 WeakPolarHBondContact CE2-OG1 3.45Å; G528-T532 PolarHBondContact O-N 3.38Å; G528-T532 VanDerWaalsContact O-N 3.09Å; G528-T532 PolarHBondContact O-OG1 3.14Å; T532-K534 VanDerWaalsContact C-N 3.26Å; T532-K534 PolarHBondContact O-N 2.92Å
533P57.1Low77.2Confident85 Ų8551.8 Ų51.855%0.55227%0.27SS*.THydrogen-bonded Turntrans-78.5-9.8-174.97.96.3000113.2I531I531-P533 WeakPolarHBondContact O-CD 3.08Å; I531-P533 VanDerWaalsContact O-N 3.15Å
534K51.9Low77.2Confident195 Ų19555.8 Ų55.885%0.84829%0.29SS*.THydrogen-bonded Turntrans-101.2-1.5-163.6-73.6-167.9176.4-177.30116.5T532T532-K534 VanDerWaalsContact C-N 3.26Å; T532-K534 PolarHBondContact O-N 2.92Å
535E51.4Low77.3Confident107 Ų10758.7 Ų58.750%0.530%0.301SS..  trans-119.5100.7170.7-68.5-178-176.100108N537 G538E535-N537 PolarHBondContact O-N 3.38Å; E535-G538 PolarHBondContact O-N 3.28Å; E535-G538 WeakPolarHBondContact OE2-CA 3.42Å
536E51.4Low77.5Confident201 Ų20158.6 Ų58.694%0.93930%0.301SS*.THydrogen-bonded Turntrans-50.2-9.9166.3-94.6-179.2152.900112.7
537N66.1Low77.8Confident100 Ų10057.8 Ų57.854%0.53530%0.299SS..THydrogen-bonded Turntrans-128.821.3176.5-76.2-51.5000115E535 L539 R540 A541E535-N537 PolarHBondContact O-N 3.38Å; N537-L539 VanDerWaalsContact C-N 3.29Å; N537-L539 PolarHBondContact O-N 3.09Å; N537-R540 HydrophobicContact CB-CB 4.31Å; N537-R540 CarbonylContact O-C 3.58Å; N537-R540 PolarHBondContact O-N 2.86Å; N537-A541 WeakPolarHBondContact O-CB 3.37Å; N537-A541 PolarHBondContact O-N 3.02Å
538G78.3Confident78.2Confident10 Ų1061 Ų6110%0.10332%0.316CS..Hα-helixtrans-58.1-36.2-172.900000114.8E535 T542E535-G538 PolarHBondContact O-N 3.28Å; E535-G538 WeakPolarHBondContact OE2-CA 3.42Å; G538-T542 WeakPolarHBondContact O-CB 3.45Å; G538-T542 PolarHBondContact O-N 3.38Å; G538-T542 PolarHBondContact O-OG1 3.02Å
539L83.4Confident78.6Confident23 Ų2362.6 Ų62.612%0.1232%0.323CS..Hα-helixtrans-66.5-47.4173.2-178.757.3000111.8I529 N537 T542 L543 L582 V586 L591I529-L539 HydrophobicContact CD1-CD1 4.04Å; I529-L539 HydrophobicContact CG2-CB 3.64Å; I529-L539 HydrophobicContact CG2-CD1 4.04Å; I529-L539 HydrophobicContact CG2-CG 4.38Å; N537-L539 VanDerWaalsContact C-N 3.29Å; N537-L539 PolarHBondContact O-N 3.09Å; L539-T542 PolarHBondContact O-N 3.2Å; L539-L543 WeakPolarHBondContact O-CB 3.26Å; L539-L543 PolarHBondContact O-N 3.23Å; L539-L582 HydrophobicContact CD1-CD2 3.77Å; L539-V586 HydrophobicContact CD1-CG2 4.01Å; L539-V586 HydrophobicContact CD2-CB 4.27Å; L539-V586 HydrophobicContact CD2-CG2 3.36Å; L539-V586 HydrophobicContact CG-CG2 3.47Å; L539-V586 VanDerWaalsContact CG-CG2 3.47Å; L539-L591 HydrophobicContact CD2-CD1 3.77Å
540R82.7Confident79.3Confident120 Ų12061.2 Ų61.245%0.45332%0.315SS..Hα-helixtrans-62.7-45.2178-175.6178.8-178.31418.7111.2N537 T542 L543 L544 D596N537-R540 HydrophobicContact CB-CB 4.31Å; N537-R540 CarbonylContact O-C 3.58Å; N537-R540 PolarHBondContact O-N 2.86Å; R540-T542 VanDerWaalsContact C-N 3.35Å; R540-T542 PolarHBondContact O-N 3.49Å; R540-L543 PolarHBondContact O-N 3.27Å; R540-L544 HydrophobicContact CG-CD1 4.4Å; R540-L544 WeakPolarHBondContact O-CG 3.36Å; R540-L544 PolarHBondContact O-N 3.42Å; R540-D596 IonicContact CZ-OD2 2.65Å; R540-D596 IonicContact NH1-OD2 3.78Å; R540-D596 PolarHBondContact NH1-OD2 2.99Å; R540-D596 IonicContact NH2-OD1 3.9Å; R540-D596 PolarHBondContact NH2-OD1 3.47Å; R540-D596 IonicContact NH2-OD2 3.03Å; R540-D596 PolarHBondContact NH2-OD2 3Å
541A85.4Confident80.1Confident44 Ų4463.8 Ų63.836%0.36431%0.312SS..Hα-helixtrans-61.7-42.217700000111.6N537 L544 W545N537-A541 WeakPolarHBondContact O-CB 3.37Å; N537-A541 PolarHBondContact O-N 3.02Å; A541-L544 PolarHBondContact O-N 3.46Å; A541-W545 PolarHBondContact O-N 2.8Å
542T90.1Very high80.9Confident2 Ų267.4 Ų67.41%0.01233%0.327CS..Hα-helixtrans-70-35.4177.5-53.50000112.4R506 I525 I529 G538 L539 R540 W545 A546 L582R506-T542 PolarHBondContact NH2-OG1 3.37Å; I525-T542 HydrophobicContact CG2-CG2 3.64Å; I529-T542 HydrophobicContact CD1-CG2 3.8Å; I529-T542 HydrophobicContact CG1-CG2 4.43Å; G538-T542 WeakPolarHBondContact O-CB 3.45Å; G538-T542 PolarHBondContact O-N 3.38Å; G538-T542 PolarHBondContact O-OG1 3.02Å; L539-T542 PolarHBondContact O-N 3.2Å; R540-T542 VanDerWaalsContact C-N 3.35Å; R540-T542 PolarHBondContact O-N 3.49Å; T542-W545 HydrophobicContact CG2-CE3 4.26Å; T542-W545 PolarHBondContact O-N 2.92Å; T542-A546 PolarHBondContact O-N 3.41Å; T542-L582 HydrophobicContact CG2-CD1 4.1Å
543L90.8Very high81.8Confident7 Ų766.1 Ų66.14%0.03732%0.319CS..Hα-helixtrans-63.5-45.7172.1176.361.6000111.5L539 R540 W545 A546 I547 L582 I583 V586L539-L543 WeakPolarHBondContact O-CB 3.26Å; L539-L543 PolarHBondContact O-N 3.23Å; R540-L543 PolarHBondContact O-N 3.27Å; L543-W545 VanDerWaalsContact C-N 3.33Å; L543-W545 PolarHBondContact O-N 3.47Å; L543-A546 PolarHBondContact O-N 2.99Å; L543-I547 HydrophobicContact CD1-CD1 4.03Å; L543-I547 HydrophobicContact CD1-CG1 4.24Å; L543-I547 HydrophobicContact CG-CD1 3.99Å; L543-I547 WeakPolarHBondContact O-CG1 3.35Å; L543-I547 PolarHBondContact O-N 2.91Å; L543-L582 HydrophobicContact CB-CD1 4.41Å; L543-L582 HydrophobicContact CD1-CB 4Å; L543-I583 HydrophobicContact CD1-CD1 4.4Å; L543-I583 HydrophobicContact CD1-CG1 3.76Å; L543-I583 HydrophobicContact CD2-CG1 4.25Å; L543-V586 HydrophobicContact CD2-CG2 4.43Å
544L90.7Very high83.4Confident100 Ų10063.2 Ų63.252%0.52430%0.299SS..Hα-helixtrans-61.2-41.7176.7-71.5173.4000111.8R540 A541 I547 D548R540-L544 HydrophobicContact CG-CD1 4.4Å; R540-L544 WeakPolarHBondContact O-CG 3.36Å; R540-L544 PolarHBondContact O-N 3.42Å; A541-L544 PolarHBondContact O-N 3.46Å; L544-I547 PolarHBondContact O-N 2.91Å; L544-D548 WeakPolarHBondContact O-CB 3.49Å; L544-D548 PolarHBondContact O-N 3.38Å
545W93Very high85.2Confident60 Ų6058.2 Ų58.223%0.22728%0.278CS..Hα-helixtrans-58.8-46.7172.2169.476.4000112R506 L509 I525 A541 T542 L543 I547 D548 E549 L578R506-W545 HydrophobicContact CB-CH2 4.27Å; R506-W545 HydrophobicContact CB-CZ2 4.2Å; R506-W545 HydrophobicContact CG-CH2 4.26Å; R506-W545 HydrophobicContact CG-CZ2 4.44Å; L509-W545 HydrophobicContact CD2-CH2 4.18Å; L509-W545 HydrophobicContact CD2-CZ3 4.32Å; I525-W545 HydrophobicContact CD1-CZ3 4.32Å; A541-W545 PolarHBondContact O-N 2.8Å; T542-W545 HydrophobicContact CG2-CE3 4.26Å; T542-W545 PolarHBondContact O-N 2.92Å; L543-W545 VanDerWaalsContact C-N 3.33Å; L543-W545 PolarHBondContact O-N 3.47Å; W545-I547 VanDerWaalsContact C-N 3.33Å; W545-I547 PolarHBondContact O-N 3.18Å; W545-D548 WeakPolarHBondContact O-CB 3.45Å; W545-D548 PolarHBondContact O-N 2.85Å; W545-E549 HydrophobicContact CD2-CG 4.36Å; W545-E549 HydrophobicContact CZ2-CG 3.92Å; W545-E549 WeakPolarHBondContact O-CG 3.39Å; W545-E549 PolarHBondContact O-N 3.14Å; W545-L578 HydrophobicContact CZ3-CD2 3.75Å
546A94.2Very high86.8Confident1 Ų155.5 Ų55.51%0.00827%0.266CS..Hα-helixtrans-65-36179.400000112.5T542 L543 E549 L550 I575 L578 V579 L582T542-A546 PolarHBondContact O-N 3.41Å; L543-A546 PolarHBondContact O-N 2.99Å; A546-E549 PolarHBondContact O-N 3.46Å; A546-L550 PolarHBondContact O-N 3.49Å; A546-I575 WeakPolarHBondContact O-CG2 2.99Å; A546-L578 HydrophobicContact CB-CD2 4.29Å; A546-V579 HydrophobicContact CB-CG2 3.72Å; A546-L582 HydrophobicContact CB-CD1 4.15Å
547I94.6Very high88.5Confident13 Ų1346.2 Ų46.27%0.06722%0.224CC..Hα-helixtrans-67.3-38.5173.7-68.2172.1000111L543 L544 W545 L550 R551 V603 V604L543-I547 HydrophobicContact CD1-CD1 4.03Å; L543-I547 HydrophobicContact CD1-CG1 4.24Å; L543-I547 HydrophobicContact CG-CD1 3.99Å; L543-I547 WeakPolarHBondContact O-CG1 3.35Å; L543-I547 PolarHBondContact O-N 2.91Å; L544-I547 PolarHBondContact O-N 2.91Å; W545-I547 VanDerWaalsContact C-N 3.33Å; W545-I547 PolarHBondContact O-N 3.18Å; I547-L550 WeakPolarHBondContact O-CB 3.36Å; I547-L550 PolarHBondContact O-N 3.45Å; I547-R551 WeakPolarHBondContact O-CG 3.42Å; I547-R551 PolarHBondContact O-N 2.84Å; I547-V603 HydrophobicContact CG2-CG1 4.12Å; I547-V604 HydrophobicContact CD1-CG2 4.03Å; I547-V604 HydrophobicContact CG1-CG2 3.86Å
548D94.6Very high89.3Confident72 Ų7247 Ų4739%0.38522%0.222SC..Hα-helixtrans-64-43.1174.9-174.162000111.7L544 W545 L550 R551 K552L544-D548 WeakPolarHBondContact O-CB 3.49Å; L544-D548 PolarHBondContact O-N 3.38Å; W545-D548 WeakPolarHBondContact O-CB 3.45Å; W545-D548 PolarHBondContact O-N 2.85Å; D548-L550 VanDerWaalsContact C-N 3.3Å; D548-L550 PolarHBondContact O-N 3.25Å; D548-R551 PolarHBondContact O-N 2.87Å; D548-K552 WeakPolarHBondContact O-CG 3.22Å; D548-K552 PolarHBondContact O-N 2.92Å; D548-K552 WeakPolarHBondContact OD2-CE 3.46Å; D548-K552 IonicContact OD2-NZ 3.81Å; D548-K552 PolarHBondContact OD2-NZ 3.5Å
549E93.6Very high89.4Confident35 Ų3553.4 Ų53.416%0.16425%0.25CC..Hα-helixtrans-62.3-35.5172.5-68-56.9132.300112.7W545 A546 K552 S553 I575W545-E549 HydrophobicContact CD2-CG 4.36Å; W545-E549 HydrophobicContact CZ2-CG 3.92Å; W545-E549 WeakPolarHBondContact O-CG 3.39Å; W545-E549 PolarHBondContact O-N 3.14Å; A546-E549 PolarHBondContact O-N 3.46Å; E549-K552 IonicContact OE1-NZ 3.78Å; E549-K552 PolarHBondContact OE1-NZ 3.38Å; E549-S553 PolarHBondContact O-N 2.81Å; E549-S553 PolarHBondContact O-OG 3.45Å; E549-I575 HydrophobicContact CB-CD1 4.09Å; E549-I575 HydrophobicContact CB-CG1 4.39Å; E549-I575 HydrophobicContact CB-CG2 4.22Å
550L94.6Very high88.7Confident1 Ų153.4 Ų53.41%0.00525%0.252CS..Hα-helixtrans-66.1-42.2173.5-177.263.9000111.5A546 I547 D548 S553 Q554 I575 V576 V604 I611A546-L550 PolarHBondContact O-N 3.49Å; I547-L550 WeakPolarHBondContact O-CB 3.36Å; I547-L550 PolarHBondContact O-N 3.45Å; D548-L550 VanDerWaalsContact C-N 3.3Å; D548-L550 PolarHBondContact O-N 3.25Å; L550-S553 WeakPolarHBondContact O-CB 3.25Å; L550-S553 PolarHBondContact O-N 2.9Å; L550-Q554 PolarHBondContact O-N 2.67Å; L550-I575 HydrophobicContact CB-CG2 3.85Å; L550-I575 HydrophobicContact CD1-CG2 4.37Å; L550-V576 HydrophobicContact CD1-CG2 3.79Å; L550-V604 HydrophobicContact CD2-CB 4.49Å; L550-V604 HydrophobicContact CD2-CG1 3.88Å; L550-V604 HydrophobicContact CD2-CG2 4.42Å; L550-I611 HydrophobicContact CD1-CD1 3.61Å; L550-I611 HydrophobicContact CG-CD1 4.41Å
551R93.7Very high87.9Confident115 Ų11552.5 Ų52.543%0.43427%0.269SS..Hα-helixtrans-65.4-40.6176.5-75.5177.5174.5-179.6-1.6112.1I547 D548 S553 Q554 E555I547-R551 WeakPolarHBondContact O-CG 3.42Å; I547-R551 PolarHBondContact O-N 2.84Å; D548-R551 PolarHBondContact O-N 2.87Å; R551-S553 VanDerWaalsContact C-N 3.27Å; R551-S553 PolarHBondContact O-N 3.16Å; R551-Q554 WeakPolarHBondContact O-CB 3.45Å; R551-Q554 PolarHBondContact O-N 2.84Å; R551-E555 PolarHBondContact O-N 2.87Å
552K91.2Very high87.1Confident94 Ų9454.7 Ų54.741%0.40928%0.275SS..Hα-helixtrans-57.8-43171.3-71168.7-175154.30111.2D548 E549 E555 I556D548-K552 WeakPolarHBondContact O-CG 3.22Å; D548-K552 PolarHBondContact O-N 2.92Å; D548-K552 WeakPolarHBondContact OD2-CE 3.46Å; D548-K552 IonicContact OD2-NZ 3.81Å; D548-K552 PolarHBondContact OD2-NZ 3.5Å; E549-K552 IonicContact OE1-NZ 3.78Å; E549-K552 PolarHBondContact OE1-NZ 3.38Å; K552-E555 PolarHBondContact O-N 3.29Å; K552-I556 VanDerWaalsContact O-CG1 3.3Å; K552-I556 WeakPolarHBondContact O-CG1 3.47Å; K552-I556 PolarHBondContact O-N 2.79Å
553S89.8Confident86.1Confident3 Ų355 Ų552%0.02128%0.277CS..Hα-helixtrans-65.5-40.6176.5-59.90000112.5E549 L550 R551 I556 C557 I575E549-S553 PolarHBondContact O-N 2.81Å; E549-S553 PolarHBondContact O-OG 3.45Å; L550-S553 WeakPolarHBondContact O-CB 3.25Å; L550-S553 PolarHBondContact O-N 2.9Å; R551-S553 VanDerWaalsContact C-N 3.27Å; R551-S553 PolarHBondContact O-N 3.16Å; S553-I556 PolarHBondContact O-N 3.15Å; S553-C557 PolarHBondContact O-N 3.43Å; S553-C557 PolarHBondContact O-SG 3.21Å; S553-C557 VanDerWaalsContact O-SG 3.36Å; S553-I575 WeakPolarHBondContact OG-CD1 3.47Å
554Q91Very high84.9Confident25 Ų2557 Ų5712%0.11729%0.287CS..Hα-helixtrans-61.1-43.3173.9-177.5-167.17.900111.6L550 R551 C557 K558 S607 D610 I611L550-Q554 PolarHBondContact O-N 2.67Å; R551-Q554 WeakPolarHBondContact O-CB 3.45Å; R551-Q554 PolarHBondContact O-N 2.84Å; Q554-C557 WeakPolarHBondContact O-CB 3.46Å; Q554-C557 PolarHBondContact O-N 3.24Å; Q554-K558 VanDerWaalsContact NE2-NZ 3.16Å; Q554-K558 WeakPolarHBondContact O-CG 3.36Å; Q554-K558 PolarHBondContact O-N 2.83Å; Q554-S607 PolarHBondContact OE1-OG 3.27Å; Q554-D610 HydrophobicContact CG-CB 4.12Å; Q554-D610 PolarHBondContact NE2-OD2 2.75Å; Q554-I611 HydrophobicContact CB-CD1 4.1Å; Q554-I611 HydrophobicContact CB-CG1 4.09Å; Q554-I611 HydrophobicContact CG-CG1 4.42Å
555E89.2Confident83.7Confident90 Ų9055.7 Ų55.742%0.42128%0.278SS..Hα-helixtrans-64.9-40.9178.1-170.857.9-153.300111.5R551 K552 C557 K558 Q559R551-E555 PolarHBondContact O-N 2.87Å; K552-E555 PolarHBondContact O-N 3.29Å; E555-C557 VanDerWaalsContact C-N 3.3Å; E555-C557 PolarHBondContact O-N 2.82Å; E555-K558 PolarHBondContact O-N 3.24Å; E555-Q559 HydrophobicContact CG-CG 4.35Å; E555-Q559 WeakPolarHBondContact O-CG 3.42Å; E555-Q559 PolarHBondContact O-N 3.48Å; E555-Q559 WeakPolarHBondContact OE1-CG 3.31Å; E555-Q559 PolarHBondContact OE1-NE2 2.98Å
556I85.3Confident82.4Confident49 Ų4952.9 Ų52.925%0.25127%0.267SS..Hα-helixtrans-59-42.2172.4-68.2164.3000111K552 S553 K558 Q559 S560 F565 I566 T570K552-I556 VanDerWaalsContact O-CG1 3.3Å; K552-I556 WeakPolarHBondContact O-CG1 3.47Å; K552-I556 PolarHBondContact O-N 2.79Å; S553-I556 PolarHBondContact O-N 3.15Å; I556-K558 VanDerWaalsContact C-N 3.28Å; I556-K558 PolarHBondContact O-N 3.22Å; I556-Q559 PolarHBondContact O-N 3.26Å; I556-S560 WeakPolarHBondContact O-CB 3.45Å; I556-S560 PolarHBondContact O-N 2.81Å; I556-F565 HydrophobicContact CG2-CD1 4.48Å; I556-F565 HydrophobicContact CG2-CE1 4.22Å; I556-I566 HydrophobicContact CG2-CG1 4.26Å; I556-T570 HydrophobicContact CD1-CG2 3.84Å
557C85.6Confident81.1Confident6 Ų653.2 Ų53.24%0.04127%0.269CS..Hα-helixtrans-64.5-29.5175.2-70.70000113.4S553 Q554 E555 I566 T614S553-C557 PolarHBondContact O-N 3.43Å; S553-C557 PolarHBondContact O-SG 3.21Å; S553-C557 VanDerWaalsContact O-SG 3.36Å; Q554-C557 WeakPolarHBondContact O-CB 3.46Å; Q554-C557 PolarHBondContact O-N 3.24Å; E555-C557 VanDerWaalsContact C-N 3.3Å; E555-C557 PolarHBondContact O-N 2.82Å; C557-I566 HydrophobicContact CB-CD1 4.41Å; C557-T614 HydrophobicContact CB-CG2 4.05Å
558K84.4Confident79.8Confident117 Ų11756.2 Ų56.251%0.50929%0.291SS..Hα-helixtrans-80-35.9177.5-73.8177.1176.9177.80112.8Q554 E555 I556 D610Q554-K558 VanDerWaalsContact NE2-NZ 3.16Å; Q554-K558 WeakPolarHBondContact O-CG 3.36Å; Q554-K558 PolarHBondContact O-N 2.83Å; E555-K558 PolarHBondContact O-N 3.24Å; I556-K558 VanDerWaalsContact C-N 3.28Å; I556-K558 PolarHBondContact O-N 3.22Å; K558-D610 WeakPolarHBondContact CE-OD2 3.19Å; K558-D610 IonicContact NZ-OD2 2.65Å; K558-D610 PolarHBondContact NZ-OD2 3.3Å
559Q79.2Confident78.3Confident145 Ų14560.7 Ų60.768%0.67830%0.303SS*.Hα-helixtrans-84.5-28.2-176.2-67.8179.1-0.100113.5E555 I556E555-Q559 HydrophobicContact CG-CG 4.35Å; E555-Q559 WeakPolarHBondContact O-CG 3.42Å; E555-Q559 PolarHBondContact O-N 3.48Å; E555-Q559 WeakPolarHBondContact OE1-CG 3.31Å; E555-Q559 PolarHBondContact OE1-NE2 2.98Å; I556-Q559 PolarHBondContact O-N 3.26Å
560S69.9Low77.2Confident23 Ų2359.8 Ų59.816%0.16130%0.299CS..  trans-103.7117.4-176.2-178.70000111.8I556 N562I556-S560 WeakPolarHBondContact O-CB 3.45Å; I556-S560 PolarHBondContact O-N 2.81Å; S560-N562 PolarHBondContact OG-N 3.29Å; S560-N562 PolarHBondContact OG-O 3.48Å
561A65.3Low76.7Confident100 Ų10059.7 Ų59.783%0.82630%0.299SS*.  trans-73.2-18.1165.400000112.4L563A561-L563 PolarHBondContact O-N 3.25Å
562N68.2Low76.5Confident90 Ų9054.2 Ų54.248%0.48128%0.279SS..  trans-84.7106.6-178.7-172.5-25.4000110.6S560 N564 F565 I566S560-N562 PolarHBondContact OG-N 3.29Å; S560-N562 PolarHBondContact OG-O 3.48Å; N562-N564 VanDerWaalsContact C-N 3.34Å; N562-N564 PolarHBondContact O-N 3.32Å; N562-N564 WeakPolarHBondContact OD1-CB 3.36Å; N562-N564 PolarHBondContact OD1-N 3.02Å; N562-F565 HydrophobicContact CB-CB 4.03Å; N562-F565 WeakPolarHBondContact O-CB 3.47Å; N562-F565 PolarHBondContact O-N 3.42Å; N562-F565 PolarHBondContact OD1-N 3.29Å; N562-I566 PolarHBondContact O-N 2.92Å
563L68.8Low76.5Confident10 Ų1049.9 Ų49.95%0.05226%0.26CS..Hα-helixtrans-70.6-27.9-178.9-123.783.6000113.6A561 F565 I566 T567 T614 A618 F648A561-L563 PolarHBondContact O-N 3.25Å; L563-F565 VanDerWaalsContact C-N 3.31Å; L563-I566 HydrophobicContact CD1-CD1 4.1Å; L563-I566 HydrophobicContact CG-CD1 4.47Å; L563-I566 PolarHBondContact O-N 2.97Å; L563-T567 PolarHBondContact O-N 2.9Å; L563-T567 PolarHBondContact O-OG1 2.83Å; L563-T614 HydrophobicContact CD1-CG2 3.86Å; L563-T614 WeakPolarHBondContact CD1-O 3.48Å; L563-A618 HydrophobicContact CD2-CB 3.55Å; L563-F648 HydrophobicContact CB-CE2 3.62Å; L563-F648 HydrophobicContact CB-CZ 3.65Å; L563-F648 HydrophobicContact CD2-CE1 4.47Å; L563-F648 HydrophobicContact CD2-CE2 3.9Å; L563-F648 HydrophobicContact CD2-CZ 3.39Å; L563-F648 HydrophobicContact CG-CE2 4.1Å; L563-F648 HydrophobicContact CG-CZ 4.01Å
564N65.8Low76.6Confident47 Ų4749.8 Ų49.825%0.25126%0.259SS..Hα-helixtrans-66-37.3173.4-69.4-19.8000110.7N562 I566 T567 S568 F648N562-N564 VanDerWaalsContact C-N 3.34Å; N562-N564 PolarHBondContact O-N 3.32Å; N562-N564 WeakPolarHBondContact OD1-CB 3.36Å; N562-N564 PolarHBondContact OD1-N 3.02Å; N564-I566 VanDerWaalsContact C-N 3.35Å; N564-T567 PolarHBondContact O-OG1 2.65Å; N564-S568 WeakPolarHBondContact O-CB 3.11Å; N564-S568 PolarHBondContact O-N 3.16Å; N564-S568 PolarHBondContact O-OG 3.47Å; N564-F648 WeakPolarHBondContact OD1-CD2 3.2Å
565F65.9Low76.8Confident74 Ų7448.7 Ų48.733%0.32525%0.254SS..Hα-helixtrans-62.5-42.2174.4178.7-92.8000111.8I556 N562 L563 S568 R569I556-F565 HydrophobicContact CG2-CD1 4.48Å; I556-F565 HydrophobicContact CG2-CE1 4.22Å; N562-F565 HydrophobicContact CB-CB 4.03Å; N562-F565 WeakPolarHBondContact O-CB 3.47Å; N562-F565 PolarHBondContact O-N 3.42Å; N562-F565 PolarHBondContact OD1-N 3.29Å; L563-F565 VanDerWaalsContact C-N 3.31Å; F565-S568 PolarHBondContact O-OG 2.72Å; F565-R569 VanDerWaalsContact CE2-NE 3.27Å; F565-R569 PolarHBondContact O-N 3.06Å
566I65.9Low77.1Confident0 Ų044.4 Ų44.40%023%0.234CC..Hα-helixtrans-63.2-52.1178.6-62.7168.8000110.4I556 C557 N562 L563 N564 S568 T570 I572 T614I556-I566 HydrophobicContact CG2-CG1 4.26Å; C557-I566 HydrophobicContact CB-CD1 4.41Å; N562-I566 PolarHBondContact O-N 2.92Å; L563-I566 HydrophobicContact CD1-CD1 4.1Å; L563-I566 HydrophobicContact CG-CD1 4.47Å; L563-I566 PolarHBondContact O-N 2.97Å; N564-I566 VanDerWaalsContact C-N 3.35Å; I566-S568 VanDerWaalsContact C-N 3.34Å; I566-S568 PolarHBondContact O-N 3.44Å; I566-T570 PolarHBondContact O-OG1 3.3Å; I566-I572 HydrophobicContact CG2-CD1 3.78Å; I566-T614 HydrophobicContact CD1-CG2 3.92Å
567T67.4Low77.5Confident9 Ų943 Ų436%0.05523%0.226CC..Hα-helixtrans-73.3-20.9-174.651.80000114.5L563 N564 F648 V651L563-T567 PolarHBondContact O-N 2.9Å; L563-T567 PolarHBondContact O-OG1 2.83Å; N564-T567 PolarHBondContact O-OG1 2.65Å; T567-F648 HydrophobicContact CG2-CD2 3.75Å; T567-F648 HydrophobicContact CG2-CE2 3.74Å; T567-F648 VanDerWaalsContact OG1-CD2 3.25Å; T567-F648 WeakPolarHBondContact OG1-CD2 3.29Å; T567-V651 HydrophobicContact CG2-CB 4.45Å; T567-V651 HydrophobicContact CG2-CG1 3.99Å
568S66.1Low78Confident76 Ų7642.7 Ų42.753%0.53122%0.224SC..Hα-helixtrans-88.7-23.3179.958.30000114.3N564 F565 I566N564-S568 WeakPolarHBondContact O-CB 3.11Å; N564-S568 PolarHBondContact O-N 3.16Å; N564-S568 PolarHBondContact O-OG 3.47Å; F565-S568 PolarHBondContact O-OG 2.72Å; I566-S568 VanDerWaalsContact C-N 3.34Å; I566-S568 PolarHBondContact O-N 3.44Å
569R64.2Low78.6Confident165 Ų16537.1 Ų37.162%0.62320%0.2SC*.Hα-helixtrans-102-24.1-173.9-72.6-163.9170.5-162.50115.1F565F565-R569 VanDerWaalsContact CE2-NE 3.27Å; F565-R569 PolarHBondContact O-N 3.06Å
570T68.9Low79.3Confident16 Ų1632.1 Ų32.110%0.09818%0.175CC..  trans-133.9138.3-172.960.10000112.5P510 I556 I566 I572P510-T570 WeakPolarHBondContact O-CA 3.37Å; I556-T570 HydrophobicContact CD1-CG2 3.84Å; I566-T570 PolarHBondContact O-OG1 3.3Å; T570-I572 VanDerWaalsContact C-N 3.3Å; T570-I572 PolarHBondContact O-N 2.9Å; T570-I572 WeakPolarHBondContact OG1-CG1 3.47Å
571S84.7Confident80.4Confident0 Ų032.2 Ų32.20%017%0.174CC..  trans-90.167.6173.7-1640000110.6L509 P510 S512 I518 F573 G574 I575L509-S571 WeakPolarHBondContact O-CB 3.28Å; P510-S571 PolarHBondContact O-N 3.47Å; S512-S571 WeakPolarHBondContact O-CB 3.43Å; S512-S571 PolarHBondContact O-OG 2.93Å; I518-S571 VanDerWaalsContact CD1-OG 3.22Å; I518-S571 WeakPolarHBondContact CD1-OG 3.35Å; S571-F573 PolarHBondContact O-N 3.48Å; S571-G574 PolarHBondContact O-N 3.23Å; S571-I575 PolarHBondContact O-N 2.84Å; S571-I575 VanDerWaalsContact O-N 3.11Å
572I90Very high81.7Confident0 Ų027.5 Ų27.50%013%0.134CC..Hα-helixtrans-55.9-41-177.9-55.8-176.8000110.7I566 T570 G574 I575 V576 I611 I615 I655I566-I572 HydrophobicContact CG2-CD1 3.78Å; T570-I572 VanDerWaalsContact C-N 3.3Å; T570-I572 PolarHBondContact O-N 2.9Å; T570-I572 WeakPolarHBondContact OG1-CG1 3.47Å; I572-G574 VanDerWaalsContact C-N 3.34Å; I572-G574 PolarHBondContact O-N 3.12Å; I572-I575 PolarHBondContact O-N 3.36Å; I572-V576 HydrophobicContact CG2-CG2 4.31Å; I572-V576 VanDerWaalsContact O-CG2 3.29Å; I572-V576 WeakPolarHBondContact O-CG2 3.3Å; I572-V576 PolarHBondContact O-N 3.33Å; I572-I611 HydrophobicContact CD1-CG2 4.49Å; I572-I611 HydrophobicContact CG2-CD1 4.18Å; I572-I611 HydrophobicContact CG2-CG2 3.92Å; I572-I615 HydrophobicContact CD1-CD1 4.32Å; I572-I655 HydrophobicContact CB-CD1 3.87Å; I572-I655 HydrophobicContact CB-CG1 4Å; I572-I655 HydrophobicContact CB-CG2 4.35Å; I572-I655 HydrophobicContact CD1-CD1 4.27Å; I572-I655 HydrophobicContact CG1-CD1 4.36Å; I572-I655 HydrophobicContact CG2-CG1 4.43Å; I572-I655 HydrophobicContact CG2-CG2 3.86Å
573F91.1Very high82.9Confident3 Ų323.2 Ų23.21%0.01311%0.112CC..Hα-helixtrans-66.2-34.9179.169.1-87.5000112.6L513 L515 I518 S571 M577 R654 I655 E658L513-F573 HydrophobicContact CD2-CE1 4.29Å; L515-F573 HydrophobicContact CD1-CE2 4.31Å; I518-F573 HydrophobicContact CD1-CD2 4.16Å; I518-F573 HydrophobicContact CD1-CE1 4.15Å; I518-F573 HydrophobicContact CD1-CE2 3.15Å; I518-F573 HydrophobicContact CD1-CZ 3.14Å; S571-F573 PolarHBondContact O-N 3.48Å; F573-M577 VanDerWaalsContact O-CB 3.23Å; F573-M577 WeakPolarHBondContact O-CB 3.48Å; F573-M577 PolarHBondContact O-N 3.37Å; F573-R654 HydrophobicContact CB-CB 4.18Å; F573-R654 HydrophobicContact CD1-CB 4.23Å; F573-R654 HydrophobicContact CD2-CB 4.24Å; F573-R654 HydrophobicContact CG-CB 3.97Å; F573-I655 HydrophobicContact CB-CB 4.44Å; F573-I655 HydrophobicContact CB-CG1 3.85Å; F573-I655 HydrophobicContact CD1-CG1 4.19Å; F573-E658 HydrophobicContact CB-CG 4.22Å
574G92.2Very high84Confident0 Ų025.5 Ų25.50%012%0.122CC..Hα-helixtrans-66.3-39.6174.800000112.7I518 S571 I572 L578I518-G574 VanDerWaalsContact CG2-CA 3.44Å; S571-G574 PolarHBondContact O-N 3.23Å; I572-G574 VanDerWaalsContact C-N 3.34Å; I572-G574 PolarHBondContact O-N 3.12Å; G574-L578 PolarHBondContact O-N 2.91Å
575I94.8Very high85Confident2 Ų223.9 Ų23.91%0.0111%0.114CC..Hα-helixtrans-64.9-50.1174.9-61.9164.1000110.5P510 A546 E549 L550 S553 S571 I572 M577 L578 V579P510-I575 HydrophobicContact CB-CD1 4.06Å; P510-I575 HydrophobicContact CB-CG1 4.3Å; A546-I575 WeakPolarHBondContact O-CG2 2.99Å; E549-I575 HydrophobicContact CB-CD1 4.09Å; E549-I575 HydrophobicContact CB-CG1 4.39Å; E549-I575 HydrophobicContact CB-CG2 4.22Å; L550-I575 HydrophobicContact CB-CG2 3.85Å; L550-I575 HydrophobicContact CD1-CG2 4.37Å; S553-I575 WeakPolarHBondContact OG-CD1 3.47Å; S571-I575 PolarHBondContact O-N 2.84Å; S571-I575 VanDerWaalsContact O-N 3.11Å; I572-I575 PolarHBondContact O-N 3.36Å; I575-M577 VanDerWaalsContact C-N 3.3Å; I575-M577 PolarHBondContact O-N 2.61Å; I575-L578 PolarHBondContact O-N 3.43Å; I575-L578 VanDerWaalsContact O-N 3.16Å; I575-V579 HydrophobicContact CG2-CG2 4.44Å; I575-V579 WeakPolarHBondContact O-CG2 3.42Å; I575-V579 PolarHBondContact O-N 3.28Å
576V95.3Very high86Confident0 Ų020.7 Ų20.70%010%0.1CC..Hα-helixtrans-59.5-42.1178.3173.80000111.1L550 I572 V579 R580 E658 I659 L662L550-V576 HydrophobicContact CD1-CG2 3.79Å; I572-V576 HydrophobicContact CG2-CG2 4.31Å; I572-V576 VanDerWaalsContact O-CG2 3.29Å; I572-V576 WeakPolarHBondContact O-CG2 3.3Å; I572-V576 PolarHBondContact O-N 3.33Å; V576-V579 PolarHBondContact O-N 2.98Å; V576-R580 WeakPolarHBondContact O-CB 3.21Å; V576-R580 PolarHBondContact O-N 3Å; V576-E658 HydrophobicContact CB-CB 4.26Å; V576-E658 HydrophobicContact CG1-CB 3.88Å; V576-I659 HydrophobicContact CG1-CG1 4.17Å; V576-I659 HydrophobicContact CG2-CG1 4.3Å; V576-L662 HydrophobicContact CG1-CB 4.3Å; V576-L662 HydrophobicContact CG1-CD2 4.06Å
577M94.5Very high87Confident20 Ų2022.7 Ų22.710%0.09911%0.112CC..Hα-helixtrans-59.6-47.7175.1-175.6-16974.900111.4I518 A522 F573 I575 R580 L581 E658I518-M577 HydrophobicContact CG2-CE 3.6Å; I518-M577 HydrophobicContact CG2-SD 4.45Å; A522-M577 HydrophobicContact CB-CE 3.34Å; F573-M577 VanDerWaalsContact O-CB 3.23Å; F573-M577 WeakPolarHBondContact O-CB 3.48Å; F573-M577 PolarHBondContact O-N 3.37Å; I575-M577 VanDerWaalsContact C-N 3.3Å; I575-M577 PolarHBondContact O-N 2.61Å; M577-R580 WeakPolarHBondContact O-CB 2.96Å; M577-R580 PolarHBondContact O-N 2.89Å; M577-L581 HydrophobicContact CG-CD1 4.11Å; M577-L581 VanDerWaalsContact O-CG 3.26Å; M577-L581 WeakPolarHBondContact O-CG 3.28Å; M577-L581 PolarHBondContact O-N 3.32Å; M577-E658 HydrophobicContact CB-CG 4.3Å
578L95.5Very high87.8Confident0 Ų026 Ų260%014%0.136CC..Hα-helixtrans-64.3-45.2178.5-179.863.2000111.6L509 A522 I525 R526 W545 A546 G574 I575 R580 L581 L582L509-L578 HydrophobicContact CD1-CB 4.48Å; L509-L578 HydrophobicContact CD2-CB 3.86Å; L509-L578 HydrophobicContact CD2-CD2 3.38Å; L509-L578 HydrophobicContact CD2-CG 4.24Å; A522-L578 HydrophobicContact CB-CD1 4.21Å; I525-L578 HydrophobicContact CD1-CD2 3.93Å; I525-L578 HydrophobicContact CG2-CD1 4.34Å; I525-L578 HydrophobicContact CG2-CD2 4.38Å; R526-L578 HydrophobicContact CG-CD1 4.42Å; W545-L578 HydrophobicContact CZ3-CD2 3.75Å; A546-L578 HydrophobicContact CB-CD2 4.29Å; G574-L578 PolarHBondContact O-N 2.91Å; I575-L578 PolarHBondContact O-N 3.43Å; I575-L578 VanDerWaalsContact O-N 3.16Å; L578-R580 VanDerWaalsContact C-N 3.29Å; L578-R580 PolarHBondContact O-N 3.11Å; L578-L581 PolarHBondContact O-N 3.48Å; L578-L581 VanDerWaalsContact O-N 3.14Å; L578-L582 HydrophobicContact CD1-CD1 3.99Å; L578-L582 HydrophobicContact CD1-CD2 4.16Å; L578-L582 HydrophobicContact CD1-CG 3.8Å; L578-L582 HydrophobicContact CD2-CD1 4.21Å; L578-L582 HydrophobicContact CG-CD1 3.75Å; L578-L582 HydrophobicContact CG-CG 4.02Å; L578-L582 WeakPolarHBondContact O-CB 3.41Å; L578-L582 VanDerWaalsContact O-CG 3.31Å; L578-L582 WeakPolarHBondContact O-CG 3.3Å; L578-L582 PolarHBondContact O-N 3.4Å
579V95.9Very high88.4Confident0 Ų027.4 Ų27.40%013%0.134CC..Hα-helixtrans-55.6-46176.3171.30000110.5A546 I575 V576 L581 L582 I583 V604A546-V579 HydrophobicContact CB-CG2 3.72Å; I575-V579 HydrophobicContact CG2-CG2 4.44Å; I575-V579 WeakPolarHBondContact O-CG2 3.42Å; I575-V579 PolarHBondContact O-N 3.28Å; V576-V579 PolarHBondContact O-N 2.98Å; V579-L581 PolarHBondContact O-N 3Å; V579-L582 PolarHBondContact O-N 3.37Å; V579-I583 HydrophobicContact CG1-CD1 3.73Å; V579-I583 HydrophobicContact CG1-CG1 4.43Å; V579-I583 VanDerWaalsContact O-CG1 3.3Å; V579-I583 WeakPolarHBondContact O-CG1 3.32Å; V579-I583 PolarHBondContact O-N 3.26Å; V579-V604 HydrophobicContact CG1-CG1 3.94Å; V579-V604 HydrophobicContact CG1-CG2 4.06Å
580R95.6Very high89.1Confident39 Ų3928 Ų2815%0.14714%0.144CC..Hα-helixtrans-56-50.4175.3-174.2171.154.971.2-4.6112V576 M577 L578 Q584 E658 L662 F665V576-R580 WeakPolarHBondContact O-CB 3.21Å; V576-R580 PolarHBondContact O-N 3Å; M577-R580 WeakPolarHBondContact O-CB 2.96Å; M577-R580 PolarHBondContact O-N 2.89Å; L578-R580 VanDerWaalsContact C-N 3.29Å; L578-R580 PolarHBondContact O-N 3.11Å; R580-Q584 WeakPolarHBondContact O-CB 3.45Å; R580-Q584 VanDerWaalsContact O-CG 3.31Å; R580-Q584 WeakPolarHBondContact O-CG 3.42Å; R580-Q584 PolarHBondContact O-N 3Å; R580-E658 IonicContact CZ-OE2 3.72Å; R580-E658 IonicContact NE-OE2 3.37Å; R580-E658 PolarHBondContact NE-OE2 3.45Å; R580-E658 IonicContact NH2-OE2 3.43Å; R580-E658 PolarHBondContact NH2-OE2 2.95Å; R580-L662 HydrophobicContact CB-CB 4.43Å; R580-L662 HydrophobicContact CB-CD1 3.56Å; R580-L662 HydrophobicContact CG-CB 4.44Å; R580-L662 HydrophobicContact CG-CD1 3.85Å; R580-F665 HydrophobicContact CG-CD1 4.46Å
581L93.1Very high89.6Confident26 Ų2632.4 Ų32.414%0.13617%0.166CC..Hα-helixtrans-67.1-37.6-177.3-67.2173.3000112.4A522 M577 L578 V579 Q584 D585A522-L581 HydrophobicContact CB-CD1 4.34Å; M577-L581 HydrophobicContact CG-CD1 4.11Å; M577-L581 VanDerWaalsContact O-CG 3.26Å; M577-L581 WeakPolarHBondContact O-CG 3.28Å; M577-L581 PolarHBondContact O-N 3.32Å; L578-L581 PolarHBondContact O-N 3.48Å; L578-L581 VanDerWaalsContact O-N 3.14Å; V579-L581 PolarHBondContact O-N 3Å; L581-Q584 WeakPolarHBondContact O-CB 3.02Å; L581-Q584 PolarHBondContact O-N 3.13Å; L581-D585 VanDerWaalsContact O-CG 3.31Å; L581-D585 PolarHBondContact O-N 3.05Å
582L92.7Very high89.5Confident0 Ų034.2 Ų34.20%018%0.175CC..Hα-helixtrans-69.4-42.9177.4-68176.7000111.7R526 I529 L539 T542 L543 A546 L578 V579 Q584 D585 V586R526-L582 HydrophobicContact CG-CD2 4.15Å; I529-L582 HydrophobicContact CD1-CD2 3.62Å; L539-L582 HydrophobicContact CD1-CD2 3.77Å; T542-L582 HydrophobicContact CG2-CD1 4.1Å; L543-L582 HydrophobicContact CB-CD1 4.41Å; L543-L582 HydrophobicContact CD1-CB 4Å; A546-L582 HydrophobicContact CB-CD1 4.15Å; L578-L582 HydrophobicContact CD1-CD1 3.99Å; L578-L582 HydrophobicContact CD1-CD2 4.16Å; L578-L582 HydrophobicContact CD1-CG 3.8Å; L578-L582 HydrophobicContact CD2-CD1 4.21Å; L578-L582 HydrophobicContact CG-CD1 3.75Å; L578-L582 HydrophobicContact CG-CG 4.02Å; L578-L582 WeakPolarHBondContact O-CB 3.41Å; L578-L582 VanDerWaalsContact O-CG 3.31Å; L578-L582 WeakPolarHBondContact O-CG 3.3Å; L578-L582 PolarHBondContact O-N 3.4Å; V579-L582 PolarHBondContact O-N 3.37Å; L582-Q584 VanDerWaalsContact C-N 3.29Å; L582-Q584 PolarHBondContact O-N 3.35Å; L582-D585 PolarHBondContact O-N 2.99Å; L582-V586 WeakPolarHBondContact O-CB 3.5Å; L582-V586 VanDerWaalsContact O-CG2 3.22Å; L582-V586 WeakPolarHBondContact O-CG2 3.33Å; L582-V586 PolarHBondContact O-N 3.1Å
583I92.2Very high89.2Confident1 Ų136.9 Ų36.91%0.00519%0.194CC..Hα-helixtrans-64.6-38.6175.5-61.9171.2000110L543 V579 D585 V586 V587 L597 F665 F666L543-I583 HydrophobicContact CD1-CD1 4.4Å; L543-I583 HydrophobicContact CD1-CG1 3.76Å; L543-I583 HydrophobicContact CD2-CG1 4.25Å; V579-I583 HydrophobicContact CG1-CD1 3.73Å; V579-I583 HydrophobicContact CG1-CG1 4.43Å; V579-I583 VanDerWaalsContact O-CG1 3.3Å; V579-I583 WeakPolarHBondContact O-CG1 3.32Å; V579-I583 PolarHBondContact O-N 3.26Å; I583-D585 VanDerWaalsContact C-N 3.33Å; I583-D585 PolarHBondContact O-N 2.93Å; I583-V586 PolarHBondContact O-N 3.23Å; I583-V587 HydrophobicContact CG2-CG2 4.08Å; I583-V587 WeakPolarHBondContact O-CB 3.36Å; I583-V587 VanDerWaalsContact O-CG2 3.23Å; I583-V587 WeakPolarHBondContact O-CG2 3.42Å; I583-V587 PolarHBondContact O-N 3.25Å; I583-L597 HydrophobicContact CG2-CD1 3.99Å; I583-F665 HydrophobicContact CB-CE1 4.12Å; I583-F665 HydrophobicContact CG2-CE1 3.74Å; I583-F665 HydrophobicContact CG2-CZ 4.41Å; I583-F666 HydrophobicContact CD1-CE1 3.52Å; I583-F666 HydrophobicContact CD1-CZ 3.6Å; I583-F666 HydrophobicContact CG2-CE1 4.21Å
584Q91.2Very high88.9Confident57 Ų5740.2 Ų40.227%0.26622%0.215SC..Hα-helixtrans-55.1-47.4171.6-81.6175.9-7.400112.3R580 L581 L582 S588 F665R580-Q584 WeakPolarHBondContact O-CB 3.45Å; R580-Q584 VanDerWaalsContact O-CG 3.31Å; R580-Q584 WeakPolarHBondContact O-CG 3.42Å; R580-Q584 PolarHBondContact O-N 3Å; L581-Q584 WeakPolarHBondContact O-CB 3.02Å; L581-Q584 PolarHBondContact O-N 3.13Å; L582-Q584 VanDerWaalsContact C-N 3.29Å; L582-Q584 PolarHBondContact O-N 3.35Å; Q584-S588 VanDerWaalsContact O-CB 3.29Å; Q584-S588 WeakPolarHBondContact O-CB 3.2Å; Q584-S588 PolarHBondContact O-N 3.29Å; Q584-S588 PolarHBondContact O-OG 3.11Å; Q584-F665 HydrophobicContact CB-CE1 4.46Å; Q584-F665 HydrophobicContact CB-CE2 4.32Å; Q584-F665 HydrophobicContact CB-CZ 4.03Å; Q584-F665 HydrophobicContact CG-CD1 3.94Å; Q584-F665 HydrophobicContact CG-CD2 3.64Å; Q584-F665 HydrophobicContact CG-CE1 3.61Å; Q584-F665 HydrophobicContact CG-CE2 3.29Å; Q584-F665 HydrophobicContact CG-CG 3.96Å; Q584-F665 HydrophobicContact CG-CZ 3.28Å
585D87.9Confident88.6Confident14 Ų1443.6 Ų43.68%0.07524%0.242CC..Hα-helixtrans-65.3-49.1179.8-69.5-24.2000111.5R486 R526 L581 L582 I583 V587 S588 E589R486-D585 IonicContact CZ-OD1 2.65Å; R486-D585 IonicContact NH1-OD1 3.95Å; R486-D585 PolarHBondContact NH1-OD1 2.84Å; R486-D585 IonicContact NH2-OD1 2.73Å; R486-D585 PolarHBondContact NH2-OD1 3.39Å; R526-D585 IonicContact CZ-OD1 2.84Å; R526-D585 IonicContact CZ-OD2 3.34Å; R526-D585 VanDerWaalsContact CZ-OD2 3.24Å; R526-D585 IonicContact NE-OD2 2.79Å; R526-D585 PolarHBondContact NE-OD2 2.86Å; R526-D585 IonicContact NH2-OD1 3.54Å; R526-D585 PolarHBondContact NH2-OD1 3.4Å; R526-D585 IonicContact NH2-OD2 3.39Å; R526-D585 PolarHBondContact NH2-OD2 3.43Å; L581-D585 VanDerWaalsContact O-CG 3.31Å; L581-D585 PolarHBondContact O-N 3.05Å; L582-D585 PolarHBondContact O-N 2.99Å; I583-D585 VanDerWaalsContact C-N 3.33Å; I583-D585 PolarHBondContact O-N 2.93Å; D585-V587 VanDerWaalsContact C-N 3.33Å; D585-V587 PolarHBondContact O-N 3.15Å; D585-S588 WeakPolarHBondContact CA-OG 3.15Å; D585-S588 PolarHBondContact O-N 3.31Å; D585-S588 PolarHBondContact O-OG 2.85Å; D585-E589 WeakPolarHBondContact O-CB 3.47Å; D585-E589 PolarHBondContact O-N 3Å
586V87.2Confident88.2Confident7 Ų746 Ų464%0.04226%0.255CS..Hα-helixtrans-58.6-41.8178.5175.80000112.3L539 L543 L582 I583 Q590 L591 I592L539-V586 HydrophobicContact CD1-CG2 4.01Å; L539-V586 HydrophobicContact CD2-CB 4.27Å; L539-V586 HydrophobicContact CD2-CG2 3.36Å; L539-V586 HydrophobicContact CG-CG2 3.47Å; L539-V586 VanDerWaalsContact CG-CG2 3.47Å; L543-V586 HydrophobicContact CD2-CG2 4.43Å; L582-V586 WeakPolarHBondContact O-CB 3.5Å; L582-V586 VanDerWaalsContact O-CG2 3.22Å; L582-V586 WeakPolarHBondContact O-CG2 3.33Å; L582-V586 PolarHBondContact O-N 3.1Å; I583-V586 PolarHBondContact O-N 3.23Å; V586-Q590 PolarHBondContact O-N 3Å; V586-L591 HydrophobicContact CG1-CB 4.32Å; V586-L591 PolarHBondContact O-N 2.9Å; V586-I592 HydrophobicContact CG1-CB 3.35Å; V586-I592 HydrophobicContact CG1-CD1 4.1Å; V586-I592 HydrophobicContact CG1-CG1 4.28Å; V586-I592 HydrophobicContact CG1-CG2 3.49Å; V586-I592 VanDerWaalsContact CG1-CG2 3.49Å
587V87.3Confident87.9Confident42 Ų4246.8 Ų46.826%0.25526%0.259SS..Hα-helixtrans-68.8-44.6176.9170.90000110.8I583 D585 E589 Q590 L597 V669I583-V587 HydrophobicContact CG2-CG2 4.08Å; I583-V587 WeakPolarHBondContact O-CB 3.36Å; I583-V587 VanDerWaalsContact O-CG2 3.23Å; I583-V587 WeakPolarHBondContact O-CG2 3.42Å; I583-V587 PolarHBondContact O-N 3.25Å; D585-V587 VanDerWaalsContact C-N 3.33Å; D585-V587 PolarHBondContact O-N 3.15Å; V587-E589 VanDerWaalsContact C-N 3.26Å; V587-E589 PolarHBondContact O-N 3.2Å; V587-Q590 PolarHBondContact O-N 3.2Å; V587-L597 HydrophobicContact CG2-CD1 3.9Å; V587-L597 HydrophobicContact CG2-CD2 4.1Å; V587-V669 HydrophobicContact CG1-CB 4.35Å; V587-V669 HydrophobicContact CG1-CG1 4.1Å
588S83.8Confident87.6Confident79 Ų7949 Ų4955%0.55227%0.266SS*.Hα-helixtrans-63.5-31.8-179.570.50000113.2Q584 D585Q584-S588 VanDerWaalsContact O-CB 3.29Å; Q584-S588 WeakPolarHBondContact O-CB 3.2Å; Q584-S588 PolarHBondContact O-N 3.29Å; Q584-S588 PolarHBondContact O-OG 3.11Å; D585-S588 WeakPolarHBondContact CA-OG 3.15Å; D585-S588 PolarHBondContact O-N 3.31Å; D585-S588 PolarHBondContact O-OG 2.85Å
589E79.4Confident87.4Confident105 Ų10554.2 Ų54.249%0.49129%0.29SS..THydrogen-bonded Turntrans-94.41.5-179.4-65.3179.3-167.700113R486 D585 V587 L591R486-E589 IonicContact NH2-OE1 3.1Å; R486-E589 PolarHBondContact NH2-OE1 3.35Å; D585-E589 WeakPolarHBondContact O-CB 3.47Å; D585-E589 PolarHBondContact O-N 3Å; V587-E589 VanDerWaalsContact C-N 3.26Å; V587-E589 PolarHBondContact O-N 3.2Å; E589-L591 HydrophobicContact CB-CD1 3.71Å; E589-L591 HydrophobicContact CB-CG 3.74Å; E589-L591 PolarHBondContact O-N 3.25Å; E589-L591 WeakPolarHBondContact OE2-CD1 3.4Å
590Q77.9Confident87.2Confident178 Ų17854.9 Ų54.983%0.83230%0.295SS*.THydrogen-bonded Turntrans55.234.4-178.5-58.4-176.4-13.800113.9V586 V587V586-Q590 PolarHBondContact O-N 3Å; V587-Q590 PolarHBondContact O-N 3.2Å
591L79Confident87.2Confident107 Ų10753 Ų5356%0.5629%0.288SS*.  trans-90.64.1-173.6-66.3174.1000114.5L539 V586 E589L539-L591 HydrophobicContact CD2-CD1 3.77Å; V586-L591 HydrophobicContact CG1-CB 4.32Å; V586-L591 PolarHBondContact O-N 2.9Å; E589-L591 HydrophobicContact CB-CD1 3.71Å; E589-L591 HydrophobicContact CB-CG 3.74Å; E589-L591 PolarHBondContact O-N 3.25Å; E589-L591 WeakPolarHBondContact OE2-CD1 3.4Å
592I82.7Confident87.2Confident39 Ų3953.9 Ų53.920%0.229%0.292CS..SBendtrans-125.9139.2-177.5-165.4162.7000111V586 D596 L597V586-I592 HydrophobicContact CG1-CB 3.35Å; V586-I592 HydrophobicContact CG1-CD1 4.1Å; V586-I592 HydrophobicContact CG1-CG1 4.28Å; V586-I592 HydrophobicContact CG1-CG2 3.49Å; V586-I592 VanDerWaalsContact CG1-CG2 3.49Å; I592-D596 HydrophobicContact CD1-CB 3.95Å; I592-D596 HydrophobicContact CG1-CB 3.52Å; I592-L597 HydrophobicContact CD1-CB 4.05Å; I592-L597 HydrophobicContact CD1-CD1 4.42Å; I592-L597 HydrophobicContact CG1-CB 4.15Å; I592-L597 HydrophobicContact CG2-CB 3.98Å; I592-L597 HydrophobicContact CG2-CD1 4.36Å; I592-L597 HydrophobicContact CG2-CD2 4.46Å; I592-L597 HydrophobicContact CG2-CG 4.49Å
593S85Confident87.3Confident56 Ų5655.1 Ų55.139%0.39230%0.299SS..  trans-66.9151.9170.472.90000110.3A595 D596 L597S593-A595 PolarHBondContact O-N 3.19Å; S593-D596 PolarHBondContact O-N 2.81Å; S593-D596 VanDerWaalsContact OG-CB 3.27Å; S593-D596 WeakPolarHBondContact OG-CB 3.46Å; S593-D596 PolarHBondContact OG-N 3.31Å; S593-D596 PolarHBondContact OG-OD2 2.92Å; S593-L597 WeakPolarHBondContact O-CB 3.38Å; S593-L597 PolarHBondContact O-N 2.85Å
594V83.5Confident87.5Confident73 Ų7355 Ų5544%0.44230%0.299SS..Hα-helixtrans-56.8-38.2176.31790000110.9L597 R598 P671V594-L597 PolarHBondContact O-N 3.41Å; V594-R598 WeakPolarHBondContact O-CB 3.38Å; V594-R598 PolarHBondContact O-N 2.88Å; V594-P671 HydrophobicContact CG1-CB 4.18Å; V594-P671 HydrophobicContact CG1-CG 4.03Å
595A85.6Confident87.8Confident70 Ų7052.4 Ų52.458%0.57929%0.286SS*.Hα-helixtrans-66.6-45.4177.900000113.2S593 L597 R598 H599S593-A595 PolarHBondContact O-N 3.19Å; A595-L597 VanDerWaalsContact C-N 3.32Å; A595-L597 PolarHBondContact O-N 3.22Å; A595-R598 WeakPolarHBondContact O-CB 3.16Å; A595-R598 PolarHBondContact O-N 3.47Å; A595-H599 PolarHBondContact O-N 2.83Å
596D86.6Confident88.2Confident52 Ų5257.5 Ų57.528%0.27830%0.304SS..Hα-helixtrans-65.2-37.9176.6-74.2-42.1000111.3R540 I592 S593 H599 S600R540-D596 IonicContact CZ-OD2 2.65Å; R540-D596 IonicContact NH1-OD2 3.78Å; R540-D596 PolarHBondContact NH1-OD2 2.99Å; R540-D596 IonicContact NH2-OD1 3.9Å; R540-D596 PolarHBondContact NH2-OD1 3.47Å; R540-D596 IonicContact NH2-OD2 3.03Å; R540-D596 PolarHBondContact NH2-OD2 3Å; I592-D596 HydrophobicContact CD1-CB 3.95Å; I592-D596 HydrophobicContact CG1-CB 3.52Å; S593-D596 PolarHBondContact O-N 2.81Å; S593-D596 VanDerWaalsContact OG-CB 3.27Å; S593-D596 WeakPolarHBondContact OG-CB 3.46Å; S593-D596 PolarHBondContact OG-N 3.31Å; S593-D596 PolarHBondContact OG-OD2 2.92Å; D596-H599 PolarHBondContact O-N 3.28Å; D596-S600 WeakPolarHBondContact O-CB 3.34Å; D596-S600 PolarHBondContact O-N 3.48Å; D596-S600 PolarHBondContact O-OG 3.35Å
597L88.9Confident88.6Confident17 Ų1757.4 Ų57.49%0.08930%0.304CS..Hα-helixtrans-64.5-44.6175.7-179.661.1000110.7I583 V587 I592 S593 V594 A595 H599 S600 I601I583-L597 HydrophobicContact CG2-CD1 3.99Å; V587-L597 HydrophobicContact CG2-CD1 3.9Å; V587-L597 HydrophobicContact CG2-CD2 4.1Å; I592-L597 HydrophobicContact CD1-CB 4.05Å; I592-L597 HydrophobicContact CD1-CD1 4.42Å; I592-L597 HydrophobicContact CG1-CB 4.15Å; I592-L597 HydrophobicContact CG2-CB 3.98Å; I592-L597 HydrophobicContact CG2-CD1 4.36Å; I592-L597 HydrophobicContact CG2-CD2 4.46Å; I592-L597 HydrophobicContact CG2-CG 4.49Å; S593-L597 WeakPolarHBondContact O-CB 3.38Å; S593-L597 PolarHBondContact O-N 2.85Å; V594-L597 PolarHBondContact O-N 3.41Å; A595-L597 VanDerWaalsContact C-N 3.32Å; A595-L597 PolarHBondContact O-N 3.22Å; L597-H599 PolarHBondContact O-N 2.93Å; L597-S600 PolarHBondContact O-N 3.47Å; L597-I601 HydrophobicContact CD1-CD1 3.93Å; L597-I601 HydrophobicContact CD1-CG1 4.15Å; L597-I601 HydrophobicContact CG-CD1 3.87Å; L597-I601 HydrophobicContact CG-CG1 4.46Å; L597-I601 WeakPolarHBondContact O-CB 3.23Å; L597-I601 WeakPolarHBondContact O-CG1 3.49Å; L597-I601 PolarHBondContact O-N 3.43Å
598R89.7Confident89Confident67 Ų6755.4 Ų55.425%0.25329%0.292SS..Hα-helixtrans-54.9-53.5175.2-166.4-178.491.7-179.60.2111.2V594 A595 S600 I601 E602 E678 F682V594-R598 WeakPolarHBondContact O-CB 3.38Å; V594-R598 PolarHBondContact O-N 2.88Å; A595-R598 WeakPolarHBondContact O-CB 3.16Å; A595-R598 PolarHBondContact O-N 3.47Å; R598-S600 VanDerWaalsContact C-N 3.32Å; R598-S600 PolarHBondContact O-N 2.93Å; R598-I601 PolarHBondContact O-N 3.49Å; R598-E602 WeakPolarHBondContact O-CB 3.43Å; R598-E602 PolarHBondContact O-N 3.42Å; R598-E678 IonicContact CZ-OE1 2.85Å; R598-E678 VanDerWaalsContact NH1-CD 3.29Å; R598-E678 IonicContact NH1-OE1 2.68Å; R598-E678 PolarHBondContact NH1-OE1 3.48Å; R598-E678 IonicContact NH2-OE1 2.86Å; R598-E678 PolarHBondContact NH2-OE1 3.31Å; R598-F682 HydrophobicContact CB-CE1 4.3Å; R598-F682 HydrophobicContact CB-CZ 4.32Å; R598-F682 HydrophobicContact CG-CB 4.46Å; R598-F682 HydrophobicContact CG-CD1 3.47Å; R598-F682 VanDerWaalsContact CG-CD1 3.47Å; R598-F682 HydrophobicContact CG-CD2 3.51Å; R598-F682 HydrophobicContact CG-CE1 3.4Å; R598-F682 HydrophobicContact CG-CE2 3.43Å; R598-F682 VanDerWaalsContact CG-CE2 3.43Å; R598-F682 HydrophobicContact CG-CG 3.52Å; R598-F682 HydrophobicContact CG-CZ 3.36Å; R598-F682 WeakPolarHBondContact O-CZ 3.44Å
599H91.2Very high89.6Confident109 Ų10952.8 Ų52.851%0.50527%0.273SS..Hα-helixtrans-59.5-43.8179.5-177.269.1000111.8A595 D596 L597 E602 V603A595-H599 PolarHBondContact O-N 2.83Å; D596-H599 PolarHBondContact O-N 3.28Å; L597-H599 PolarHBondContact O-N 2.93Å; H599-E602 PolarHBondContact O-N 3.24Å; H599-V603 WeakPolarHBondContact O-CB 3.41Å; H599-V603 VanDerWaalsContact O-CG2 3.31Å; H599-V603 WeakPolarHBondContact O-CG2 3.49Å; H599-V603 PolarHBondContact O-N 3.04Å
600S91.9Very high90.3Very high14 Ų1450.5 Ų50.510%0.09826%0.264CS..Hα-helixtrans-63.8-46179.3-58.60000111.9D596 L597 R598 E602 V604D596-S600 WeakPolarHBondContact O-CB 3.34Å; D596-S600 PolarHBondContact O-N 3.48Å; D596-S600 PolarHBondContact O-OG 3.35Å; L597-S600 PolarHBondContact O-N 3.47Å; R598-S600 VanDerWaalsContact C-N 3.32Å; R598-S600 PolarHBondContact O-N 2.93Å; S600-E602 VanDerWaalsContact C-N 3.34Å; S600-E602 PolarHBondContact O-N 2.99Å; S600-V604 VanDerWaalsContact O-CB 3.28Å; S600-V604 WeakPolarHBondContact O-CB 3.45Å; S600-V604 WeakPolarHBondContact O-CG2 3.03Å; S600-V604 PolarHBondContact O-N 3.3Å
601I93.7Very high91Very high1 Ų142 Ų421%0.00522%0.224CC..Hα-helixtrans-60-46.2176-71.5172.4000110.3L597 R598 T605 F666 V669 L670 F682 M686L597-I601 HydrophobicContact CD1-CD1 3.93Å; L597-I601 HydrophobicContact CD1-CG1 4.15Å; L597-I601 HydrophobicContact CG-CD1 3.87Å; L597-I601 HydrophobicContact CG-CG1 4.46Å; L597-I601 WeakPolarHBondContact O-CB 3.23Å; L597-I601 WeakPolarHBondContact O-CG1 3.49Å; L597-I601 PolarHBondContact O-N 3.43Å; R598-I601 PolarHBondContact O-N 3.49Å; I601-T605 WeakPolarHBondContact O-CB 3.49Å; I601-T605 PolarHBondContact O-N 3.48Å; I601-T605 PolarHBondContact O-OG1 3.17Å; I601-F666 HydrophobicContact CB-CE2 4.48Å; I601-F666 HydrophobicContact CG1-CD1 4.16Å; I601-F666 HydrophobicContact CG1-CD2 4.46Å; I601-F666 HydrophobicContact CG1-CE1 4.17Å; I601-F666 HydrophobicContact CG1-CE2 4.47Å; I601-F666 HydrophobicContact CG1-CG 4.3Å; I601-F666 HydrophobicContact CG1-CZ 4.31Å; I601-F666 HydrophobicContact CG2-CB 4.49Å; I601-F666 HydrophobicContact CG2-CD2 3.9Å; I601-F666 HydrophobicContact CG2-CE2 4.26Å; I601-F666 HydrophobicContact CG2-CG 4.22Å; I601-V669 HydrophobicContact CD1-CG2 4.45Å; I601-L670 HydrophobicContact CD1-CD2 4.23Å; I601-L670 HydrophobicContact CG2-CD2 4.31Å; I601-F682 HydrophobicContact CB-CZ 4.32Å; I601-F682 HydrophobicContact CG2-CE1 4.42Å; I601-F682 HydrophobicContact CG2-CZ 4.1Å; I601-M686 HydrophobicContact CG2-CG 4.38Å
602E94.4Very high91.7Very high44 Ų4436.9 Ų36.921%0.20620%0.197CC..Hα-helixtrans-61.7-50.9-178-167.1176.7177.500112.3R598 H599 S600 R606 F682 M686R598-E602 WeakPolarHBondContact O-CB 3.43Å; R598-E602 PolarHBondContact O-N 3.42Å; H599-E602 PolarHBondContact O-N 3.24Å; S600-E602 VanDerWaalsContact C-N 3.34Å; S600-E602 PolarHBondContact O-N 2.99Å; E602-R606 VanDerWaalsContact CD-NH1 3.28Å; E602-R606 WeakPolarHBondContact O-CG 3.07Å; E602-R606 PolarHBondContact O-N 3.23Å; E602-R606 VanDerWaalsContact O-N 3.13Å; E602-R606 IonicContact OE1-CZ 2.68Å; E602-R606 IonicContact OE1-NH1 2.84Å; E602-R606 PolarHBondContact OE1-NH1 2.86Å; E602-R606 IonicContact OE1-NH2 2.76Å; E602-R606 PolarHBondContact OE1-NH2 2.78Å; E602-F682 HydrophobicContact CB-CE2 3.84Å; E602-F682 HydrophobicContact CB-CZ 4.19Å; E602-F682 HydrophobicContact CG-CE2 4.12Å; E602-M686 HydrophobicContact CB-SD 4.5Å; E602-M686 HydrophobicContact CG-CE 4.28Å; E602-M686 HydrophobicContact CG-SD 4.4Å
603V95Very high92.1Very high25 Ų2539.3 Ų39.315%0.15221%0.214CC..Hα-helixtrans-60.5-49.3179.1166.50000110.8I547 H599 S607I547-V603 HydrophobicContact CG2-CG1 4.12Å; H599-V603 WeakPolarHBondContact O-CB 3.41Å; H599-V603 VanDerWaalsContact O-CG2 3.31Å; H599-V603 WeakPolarHBondContact O-CG2 3.49Å; H599-V603 PolarHBondContact O-N 3.04Å; V603-S607 WeakPolarHBondContact O-CB 3.21Å; V603-S607 PolarHBondContact O-N 3.46Å; V603-S607 PolarHBondContact O-OG 2.77Å
604V96.7Very high92.2Very high0 Ų038.5 Ų38.50%021%0.207CC..Hα-helixtrans-68.9-41.1-175.9173.30000110.8I547 L550 V579 S600 S607 C608 L662 F666I547-V604 HydrophobicContact CD1-CG2 4.03Å; I547-V604 HydrophobicContact CG1-CG2 3.86Å; L550-V604 HydrophobicContact CD2-CB 4.49Å; L550-V604 HydrophobicContact CD2-CG1 3.88Å; L550-V604 HydrophobicContact CD2-CG2 4.42Å; V579-V604 HydrophobicContact CG1-CG1 3.94Å; V579-V604 HydrophobicContact CG1-CG2 4.06Å; S600-V604 VanDerWaalsContact O-CB 3.28Å; S600-V604 WeakPolarHBondContact O-CB 3.45Å; S600-V604 WeakPolarHBondContact O-CG2 3.03Å; S600-V604 PolarHBondContact O-N 3.3Å; V604-S607 PolarHBondContact O-N 3.46Å; V604-C608 WeakPolarHBondContact O-CB 3.37Å; V604-C608 PolarHBondContact O-N 2.84Å; V604-C608 PolarHBondContact O-SG 3.41Å; V604-L662 HydrophobicContact CG1-CD2 3.57Å; V604-F666 HydrophobicContact CB-CE2 4.08Å; V604-F666 HydrophobicContact CB-CZ 4.08Å; V604-F666 HydrophobicContact CG1-CE2 3.88Å; V604-F666 HydrophobicContact CG1-CZ 3.83Å
605T96.6Very high92.4Very high1 Ų135 Ų351%0.00619%0.186CC..Hα-helixtrans-60.9-50179.5-58.20000110.8I601 S607 C608 V609 F663 F666 L689 V690I601-T605 WeakPolarHBondContact O-CB 3.49Å; I601-T605 PolarHBondContact O-N 3.48Å; I601-T605 PolarHBondContact O-OG1 3.17Å; T605-S607 PolarHBondContact O-N 2.85Å; T605-C608 PolarHBondContact O-N 3.42Å; T605-V609 WeakPolarHBondContact O-CG2 3.36Å; T605-V609 PolarHBondContact O-N 2.96Å; T605-F663 HydrophobicContact CG2-CD1 4.47Å; T605-F663 HydrophobicContact CG2-CE1 3.86Å; T605-F663 HydrophobicContact CG2-CZ 4.13Å; T605-F666 WeakPolarHBondContact OG1-CD2 3.39Å; T605-F666 WeakPolarHBondContact OG1-CE2 3.41Å; T605-L689 HydrophobicContact CG2-CD2 3.78Å; T605-L689 HydrophobicContact CG2-CG 4.3Å; T605-V690 HydrophobicContact CG2-CG2 4.23Å
606R95.8Very high92.5Very high121 Ų12131.9 Ų31.946%0.45716%0.159SC..Hα-helixtrans-62.8-41.3178-69.2-169.2-175.6119.18.5112.5E602 C608 V609 D610 L689E602-R606 VanDerWaalsContact CD-NH1 3.28Å; E602-R606 WeakPolarHBondContact O-CG 3.07Å; E602-R606 PolarHBondContact O-N 3.23Å; E602-R606 VanDerWaalsContact O-N 3.13Å; E602-R606 IonicContact OE1-CZ 2.68Å; E602-R606 IonicContact OE1-NH1 2.84Å; E602-R606 PolarHBondContact OE1-NH1 2.86Å; E602-R606 IonicContact OE1-NH2 2.76Å; E602-R606 PolarHBondContact OE1-NH2 2.78Å; R606-C608 VanDerWaalsContact C-N 3.31Å; R606-C608 PolarHBondContact O-N 3Å; R606-V609 PolarHBondContact O-N 3.49Å; R606-D610 PolarHBondContact O-N 2.84Å; R606-L689 HydrophobicContact CG-CD2 4.1Å
607S95.9Very high92.3Very high5 Ų531.4 Ų31.44%0.03516%0.159CC..Hα-helixtrans-60.5-41.8176.3-52.60000111.7Q554 V603 V604 T605 I611Q554-S607 PolarHBondContact OE1-OG 3.27Å; V603-S607 WeakPolarHBondContact O-CB 3.21Å; V603-S607 PolarHBondContact O-N 3.46Å; V603-S607 PolarHBondContact O-OG 2.77Å; V604-S607 PolarHBondContact O-N 3.46Å; T605-S607 PolarHBondContact O-N 2.85Å; S607-I611 WeakPolarHBondContact O-CB 3.24Å; S607-I611 WeakPolarHBondContact O-CD1 3.43Å; S607-I611 VanDerWaalsContact O-CG1 3.24Å; S607-I611 WeakPolarHBondContact O-CG1 3.39Å; S607-I611 PolarHBondContact O-N 3.39Å; S607-I611 VanDerWaalsContact O-N 3.07Å
608C96.5Very high91.8Very high0 Ų030.9 Ų30.90%016%0.157CC..Hα-helixtrans-69.5-37.2177.8-68.10000112.7V604 T605 R606 I611 A612 I659 F663V604-C608 WeakPolarHBondContact O-CB 3.37Å; V604-C608 PolarHBondContact O-N 2.84Å; V604-C608 PolarHBondContact O-SG 3.41Å; T605-C608 PolarHBondContact O-N 3.42Å; R606-C608 VanDerWaalsContact C-N 3.31Å; R606-C608 PolarHBondContact O-N 3Å; C608-I611 PolarHBondContact O-N 2.87Å; C608-A612 VanDerWaalsContact O-CB 3.25Å; C608-A612 WeakPolarHBondContact O-CB 3.3Å; C608-A612 PolarHBondContact O-N 3.12Å; C608-I659 HydrophobicContact CB-CD1 4.27Å; C608-I659 HydrophobicContact CB-CG1 4.09Å; C608-I659 HydrophobicContact CB-CG2 4Å; C608-F663 HydrophobicContact CB-CE1 3.76Å; C608-F663 HydrophobicContact CB-CZ 3.67Å
609V96.2Very high91.4Very high25 Ų2528 Ų2815%0.15215%0.146CC..Hα-helixtrans-63.5-44.6174.9170.30000110.9T605 R606 I611 A612 T613 F663 L689 H693T605-V609 WeakPolarHBondContact O-CG2 3.36Å; T605-V609 PolarHBondContact O-N 2.96Å; R606-V609 PolarHBondContact O-N 3.49Å; V609-I611 PolarHBondContact O-N 3.29Å; V609-A612 PolarHBondContact O-N 2.92Å; V609-T613 WeakPolarHBondContact O-CB 3.41Å; V609-T613 PolarHBondContact O-N 3.27Å; V609-T613 PolarHBondContact O-OG1 3.31Å; V609-F663 HydrophobicContact CG2-CE2 4.21Å; V609-F663 HydrophobicContact CG2-CZ 3.9Å; V609-L689 HydrophobicContact CG1-CD1 4.43Å; V609-L689 HydrophobicContact CG2-CD1 4.18Å; V609-L689 HydrophobicContact CG2-CD2 4.46Å; V609-L689 HydrophobicContact CG2-CG 4.12Å; V609-H693 HydrophobicContact CG2-CB 4.44Å
610D93.5Very high90.7Very high56 Ų5624.9 Ų24.930%0.29913%0.132SC..Hα-helixtrans-58.8-49.4175.6-74.70000110.9Q554 K558 R606 A612 T613 T614Q554-D610 HydrophobicContact CG-CB 4.12Å; Q554-D610 PolarHBondContact NE2-OD2 2.75Å; K558-D610 WeakPolarHBondContact CE-OD2 3.19Å; K558-D610 IonicContact NZ-OD2 2.65Å; K558-D610 PolarHBondContact NZ-OD2 3.3Å; R606-D610 PolarHBondContact O-N 2.84Å; D610-A612 PolarHBondContact O-N 2.7Å; D610-T613 PolarHBondContact O-N 3.49Å; D610-T614 PolarHBondContact O-N 3.22Å; D610-T614 PolarHBondContact O-OG1 3.45Å
611I93.2Very high89.3Confident0 Ų030 Ų300%016%0.158CC..Hα-helixtrans-59.3-46.7177.3-72.6168.1000111.3L550 Q554 I572 S607 C608 V609 T613 T614 I615 I655 I659L550-I611 HydrophobicContact CD1-CD1 3.61Å; L550-I611 HydrophobicContact CG-CD1 4.41Å; Q554-I611 HydrophobicContact CB-CD1 4.1Å; Q554-I611 HydrophobicContact CB-CG1 4.09Å; Q554-I611 HydrophobicContact CG-CG1 4.42Å; I572-I611 HydrophobicContact CD1-CG2 4.49Å; I572-I611 HydrophobicContact CG2-CD1 4.18Å; I572-I611 HydrophobicContact CG2-CG2 3.92Å; S607-I611 WeakPolarHBondContact O-CB 3.24Å; S607-I611 WeakPolarHBondContact O-CD1 3.43Å; S607-I611 VanDerWaalsContact O-CG1 3.24Å; S607-I611 WeakPolarHBondContact O-CG1 3.39Å; S607-I611 PolarHBondContact O-N 3.39Å; S607-I611 VanDerWaalsContact O-N 3.07Å; C608-I611 PolarHBondContact O-N 2.87Å; V609-I611 PolarHBondContact O-N 3.29Å; I611-T613 VanDerWaalsContact C-N 3.32Å; I611-T613 PolarHBondContact O-N 3.3Å; I611-T614 PolarHBondContact O-N 3.44Å; I611-I615 HydrophobicContact CG2-CD1 3.58Å; I611-I615 WeakPolarHBondContact O-CG1 3.45Å; I611-I615 PolarHBondContact O-N 3.39Å; I611-I655 HydrophobicContact CG2-CG2 4.04Å; I611-I659 HydrophobicContact CG2-CD1 4.1Å
612A92.8Very high87.4Confident0 Ų030.9 Ų30.90%017%0.168CC..Hα-helixtrans-63-40.118000000111.6C608 V609 D610 T614 I615 L616 I656 I659 H693C608-A612 VanDerWaalsContact O-CB 3.25Å; C608-A612 WeakPolarHBondContact O-CB 3.3Å; C608-A612 PolarHBondContact O-N 3.12Å; V609-A612 PolarHBondContact O-N 2.92Å; D610-A612 PolarHBondContact O-N 2.7Å; A612-T614 VanDerWaalsContact C-N 3.3Å; A612-T614 PolarHBondContact O-N 3.17Å; A612-I615 PolarHBondContact O-N 3.45Å; A612-I615 VanDerWaalsContact O-N 3.14Å; A612-L616 HydrophobicContact CB-CD1 4.48Å; A612-L616 VanDerWaalsContact O-CB 3.32Å; A612-L616 WeakPolarHBondContact O-CB 3.41Å; A612-L616 WeakPolarHBondContact O-CD1 3.45Å; A612-L616 WeakPolarHBondContact O-CG 3.49Å; A612-L616 PolarHBondContact O-N 3.33Å; A612-I656 HydrophobicContact CB-CD1 3.75Å; A612-I659 HydrophobicContact CB-CD1 4.14Å; A612-H693 VanDerWaalsContact CB-CE1 3.47Å; A612-H693 WeakPolarHBondContact CB-CE1 3.49Å
613T91.2Very high85.7Confident90 Ų9031.4 Ų31.455%0.55217%0.169SC*.Hα-helixtrans-60.6-40.6177.8-56.40000111.3V609 D610 I611 P617V609-T613 WeakPolarHBondContact O-CB 3.41Å; V609-T613 PolarHBondContact O-N 3.27Å; V609-T613 PolarHBondContact O-OG1 3.31Å; D610-T613 PolarHBondContact O-N 3.49Å; I611-T613 VanDerWaalsContact C-N 3.32Å; I611-T613 PolarHBondContact O-N 3.3Å; T613-P617 WeakPolarHBondContact O-CD 3.43Å
614T88.2Confident83.8Confident38 Ų3831.5 Ų31.523%0.23317%0.167CC..Hα-helixtrans-67.1-38.5174.2-58.10000112.6C557 L563 I566 D610 I611 A612 P617C557-T614 HydrophobicContact CB-CG2 4.05Å; L563-T614 HydrophobicContact CD1-CG2 3.86Å; L563-T614 WeakPolarHBondContact CD1-O 3.48Å; I566-T614 HydrophobicContact CD1-CG2 3.92Å; D610-T614 PolarHBondContact O-N 3.22Å; D610-T614 PolarHBondContact O-OG1 3.45Å; I611-T614 PolarHBondContact O-N 3.44Å; A612-T614 VanDerWaalsContact C-N 3.3Å; A612-T614 PolarHBondContact O-N 3.17Å; T614-P617 WeakPolarHBondContact O-CD 3.46Å
615I87.5Confident81.7Confident0 Ų037 Ų370%020%0.2CC..Hα-helixtrans-87.3-33.1-171.2-67.4172.2000113.4I572 I611 A612 P617 A618 I655 I656I572-I615 HydrophobicContact CD1-CD1 4.32Å; I611-I615 HydrophobicContact CG2-CD1 3.58Å; I611-I615 WeakPolarHBondContact O-CG1 3.45Å; I611-I615 PolarHBondContact O-N 3.39Å; A612-I615 PolarHBondContact O-N 3.45Å; A612-I615 VanDerWaalsContact O-N 3.14Å; I615-P617 VanDerWaalsContact C-N 3.32Å; I615-A618 WeakPolarHBondContact O-CB 3.41Å; I615-A618 PolarHBondContact O-N 3.44Å; I615-I655 HydrophobicContact CD1-CB 4.12Å; I615-I655 HydrophobicContact CD1-CD1 3.62Å; I615-I655 HydrophobicContact CD1-CG1 4.43Å; I615-I655 HydrophobicContact CD1-CG2 3.58Å; I615-I656 HydrophobicContact CG2-CD1 4.45Å; I615-I656 HydrophobicContact CG2-CG1 4.37Å
616L87.2Confident79.2Confident5 Ų543.7 Ų43.73%0.02624%0.236CC..G310 helixtrans-52.2-38.3-176-83.4165.6000114.9A612 A618 L619 I656 T696 V697 T701A612-L616 HydrophobicContact CB-CD1 4.48Å; A612-L616 VanDerWaalsContact O-CB 3.32Å; A612-L616 WeakPolarHBondContact O-CB 3.41Å; A612-L616 WeakPolarHBondContact O-CD1 3.45Å; A612-L616 WeakPolarHBondContact O-CG 3.49Å; A612-L616 PolarHBondContact O-N 3.33Å; L616-A618 PolarHBondContact O-N 3.11Å; L616-L619 PolarHBondContact O-N 3.28Å; L616-I656 HydrophobicContact CD2-CD1 4.12Å; L616-I656 HydrophobicContact CD2-CG1 4.31Å; L616-I656 HydrophobicContact CG-CD1 3.99Å; L616-T696 HydrophobicContact CD1-CG2 3.98Å; L616-V697 HydrophobicContact CD1-CG2 4.28Å; L616-V697 HydrophobicContact CD2-CG2 4.06Å; L616-T701 HydrophobicContact CD2-CG2 3.41Å; L616-T701 VanDerWaalsContact CD2-CG2 3.41Å
617P82.5Confident76.9Confident42 Ų4240.4 Ų40.427%0.27323%0.23SC..G310 helixtrans-53.2-32.4173.8-29.336.9000114.4T613 T614 I615 L619 Q620 Y623T613-P617 WeakPolarHBondContact O-CD 3.43Å; T614-P617 WeakPolarHBondContact O-CD 3.46Å; I615-P617 VanDerWaalsContact C-N 3.32Å; P617-L619 PolarHBondContact O-N 2.88Å; P617-Q620 WeakPolarHBondContact O-CB 3.44Å; P617-Q620 WeakPolarHBondContact O-CG 3.25Å; P617-Q620 PolarHBondContact O-N 3.48Å; P617-Y623 HydrophobicContact CB-CD2 3.97Å; P617-Y623 HydrophobicContact CB-CE2 3.85Å; P617-Y623 WeakPolarHBondContact O-CD2 3.44Å
618A78.5Confident74.4Confident5 Ų547 Ų474%0.04127%0.265CS..G310 helixtrans-61.1-25.1176.100000114.9L563 I615 L616 Q620 F648L563-A618 HydrophobicContact CD2-CB 3.55Å; I615-A618 WeakPolarHBondContact O-CB 3.41Å; I615-A618 PolarHBondContact O-N 3.44Å; L616-A618 PolarHBondContact O-N 3.11Å; A618-Q620 VanDerWaalsContact C-N 3.3Å; A618-F648 HydrophobicContact CB-CD1 4.23Å; A618-F648 HydrophobicContact CB-CE1 3.22Å; A618-F648 HydrophobicContact CB-CE2 4.46Å; A618-F648 HydrophobicContact CB-CZ 3.37Å
619L81.5Confident72Confident6 Ų648.6 Ų48.63%0.03127%0.273CS..G310 helixtrans-96.413.3-174.3-61.2171.3000111.9L616 P617 T649 W653 I656 T701 N702 V706L616-L619 PolarHBondContact O-N 3.28Å; P617-L619 PolarHBondContact O-N 2.88Å; L619-T649 HydrophobicContact CD2-CG2 4.23Å; L619-W653 HydrophobicContact CD2-CB 4.12Å; L619-I656 HydrophobicContact CD1-CB 4.37Å; L619-I656 HydrophobicContact CD1-CG1 3.74Å; L619-T701 HydrophobicContact CB-CG2 4.28Å; L619-N702 PolarHBondContact O-N 3.48Å; L619-V706 HydrophobicContact CD1-CG2 3.86Å; L619-V706 HydrophobicContact CD2-CG2 4.31Å; L619-V706 HydrophobicContact CG-CG2 4.46Å
620Q76.5Confident69.5Low45 Ų4551.2 Ų51.221%0.2129%0.292CS..SBendtrans-100.1144.9178.5-56.9-171.9-2.200111P617 A618 S700 R750P617-Q620 WeakPolarHBondContact O-CB 3.44Å; P617-Q620 WeakPolarHBondContact O-CG 3.25Å; P617-Q620 PolarHBondContact O-N 3.48Å; A618-Q620 VanDerWaalsContact C-N 3.3Å; Q620-S700 WeakPolarHBondContact CG-O 3.5Å; Q620-S700 PolarHBondContact NE2-O 2.86Å; Q620-R750 VanDerWaalsContact CD-NH2 3.31Å
621D61.8Low67Low120 Ų12053 Ų5364%0.64231%0.309SS*.THydrogen-bonded Turntrans-66.9140.6168.6-65-37.1000109.4N702D621-N702 WeakPolarHBondContact CB-ND2 3.35Å; D621-N702 VanDerWaalsContact CG-ND2 3.33Å; D621-N702 WeakPolarHBondContact OD2-CB 3.45Å; D621-N702 PolarHBondContact OD2-ND2 3.15Å
622G54.9Low64.6Low21 Ų2154.2 Ų54.222%0.21632%0.319CS..THydrogen-bonded Turntrans90.4-12.4178.100000115.9F624 V625 D626G622-F624 VanDerWaalsContact C-N 3.29Å; G622-F624 PolarHBondContact O-N 3.39Å; G622-V625 WeakPolarHBondContact O-CA 3.48Å; G622-V625 WeakPolarHBondContact O-CB 3.24Å; G622-V625 PolarHBondContact O-N 3.22Å; G622-D626 PolarHBondContact O-N 3.39Å
623Y57.2Low62.1Low55 Ų5561.7 Ų61.722%0.21635%0.348CS..Hα-helixtrans-53-44.9-179.5-176.5-101.3000112.9P617 V625 T627 F648P617-Y623 HydrophobicContact CB-CD2 3.97Å; P617-Y623 HydrophobicContact CB-CE2 3.85Å; P617-Y623 WeakPolarHBondContact O-CD2 3.44Å; Y623-V625 VanDerWaalsContact C-N 3.27Å; Y623-V625 PolarHBondContact O-N 2.98Å; Y623-T627 WeakPolarHBondContact O-CB 3.43Å; Y623-T627 PolarHBondContact O-N 3.41Å; Y623-T627 VanDerWaalsContact O-N 3.13Å; Y623-T627 PolarHBondContact O-OG1 2.91Å; Y623-F648 HydrophobicContact CE1-CE1 4.45Å; Y623-F648 HydrophobicContact CE1-CZ 4.31Å
624F56.3Low59.7Low26 Ų2665.9 Ų65.911%0.11436%0.362CS..Hα-helixtrans-76.6-9176.8-69.5-84.5000114.7G622 L629 R645 F648G622-F624 VanDerWaalsContact C-N 3.29Å; G622-F624 PolarHBondContact O-N 3.39Å; F624-L629 HydrophobicContact CB-CD1 4.45Å; F624-L629 HydrophobicContact CD1-CD1 3.71Å; F624-R645 HydrophobicContact CD1-CG 4.47Å; F624-R645 HydrophobicContact CD2-CG 3.91Å; F624-R645 VanDerWaalsContact CD2-NE 3.28Å; F624-R645 HydrophobicContact CE1-CG 4.25Å; F624-R645 HydrophobicContact CE2-CG 3.65Å; F624-R645 HydrophobicContact CG-CG 4.3Å; F624-R645 HydrophobicContact CZ-CB 4.41Å; F624-R645 HydrophobicContact CZ-CG 3.81Å; F624-F648 HydrophobicContact CE1-CD1 4.45Å; F624-F648 AromaticContact CE2-CD1 3.78Å; F624-F648 HydrophobicContact CE2-CD1 3.78Å; F624-F648 AromaticContact CE2-CE1 3.84Å; F624-F648 HydrophobicContact CE2-CE1 3.84Å; F624-F648 AromaticContact CZ-CD1 3.31Å; F624-F648 HydrophobicContact CZ-CD1 3.31Å; F624-F648 AromaticContact CZ-CE1 3.5Å; F624-F648 HydrophobicContact CZ-CE1 3.5Å; F624-F648 HydrophobicContact CZ-CG 4.05Å; F624-F648 HydrophobicContact CZ-CZ 4.46Å
625V51.1Low57.5Low115 Ų11571.8 Ų71.870%0.69739%0.386SS*.Hα-helixtrans-91-39.6176.5-176.20000110.2G622 Y623G622-V625 WeakPolarHBondContact O-CA 3.48Å; G622-V625 WeakPolarHBondContact O-CB 3.24Å; G622-V625 PolarHBondContact O-N 3.22Å; Y623-V625 VanDerWaalsContact C-N 3.27Å; Y623-V625 PolarHBondContact O-N 2.98Å
626D45Very low55Low142 Ų14277.6 Ų77.676%0.75941%0.412SS*.Hα-helixtrans-87.8-19.5-177.6-63.6-32.6000113.6G622 D628G622-D626 PolarHBondContact O-N 3.39Å; D626-D628 PolarHBondContact O-N 3.36Å
627T47.7Very low52.8Low53 Ų5381.4 Ų81.433%0.32544%0.436SS..SBendtrans-80.3121.1174.3-42.70000108.9Y623 L629Y623-T627 WeakPolarHBondContact O-CB 3.43Å; Y623-T627 PolarHBondContact O-N 3.41Å; Y623-T627 VanDerWaalsContact O-N 3.13Å; Y623-T627 PolarHBondContact O-OG1 2.91Å; T627-L629 HydrophobicContact CG2-CG 4.45Å; T627-L629 PolarHBondContact O-N 3.47Å
628D43.2Very low50.8Low144 Ų14486.6 Ų86.677%0.7746%0.456SS*.  trans-60.282173.4-117.4-25.3000110.5D626 S630D626-D628 PolarHBondContact O-N 3.36Å; D628-S630 PolarHBondContact O-N 3.45Å
629L45.4Very low49Very low32 Ų3291.9 Ų91.917%0.16848%0.484CS..  trans-90.416.5178.2-73.5165000111.9F624 T627 S631 A632 Y633 F641F624-L629 HydrophobicContact CB-CD1 4.45Å; F624-L629 HydrophobicContact CD1-CD1 3.71Å; T627-L629 HydrophobicContact CG2-CG 4.45Å; T627-L629 PolarHBondContact O-N 3.47Å; L629-S631 PolarHBondContact O-N 3.19Å; L629-S631 VanDerWaalsContact O-N 3.13Å; L629-A632 HydrophobicContact CB-CB 4.48Å; L629-A632 HydrophobicContact CD2-CB 4.19Å; L629-A632 PolarHBondContact O-N 2.97Å; L629-Y633 PolarHBondContact O-N 3.2Å; L629-F641 HydrophobicContact CD1-CE2 4.26Å; L629-F641 HydrophobicContact CD1-CZ 4.05Å
630S43.7Very low47.3Very low81 Ų8195.3 Ų95.357%0.56650%0.502SS*.THydrogen-bonded Turntrans-51.1-33.7174.450.80000112.3D628D628-S630 PolarHBondContact O-N 3.45Å
631S42.8Very low45.9Very low93 Ų9395.5 Ų95.565%0.6550%0.503SS*.THydrogen-bonded Turntrans-73-20.6174.858.70000115.4L629L629-S631 PolarHBondContact O-N 3.19Å; L629-S631 VanDerWaalsContact O-N 3.13Å
632A41.9Very low45.4Very low25 Ų2593.7 Ų93.721%0.20749%0.492CS..THydrogen-bonded Turntrans-91.6-21.1179.900000113.1L629 E634 Q635L629-A632 HydrophobicContact CB-CB 4.48Å; L629-A632 HydrophobicContact CD2-CB 4.19Å; L629-A632 PolarHBondContact O-N 2.97Å; A632-E634 PolarHBondContact O-N 3.41Å; A632-Q635 PolarHBondContact O-N 3.09Å
633Y40.6Very low45.2Very low158 Ų15897.1 Ų97.162%0.6251%0.505SS*.THydrogen-bonded Turntrans-66-24.7178.6-116.1-88.6000113.1L629L629-Y633 PolarHBondContact O-N 3.2Å
634E40.8Very low45.5Very low177 Ų17797.2 Ų97.283%0.82751%0.514SS*.THydrogen-bonded Turntrans-79.1-15.9-177.7-67.8-173.4168.400114A632A632-E634 PolarHBondContact O-N 3.41Å
635Q41.3Very low45.9Very low162 Ų162100.8 Ų100.876%0.75753%0.527SS*.THydrogen-bonded Turntrans-112.4-14-173-72.6-174.4-2.200115.6A632A632-Q635 PolarHBondContact O-N 3.09Å
636F35.7Very low46.7Very low122 Ų122101.4 Ų101.454%0.53552%0.522SS..SBendtrans-125.3140.1-173.8-71.6-76000112.1D640F636-D640 HydrophobicContact CB-CB 4.04Å; F636-D640 HydrophobicContact CD1-CB 3.82Å; F636-D640 HydrophobicContact CG-CB 4.37Å
637T40.9Very low47.8Very low86 Ų8698.1 Ų98.153%0.52851%0.507SS..  trans-66.2158.1169.667.90000110.2D639 D640 F641T637-D639 PolarHBondContact O-N 2.65Å; T637-D639 VanDerWaalsContact O-N 3.16Å; T637-D640 PolarHBondContact N-OD2 3.03Å; T637-D640 PolarHBondContact O-N 3.04Å; T637-D640 PolarHBondContact OG1-OD2 2.65Å; T637-F641 PolarHBondContact O-N 3.23Å; T637-F641 VanDerWaalsContact O-N 3.13Å
638Q40Very low49.1Very low150 Ų15095.8 Ų95.870%0.70149%0.493SS*.Hα-helixtrans-57.2-32.7-177.1-154.4173.512.100112.5I642Q638-I642 WeakPolarHBondContact O-CG1 3.34Å; Q638-I642 PolarHBondContact O-N 3.48Å
639D40.7Very low50.8Low117 Ų11790.7 Ų90.763%0.62647%0.467SS*.Hα-helixtrans-73.6-37.8176.1-73.7-32.5000112.9T637 F641 I642 N643T637-D639 PolarHBondContact O-N 2.65Å; T637-D639 VanDerWaalsContact O-N 3.16Å; D639-F641 VanDerWaalsContact C-N 3.34Å; D639-F641 PolarHBondContact O-N 3.27Å; D639-I642 PolarHBondContact O-N 3.08Å; D639-N643 WeakPolarHBondContact O-CB 3.39Å; D639-N643 PolarHBondContact O-N 3.13Å; D639-N643 PolarHBondContact O-ND2 3.04Å; D639-N643 VanDerWaalsContact O-ND2 3.15Å
640D45.7Very low52.4Low78 Ų7892.8 Ų92.842%0.41748%0.478SS..Hα-helixtrans-64.4-39.1175.8-66.7-40.9000111.6F636 T637 N643 S644F636-D640 HydrophobicContact CB-CB 4.04Å; F636-D640 HydrophobicContact CD1-CB 3.82Å; F636-D640 HydrophobicContact CG-CB 4.37Å; T637-D640 PolarHBondContact N-OD2 3.03Å; T637-D640 PolarHBondContact O-N 3.04Å; T637-D640 PolarHBondContact OG1-OD2 2.65Å; D640-N643 PolarHBondContact O-N 3.08Å; D640-S644 VanDerWaalsContact O-CB 3.3Å; D640-S644 WeakPolarHBondContact O-CB 3.39Å; D640-S644 PolarHBondContact O-N 2.73Å
641F46.9Very low54.3Low49 Ų4989.1 Ų89.122%0.21545%0.452CS..Hα-helixtrans-65.1-42.9177.7-173.9-96.1000112.3L629 T637 D639 S644 R645L629-F641 HydrophobicContact CD1-CE2 4.26Å; L629-F641 HydrophobicContact CD1-CZ 4.05Å; T637-F641 PolarHBondContact O-N 3.23Å; T637-F641 VanDerWaalsContact O-N 3.13Å; D639-F641 VanDerWaalsContact C-N 3.34Å; D639-F641 PolarHBondContact O-N 3.27Å; F641-S644 PolarHBondContact O-N 2.79Å; F641-R645 PolarHBondContact O-N 3.16Å
642I51.3Low56.4Low81 Ų8184.7 Ų84.742%0.41542%0.421SS..Hα-helixtrans-64.6-45.1177.6-67167.5000110.5Q638 D639 S644 R645 Q646Q638-I642 WeakPolarHBondContact O-CG1 3.34Å; Q638-I642 PolarHBondContact O-N 3.48Å; D639-I642 PolarHBondContact O-N 3.08Å; I642-S644 VanDerWaalsContact C-N 3.35Å; I642-S644 PolarHBondContact O-N 3.36Å; I642-R645 PolarHBondContact O-N 3.19Å; I642-Q646 WeakPolarHBondContact O-CG 3.38Å; I642-Q646 PolarHBondContact O-N 2.96Å; I642-Q646 VanDerWaalsContact O-N 3.14Å
643N52Low58.6Low94 Ų9486.7 Ų86.750%0.50342%0.423SS..Hα-helixtrans-63.8-39177.3-74.2-33.7000112.1D639 D640 T647D639-N643 WeakPolarHBondContact O-CB 3.39Å; D639-N643 PolarHBondContact O-N 3.13Å; D639-N643 PolarHBondContact O-ND2 3.04Å; D639-N643 VanDerWaalsContact O-ND2 3.15Å; D640-N643 PolarHBondContact O-N 3.08Å; N643-T647 WeakPolarHBondContact O-CB 3.28Å; N643-T647 PolarHBondContact O-N 3.29Å; N643-T647 PolarHBondContact O-OG1 2.92Å
644S62.9Low60.9Low56 Ų5681.8 Ų81.839%0.39240%0.403SS..Hα-helixtrans-63.1-45.2174.4-177.40000111.8D640 F641 I642 Q646 T647 F648D640-S644 VanDerWaalsContact O-CB 3.3Å; D640-S644 WeakPolarHBondContact O-CB 3.39Å; D640-S644 PolarHBondContact O-N 2.73Å; F641-S644 PolarHBondContact O-N 2.79Å; I642-S644 VanDerWaalsContact C-N 3.35Å; I642-S644 PolarHBondContact O-N 3.36Å; S644-Q646 PolarHBondContact O-N 2.69Å; S644-T647 PolarHBondContact O-N 2.87Å; S644-F648 WeakPolarHBondContact O-CB 3.45Å; S644-F648 PolarHBondContact O-N 3.22Å
645R65.4Low63.3Low101 Ų10173.3 Ų73.338%0.38136%0.364SS..Hα-helixtrans-60.8-43.2179-175.4174.6-178.4-174.61.9112.4F624 F641 I642 T649F624-R645 HydrophobicContact CD1-CG 4.47Å; F624-R645 HydrophobicContact CD2-CG 3.91Å; F624-R645 VanDerWaalsContact CD2-NE 3.28Å; F624-R645 HydrophobicContact CE1-CG 4.25Å; F624-R645 HydrophobicContact CE2-CG 3.65Å; F624-R645 HydrophobicContact CG-CG 4.3Å; F624-R645 HydrophobicContact CZ-CB 4.41Å; F624-R645 HydrophobicContact CZ-CG 3.81Å; F641-R645 PolarHBondContact O-N 3.16Å; I642-R645 PolarHBondContact O-N 3.19Å; R645-T649 WeakPolarHBondContact O-CB 3.2Å; R645-T649 PolarHBondContact O-N 2.86Å; R645-T649 PolarHBondContact O-OG1 2.79Å
646Q67.2Low65.8Low128 Ų12865.7 Ų65.760%0.59833%0.328SS*.Hα-helixtrans-65.6-46.7177.8-70.2-178.1500111.6I642 S644 F648 T649 L650I642-Q646 WeakPolarHBondContact O-CG 3.38Å; I642-Q646 PolarHBondContact O-N 2.96Å; I642-Q646 VanDerWaalsContact O-N 3.14Å; S644-Q646 PolarHBondContact O-N 2.69Å; Q646-F648 VanDerWaalsContact C-N 3.32Å; Q646-F648 PolarHBondContact O-N 2.78Å; Q646-T649 PolarHBondContact O-N 3.27Å; Q646-L650 WeakPolarHBondContact O-CB 3.33Å; Q646-L650 PolarHBondContact O-N 3.1Å
647T67.9Low68.5Low74 Ų7463.5 Ų63.545%0.45432%0.318SS..Hα-helixtrans-59-45.7177-57.20000111.1N643 S644 L650 V651N643-T647 WeakPolarHBondContact O-CB 3.28Å; N643-T647 PolarHBondContact O-N 3.29Å; N643-T647 PolarHBondContact O-OG1 2.92Å; S644-T647 PolarHBondContact O-N 2.87Å; T647-L650 PolarHBondContact O-N 2.96Å; T647-V651 HydrophobicContact CG2-CG2 4.48Å; T647-V651 WeakPolarHBondContact O-CG2 3.5Å; T647-V651 PolarHBondContact O-N 3.35Å
648F74.8Confident71.1Confident4 Ų460.5 Ų60.52%0.01830%0.299CS..Hα-helixtrans-59.4-50177.4173.9-97.9000112.9L563 N564 T567 A618 Y623 F624 S644 Q646 L650 V651 S652L563-F648 HydrophobicContact CB-CE2 3.62Å; L563-F648 HydrophobicContact CB-CZ 3.65Å; L563-F648 HydrophobicContact CD2-CE1 4.47Å; L563-F648 HydrophobicContact CD2-CE2 3.9Å; L563-F648 HydrophobicContact CD2-CZ 3.39Å; L563-F648 HydrophobicContact CG-CE2 4.1Å; L563-F648 HydrophobicContact CG-CZ 4.01Å; N564-F648 WeakPolarHBondContact OD1-CD2 3.2Å; T567-F648 HydrophobicContact CG2-CD2 3.75Å; T567-F648 HydrophobicContact CG2-CE2 3.74Å; T567-F648 VanDerWaalsContact OG1-CD2 3.25Å; T567-F648 WeakPolarHBondContact OG1-CD2 3.29Å; A618-F648 HydrophobicContact CB-CD1 4.23Å; A618-F648 HydrophobicContact CB-CE1 3.22Å; A618-F648 HydrophobicContact CB-CE2 4.46Å; A618-F648 HydrophobicContact CB-CZ 3.37Å; Y623-F648 HydrophobicContact CE1-CE1 4.45Å; Y623-F648 HydrophobicContact CE1-CZ 4.31Å; F624-F648 HydrophobicContact CE1-CD1 4.45Å; F624-F648 AromaticContact CE2-CD1 3.78Å; F624-F648 HydrophobicContact CE2-CD1 3.78Å; F624-F648 AromaticContact CE2-CE1 3.84Å; F624-F648 HydrophobicContact CE2-CE1 3.84Å; F624-F648 AromaticContact CZ-CD1 3.31Å; F624-F648 HydrophobicContact CZ-CD1 3.31Å; F624-F648 AromaticContact CZ-CE1 3.5Å; F624-F648 HydrophobicContact CZ-CE1 3.5Å; F624-F648 HydrophobicContact CZ-CG 4.05Å; F624-F648 HydrophobicContact CZ-CZ 4.46Å; S644-F648 WeakPolarHBondContact O-CB 3.45Å; S644-F648 PolarHBondContact O-N 3.22Å; Q646-F648 VanDerWaalsContact C-N 3.32Å; Q646-F648 PolarHBondContact O-N 2.78Å; F648-L650 PolarHBondContact O-N 3.26Å; F648-V651 PolarHBondContact O-N 3.47Å; F648-S652 WeakPolarHBondContact O-CB 3.42Å; F648-S652 PolarHBondContact O-N 2.7Å; F648-S652 PolarHBondContact O-OG 3.19Å; F648-S652 VanDerWaalsContact O-OG 3.1Å
649T79Confident73.8Confident36 Ų3653.4 Ų53.422%0.22127%0.265CS..Hα-helixtrans-59.2-41.2178.2-55.50000110.8L619 R645 Q646 W653L619-T649 HydrophobicContact CD2-CG2 4.23Å; R645-T649 WeakPolarHBondContact O-CB 3.2Å; R645-T649 PolarHBondContact O-N 2.86Å; R645-T649 PolarHBondContact O-OG1 2.79Å; Q646-T649 PolarHBondContact O-N 3.27Å; T649-W653 WeakPolarHBondContact O-CB 3.45Å; T649-W653 PolarHBondContact O-N 3.4Å
650L79.9Confident76.5Confident77 Ų7747.8 Ų47.840%0.40324%0.236SC..Hα-helixtrans-67.9-42.1-179.9-176.9131.7000112.6Q646 T647 F648 R654Q646-L650 WeakPolarHBondContact O-CB 3.33Å; Q646-L650 PolarHBondContact O-N 3.1Å; T647-L650 PolarHBondContact O-N 2.96Å; F648-L650 PolarHBondContact O-N 3.26Å; L650-R654 VanDerWaalsContact O-CG 3.32Å; L650-R654 WeakPolarHBondContact O-CG 3.42Å; L650-R654 PolarHBondContact O-N 3.15Å; L650-R654 VanDerWaalsContact O-N 3.08Å
651V83.5Confident78.9Confident4 Ų444.7 Ų44.72%0.02422%0.22CC..Hα-helixtrans-66.2-47.3176.2172.50000110.7L513 T567 T647 F648 W653 R654 I655L513-V651 HydrophobicContact CD2-CG1 4.49Å; L513-V651 HydrophobicContact CD2-CG2 4.27Å; T567-V651 HydrophobicContact CG2-CB 4.45Å; T567-V651 HydrophobicContact CG2-CG1 3.99Å; T647-V651 HydrophobicContact CG2-CG2 4.48Å; T647-V651 WeakPolarHBondContact O-CG2 3.5Å; T647-V651 PolarHBondContact O-N 3.35Å; F648-V651 PolarHBondContact O-N 3.47Å; V651-W653 VanDerWaalsContact C-N 3.32Å; V651-W653 PolarHBondContact O-N 2.66Å; V651-R654 WeakPolarHBondContact O-CB 3.5Å; V651-R654 PolarHBondContact O-N 2.68Å; V651-R654 VanDerWaalsContact O-N 3.09Å; V651-I655 HydrophobicContact CG1-CD1 3.89Å; V651-I655 HydrophobicContact CG1-CG1 4.48Å; V651-I655 WeakPolarHBondContact O-CG1 3.46Å; V651-I655 PolarHBondContact O-N 2.84Å
652S86.5Confident81.3Confident0 Ų042.3 Ų42.30%021%0.21CC..Hα-helixtrans-57.5-43.9177-65.50000112F648 R654 I655 I656F648-S652 WeakPolarHBondContact O-CB 3.42Å; F648-S652 PolarHBondContact O-N 2.7Å; F648-S652 PolarHBondContact O-OG 3.19Å; F648-S652 VanDerWaalsContact O-OG 3.1Å; S652-R654 PolarHBondContact O-N 3.05Å; S652-I655 PolarHBondContact O-N 3.33Å; S652-I656 WeakPolarHBondContact O-CG1 3.43Å; S652-I656 PolarHBondContact O-N 3.22Å; S652-I656 VanDerWaalsContact O-N 3.16Å
653W87.5Confident83.6Confident67 Ų6738.5 Ų38.525%0.25419%0.19SC..Hα-helixtrans-61.8-42.2175.2169.255.8000112.4L619 T649 V651 I655 I656 K657 G705 V706 T709L619-W653 HydrophobicContact CD2-CB 4.12Å; T649-W653 WeakPolarHBondContact O-CB 3.45Å; T649-W653 PolarHBondContact O-N 3.4Å; V651-W653 VanDerWaalsContact C-N 3.32Å; V651-W653 PolarHBondContact O-N 2.66Å; W653-I655 VanDerWaalsContact C-N 3.35Å; W653-I655 PolarHBondContact O-N 2.94Å; W653-I656 PolarHBondContact O-N 2.97Å; W653-K657 WeakPolarHBondContact O-CB 3.14Å; W653-K657 PolarHBondContact O-N 3.38Å; W653-G705 PolarHBondContact NE1-O 3.3Å; W653-V706 HydrophobicContact CG-CG2 4.34Å; W653-T709 HydrophobicContact CZ2-CG2 4.25Å
654R88.3Confident85.7Confident54 Ų5434 Ų3420%0.20417%0.167CC..Hα-helixtrans-63.2-39177.6-75.2175.7176.9-1651.6112.6L513 F573 L650 V651 S652 K657 E658L513-R654 PolarHBondContact O-NH1 2.78Å; F573-R654 HydrophobicContact CB-CB 4.18Å; F573-R654 HydrophobicContact CD1-CB 4.23Å; F573-R654 HydrophobicContact CD2-CB 4.24Å; F573-R654 HydrophobicContact CG-CB 3.97Å; L650-R654 VanDerWaalsContact O-CG 3.32Å; L650-R654 WeakPolarHBondContact O-CG 3.42Å; L650-R654 PolarHBondContact O-N 3.15Å; L650-R654 VanDerWaalsContact O-N 3.08Å; V651-R654 WeakPolarHBondContact O-CB 3.5Å; V651-R654 PolarHBondContact O-N 2.68Å; V651-R654 VanDerWaalsContact O-N 3.09Å; S652-R654 PolarHBondContact O-N 3.05Å; R654-K657 PolarHBondContact O-N 3.14Å; R654-E658 PolarHBondContact O-N 3.29Å
655I91.8Very high87.3Confident0 Ų032.8 Ų32.80%015%0.154CC..Hα-helixtrans-62.8-51177.1-63.7165.5000110I572 F573 I611 I615 V651 S652 W653 K657 E658 I659I572-I655 HydrophobicContact CB-CD1 3.87Å; I572-I655 HydrophobicContact CB-CG1 4Å; I572-I655 HydrophobicContact CB-CG2 4.35Å; I572-I655 HydrophobicContact CD1-CD1 4.27Å; I572-I655 HydrophobicContact CG1-CD1 4.36Å; I572-I655 HydrophobicContact CG2-CG1 4.43Å; I572-I655 HydrophobicContact CG2-CG2 3.86Å; F573-I655 HydrophobicContact CB-CB 4.44Å; F573-I655 HydrophobicContact CB-CG1 3.85Å; F573-I655 HydrophobicContact CD1-CG1 4.19Å; I611-I655 HydrophobicContact CG2-CG2 4.04Å; I615-I655 HydrophobicContact CD1-CB 4.12Å; I615-I655 HydrophobicContact CD1-CD1 3.62Å; I615-I655 HydrophobicContact CD1-CG1 4.43Å; I615-I655 HydrophobicContact CD1-CG2 3.58Å; V651-I655 HydrophobicContact CG1-CD1 3.89Å; V651-I655 HydrophobicContact CG1-CG1 4.48Å; V651-I655 WeakPolarHBondContact O-CG1 3.46Å; V651-I655 PolarHBondContact O-N 2.84Å; S652-I655 PolarHBondContact O-N 3.33Å; W653-I655 VanDerWaalsContact C-N 3.35Å; W653-I655 PolarHBondContact O-N 2.94Å; I655-K657 VanDerWaalsContact C-N 3.29Å; I655-K657 PolarHBondContact O-N 3.25Å; I655-E658 PolarHBondContact O-N 3.42Å; I655-I659 HydrophobicContact CG2-CD1 3.79Å; I655-I659 HydrophobicContact CG2-CG1 4.49Å; I655-I659 VanDerWaalsContact O-CG1 3.32Å; I655-I659 WeakPolarHBondContact O-CG1 3.29Å; I655-I659 PolarHBondContact O-N 3.5Å
656I93.2Very high88.7Confident1 Ų128.1 Ų28.11%0.00514%0.137CC..Hα-helixtrans-61.3-38.5177.2-62-57.3000111.5A612 I615 L616 L619 S652 W653 I659 N660 V697 V706A612-I656 HydrophobicContact CB-CD1 3.75Å; I615-I656 HydrophobicContact CG2-CD1 4.45Å; I615-I656 HydrophobicContact CG2-CG1 4.37Å; L616-I656 HydrophobicContact CD2-CD1 4.12Å; L616-I656 HydrophobicContact CD2-CG1 4.31Å; L616-I656 HydrophobicContact CG-CD1 3.99Å; L619-I656 HydrophobicContact CD1-CB 4.37Å; L619-I656 HydrophobicContact CD1-CG1 3.74Å; S652-I656 WeakPolarHBondContact O-CG1 3.43Å; S652-I656 PolarHBondContact O-N 3.22Å; S652-I656 VanDerWaalsContact O-N 3.16Å; W653-I656 PolarHBondContact O-N 2.97Å; I656-I659 PolarHBondContact O-N 3.33Å; I656-N660 WeakPolarHBondContact O-CB 3.32Å; I656-N660 PolarHBondContact O-N 3.49Å; I656-N660 PolarHBondContact O-ND2 3.13Å; I656-N660 PolarHBondContact O-OD1 2.96Å; I656-V697 HydrophobicContact CG2-CG2 4.39Å; I656-V706 HydrophobicContact CG2-CG1 4.2Å
657K93.9Very high90Very high76 Ų7622 Ų2233%0.3311%0.108SC..Hα-helixtrans-60.4-50.1176.6-177.9-168.1169.8-163.10112W653 R654 I655 N660 A661 F713W653-K657 WeakPolarHBondContact O-CB 3.14Å; W653-K657 PolarHBondContact O-N 3.38Å; R654-K657 PolarHBondContact O-N 3.14Å; I655-K657 VanDerWaalsContact C-N 3.29Å; I655-K657 PolarHBondContact O-N 3.25Å; K657-N660 PolarHBondContact O-N 3.4Å; K657-A661 PolarHBondContact O-N 3.47Å; K657-F713 HydrophobicContact CG-CE2 4.24Å
658E94.4Very high91.1Very high24 Ų2421.2 Ų21.211%0.11210%0.103CC..Hα-helixtrans-69.7-33.5-179.4-70-55.213400112.3F573 V576 M577 R580 R654 I655 A661 L662F573-E658 HydrophobicContact CB-CG 4.22Å; V576-E658 HydrophobicContact CB-CB 4.26Å; V576-E658 HydrophobicContact CG1-CB 3.88Å; M577-E658 HydrophobicContact CB-CG 4.3Å; R580-E658 IonicContact CZ-OE2 3.72Å; R580-E658 IonicContact NE-OE2 3.37Å; R580-E658 PolarHBondContact NE-OE2 3.45Å; R580-E658 IonicContact NH2-OE2 3.43Å; R580-E658 PolarHBondContact NH2-OE2 2.95Å; R654-E658 PolarHBondContact O-N 3.29Å; I655-E658 PolarHBondContact O-N 3.42Å; E658-A661 PolarHBondContact O-N 3.02Å; E658-L662 WeakPolarHBondContact O-CB 3.47Å; E658-L662 PolarHBondContact O-N 3.26Å
659I97Very high91.8Very high0 Ų022.5 Ų22.50%011%0.112CC..Hα-helixtrans-61.1-47.4171.1-71.1171.1000110.5V576 C608 I611 A612 I655 I656 A661 L662 F663V576-I659 HydrophobicContact CG1-CG1 4.17Å; V576-I659 HydrophobicContact CG2-CG1 4.3Å; C608-I659 HydrophobicContact CB-CD1 4.27Å; C608-I659 HydrophobicContact CB-CG1 4.09Å; C608-I659 HydrophobicContact CB-CG2 4Å; I611-I659 HydrophobicContact CG2-CD1 4.1Å; A612-I659 HydrophobicContact CB-CD1 4.14Å; I655-I659 HydrophobicContact CG2-CD1 3.79Å; I655-I659 HydrophobicContact CG2-CG1 4.49Å; I655-I659 VanDerWaalsContact O-CG1 3.32Å; I655-I659 WeakPolarHBondContact O-CG1 3.29Å; I655-I659 PolarHBondContact O-N 3.5Å; I656-I659 PolarHBondContact O-N 3.33Å; I659-A661 VanDerWaalsContact C-N 3.32Å; I659-A661 PolarHBondContact O-N 3.14Å; I659-L662 WeakPolarHBondContact O-CB 3.45Å; I659-L662 PolarHBondContact O-N 2.87Å; I659-F663 HydrophobicContact CG2-CD2 3.98Å; I659-F663 HydrophobicContact CG2-CE1 4.11Å; I659-F663 HydrophobicContact CG2-CE2 3.54Å; I659-F663 HydrophobicContact CG2-CG 4.45Å; I659-F663 HydrophobicContact CG2-CZ 3.62Å; I659-F663 WeakPolarHBondContact O-CG 3.26Å; I659-F663 PolarHBondContact O-N 3.38Å
660N97.2Very high92.3Very high0 Ų021.1 Ų21.10%010%0.103CC..Hα-helixtrans-63.5-38.5178.7-68-14000111.9I656 K657 L662 F663 S664 H693 F694 F713I656-N660 WeakPolarHBondContact O-CB 3.32Å; I656-N660 PolarHBondContact O-N 3.49Å; I656-N660 PolarHBondContact O-ND2 3.13Å; I656-N660 PolarHBondContact O-OD1 2.96Å; K657-N660 PolarHBondContact O-N 3.4Å; N660-L662 VanDerWaalsContact C-N 3.35Å; N660-F663 PolarHBondContact O-N 3.45Å; N660-S664 PolarHBondContact O-N 2.96Å; N660-H693 PolarHBondContact OD1-NE2 3.16Å; N660-F694 HydrophobicContact CB-CE1 4.07Å; N660-F694 HydrophobicContact CB-CZ 3.78Å; N660-F713 HydrophobicContact CB-CB 4.35Å; N660-F713 HydrophobicContact CB-CD2 3.55Å; N660-F713 HydrophobicContact CB-CE2 4.19Å; N660-F713 HydrophobicContact CB-CG 4.2Å
661A97Very high92.1Very high12 Ų1218.5 Ų18.510%0.0999%0.09CC..Hα-helixtrans-63.2-41.2174.300000112K657 E658 I659 F665 F713K657-A661 PolarHBondContact O-N 3.47Å; E658-A661 PolarHBondContact O-N 3.02Å; I659-A661 VanDerWaalsContact C-N 3.32Å; I659-A661 PolarHBondContact O-N 3.14Å; A661-F665 PolarHBondContact O-N 3.4Å; A661-F713 HydrophobicContact CB-CD1 4.27Å; A661-F713 HydrophobicContact CB-CE1 3.61Å; A661-F713 HydrophobicContact CB-CE2 4.14Å; A661-F713 HydrophobicContact CB-CZ 3.53Å
662L97.4Very high91.9Very high0 Ų020.5 Ų20.50%010%0.101CC..Hα-helixtrans-64.7-45.4176.6178.470.2000111.4V576 R580 V604 E658 I659 N660 S664 F665 F666V576-L662 HydrophobicContact CG1-CB 4.3Å; V576-L662 HydrophobicContact CG1-CD2 4.06Å; R580-L662 HydrophobicContact CB-CB 4.43Å; R580-L662 HydrophobicContact CB-CD1 3.56Å; R580-L662 HydrophobicContact CG-CB 4.44Å; R580-L662 HydrophobicContact CG-CD1 3.85Å; V604-L662 HydrophobicContact CG1-CD2 3.57Å; E658-L662 WeakPolarHBondContact O-CB 3.47Å; E658-L662 PolarHBondContact O-N 3.26Å; I659-L662 WeakPolarHBondContact O-CB 3.45Å; I659-L662 PolarHBondContact O-N 2.87Å; N660-L662 VanDerWaalsContact C-N 3.35Å; L662-S664 PolarHBondContact O-N 3.11Å; L662-F665 PolarHBondContact O-N 3.12Å; L662-F666 HydrophobicContact CD1-CD1 4.02Å; L662-F666 HydrophobicContact CD1-CE1 3.44Å; L662-F666 VanDerWaalsContact CD1-CE1 3.44Å; L662-F666 HydrophobicContact CD1-CE2 4.14Å; L662-F666 HydrophobicContact CD1-CZ 3.53Å; L662-F666 HydrophobicContact CD2-CE2 4.08Å; L662-F666 HydrophobicContact CD2-CZ 4.09Å; L662-F666 HydrophobicContact CG-CD1 4.42Å; L662-F666 HydrophobicContact CG-CD2 4.26Å; L662-F666 HydrophobicContact CG-CE1 4.08Å; L662-F666 HydrophobicContact CG-CE2 3.92Å; L662-F666 HydrophobicContact CG-CZ 3.84Å; L662-F666 WeakPolarHBondContact O-CG 3.49Å; L662-F666 PolarHBondContact O-N 3.39Å
663F97.9Very high91.4Very high0 Ų024 Ų240%012%0.119CC..Hα-helixtrans-64.1-39.7178.3-70.7-6.4000112.6T605 C608 V609 I659 N660 F665 F666 V667 V690 H693 F694T605-F663 HydrophobicContact CG2-CD1 4.47Å; T605-F663 HydrophobicContact CG2-CE1 3.86Å; T605-F663 HydrophobicContact CG2-CZ 4.13Å; C608-F663 HydrophobicContact CB-CE1 3.76Å; C608-F663 HydrophobicContact CB-CZ 3.67Å; V609-F663 HydrophobicContact CG2-CE2 4.21Å; V609-F663 HydrophobicContact CG2-CZ 3.9Å; I659-F663 HydrophobicContact CG2-CD2 3.98Å; I659-F663 HydrophobicContact CG2-CE1 4.11Å; I659-F663 HydrophobicContact CG2-CE2 3.54Å; I659-F663 HydrophobicContact CG2-CG 4.45Å; I659-F663 HydrophobicContact CG2-CZ 3.62Å; I659-F663 WeakPolarHBondContact O-CG 3.26Å; I659-F663 PolarHBondContact O-N 3.38Å; N660-F663 PolarHBondContact O-N 3.45Å; F663-F665 VanDerWaalsContact C-N 3.32Å; F663-F665 PolarHBondContact O-N 3.42Å; F663-F666 HydrophobicContact CD1-CD2 4.46Å; F663-F666 PolarHBondContact O-N 3.02Å; F663-V667 WeakPolarHBondContact O-CG2 3.43Å; F663-V667 PolarHBondContact O-N 3.26Å; F663-V690 HydrophobicContact CB-CG1 3.81Å; F663-V690 HydrophobicContact CB-CG2 4.06Å; F663-V690 HydrophobicContact CD1-CG2 4.27Å; F663-V690 HydrophobicContact CD2-CG1 4.14Å; F663-V690 HydrophobicContact CD2-CG2 4.08Å; F663-V690 HydrophobicContact CG-CG1 4.23Å; F663-V690 HydrophobicContact CG-CG2 3.89Å; F663-H693 AromaticContact CD2-CD2 3.61Å; F663-H693 HydrophobicContact CE2-CB 4.09Å; F663-H693 AromaticContact CE2-CD2 3.51Å; F663-H693 AromaticContact CE2-CG 3.65Å; F663-H693 AromaticContact CE2-NE2 3.9Å; F663-F694 HydrophobicContact CB-CE2 4.17Å; F663-F694 HydrophobicContact CD2-CE2 4.4Å
664S96.7Very high90.6Very high1 Ų130 Ų301%0.00715%0.15CC..Hα-helixtrans-55.4-51.6172.5-162.80000110.9N660 L662 F666 V667 T668 F713 E716N660-S664 PolarHBondContact O-N 2.96Å; L662-S664 PolarHBondContact O-N 3.11Å; S664-F666 PolarHBondContact O-N 3.5Å; S664-V667 PolarHBondContact O-N 3.29Å; S664-T668 PolarHBondContact O-N 2.86Å; S664-T668 VanDerWaalsContact O-N 3.13Å; S664-T668 PolarHBondContact O-OG1 3Å; S664-T668 VanDerWaalsContact O-OG1 3.1Å; S664-F713 PolarHBondContact OG-O 3.4Å; S664-E716 VanDerWaalsContact OG-CD 3.3Å; S664-E716 PolarHBondContact OG-OE2 2.74Å
665F96Very high90Very high29 Ų2935.3 Ų35.313%0.12718%0.182CC..Hα-helixtrans-60.7-45.3178.7171.6-109000112.5R580 I583 Q584 A661 L662 F663 V667 T668 V669R580-F665 HydrophobicContact CG-CD1 4.46Å; I583-F665 HydrophobicContact CB-CE1 4.12Å; I583-F665 HydrophobicContact CG2-CE1 3.74Å; I583-F665 HydrophobicContact CG2-CZ 4.41Å; Q584-F665 HydrophobicContact CB-CE1 4.46Å; Q584-F665 HydrophobicContact CB-CE2 4.32Å; Q584-F665 HydrophobicContact CB-CZ 4.03Å; Q584-F665 HydrophobicContact CG-CD1 3.94Å; Q584-F665 HydrophobicContact CG-CD2 3.64Å; Q584-F665 HydrophobicContact CG-CE1 3.61Å; Q584-F665 HydrophobicContact CG-CE2 3.29Å; Q584-F665 HydrophobicContact CG-CG 3.96Å; Q584-F665 HydrophobicContact CG-CZ 3.28Å; A661-F665 PolarHBondContact O-N 3.4Å; L662-F665 PolarHBondContact O-N 3.12Å; F663-F665 VanDerWaalsContact C-N 3.32Å; F663-F665 PolarHBondContact O-N 3.42Å; F665-V667 PolarHBondContact O-N 3.33Å; F665-T668 WeakPolarHBondContact O-CB 3.4Å; F665-T668 PolarHBondContact O-N 3.44Å; F665-T668 VanDerWaalsContact O-N 3.11Å; F665-V669 HydrophobicContact CD2-CG1 3.97Å; F665-V669 HydrophobicContact CE1-CG1 4.4Å; F665-V669 HydrophobicContact CE1-CG2 4.06Å; F665-V669 HydrophobicContact CE2-CB 4.43Å; F665-V669 HydrophobicContact CE2-CG1 3.26Å; F665-V669 HydrophobicContact CE2-CG2 4.36Å; F665-V669 HydrophobicContact CZ-CB 4.32Å; F665-V669 HydrophobicContact CZ-CG1 3.52Å; F665-V669 HydrophobicContact CZ-CG2 3.93Å; F665-V669 WeakPolarHBondContact O-CG2 3.18Å; F665-V669 PolarHBondContact O-N 2.98Å
666F95.2Very high89.5Confident3 Ų336.9 Ų36.91%0.01319%0.193CC..Hα-helixtrans-57-48.1177.2-77.9-2.4000111.8I583 I601 V604 T605 L662 F663 S664 T668 V669 L670I583-F666 HydrophobicContact CD1-CE1 3.52Å; I583-F666 HydrophobicContact CD1-CZ 3.6Å; I583-F666 HydrophobicContact CG2-CE1 4.21Å; I601-F666 HydrophobicContact CB-CE2 4.48Å; I601-F666 HydrophobicContact CG1-CD1 4.16Å; I601-F666 HydrophobicContact CG1-CD2 4.46Å; I601-F666 HydrophobicContact CG1-CE1 4.17Å; I601-F666 HydrophobicContact CG1-CE2 4.47Å; I601-F666 HydrophobicContact CG1-CG 4.3Å; I601-F666 HydrophobicContact CG1-CZ 4.31Å; I601-F666 HydrophobicContact CG2-CB 4.49Å; I601-F666 HydrophobicContact CG2-CD2 3.9Å; I601-F666 HydrophobicContact CG2-CE2 4.26Å; I601-F666 HydrophobicContact CG2-CG 4.22Å; V604-F666 HydrophobicContact CB-CE2 4.08Å; V604-F666 HydrophobicContact CB-CZ 4.08Å; V604-F666 HydrophobicContact CG1-CE2 3.88Å; V604-F666 HydrophobicContact CG1-CZ 3.83Å; T605-F666 WeakPolarHBondContact OG1-CD2 3.39Å; T605-F666 WeakPolarHBondContact OG1-CE2 3.41Å; L662-F666 HydrophobicContact CD1-CD1 4.02Å; L662-F666 HydrophobicContact CD1-CE1 3.44Å; L662-F666 VanDerWaalsContact CD1-CE1 3.44Å; L662-F666 HydrophobicContact CD1-CE2 4.14Å; L662-F666 HydrophobicContact CD1-CZ 3.53Å; L662-F666 HydrophobicContact CD2-CE2 4.08Å; L662-F666 HydrophobicContact CD2-CZ 4.09Å; L662-F666 HydrophobicContact CG-CD1 4.42Å; L662-F666 HydrophobicContact CG-CD2 4.26Å; L662-F666 HydrophobicContact CG-CE1 4.08Å; L662-F666 HydrophobicContact CG-CE2 3.92Å; L662-F666 HydrophobicContact CG-CZ 3.84Å; L662-F666 WeakPolarHBondContact O-CG 3.49Å; L662-F666 PolarHBondContact O-N 3.39Å; F663-F666 HydrophobicContact CD1-CD2 4.46Å; F663-F666 PolarHBondContact O-N 3.02Å; S664-F666 PolarHBondContact O-N 3.5Å; F666-T668 PolarHBondContact O-N 3.28Å; F666-V669 PolarHBondContact O-N 2.95Å; F666-V669 VanDerWaalsContact O-N 3.13Å; F666-L670 WeakPolarHBondContact O-CG 3.23Å; F666-L670 PolarHBondContact O-N 2.78Å
667V94.2Very high89.1Confident1 Ų144.3 Ų44.31%0.00623%0.226CC..Hα-helixtrans-60.3-38.1178178.10000111.2F663 S664 F665 V669 V687 V690 I717 T720 R723F663-V667 WeakPolarHBondContact O-CG2 3.43Å; F663-V667 PolarHBondContact O-N 3.26Å; S664-V667 PolarHBondContact O-N 3.29Å; F665-V667 PolarHBondContact O-N 3.33Å; V667-V669 PolarHBondContact O-N 2.76Å; V667-V687 HydrophobicContact CG1-CG2 4.04Å; V667-V687 HydrophobicContact CG2-CG2 4.15Å; V667-V690 HydrophobicContact CG2-CG1 4.23Å; V667-I717 HydrophobicContact CB-CG1 4.26Å; V667-I717 HydrophobicContact CB-CG2 4.49Å; V667-I717 HydrophobicContact CG1-CG2 4.16Å; V667-I717 HydrophobicContact CG2-CD1 4.47Å; V667-I717 HydrophobicContact CG2-CG1 4.26Å; V667-I717 HydrophobicContact CG2-CG2 4.27Å; V667-T720 HydrophobicContact CG1-CG2 3.85Å; V667-R723 PolarHBondContact O-NH2 3.5Å
668T91.5Very high88.6Confident56 Ų5646.5 Ų46.534%0.34424%0.237SC..Hα-helixtrans-62.3-39.2175.6-54.90000113.4S664 F665 F666 R723S664-T668 PolarHBondContact O-N 2.86Å; S664-T668 VanDerWaalsContact O-N 3.13Å; S664-T668 PolarHBondContact O-OG1 3Å; S664-T668 VanDerWaalsContact O-OG1 3.1Å; F665-T668 WeakPolarHBondContact O-CB 3.4Å; F665-T668 PolarHBondContact O-N 3.44Å; F665-T668 VanDerWaalsContact O-N 3.11Å; F666-T668 PolarHBondContact O-N 3.28Å; T668-R723 PolarHBondContact O-NH1 2.97Å
669V90.1Very high88.1Confident32 Ų3246.4 Ų46.419%0.19424%0.237CC..Hα-helixtrans-97.4-3.9-175.3-57.20000115.1V587 I601 F665 F666 V667V587-V669 HydrophobicContact CG1-CB 4.35Å; V587-V669 HydrophobicContact CG1-CG1 4.1Å; I601-V669 HydrophobicContact CD1-CG2 4.45Å; F665-V669 HydrophobicContact CD2-CG1 3.97Å; F665-V669 HydrophobicContact CE1-CG1 4.4Å; F665-V669 HydrophobicContact CE1-CG2 4.06Å; F665-V669 HydrophobicContact CE2-CB 4.43Å; F665-V669 HydrophobicContact CE2-CG1 3.26Å; F665-V669 HydrophobicContact CE2-CG2 4.36Å; F665-V669 HydrophobicContact CZ-CB 4.32Å; F665-V669 HydrophobicContact CZ-CG1 3.52Å; F665-V669 HydrophobicContact CZ-CG2 3.93Å; F665-V669 WeakPolarHBondContact O-CG2 3.18Å; F665-V669 PolarHBondContact O-N 2.98Å; F666-V669 PolarHBondContact O-N 2.95Å; F666-V669 VanDerWaalsContact O-N 3.13Å; V667-V669 PolarHBondContact O-N 2.76Å
670L88.9Confident87.7Confident6 Ų647.8 Ų47.83%0.03124%0.244CC..  trans-52.4128.4175.3-84.6172.3000110.6I601 F666 L672 F682 A683 M686 V687I601-L670 HydrophobicContact CD1-CD2 4.23Å; I601-L670 HydrophobicContact CG2-CD2 4.31Å; F666-L670 WeakPolarHBondContact O-CG 3.23Å; F666-L670 PolarHBondContact O-N 2.78Å; L670-L672 PolarHBondContact O-N 3.47Å; L670-F682 HydrophobicContact CD2-CD1 4.06Å; L670-F682 HydrophobicContact CD2-CE1 3.54Å; L670-A683 HydrophobicContact CB-CB 4.25Å; L670-A683 HydrophobicContact CD1-CB 4.16Å; L670-A683 HydrophobicContact CD2-CB 4.36Å; L670-A683 HydrophobicContact CG-CB 4.49Å; L670-M686 HydrophobicContact CD1-CB 4.2Å; L670-M686 HydrophobicContact CD2-CB 4.4Å; L670-V687 HydrophobicContact CD1-CG2 3.68Å
671P75.7Confident87.4Confident22 Ų2251.9 Ų51.914%0.14327%0.266CS..  trans-66.3124.3177.327.7-33000109.3V594V594-P671 HydrophobicContact CG1-CB 4.18Å; V594-P671 HydrophobicContact CG1-CG 4.03Å
672L79.7Confident87.1Confident47 Ų4752 Ų5225%0.24627%0.265CS..  trans-117.1111.7169.5-68.7173000106.8L670 A683 F684 R723 L727L670-L672 PolarHBondContact O-N 3.47Å; L672-A683 HydrophobicContact CD2-CB 3.97Å; L672-F684 HydrophobicContact CD2-CE1 4.23Å; L672-R723 HydrophobicContact CD1-CB 3.8Å; L672-L727 HydrophobicContact CD1-CD1 3.77Å; L672-L727 HydrophobicContact CD2-CD1 4.3Å
673N75.2Confident86.8Confident73 Ų7352 Ų5239%0.3927%0.265SS..  trans-119.6127.9-176.7-78-26.4000109D675 S676 D679 N680N673-D675 PolarHBondContact O-N 2.95Å; N673-S676 PolarHBondContact O-N 3.5Å; N673-D679 PolarHBondContact ND2-OD2 3.48Å; N673-N680 PolarHBondContact N-OD1 3.06Å; N673-N680 PolarHBondContact O-ND2 3.4Å; N673-N680 PolarHBondContact O-OD1 3.08Å
674H70.8Confident86.7Confident192 Ų19253 Ų5389%0.88927%0.269SS*.SBendtrans-60.8-27.7179-76-71.5000113
675D77.1Confident86.6Confident167 Ų16755.3 Ų55.389%0.89329%0.286SS*.SBendtrans-99.6-15.5-173.9-56.3-43.2000114.4N673N673-D675 PolarHBondContact O-N 2.95Å
676S80.5Confident86.5Confident32 Ų3254.2 Ų54.222%0.22428%0.281CS..  trans-104.6101-175179.40000111.3N673 E678 D679 N680N673-S676 PolarHBondContact O-N 3.5Å; S676-E678 VanDerWaalsContact C-N 3.28Å; S676-E678 PolarHBondContact O-N 3.36Å; S676-D679 WeakPolarHBondContact CB-OD2 3.46Å; S676-D679 WeakPolarHBondContact OG-CB 3.44Å; S676-D679 PolarHBondContact OG-N 3.02Å; S676-D679 PolarHBondContact OG-OD2 3.02Å; S676-N680 PolarHBondContact O-N 3.38Å; S676-N680 PolarHBondContact O-ND2 3.28Å; S676-N680 VanDerWaalsContact O-ND2 3.11Å
677K84.8Confident86.6Confident158 Ų15854.1 Ų54.169%0.68728%0.28SS*.Hα-helixtrans-61-39.4174.2-173178.7177.6-175.70111.7N680 D681K677-N680 PolarHBondContact O-N 3.21Å; K677-D681 WeakPolarHBondContact O-CB 3.43Å; K677-D681 VanDerWaalsContact O-CG 3.32Å; K677-D681 PolarHBondContact O-N 3.41Å
678E84.1Confident86.7Confident122 Ų12259.9 Ų59.957%0.5730%0.302SS*.Hα-helixtrans-64.3-42.8-178.4-165-175.3165.600112.3R598 S676 F682R598-E678 IonicContact CZ-OE1 2.85Å; R598-E678 VanDerWaalsContact NH1-CD 3.29Å; R598-E678 IonicContact NH1-OE1 2.68Å; R598-E678 PolarHBondContact NH1-OE1 3.48Å; R598-E678 IonicContact NH2-OE1 2.86Å; R598-E678 PolarHBondContact NH2-OE1 3.31Å; S676-E678 VanDerWaalsContact C-N 3.28Å; S676-E678 PolarHBondContact O-N 3.36Å; E678-F682 WeakPolarHBondContact O-CB 3.38Å; E678-F682 PolarHBondContact O-N 3.36Å
679D83.9Confident87Confident22 Ų2259.3 Ų59.312%0.11830%0.297CS..Hα-helixtrans-65.8-40.6177.5-67.6-33.1000111.5N673 S676 A683N673-D679 PolarHBondContact ND2-OD2 3.48Å; S676-D679 WeakPolarHBondContact CB-OD2 3.46Å; S676-D679 WeakPolarHBondContact OG-CB 3.44Å; S676-D679 PolarHBondContact OG-N 3.02Å; S676-D679 PolarHBondContact OG-OD2 3.02Å; D679-A683 WeakPolarHBondContact O-CB 3.36Å; D679-A683 PolarHBondContact O-N 3.12Å
680N88.2Confident87.3Confident28 Ų2857.9 Ų57.915%0.1529%0.288CS..Hα-helixtrans-66.8-46.9178.3-70.4-31.2000111.6N673 S676 K677 F682 A683 F684N673-N680 PolarHBondContact N-OD1 3.06Å; N673-N680 PolarHBondContact O-ND2 3.4Å; N673-N680 PolarHBondContact O-OD1 3.08Å; S676-N680 PolarHBondContact O-N 3.38Å; S676-N680 PolarHBondContact O-ND2 3.28Å; S676-N680 VanDerWaalsContact O-ND2 3.11Å; K677-N680 PolarHBondContact O-N 3.21Å; N680-F682 VanDerWaalsContact C-N 3.3Å; N680-F682 PolarHBondContact O-N 3.26Å; N680-A683 PolarHBondContact O-N 2.62Å; N680-F684 HydrophobicContact CB-CE2 3.8Å; N680-F684 HydrophobicContact CB-CZ 3.85Å; N680-F684 WeakPolarHBondContact O-CB 3.24Å; N680-F684 WeakPolarHBondContact O-CD1 3.49Å; N680-F684 WeakPolarHBondContact O-CD2 3.17Å; N680-F684 WeakPolarHBondContact O-CG 3.49Å; N680-F684 PolarHBondContact O-N 3.2Å
681D90.3Very high87.7Confident86 Ų8657.6 Ų57.646%0.4629%0.287SS..Hα-helixtrans-61.1-41.1177.9-73.6-17.9000111K677 S685K677-D681 WeakPolarHBondContact O-CB 3.43Å; K677-D681 VanDerWaalsContact O-CG 3.32Å; K677-D681 PolarHBondContact O-N 3.41Å; D681-S685 WeakPolarHBondContact O-CB 3.21Å; D681-S685 PolarHBondContact O-N 3.37Å
682F91.7Very high88.6Confident15 Ų1560.1 Ų60.17%0.06630%0.299CS..Hα-helixtrans-59.3-53171.3172.1-98.2000111.9R598 I601 E602 L670 E678 N680 F684 S685 M686R598-F682 HydrophobicContact CB-CE1 4.3Å; R598-F682 HydrophobicContact CB-CZ 4.32Å; R598-F682 HydrophobicContact CG-CB 4.46Å; R598-F682 HydrophobicContact CG-CD1 3.47Å; R598-F682 VanDerWaalsContact CG-CD1 3.47Å; R598-F682 HydrophobicContact CG-CD2 3.51Å; R598-F682 HydrophobicContact CG-CE1 3.4Å; R598-F682 HydrophobicContact CG-CE2 3.43Å; R598-F682 VanDerWaalsContact CG-CE2 3.43Å; R598-F682 HydrophobicContact CG-CG 3.52Å; R598-F682 HydrophobicContact CG-CZ 3.36Å; R598-F682 WeakPolarHBondContact O-CZ 3.44Å; I601-F682 HydrophobicContact CB-CZ 4.32Å; I601-F682 HydrophobicContact CG2-CE1 4.42Å; I601-F682 HydrophobicContact CG2-CZ 4.1Å; E602-F682 HydrophobicContact CB-CE2 3.84Å; E602-F682 HydrophobicContact CB-CZ 4.19Å; E602-F682 HydrophobicContact CG-CE2 4.12Å; L670-F682 HydrophobicContact CD2-CD1 4.06Å; L670-F682 HydrophobicContact CD2-CE1 3.54Å; E678-F682 WeakPolarHBondContact O-CB 3.38Å; E678-F682 PolarHBondContact O-N 3.36Å; N680-F682 VanDerWaalsContact C-N 3.3Å; N680-F682 PolarHBondContact O-N 3.26Å; F682-F684 VanDerWaalsContact C-N 3.29Å; F682-F684 PolarHBondContact O-N 3.45Å; F682-S685 PolarHBondContact O-N 2.79Å; F682-S685 VanDerWaalsContact O-N 3.12Å; F682-S685 PolarHBondContact O-OG 3.5Å; F682-M686 HydrophobicContact CD1-CG 4.31Å; F682-M686 HydrophobicContact CD2-CG 4.19Å; F682-M686 HydrophobicContact CE1-CG 3.76Å; F682-M686 HydrophobicContact CE2-CE 4.19Å; F682-M686 HydrophobicContact CE2-CG 3.62Å; F682-M686 HydrophobicContact CE2-SD 3.98Å; F682-M686 HydrophobicContact CZ-CG 3.4Å; F682-M686 HydrophobicContact CZ-SD 4.03Å; F682-M686 PolarHBondContact O-N 3.36Å
683A91.5Very high89.4Confident1 Ų158.3 Ų58.31%0.00829%0.289CS..Hα-helixtrans-58.4-42.5-178.500000111.6L670 L672 D679 N680 M686 V687L670-A683 HydrophobicContact CB-CB 4.25Å; L670-A683 HydrophobicContact CD1-CB 4.16Å; L670-A683 HydrophobicContact CD2-CB 4.36Å; L670-A683 HydrophobicContact CG-CB 4.49Å; L672-A683 HydrophobicContact CD2-CB 3.97Å; D679-A683 WeakPolarHBondContact O-CB 3.36Å; D679-A683 PolarHBondContact O-N 3.12Å; N680-A683 PolarHBondContact O-N 2.62Å; A683-M686 PolarHBondContact O-N 2.85Å; A683-V687 VanDerWaalsContact O-CG2 3.3Å; A683-V687 WeakPolarHBondContact O-CG2 3.31Å; A683-V687 PolarHBondContact O-N 3.02Å
684F94Very high90.3Very high19 Ų1954.8 Ų54.88%0.08327%0.271CS..Hα-helixtrans-65.2-39.9177.2-57.3-24.5000112.1L672 N680 F682 R688 Q726 L727 I730L672-F684 HydrophobicContact CD2-CE1 4.23Å; N680-F684 HydrophobicContact CB-CE2 3.8Å; N680-F684 HydrophobicContact CB-CZ 3.85Å; N680-F684 WeakPolarHBondContact O-CB 3.24Å; N680-F684 WeakPolarHBondContact O-CD1 3.49Å; N680-F684 WeakPolarHBondContact O-CD2 3.17Å; N680-F684 WeakPolarHBondContact O-CG 3.49Å; N680-F684 PolarHBondContact O-N 3.2Å; F682-F684 VanDerWaalsContact C-N 3.29Å; F682-F684 PolarHBondContact O-N 3.45Å; F684-R688 WeakPolarHBondContact O-CG 3.28Å; F684-R688 PolarHBondContact O-N 2.94Å; F684-Q726 HydrophobicContact CD1-CB 4.27Å; F684-Q726 HydrophobicContact CD2-CB 4.31Å; F684-Q726 HydrophobicContact CE1-CB 3.68Å; F684-Q726 HydrophobicContact CE2-CB 3.71Å; F684-Q726 HydrophobicContact CE2-CG 3.76Å; F684-Q726 HydrophobicContact CZ-CB 3.37Å; F684-Q726 HydrophobicContact CZ-CG 3.73Å; F684-L727 HydrophobicContact CD1-CD2 3.67Å; F684-L727 HydrophobicContact CD1-CG 4.18Å; F684-L727 HydrophobicContact CE1-CD2 4.04Å; F684-L727 HydrophobicContact CE1-CG 4.02Å; F684-I730 HydrophobicContact CB-CD1 4.08Å; F684-I730 HydrophobicContact CD1-CD1 4.41Å; F684-I730 HydrophobicContact CG-CD1 4.46Å
685S94.8Very high91.3Very high51 Ų5146.7 Ų46.736%0.35723%0.234SC..Hα-helixtrans-63-42.2175.878.40000112.2D681 F682 R688 L689D681-S685 WeakPolarHBondContact O-CB 3.21Å; D681-S685 PolarHBondContact O-N 3.37Å; F682-S685 PolarHBondContact O-N 2.79Å; F682-S685 VanDerWaalsContact O-N 3.12Å; F682-S685 PolarHBondContact O-OG 3.5Å; S685-R688 PolarHBondContact O-N 3.29Å; S685-L689 PolarHBondContact O-N 3.03Å; S685-L689 VanDerWaalsContact O-N 3.1Å
686M95.4Very high92Very high6 Ų641.9 Ų41.93%0.0321%0.21CC..Hα-helixtrans-69.6-41.8178.9-68.3-5899.100111.8I601 E602 L670 F682 A683 R688 L689 V690I601-M686 HydrophobicContact CG2-CG 4.38Å; E602-M686 HydrophobicContact CB-SD 4.5Å; E602-M686 HydrophobicContact CG-CE 4.28Å; E602-M686 HydrophobicContact CG-SD 4.4Å; L670-M686 HydrophobicContact CD1-CB 4.2Å; L670-M686 HydrophobicContact CD2-CB 4.4Å; F682-M686 HydrophobicContact CD1-CG 4.31Å; F682-M686 HydrophobicContact CD2-CG 4.19Å; F682-M686 HydrophobicContact CE1-CG 3.76Å; F682-M686 HydrophobicContact CE2-CE 4.19Å; F682-M686 HydrophobicContact CE2-CG 3.62Å; F682-M686 HydrophobicContact CE2-SD 3.98Å; F682-M686 HydrophobicContact CZ-CG 3.4Å; F682-M686 HydrophobicContact CZ-SD 4.03Å; F682-M686 PolarHBondContact O-N 3.36Å; A683-M686 PolarHBondContact O-N 2.85Å; M686-R688 VanDerWaalsContact C-N 3.34Å; M686-R688 PolarHBondContact O-N 2.97Å; M686-L689 HydrophobicContact CE-CD2 4.5Å; M686-L689 PolarHBondContact O-N 3.42Å; M686-V690 WeakPolarHBondContact O-CG2 3.41Å; M686-V690 PolarHBondContact O-N 3.31Å
687V95.7Very high92.5Very high0 Ų040.4 Ų40.40%020%0.2CC..Hα-helixtrans-62.6-41.1176.7171.80000111.2V667 L670 A683 V690 C691 M721 L727 I730V667-V687 HydrophobicContact CG1-CG2 4.04Å; V667-V687 HydrophobicContact CG2-CG2 4.15Å; L670-V687 HydrophobicContact CD1-CG2 3.68Å; A683-V687 VanDerWaalsContact O-CG2 3.3Å; A683-V687 WeakPolarHBondContact O-CG2 3.31Å; A683-V687 PolarHBondContact O-N 3.02Å; V687-V690 PolarHBondContact O-N 3.48Å; V687-C691 WeakPolarHBondContact O-CB 3.48Å; V687-C691 PolarHBondContact O-N 3.42Å; V687-C691 PolarHBondContact O-SG 2.73Å; V687-M721 HydrophobicContact CG1-CG 4.34Å; V687-M721 HydrophobicContact CG1-SD 3.88Å; V687-L727 HydrophobicContact CB-CD2 4.06Å; V687-L727 HydrophobicContact CG1-CD2 4.05Å; V687-L727 HydrophobicContact CG2-CD2 3.79Å; V687-I730 HydrophobicContact CG1-CD1 4.49Å; V687-I730 HydrophobicContact CG1-CG2 4.26Å
688R96.9Very high92.7Very high122 Ų12233 Ų3346%0.4617%0.168SC..Hα-helixtrans-60.9-48.9174.3-75.5-177179.7128.3-1111.8F684 S685 M686 V690 C691 D692 I730 Y734F684-R688 WeakPolarHBondContact O-CG 3.28Å; F684-R688 PolarHBondContact O-N 2.94Å; S685-R688 PolarHBondContact O-N 3.29Å; M686-R688 VanDerWaalsContact C-N 3.34Å; M686-R688 PolarHBondContact O-N 2.97Å; R688-V690 VanDerWaalsContact C-N 3.28Å; R688-V690 PolarHBondContact O-N 3.38Å; R688-C691 PolarHBondContact O-N 3.4Å; R688-C691 VanDerWaalsContact O-N 3.09Å; R688-D692 PolarHBondContact O-N 3.41Å; R688-I730 HydrophobicContact CG-CD1 4.1Å; R688-I730 HydrophobicContact CG-CG1 4.26Å; R688-I730 HydrophobicContact CG-CG2 4.19Å; R688-Y734 PolarHBondContact O-OH 3.04Å; R688-Y734 VanDerWaalsContact O-OH 3.12Å
689L97.2Very high92.7Very high44 Ų4428.7 Ų28.723%0.2315%0.15CC..Hα-helixtrans-57.3-41.6177.4-17961.2000112.4T605 R606 V609 S685 M686 H693T605-L689 HydrophobicContact CG2-CD2 3.78Å; T605-L689 HydrophobicContact CG2-CG 4.3Å; R606-L689 HydrophobicContact CG-CD2 4.1Å; V609-L689 HydrophobicContact CG1-CD1 4.43Å; V609-L689 HydrophobicContact CG2-CD1 4.18Å; V609-L689 HydrophobicContact CG2-CD2 4.46Å; V609-L689 HydrophobicContact CG2-CG 4.12Å; S685-L689 PolarHBondContact O-N 3.03Å; S685-L689 VanDerWaalsContact O-N 3.1Å; M686-L689 HydrophobicContact CE-CD2 4.5Å; M686-L689 PolarHBondContact O-N 3.42Å; L689-H693 PolarHBondContact O-N 3.03Å; L689-H693 VanDerWaalsContact O-N 3.1Å
690V97.2Very high92.5Very high3 Ų328.4 Ų28.42%0.01815%0.149CC..Hα-helixtrans-65.8-45.2175167.90000111.2T605 F663 V667 M686 V687 R688 D692 H693 F694 I717T605-V690 HydrophobicContact CG2-CG2 4.23Å; F663-V690 HydrophobicContact CB-CG1 3.81Å; F663-V690 HydrophobicContact CB-CG2 4.06Å; F663-V690 HydrophobicContact CD1-CG2 4.27Å; F663-V690 HydrophobicContact CD2-CG1 4.14Å; F663-V690 HydrophobicContact CD2-CG2 4.08Å; F663-V690 HydrophobicContact CG-CG1 4.23Å; F663-V690 HydrophobicContact CG-CG2 3.89Å; V667-V690 HydrophobicContact CG2-CG1 4.23Å; M686-V690 WeakPolarHBondContact O-CG2 3.41Å; M686-V690 PolarHBondContact O-N 3.31Å; V687-V690 PolarHBondContact O-N 3.48Å; R688-V690 VanDerWaalsContact C-N 3.28Å; R688-V690 PolarHBondContact O-N 3.38Å; V690-D692 VanDerWaalsContact C-N 3.32Å; V690-D692 PolarHBondContact O-N 3.08Å; V690-H693 WeakPolarHBondContact O-CB 3.45Å; V690-H693 PolarHBondContact O-N 2.93Å; V690-F694 HydrophobicContact CG1-CD2 3.76Å; V690-F694 HydrophobicContact CG1-CE2 3.79Å; V690-F694 VanDerWaalsContact O-CD2 3.31Å; V690-F694 WeakPolarHBondContact O-CD2 3.25Å; V690-F694 PolarHBondContact O-N 3.32Å; V690-I717 HydrophobicContact CG1-CD1 3.81Å
691C96.4Very high92.1Very high0 Ų027.1 Ų27.10%014%0.143CC..Hα-helixtrans-63.1-36.8177.6-74.20000112.4V687 R688 F694 L695 Y734V687-C691 WeakPolarHBondContact O-CB 3.48Å; V687-C691 PolarHBondContact O-N 3.42Å; V687-C691 PolarHBondContact O-SG 2.73Å; R688-C691 PolarHBondContact O-N 3.4Å; R688-C691 VanDerWaalsContact O-N 3.09Å; C691-F694 PolarHBondContact O-N 2.82Å; C691-L695 WeakPolarHBondContact O-CB 3.25Å; C691-L695 PolarHBondContact O-N 2.86Å; C691-Y734 HydrophobicContact CB-CD2 3.95Å; C691-Y734 HydrophobicContact CB-CE1 3.99Å; C691-Y734 HydrophobicContact CB-CE2 3.31Å; C691-Y734 WeakPolarHBondContact CB-OH 3.15Å
692D95.7Very high91.2Very high75 Ų7524.7 Ų24.740%0.40113%0.129SC..Hα-helixtrans-62.6-45.3173.1-71.7-27.7000111.3R688 V690 F694 L695 T696 Y734R688-D692 PolarHBondContact O-N 3.41Å; V690-D692 VanDerWaalsContact C-N 3.32Å; V690-D692 PolarHBondContact O-N 3.08Å; D692-F694 PolarHBondContact O-N 2.85Å; D692-L695 WeakPolarHBondContact O-CB 3.02Å; D692-L695 PolarHBondContact O-N 3.14Å; D692-T696 PolarHBondContact O-N 3.44Å; D692-T696 PolarHBondContact O-OG1 3.21Å; D692-Y734 PolarHBondContact N-OH 3.03Å; D692-Y734 PolarHBondContact OD1-OH 3.48Å
693H95.8Very high90.4Very high8 Ų827.6 Ų27.64%0.03714%0.143CC..Hα-helixtrans-57.6-48.5173166.683.7000111.8V609 A612 N660 F663 L689 V690 L695 T696 V697V609-H693 HydrophobicContact CG2-CB 4.44Å; A612-H693 VanDerWaalsContact CB-CE1 3.47Å; A612-H693 WeakPolarHBondContact CB-CE1 3.49Å; N660-H693 PolarHBondContact OD1-NE2 3.16Å; F663-H693 AromaticContact CD2-CD2 3.61Å; F663-H693 HydrophobicContact CE2-CB 4.09Å; F663-H693 AromaticContact CE2-CD2 3.51Å; F663-H693 AromaticContact CE2-CG 3.65Å; F663-H693 AromaticContact CE2-NE2 3.9Å; L689-H693 PolarHBondContact O-N 3.03Å; L689-H693 VanDerWaalsContact O-N 3.1Å; V690-H693 WeakPolarHBondContact O-CB 3.45Å; V690-H693 PolarHBondContact O-N 2.93Å; H693-L695 VanDerWaalsContact C-N 3.34Å; H693-L695 PolarHBondContact O-N 3.47Å; H693-T696 WeakPolarHBondContact O-CB 3.3Å; H693-T696 PolarHBondContact O-N 3.38Å; H693-V697 VanDerWaalsContact O-CG2 3.32Å; H693-V697 WeakPolarHBondContact O-CG2 3.5Å; H693-V697 PolarHBondContact O-N 3Å
694F94.9Very high89.7Confident0 Ų035 Ų350%017%0.171CC..Hα-helixtrans-63.6-39177.9-86.2-80.9000112.2N660 F663 V690 C691 D692 T696 V697 F698 A710 F713 F714 I717N660-F694 HydrophobicContact CB-CE1 4.07Å; N660-F694 HydrophobicContact CB-CZ 3.78Å; F663-F694 HydrophobicContact CB-CE2 4.17Å; F663-F694 HydrophobicContact CD2-CE2 4.4Å; V690-F694 HydrophobicContact CG1-CD2 3.76Å; V690-F694 HydrophobicContact CG1-CE2 3.79Å; V690-F694 VanDerWaalsContact O-CD2 3.31Å; V690-F694 WeakPolarHBondContact O-CD2 3.25Å; V690-F694 PolarHBondContact O-N 3.32Å; C691-F694 PolarHBondContact O-N 2.82Å; D692-F694 PolarHBondContact O-N 2.85Å; F694-T696 VanDerWaalsContact C-N 3.34Å; F694-T696 PolarHBondContact O-N 3.01Å; F694-V697 PolarHBondContact O-N 3.37Å; F694-F698 HydrophobicContact CB-CD2 4.32Å; F694-F698 HydrophobicContact CB-CE2 4.19Å; F694-F698 AromaticContact CD1-CE2 3.89Å; F694-F698 HydrophobicContact CD1-CE2 3.89Å; F694-F698 HydrophobicContact CD1-CZ 4.43Å; F694-F698 HydrophobicContact CG-CE2 4.5Å; F694-F698 WeakPolarHBondContact O-CD2 3.23Å; F694-F698 PolarHBondContact O-N 3.34Å; F694-A710 HydrophobicContact CD1-CB 4.2Å; F694-A710 HydrophobicContact CE1-CB 3.99Å; F694-A710 WeakPolarHBondContact CE1-O 2.93Å; F694-F713 HydrophobicContact CE1-CB 4.36Å; F694-F713 HydrophobicContact CZ-CB 4.05Å; F694-F714 HydrophobicContact CB-CD2 3.69Å; F694-F714 HydrophobicContact CB-CE2 3.86Å; F694-F714 HydrophobicContact CB-CG 4.31Å; F694-F714 HydrophobicContact CD1-CB 3.74Å; F694-F714 AromaticContact CD1-CD2 3.9Å; F694-F714 HydrophobicContact CD1-CD2 3.9Å; F694-F714 HydrophobicContact CD1-CG 4.04Å; F694-F714 AromaticContact CD2-CD2 3.77Å; F694-F714 HydrophobicContact CD2-CD2 3.77Å; F694-F714 HydrophobicContact CD2-CE2 4.37Å; F694-F714 HydrophobicContact CE1-CB 3.84Å; F694-F714 HydrophobicContact CE1-CD2 4.47Å; F694-F714 HydrophobicContact CE2-CD2 4.38Å; F694-F714 HydrophobicContact CG-CB 4.26Å; F694-F714 AromaticContact CG-CD2 3.5Å; F694-F714 HydrophobicContact CG-CD2 3.5Å; F694-F714 HydrophobicContact CG-CE2 4.14Å; F694-F714 HydrophobicContact CG-CG 4.1Å; F694-F714 HydrophobicContact CZ-CB 4.44Å; F694-I717 HydrophobicContact CD2-CD1 4.02Å; F694-I717 HydrophobicContact CE2-CD1 3.35Å; F694-I717 HydrophobicContact CZ-CD1 3.88Å
695L92.5Very high88.9Confident22 Ų2235 Ų3512%0.11518%0.177CC..Hα-helixtrans-55-52.8172.1-179.862.8000109.2C691 D692 H693 V697 F698 T699 Y734 L737 F749 M761C691-L695 WeakPolarHBondContact O-CB 3.25Å; C691-L695 PolarHBondContact O-N 2.86Å; D692-L695 WeakPolarHBondContact O-CB 3.02Å; D692-L695 PolarHBondContact O-N 3.14Å; H693-L695 VanDerWaalsContact C-N 3.34Å; H693-L695 PolarHBondContact O-N 3.47Å; L695-V697 PolarHBondContact O-N 2.92Å; L695-F698 PolarHBondContact O-N 2.88Å; L695-T699 HydrophobicContact CD1-CG2 3.8Å; L695-T699 HydrophobicContact CG-CG2 4.25Å; L695-T699 WeakPolarHBondContact O-CB 3.23Å; L695-T699 WeakPolarHBondContact O-CG2 3.34Å; L695-T699 PolarHBondContact O-N 3.19Å; L695-T699 PolarHBondContact O-OG1 3.02Å; L695-T699 VanDerWaalsContact O-OG1 3.05Å; L695-Y734 HydrophobicContact CD2-CD1 4.4Å; L695-Y734 HydrophobicContact CD2-CE1 4.19Å; L695-L737 HydrophobicContact CD2-CD2 4.33Å; L695-F749 HydrophobicContact CD1-CE1 4.35Å; L695-M761 HydrophobicContact CB-CE 3.96Å; L695-M761 HydrophobicContact CB-SD 4.28Å; L695-M761 HydrophobicContact CD1-CE 3.9Å; L695-M761 HydrophobicContact CD1-SD 3.55Å; L695-M761 VanDerWaalsContact CD1-SD 3.55Å
696T90.4Very high88.4Confident66 Ų6632.6 Ų32.641%0.40516%0.16SC..Hα-helixtrans-57.7-43.7176.4-55.90000112.6L616 D692 H693 F694 F698 T699 S700L616-T696 HydrophobicContact CD1-CG2 3.98Å; D692-T696 PolarHBondContact O-N 3.44Å; D692-T696 PolarHBondContact O-OG1 3.21Å; H693-T696 WeakPolarHBondContact O-CB 3.3Å; H693-T696 PolarHBondContact O-N 3.38Å; F694-T696 VanDerWaalsContact C-N 3.34Å; F694-T696 PolarHBondContact O-N 3.01Å; T696-F698 PolarHBondContact O-N 3.46Å; T696-T699 PolarHBondContact O-N 3.5Å; T696-T699 PolarHBondContact O-OG1 2.83Å; T696-S700 WeakPolarHBondContact O-CB 3.21Å; T696-S700 PolarHBondContact O-N 3.39Å; T696-S700 PolarHBondContact O-OG 2.94Å
697V90.9Very high87.9Confident0 Ų032.4 Ų32.40%016%0.159CC..Hα-helixtrans-59.1-46.6176.9172.30000111.1L616 I656 H693 F694 L695 T701 V706 A710L616-V697 HydrophobicContact CD1-CG2 4.28Å; L616-V697 HydrophobicContact CD2-CG2 4.06Å; I656-V697 HydrophobicContact CG2-CG2 4.39Å; H693-V697 VanDerWaalsContact O-CG2 3.32Å; H693-V697 WeakPolarHBondContact O-CG2 3.5Å; H693-V697 PolarHBondContact O-N 3Å; F694-V697 PolarHBondContact O-N 3.37Å; L695-V697 PolarHBondContact O-N 2.92Å; V697-T701 WeakPolarHBondContact O-CB 3.07Å; V697-T701 WeakPolarHBondContact O-CG2 3.3Å; V697-T701 PolarHBondContact O-N 2.86Å; V697-T701 PolarHBondContact O-OG1 3.36Å; V697-V706 HydrophobicContact CG1-CG1 3.81Å; V697-A710 HydrophobicContact CG1-CB 3.87Å
698F89.4Confident87.4Confident4 Ų436.4 Ų36.42%0.01818%0.177CC..Hα-helixtrans-72.8-28.9-178.8-73.8-60.6000113.5F694 L695 T696 F707 A710 F714 G757 F760 M761F694-F698 HydrophobicContact CB-CD2 4.32Å; F694-F698 HydrophobicContact CB-CE2 4.19Å; F694-F698 AromaticContact CD1-CE2 3.89Å; F694-F698 HydrophobicContact CD1-CE2 3.89Å; F694-F698 HydrophobicContact CD1-CZ 4.43Å; F694-F698 HydrophobicContact CG-CE2 4.5Å; F694-F698 WeakPolarHBondContact O-CD2 3.23Å; F694-F698 PolarHBondContact O-N 3.34Å; L695-F698 PolarHBondContact O-N 2.88Å; T696-F698 PolarHBondContact O-N 3.46Å; F698-F707 HydrophobicContact CD1-CB 3.9Å; F698-F707 HydrophobicContact CE1-CB 4.03Å; F698-A710 HydrophobicContact CE1-CB 4.1Å; F698-A710 HydrophobicContact CZ-CB 3.97Å; F698-F714 HydrophobicContact CE2-CB 4.02Å; F698-F714 AromaticContact CE2-CD1 3.79Å; F698-F714 HydrophobicContact CE2-CD1 3.79Å; F698-F714 HydrophobicContact CE2-CE1 4.48Å; F698-F714 AromaticContact CE2-CG 3.94Å; F698-F714 HydrophobicContact CE2-CG 3.94Å; F698-F714 HydrophobicContact CZ-CB 4.15Å; F698-F714 HydrophobicContact CZ-CD1 4.39Å; F698-G757 VanDerWaalsContact CD1-O 3.25Å; F698-G757 WeakPolarHBondContact CD1-O 3.33Å; F698-G757 CarbonylContact O-C 3.5Å; F698-G757 WeakPolarHBondContact O-CA 3.42Å; F698-F760 HydrophobicContact CD1-CB 4.13Å; F698-F760 HydrophobicContact CE1-CB 3.81Å; F698-M761 HydrophobicContact CB-CB 4.12Å; F698-M761 HydrophobicContact CB-SD 4.49Å; F698-M761 HydrophobicContact CD1-CB 4.4Å; F698-M761 HydrophobicContact CD2-CB 3.53Å; F698-M761 HydrophobicContact CD2-CG 3.66Å; F698-M761 HydrophobicContact CD2-SD 4.04Å; F698-M761 HydrophobicContact CE2-CB 4.01Å; F698-M761 HydrophobicContact CE2-CG 4.07Å; F698-M761 HydrophobicContact CG-CB 3.78Å; F698-M761 HydrophobicContact CG-CG 4.37Å
699T84.5Confident87.1Confident30 Ų3032.2 Ų32.218%0.18417%0.165CC..Hα-helixtrans-90-30.2-178.861.10000113.9L695 T696 F749L695-T699 HydrophobicContact CD1-CG2 3.8Å; L695-T699 HydrophobicContact CG-CG2 4.25Å; L695-T699 WeakPolarHBondContact O-CB 3.23Å; L695-T699 WeakPolarHBondContact O-CG2 3.34Å; L695-T699 PolarHBondContact O-N 3.19Å; L695-T699 PolarHBondContact O-OG1 3.02Å; L695-T699 VanDerWaalsContact O-OG1 3.05Å; T696-T699 PolarHBondContact O-N 3.5Å; T696-T699 PolarHBondContact O-OG1 2.83Å; T699-F749 HydrophobicContact CG2-CD1 3.28Å; T699-F749 HydrophobicContact CG2-CE1 3.28Å
700S80.1Confident86.8Confident16 Ų1630.1 Ų30.111%0.11215%0.154CC..Hα-helixtrans-98.8-20.7-170.771.30000114.8Q620 T696 R750Q620-S700 WeakPolarHBondContact CG-O 3.5Å; Q620-S700 PolarHBondContact NE2-O 2.86Å; T696-S700 WeakPolarHBondContact O-CB 3.21Å; T696-S700 PolarHBondContact O-N 3.39Å; T696-S700 PolarHBondContact O-OG 2.94Å; S700-R750 PolarHBondContact O-NH1 3.27Å
701T79.3Confident86.5Confident2 Ų230.2 Ų30.21%0.01216%0.156CC..  trans-100.9144.7-172.468.60000113.6L616 L619 V697 V706L616-T701 HydrophobicContact CD2-CG2 3.41Å; L616-T701 VanDerWaalsContact CD2-CG2 3.41Å; L619-T701 HydrophobicContact CB-CG2 4.28Å; V697-T701 WeakPolarHBondContact O-CB 3.07Å; V697-T701 WeakPolarHBondContact O-CG2 3.3Å; V697-T701 PolarHBondContact O-N 2.86Å; V697-T701 PolarHBondContact O-OG1 3.36Å; T701-V706 HydrophobicContact CG2-CG1 4.23Å
702N71.6Confident86.3Confident34 Ų3436.9 Ų36.918%0.18219%0.186CC..  trans-106.2-18.1176.5-69.1-9.6000113L619 D621 R704 N752L619-N702 PolarHBondContact O-N 3.48Å; D621-N702 WeakPolarHBondContact CB-ND2 3.35Å; D621-N702 VanDerWaalsContact CG-ND2 3.33Å; D621-N702 WeakPolarHBondContact OD2-CB 3.45Å; D621-N702 PolarHBondContact OD2-ND2 3.15Å; N702-R704 PolarHBondContact O-N 3.18Å; N702-R704 VanDerWaalsContact O-N 3.15Å; N702-N752 PolarHBondContact OD1-ND2 3.02Å
703H74.7Confident86.3Confident76 Ų7634.5 Ų34.535%0.35217%0.172SC..  trans-69.5114.4-177.1-174.6-86000111.3G705 V706H703-G705 VanDerWaalsContact C-N 3.28Å; H703-G705 WeakPolarHBondContact ND1-CA 3.35Å; H703-G705 PolarHBondContact ND1-N 3.46Å; H703-G705 VanDerWaalsContact ND1-N 3.17Å; H703-G705 PolarHBondContact O-N 3.35Å; H703-V706 HydrophobicContact CB-CB 4.4Å; H703-V706 HydrophobicContact CB-CG2 3.73Å; H703-V706 PolarHBondContact ND1-N 3.38Å; H703-V706 VanDerWaalsContact O-CB 3.31Å; H703-V706 WeakPolarHBondContact O-CB 3.29Å; H703-V706 PolarHBondContact O-N 3.12Å
704R76Confident86.3Confident156 Ų15634.1 Ų34.159%0.58917%0.17SC*.Hα-helixtrans-55.7-37.9-176.3-178.8168.8176.9-169.2-5.7115.1N702 V706 F707 E708N702-R704 PolarHBondContact O-N 3.18Å; N702-R704 VanDerWaalsContact O-N 3.15Å; R704-V706 PolarHBondContact O-N 3.48Å; R704-F707 VanDerWaalsContact CA-CE1 3.44Å; R704-F707 HydrophobicContact CB-CE1 4.2Å; R704-F707 HydrophobicContact CB-CE2 4.1Å; R704-F707 HydrophobicContact CB-CZ 3.68Å; R704-F707 HydrophobicContact CG-CE2 3.66Å; R704-F707 HydrophobicContact CG-CZ 3.69Å; R704-F707 WeakPolarHBondContact O-CD2 3.41Å; R704-E708 HydrophobicContact CG-CG 4.28Å; R704-E708 IonicContact CZ-OE1 2.69Å; R704-E708 VanDerWaalsContact CZ-OE1 3.3Å; R704-E708 IonicContact NE-OE1 3.76Å; R704-E708 PolarHBondContact NE-OE1 3.48Å; R704-E708 IonicContact NH2-OE1 3.02Å; R704-E708 PolarHBondContact NH2-OE1 3.43Å; R704-E708 WeakPolarHBondContact O-CB 3.35Å; R704-E708 WeakPolarHBondContact O-CG 3.35Å; R704-E708 PolarHBondContact O-N 3.35Å; R704-E708 VanDerWaalsContact O-N 3.12Å
705G78.3Confident86.1Confident20 Ų2037.2 Ų37.221%0.20618%0.183CC..Hα-helixtrans-65-24.1175.400000114W653 H703 T709W653-G705 PolarHBondContact NE1-O 3.3Å; H703-G705 VanDerWaalsContact C-N 3.28Å; H703-G705 WeakPolarHBondContact ND1-CA 3.35Å; H703-G705 PolarHBondContact ND1-N 3.46Å; H703-G705 VanDerWaalsContact ND1-N 3.17Å; H703-G705 PolarHBondContact O-N 3.35Å; G705-T709 WeakPolarHBondContact O-CG2 3.2Å; G705-T709 PolarHBondContact O-N 3.12Å; G705-T709 PolarHBondContact O-OG1 2.76Å
706V84.5Confident86.1Confident0 Ų040.2 Ų40.20%020%0.197CC..Hα-helixtrans-72.6-56.3178.8176.80000109.5L619 W653 I656 V697 T701 H703 R704 E708 T709 A710L619-V706 HydrophobicContact CD1-CG2 3.86Å; L619-V706 HydrophobicContact CD2-CG2 4.31Å; L619-V706 HydrophobicContact CG-CG2 4.46Å; W653-V706 HydrophobicContact CG-CG2 4.34Å; I656-V706 HydrophobicContact CG2-CG1 4.2Å; V697-V706 HydrophobicContact CG1-CG1 3.81Å; T701-V706 HydrophobicContact CG2-CG1 4.23Å; H703-V706 HydrophobicContact CB-CB 4.4Å; H703-V706 HydrophobicContact CB-CG2 3.73Å; H703-V706 PolarHBondContact ND1-N 3.38Å; H703-V706 VanDerWaalsContact O-CB 3.31Å; H703-V706 WeakPolarHBondContact O-CB 3.29Å; H703-V706 PolarHBondContact O-N 3.12Å; R704-V706 PolarHBondContact O-N 3.48Å; V706-E708 VanDerWaalsContact C-N 3.35Å; V706-E708 PolarHBondContact O-N 2.82Å; V706-T709 PolarHBondContact O-N 2.82Å; V706-T709 PolarHBondContact O-OG1 3.38Å; V706-A710 VanDerWaalsContact O-CB 3.27Å; V706-A710 WeakPolarHBondContact O-CB 3.45Å; V706-A710 PolarHBondContact O-N 2.93Å
707F84.8Confident86.3Confident3 Ų337 Ų371%0.01318%0.177CC..Hα-helixtrans-72-25.8-177.555.2-111.4000113.6F698 R704 G711 S755 F760F698-F707 HydrophobicContact CD1-CB 3.9Å; F698-F707 HydrophobicContact CE1-CB 4.03Å; R704-F707 VanDerWaalsContact CA-CE1 3.44Å; R704-F707 HydrophobicContact CB-CE1 4.2Å; R704-F707 HydrophobicContact CB-CE2 4.1Å; R704-F707 HydrophobicContact CB-CZ 3.68Å; R704-F707 HydrophobicContact CG-CE2 3.66Å; R704-F707 HydrophobicContact CG-CZ 3.69Å; R704-F707 WeakPolarHBondContact O-CD2 3.41Å; F707-G711 PolarHBondContact O-N 2.91Å; F707-S755 WeakPolarHBondContact CZ-O 3.36Å; F707-F760 HydrophobicContact CD2-CD1 4.3Å; F707-F760 AromaticContact CD2-CD2 3.64Å; F707-F760 HydrophobicContact CD2-CD2 3.64Å; F707-F760 HydrophobicContact CD2-CE1 4.07Å; F707-F760 AromaticContact CD2-CE2 3.4Å; F707-F760 HydrophobicContact CD2-CE2 3.4Å; F707-F760 HydrophobicContact CD2-CG 4.08Å; F707-F760 AromaticContact CD2-CZ 3.6Å; F707-F760 HydrophobicContact CD2-CZ 3.6Å; F707-F760 AromaticContact CE2-CD2 3.9Å; F707-F760 HydrophobicContact CE2-CD2 3.9Å; F707-F760 HydrophobicContact CE2-CE1 4.4Å; F707-F760 AromaticContact CE2-CE2 3.23Å; F707-F760 HydrophobicContact CE2-CE2 3.23Å; F707-F760 AromaticContact CE2-CZ 3.51Å; F707-F760 HydrophobicContact CE2-CZ 3.51Å; F707-F760 HydrophobicContact CG-CD2 4.49Å; F707-F760 HydrophobicContact CZ-CE2 4.28Å
708E84.9Confident86.4Confident83 Ų8337.1 Ų37.139%0.38818%0.178SC..Hα-helixtrans-66.7-44.3172.2-76.5-176.2174.900111.8R704 V706 G711 F712 F760R704-E708 HydrophobicContact CG-CG 4.28Å; R704-E708 IonicContact CZ-OE1 2.69Å; R704-E708 VanDerWaalsContact CZ-OE1 3.3Å; R704-E708 IonicContact NE-OE1 3.76Å; R704-E708 PolarHBondContact NE-OE1 3.48Å; R704-E708 IonicContact NH2-OE1 3.02Å; R704-E708 PolarHBondContact NH2-OE1 3.43Å; R704-E708 WeakPolarHBondContact O-CB 3.35Å; R704-E708 WeakPolarHBondContact O-CG 3.35Å; R704-E708 PolarHBondContact O-N 3.35Å; R704-E708 VanDerWaalsContact O-N 3.12Å; V706-E708 VanDerWaalsContact C-N 3.35Å; V706-E708 PolarHBondContact O-N 2.82Å; E708-G711 PolarHBondContact O-N 3.42Å; E708-F712 PolarHBondContact O-N 3.31Å; E708-F760 HydrophobicContact CG-CE1 3.72Å; E708-F760 HydrophobicContact CG-CZ 3.8Å
709T89.9Confident86.4Confident34 Ų3439 Ų3921%0.20919%0.188CC..Hα-helixtrans-72.2-40175.751.50000112.3W653 G705 V706 G711 F712 F713W653-T709 HydrophobicContact CZ2-CG2 4.25Å; G705-T709 WeakPolarHBondContact O-CG2 3.2Å; G705-T709 PolarHBondContact O-N 3.12Å; G705-T709 PolarHBondContact O-OG1 2.76Å; V706-T709 PolarHBondContact O-N 2.82Å; V706-T709 PolarHBondContact O-OG1 3.38Å; T709-G711 VanDerWaalsContact C-N 3.3Å; T709-G711 PolarHBondContact O-N 3.4Å; T709-F712 WeakPolarHBondContact O-CB 3.38Å; T709-F712 PolarHBondContact O-N 2.92Å; T709-F713 WeakPolarHBondContact O-CD2 3.43Å; T709-F713 PolarHBondContact O-N 2.89Å
710A92.2Very high86.7Confident0 Ų038.5 Ų38.50%019%0.185CC..Hα-helixtrans-60.3-40.7172.300000111.5F694 V697 F698 V706 F712 F713 F714F694-A710 HydrophobicContact CD1-CB 4.2Å; F694-A710 HydrophobicContact CE1-CB 3.99Å; F694-A710 WeakPolarHBondContact CE1-O 2.93Å; V697-A710 HydrophobicContact CG1-CB 3.87Å; F698-A710 HydrophobicContact CE1-CB 4.1Å; F698-A710 HydrophobicContact CZ-CB 3.97Å; V706-A710 VanDerWaalsContact O-CB 3.27Å; V706-A710 WeakPolarHBondContact O-CB 3.45Å; V706-A710 PolarHBondContact O-N 2.93Å; A710-F712 VanDerWaalsContact C-N 3.31Å; A710-F712 PolarHBondContact O-N 3.29Å; A710-F713 PolarHBondContact O-N 3.41Å; A710-F714 VanDerWaalsContact O-CB 3.27Å; A710-F714 WeakPolarHBondContact O-CB 3.26Å; A710-F714 PolarHBondContact O-N 3.2Å
711G90.8Very high87.2Confident6 Ų637.8 Ų37.86%0.06218%0.18CC..Hα-helixtrans-60.3-36.4174.700000113.4F707 E708 T709 K715 C764F707-G711 PolarHBondContact O-N 2.91Å; E708-G711 PolarHBondContact O-N 3.42Å; T709-G711 VanDerWaalsContact C-N 3.3Å; T709-G711 PolarHBondContact O-N 3.4Å; G711-K715 WeakPolarHBondContact O-CB 3.2Å; G711-K715 PolarHBondContact O-N 2.98Å; G711-C764 PolarHBondContact O-SG 3.11Å; G711-C764 VanDerWaalsContact O-SG 3.41Å
712F91.7Very high87.6Confident140 Ų14041.2 Ų41.261%0.61420%0.198SC*.Hα-helixtrans-61-49.7174.6174.4-94.1000111.8E708 T709 A710E708-F712 PolarHBondContact O-N 3.31Å; T709-F712 WeakPolarHBondContact O-CB 3.38Å; T709-F712 PolarHBondContact O-N 2.92Å; A710-F712 VanDerWaalsContact C-N 3.31Å; A710-F712 PolarHBondContact O-N 3.29Å
713F95.1Very high88.3Confident24 Ų2444.7 Ų44.711%0.10521%0.209CC..Hα-helixtrans-70.7-43.9179.6-62.6-58000112.6K657 N660 A661 S664 F694 T709 A710 K715 E716 I717K657-F713 HydrophobicContact CG-CE2 4.24Å; N660-F713 HydrophobicContact CB-CB 4.35Å; N660-F713 HydrophobicContact CB-CD2 3.55Å; N660-F713 HydrophobicContact CB-CE2 4.19Å; N660-F713 HydrophobicContact CB-CG 4.2Å; A661-F713 HydrophobicContact CB-CD1 4.27Å; A661-F713 HydrophobicContact CB-CE1 3.61Å; A661-F713 HydrophobicContact CB-CE2 4.14Å; A661-F713 HydrophobicContact CB-CZ 3.53Å; S664-F713 PolarHBondContact OG-O 3.4Å; F694-F713 HydrophobicContact CE1-CB 4.36Å; F694-F713 HydrophobicContact CZ-CB 4.05Å; T709-F713 WeakPolarHBondContact O-CD2 3.43Å; T709-F713 PolarHBondContact O-N 2.89Å; A710-F713 PolarHBondContact O-N 3.41Å; F713-K715 VanDerWaalsContact C-N 3.27Å; F713-K715 PolarHBondContact O-N 2.87Å; F713-E716 WeakPolarHBondContact O-CB 3.11Å; F713-E716 PolarHBondContact O-N 2.87Å; F713-I717 PolarHBondContact O-N 3.16Å
714F95.2Very high88.9Confident0 Ų042.5 Ų42.50%020%0.202CC..Hα-helixtrans-64.3-33.5-179.7-166.8-119.5000112.3F694 F698 A710 E716 I717 C718 M761 C764 L765F694-F714 HydrophobicContact CB-CD2 3.69Å; F694-F714 HydrophobicContact CB-CE2 3.86Å; F694-F714 HydrophobicContact CB-CG 4.31Å; F694-F714 HydrophobicContact CD1-CB 3.74Å; F694-F714 AromaticContact CD1-CD2 3.9Å; F694-F714 HydrophobicContact CD1-CD2 3.9Å; F694-F714 HydrophobicContact CD1-CG 4.04Å; F694-F714 AromaticContact CD2-CD2 3.77Å; F694-F714 HydrophobicContact CD2-CD2 3.77Å; F694-F714 HydrophobicContact CD2-CE2 4.37Å; F694-F714 HydrophobicContact CE1-CB 3.84Å; F694-F714 HydrophobicContact CE1-CD2 4.47Å; F694-F714 HydrophobicContact CE2-CD2 4.38Å; F694-F714 HydrophobicContact CG-CB 4.26Å; F694-F714 AromaticContact CG-CD2 3.5Å; F694-F714 HydrophobicContact CG-CD2 3.5Å; F694-F714 HydrophobicContact CG-CE2 4.14Å; F694-F714 HydrophobicContact CG-CG 4.1Å; F694-F714 HydrophobicContact CZ-CB 4.44Å; F698-F714 HydrophobicContact CE2-CB 4.02Å; F698-F714 AromaticContact CE2-CD1 3.79Å; F698-F714 HydrophobicContact CE2-CD1 3.79Å; F698-F714 HydrophobicContact CE2-CE1 4.48Å; F698-F714 AromaticContact CE2-CG 3.94Å; F698-F714 HydrophobicContact CE2-CG 3.94Å; F698-F714 HydrophobicContact CZ-CB 4.15Å; F698-F714 HydrophobicContact CZ-CD1 4.39Å; A710-F714 VanDerWaalsContact O-CB 3.27Å; A710-F714 WeakPolarHBondContact O-CB 3.26Å; A710-F714 PolarHBondContact O-N 3.2Å; F714-E716 VanDerWaalsContact C-N 3.32Å; F714-E716 PolarHBondContact O-N 3.06Å; F714-I717 HydrophobicContact CD2-CB 4.43Å; F714-I717 HydrophobicContact CD2-CD1 4.36Å; F714-I717 HydrophobicContact CD2-CG2 4.44Å; F714-I717 WeakPolarHBondContact O-CB 3.44Å; F714-I717 PolarHBondContact O-N 3.44Å; F714-C718 PolarHBondContact O-N 3.17Å; F714-C718 PolarHBondContact O-SG 2.96Å; F714-M761 HydrophobicContact CD1-CG 4.26Å; F714-M761 HydrophobicContact CE1-CE 4.2Å; F714-M761 HydrophobicContact CE1-CG 3.67Å; F714-M761 HydrophobicContact CZ-CE 3.96Å; F714-M761 HydrophobicContact CZ-CG 4.37Å; F714-C764 HydrophobicContact CD1-CB 3.57Å; F714-C764 HydrophobicContact CE1-CB 4.18Å; F714-L765 HydrophobicContact CE1-CD2 3.92Å; F714-L765 HydrophobicContact CE1-CG 4.05Å; F714-L765 HydrophobicContact CZ-CD2 3.91Å
715K92Very high89.5Confident66 Ų6641.2 Ų41.229%0.28720%0.202SC..Hα-helixtrans-60.9-38.6171.7-177.6-175.9-177.5-177.70112.7G711 F713 C718 N719 C764 H767 F813G711-K715 WeakPolarHBondContact O-CB 3.2Å; G711-K715 PolarHBondContact O-N 2.98Å; F713-K715 VanDerWaalsContact C-N 3.27Å; F713-K715 PolarHBondContact O-N 2.87Å; K715-C718 PolarHBondContact O-N 3.45Å; K715-N719 VanDerWaalsContact O-CG 3.3Å; K715-N719 PolarHBondContact O-N 2.92Å; K715-N719 VanDerWaalsContact O-N 3.12Å; K715-N719 PolarHBondContact O-ND2 2.99Å; K715-C764 HydrophobicContact CB-CB 4.46Å; K715-H767 WeakPolarHBondContact CE-CD2 3.13Å; K715-H767 VanDerWaalsContact CE-CE1 3.45Å; K715-H767 WeakPolarHBondContact CE-CE1 3.32Å; K715-H767 WeakPolarHBondContact CE-NE2 3.37Å; K715-F813 HydrophobicContact CD-CZ 4.39Å
716E92.1Very high90Very high84 Ų8444.8 Ų44.839%0.39321%0.214SC..Hα-helixtrans-68.5-40.9175.6-176.6177.3-155.500111.5S664 F713 F714 N719 T720S664-E716 VanDerWaalsContact OG-CD 3.3Å; S664-E716 PolarHBondContact OG-OE2 2.74Å; F713-E716 WeakPolarHBondContact O-CB 3.11Å; F713-E716 PolarHBondContact O-N 2.87Å; F714-E716 VanDerWaalsContact C-N 3.32Å; F714-E716 PolarHBondContact O-N 3.06Å; E716-N719 PolarHBondContact O-N 3.09Å; E716-T720 WeakPolarHBondContact O-CB 3.28Å; E716-T720 PolarHBondContact O-N 3.08Å; E716-T720 PolarHBondContact O-OG1 2.88Å
717I94.7Very high90.4Very high0 Ų044.9 Ų44.90%021%0.214CC..Hα-helixtrans-57.8-49.6171.2-66.9170.8000110.4V667 V690 F694 F713 F714 N719 T720 M721V667-I717 HydrophobicContact CB-CG1 4.26Å; V667-I717 HydrophobicContact CB-CG2 4.49Å; V667-I717 HydrophobicContact CG1-CG2 4.16Å; V667-I717 HydrophobicContact CG2-CD1 4.47Å; V667-I717 HydrophobicContact CG2-CG1 4.26Å; V667-I717 HydrophobicContact CG2-CG2 4.27Å; V690-I717 HydrophobicContact CG1-CD1 3.81Å; F694-I717 HydrophobicContact CD2-CD1 4.02Å; F694-I717 HydrophobicContact CE2-CD1 3.35Å; F694-I717 HydrophobicContact CZ-CD1 3.88Å; F713-I717 PolarHBondContact O-N 3.16Å; F714-I717 HydrophobicContact CD2-CB 4.43Å; F714-I717 HydrophobicContact CD2-CD1 4.36Å; F714-I717 HydrophobicContact CD2-CG2 4.44Å; F714-I717 WeakPolarHBondContact O-CB 3.44Å; F714-I717 PolarHBondContact O-N 3.44Å; I717-N719 VanDerWaalsContact C-N 3.3Å; I717-N719 PolarHBondContact O-N 3.39Å; I717-T720 CarbonylContact O-C 3.57Å; I717-T720 WeakPolarHBondContact O-CA 3.4Å; I717-T720 WeakPolarHBondContact O-CB 3.3Å; I717-T720 PolarHBondContact O-N 3.49Å; I717-M721 HydrophobicContact CG2-CE 4.25Å; I717-M721 WeakPolarHBondContact O-CG 3.26Å; I717-M721 PolarHBondContact O-N 3.09Å
718C92.3Very high90.7Very high1 Ų145.7 Ų45.71%0.00722%0.219CC..Hα-helixtrans-60-36.5178.6-66.40000113.5F714 K715 M721 R731F714-C718 PolarHBondContact O-N 3.17Å; F714-C718 PolarHBondContact O-SG 2.96Å; K715-C718 PolarHBondContact O-N 3.45Å; C718-M721 HydrophobicContact CB-CE 4.18Å; C718-R731 PolarHBondContact O-NH1 2.81Å
719N89.5Confident91Very high45 Ų4545 Ų4524%0.24122%0.216CC..Hα-helixtrans-68.6-41.6173.3-68.5-32.7000111.4K715 E716 I717 M721 N722K715-N719 VanDerWaalsContact O-CG 3.3Å; K715-N719 PolarHBondContact O-N 2.92Å; K715-N719 VanDerWaalsContact O-N 3.12Å; K715-N719 PolarHBondContact O-ND2 2.99Å; E716-N719 PolarHBondContact O-N 3.09Å; I717-N719 VanDerWaalsContact C-N 3.3Å; I717-N719 PolarHBondContact O-N 3.39Å; N719-M721 PolarHBondContact O-N 3.34Å; N719-N722 WeakPolarHBondContact O-CB 3.5Å; N719-N722 PolarHBondContact O-N 3.19Å; N719-N722 VanDerWaalsContact O-N 3.13Å
720T90.5Very high91.3Very high19 Ų1943.5 Ų43.512%0.11721%0.207CC..Hα-helixtrans-64.9-29.8178.3-58.50000112.1V667 E716 I717 N722 R723V667-T720 HydrophobicContact CG1-CG2 3.85Å; E716-T720 WeakPolarHBondContact O-CB 3.28Å; E716-T720 PolarHBondContact O-N 3.08Å; E716-T720 PolarHBondContact O-OG1 2.88Å; I717-T720 CarbonylContact O-C 3.57Å; I717-T720 WeakPolarHBondContact O-CA 3.4Å; I717-T720 WeakPolarHBondContact O-CB 3.3Å; I717-T720 PolarHBondContact O-N 3.49Å; T720-N722 PolarHBondContact O-N 2.65Å; T720-R723 VanDerWaalsContact CG2-CZ 3.41Å; T720-R723 VanDerWaalsContact O-CG 3.26Å; T720-R723 WeakPolarHBondContact O-CG 3.47Å; T720-R723 PolarHBondContact O-N 3.46Å; T720-R723 PolarHBondContact O-NE 3.13Å; T720-R723 VanDerWaalsContact O-NE 3.09Å
721M91.9Very high91.3Very high0 Ų043.5 Ų43.50%021%0.207CC..G310 helixtrans-65.9-12.6174.3-72.2-168.5-71.300113.9V687 I717 C718 N719 R723 L727 V728 R731V687-M721 HydrophobicContact CG1-CG 4.34Å; V687-M721 HydrophobicContact CG1-SD 3.88Å; I717-M721 HydrophobicContact CG2-CE 4.25Å; I717-M721 WeakPolarHBondContact O-CG 3.26Å; I717-M721 PolarHBondContact O-N 3.09Å; C718-M721 HydrophobicContact CB-CE 4.18Å; N719-M721 PolarHBondContact O-N 3.34Å; M721-R723 PolarHBondContact O-N 3.3Å; M721-L727 HydrophobicContact CB-CB 4Å; M721-L727 HydrophobicContact CG-CB 4.22Å; M721-L727 CarbonylContact O-C 3.57Å; M721-L727 WeakPolarHBondContact O-CB 3.34Å; M721-V728 WeakPolarHBondContact O-CG2 3.47Å; M721-V728 PolarHBondContact O-N 2.9Å; M721-R731 HydrophobicContact CE-CB 3.73Å; M721-R731 HydrophobicContact CE-CG 3.89Å; M721-R731 HydrophobicContact SD-CB 4.11Å
722N87.2Confident91.3Very high75 Ų7546 Ų4640%0.40122%0.216SC..G310 helixtrans-69.5-10.3173.1-76-21.9000114N719 T720 C724 R731N719-N722 WeakPolarHBondContact O-CB 3.5Å; N719-N722 PolarHBondContact O-N 3.19Å; N719-N722 VanDerWaalsContact O-N 3.13Å; T720-N722 PolarHBondContact O-N 2.65Å; N722-C724 VanDerWaalsContact C-N 3.28Å; N722-C724 PolarHBondContact O-N 3.37Å; N722-R731 PolarHBondContact OD1-NH1 3.47Å; N722-R731 PolarHBondContact OD1-NH2 2.87Å
723R86.6Confident91.5Very high106 Ų10642.3 Ų42.340%0.420%0.202SC..G310 helixtrans-61-30.6-175.6-73.2179.7-60.51725.4114.2V667 T668 L672 T720 M721V667-R723 PolarHBondContact O-NH2 3.5Å; T668-R723 PolarHBondContact O-NH1 2.97Å; L672-R723 HydrophobicContact CD1-CB 3.8Å; T720-R723 VanDerWaalsContact CG2-CZ 3.41Å; T720-R723 VanDerWaalsContact O-CG 3.26Å; T720-R723 WeakPolarHBondContact O-CG 3.47Å; T720-R723 PolarHBondContact O-N 3.46Å; T720-R723 PolarHBondContact O-NE 3.13Å; T720-R723 VanDerWaalsContact O-NE 3.09Å; M721-R723 PolarHBondContact O-N 3.3Å
724C87.1Confident91.5Very high31 Ų3142 Ų4221%0.20920%0.201CC..SBendtrans-152161.5178.572.40000112.9N722 Q726 L727 V728N722-C724 VanDerWaalsContact C-N 3.28Å; N722-C724 PolarHBondContact O-N 3.37Å; C724-Q726 PolarHBondContact O-N 3.07Å; C724-L727 PolarHBondContact O-N 3.16Å; C724-L727 VanDerWaalsContact SG-CG 3.56Å; C724-V728 WeakPolarHBondContact O-CG2 3.43Å; C724-V728 PolarHBondContact O-N 3.4Å; C724-V728 VanDerWaalsContact O-N 3.1Å
725H87.5Confident91.4Very high129 Ų12942 Ų4260%0.59720%0.201SC*.Hα-helixtrans-59.2-41.2-175.1-178.3-89.2000113.3V728 Q729H725-V728 WeakPolarHBondContact O-CB 3.45Å; H725-V728 PolarHBondContact O-N 3.41Å; H725-Q729 PolarHBondContact O-N 2.88Å
726Q90Very high91.5Very high95 Ų9542.2 Ų42.244%0.44420%0.2SC..Hα-helixtrans-66.4-37.9-179.1-67.789.7-29.100112.7F684 C724 Q729 I730F684-Q726 HydrophobicContact CD1-CB 4.27Å; F684-Q726 HydrophobicContact CD2-CB 4.31Å; F684-Q726 HydrophobicContact CE1-CB 3.68Å; F684-Q726 HydrophobicContact CE2-CB 3.71Å; F684-Q726 HydrophobicContact CE2-CG 3.76Å; F684-Q726 HydrophobicContact CZ-CB 3.37Å; F684-Q726 HydrophobicContact CZ-CG 3.73Å; C724-Q726 PolarHBondContact O-N 3.07Å; Q726-Q729 WeakPolarHBondContact O-CB 3.43Å; Q726-Q729 PolarHBondContact O-N 3.19Å; Q726-I730 WeakPolarHBondContact O-CG1 3.45Å; Q726-I730 PolarHBondContact O-N 3.08Å
727L92Very high91.6Very high1 Ų141.2 Ų41.21%0.00520%0.197CC..Hα-helixtrans-69.6-38.1174.7-69.9-178.3000111.6L672 F684 V687 M721 C724 Q729 I730 R731L672-L727 HydrophobicContact CD1-CD1 3.77Å; L672-L727 HydrophobicContact CD2-CD1 4.3Å; F684-L727 HydrophobicContact CD1-CD2 3.67Å; F684-L727 HydrophobicContact CD1-CG 4.18Å; F684-L727 HydrophobicContact CE1-CD2 4.04Å; F684-L727 HydrophobicContact CE1-CG 4.02Å; V687-L727 HydrophobicContact CB-CD2 4.06Å; V687-L727 HydrophobicContact CG1-CD2 4.05Å; V687-L727 HydrophobicContact CG2-CD2 3.79Å; M721-L727 HydrophobicContact CB-CB 4Å; M721-L727 HydrophobicContact CG-CB 4.22Å; M721-L727 CarbonylContact O-C 3.57Å; M721-L727 WeakPolarHBondContact O-CB 3.34Å; C724-L727 PolarHBondContact O-N 3.16Å; C724-L727 VanDerWaalsContact SG-CG 3.56Å; L727-Q729 VanDerWaalsContact C-N 3.25Å; L727-Q729 PolarHBondContact O-N 2.86Å; L727-I730 HydrophobicContact CD2-CD1 4.11Å; L727-I730 PolarHBondContact O-N 3.1Å; L727-R731 PolarHBondContact O-N 3.39Å; L727-R731 VanDerWaalsContact O-N 3.08Å
728V90.7Very high91.5Very high21 Ų2141.3 Ų41.313%0.12720%0.198CC..Hα-helixtrans-59.9-39.5169.9171.80000110.6M721 C724 H725 R731 K732M721-V728 WeakPolarHBondContact O-CG2 3.47Å; M721-V728 PolarHBondContact O-N 2.9Å; C724-V728 WeakPolarHBondContact O-CG2 3.43Å; C724-V728 PolarHBondContact O-N 3.4Å; C724-V728 VanDerWaalsContact O-N 3.1Å; H725-V728 WeakPolarHBondContact O-CB 3.45Å; H725-V728 PolarHBondContact O-N 3.41Å; V728-R731 WeakPolarHBondContact O-CB 3.31Å; V728-R731 PolarHBondContact O-N 3.17Å; V728-K732 HydrophobicContact CG1-CD 4.28Å; V728-K732 WeakPolarHBondContact O-CG 3.33Å; V728-K732 PolarHBondContact O-N 3.45Å
729Q92.9Very high91.5Very high67 Ų6741.3 Ų41.331%0.31320%0.197SC..Hα-helixtrans-64.7-45.2176.6-170.25940.300111.5H725 Q726 L727 R731 K732 D733H725-Q729 PolarHBondContact O-N 2.88Å; Q726-Q729 WeakPolarHBondContact O-CB 3.43Å; Q726-Q729 PolarHBondContact O-N 3.19Å; L727-Q729 VanDerWaalsContact C-N 3.25Å; L727-Q729 PolarHBondContact O-N 2.86Å; Q729-R731 VanDerWaalsContact C-N 3.27Å; Q729-R731 PolarHBondContact O-N 3.06Å; Q729-K732 CarbonylContact O-C 3.56Å; Q729-K732 WeakPolarHBondContact O-CA 3.23Å; Q729-K732 WeakPolarHBondContact O-CB 3.43Å; Q729-K732 PolarHBondContact O-N 3.16Å; Q729-D733 PolarHBondContact NE2-OD1 2.87Å; Q729-D733 PolarHBondContact O-N 3.3Å
730I94.8Very high91.6Very high3 Ų341.1 Ų41.12%0.01520%0.2CC..Hα-helixtrans-54.6-46174-69.8164.2000110.5F684 V687 R688 Q726 L727 K732 D733 Y734F684-I730 HydrophobicContact CB-CD1 4.08Å; F684-I730 HydrophobicContact CD1-CD1 4.41Å; F684-I730 HydrophobicContact CG-CD1 4.46Å; V687-I730 HydrophobicContact CG1-CD1 4.49Å; V687-I730 HydrophobicContact CG1-CG2 4.26Å; R688-I730 HydrophobicContact CG-CD1 4.1Å; R688-I730 HydrophobicContact CG-CG1 4.26Å; R688-I730 HydrophobicContact CG-CG2 4.19Å; Q726-I730 WeakPolarHBondContact O-CG1 3.45Å; Q726-I730 PolarHBondContact O-N 3.08Å; L727-I730 HydrophobicContact CD2-CD1 4.11Å; L727-I730 PolarHBondContact O-N 3.1Å; I730-K732 VanDerWaalsContact C-N 3.34Å; I730-K732 PolarHBondContact O-N 3.44Å; I730-D733 WeakPolarHBondContact O-CB 3.4Å; I730-D733 PolarHBondContact O-N 3.25Å; I730-Y734 HydrophobicContact CG2-CD2 4.02Å; I730-Y734 HydrophobicContact CG2-CE2 3.84Å; I730-Y734 VanDerWaalsContact O-CD2 3.29Å; I730-Y734 WeakPolarHBondContact O-CD2 3.5Å; I730-Y734 PolarHBondContact O-N 2.94Å; I730-Y734 VanDerWaalsContact O-N 3.12Å
731R92.1Very high91.6Very high1 Ų142.6 Ų42.60%0.00421%0.205CC..Hα-helixtrans-58.2-45.2175.8-174.5178.567.7-144.4-0.4112.4C718 M721 N722 L727 V728 Q729 D733 Y734 A735 L765 S768 E769C718-R731 PolarHBondContact O-NH1 2.81Å; M721-R731 HydrophobicContact CE-CB 3.73Å; M721-R731 HydrophobicContact CE-CG 3.89Å; M721-R731 HydrophobicContact SD-CB 4.11Å; N722-R731 PolarHBondContact OD1-NH1 3.47Å; N722-R731 PolarHBondContact OD1-NH2 2.87Å; L727-R731 PolarHBondContact O-N 3.39Å; L727-R731 VanDerWaalsContact O-N 3.08Å; V728-R731 WeakPolarHBondContact O-CB 3.31Å; V728-R731 PolarHBondContact O-N 3.17Å; Q729-R731 VanDerWaalsContact C-N 3.27Å; Q729-R731 PolarHBondContact O-N 3.06Å; R731-D733 VanDerWaalsContact C-N 3.34Å; R731-Y734 PolarHBondContact O-N 3.48Å; R731-A735 PolarHBondContact O-N 3.45Å; R731-L765 WeakPolarHBondContact CD-O 3.41Å; R731-L765 HydrophobicContact CG-CD2 3.74Å; R731-S768 PolarHBondContact NE-OG 2.87Å; R731-S768 PolarHBondContact NH1-OG 3.47Å; R731-E769 IonicContact CZ-OE1 3.84Å; R731-E769 IonicContact NH2-OE1 2.84Å; R731-E769 PolarHBondContact NH2-OE1 2.86Å
732K92.5Very high91.5Very high57 Ų5742.7 Ų42.725%0.24821%0.205CC..Hα-helixtrans-62-42.7176.7-73174.3179.4178.40111.1V728 Q729 I730 Y734 A735 Y736 L779V728-K732 HydrophobicContact CG1-CD 4.28Å; V728-K732 WeakPolarHBondContact O-CG 3.33Å; V728-K732 PolarHBondContact O-N 3.45Å; Q729-K732 CarbonylContact O-C 3.56Å; Q729-K732 WeakPolarHBondContact O-CA 3.23Å; Q729-K732 WeakPolarHBondContact O-CB 3.43Å; Q729-K732 PolarHBondContact O-N 3.16Å; I730-K732 VanDerWaalsContact C-N 3.34Å; I730-K732 PolarHBondContact O-N 3.44Å; K732-Y734 VanDerWaalsContact C-N 3.32Å; K732-Y734 PolarHBondContact O-N 3.35Å; K732-A735 WeakPolarHBondContact O-CB 3.24Å; K732-A735 PolarHBondContact O-N 3.35Å; K732-Y736 HydrophobicContact CB-CD2 4.25Å; K732-Y736 HydrophobicContact CB-CE2 4.21Å; K732-Y736 WeakPolarHBondContact O-CD2 3.41Å; K732-Y736 PolarHBondContact O-N 3.08Å; K732-L779 HydrophobicContact CG-CD1 4.24Å; K732-L779 HydrophobicContact CG-CD2 3.95Å
733D95.3Very high91.6Very high63 Ų6343.3 Ų43.334%0.33721%0.206SC..Hα-helixtrans-58.6-42.9179.1-61.4-20.5000110.7Q729 I730 R731 Y736 L737Q729-D733 PolarHBondContact NE2-OD1 2.87Å; Q729-D733 PolarHBondContact O-N 3.3Å; I730-D733 WeakPolarHBondContact O-CB 3.4Å; I730-D733 PolarHBondContact O-N 3.25Å; R731-D733 VanDerWaalsContact C-N 3.34Å; D733-Y736 PolarHBondContact O-N 2.8Å; D733-L737 WeakPolarHBondContact O-CB 3.3Å; D733-L737 PolarHBondContact O-N 3.4Å
734Y94.5Very high91.6Very high17 Ų1743.9 Ų43.97%0.06722%0.217CC..Hα-helixtrans-68-34.9174.5-79.9-85.2000113.3R688 C691 D692 L695 I730 R731 K732 L737 I738 M761R688-Y734 PolarHBondContact O-OH 3.04Å; R688-Y734 VanDerWaalsContact O-OH 3.12Å; C691-Y734 HydrophobicContact CB-CD2 3.95Å; C691-Y734 HydrophobicContact CB-CE1 3.99Å; C691-Y734 HydrophobicContact CB-CE2 3.31Å; C691-Y734 WeakPolarHBondContact CB-OH 3.15Å; D692-Y734 PolarHBondContact N-OH 3.03Å; D692-Y734 PolarHBondContact OD1-OH 3.48Å; L695-Y734 HydrophobicContact CD2-CD1 4.4Å; L695-Y734 HydrophobicContact CD2-CE1 4.19Å; I730-Y734 HydrophobicContact CG2-CD2 4.02Å; I730-Y734 HydrophobicContact CG2-CE2 3.84Å; I730-Y734 VanDerWaalsContact O-CD2 3.29Å; I730-Y734 WeakPolarHBondContact O-CD2 3.5Å; I730-Y734 PolarHBondContact O-N 2.94Å; I730-Y734 VanDerWaalsContact O-N 3.12Å; R731-Y734 PolarHBondContact O-N 3.48Å; K732-Y734 VanDerWaalsContact C-N 3.32Å; K732-Y734 PolarHBondContact O-N 3.35Å; Y734-L737 HydrophobicContact CD1-CD2 4.16Å; Y734-L737 HydrophobicContact CE1-CD2 4.41Å; Y734-I738 WeakPolarHBondContact O-CG1 3.5Å; Y734-I738 PolarHBondContact O-N 2.88Å; Y734-I738 VanDerWaalsContact O-N 3.11Å; Y734-M761 HydrophobicContact CD1-CE 4.05Å
735A92.6Very high91.2Very high0 Ų044 Ų440%022%0.223CC..Hα-helixtrans-65.8-43.5174.300000111.3R731 K732 I738 L739 L765 L779 F783R731-A735 PolarHBondContact O-N 3.45Å; K732-A735 WeakPolarHBondContact O-CB 3.24Å; K732-A735 PolarHBondContact O-N 3.35Å; A735-I738 PolarHBondContact O-N 2.97Å; A735-L739 PolarHBondContact O-N 2.85Å; A735-L765 HydrophobicContact CB-CD1 4.35Å; A735-L779 HydrophobicContact CB-CD1 4.18Å; A735-F783 HydrophobicContact CB-CD2 4.17Å; A735-F783 HydrophobicContact CB-CE2 4.28Å; A735-F783 WeakPolarHBondContact O-CE2 3.31Å
736Y94.9Very high90.3Very high72 Ų7242.5 Ų42.528%0.28222%0.216SC..Hα-helixtrans-71.5-34.2176.4-72.4-58.8000113K732 D733 I738 L739 S740 L779 D782K732-Y736 HydrophobicContact CB-CD2 4.25Å; K732-Y736 HydrophobicContact CB-CE2 4.21Å; K732-Y736 WeakPolarHBondContact O-CD2 3.41Å; K732-Y736 PolarHBondContact O-N 3.08Å; D733-Y736 PolarHBondContact O-N 2.8Å; Y736-I738 VanDerWaalsContact C-N 3.29Å; Y736-I738 PolarHBondContact O-N 3.32Å; Y736-L739 HydrophobicContact CD1-CD1 3.81Å; Y736-L739 HydrophobicContact CE1-CD1 4.16Å; Y736-L739 WeakPolarHBondContact O-CB 3.44Å; Y736-L739 PolarHBondContact O-N 3.34Å; Y736-L739 VanDerWaalsContact O-N 3.12Å; Y736-S740 PolarHBondContact O-N 3.26Å; Y736-S740 PolarHBondContact O-OG 3.49Å; Y736-L779 HydrophobicContact CE2-CD1 3.98Å; Y736-D782 WeakPolarHBondContact CE1-OD2 3.45Å; Y736-D782 PolarHBondContact OH-OD2 2.89Å
737L93.7Very high89.2Confident63 Ų6343.8 Ų43.833%0.3322%0.222SC..Hα-helixtrans-59.4-41.2172.1176.362.8000111L695 D733 Y734 L739 S740 K741L695-L737 HydrophobicContact CD2-CD2 4.33Å; D733-L737 WeakPolarHBondContact O-CB 3.3Å; D733-L737 PolarHBondContact O-N 3.4Å; Y734-L737 HydrophobicContact CD1-CD2 4.16Å; Y734-L737 HydrophobicContact CE1-CD2 4.41Å; L737-L739 VanDerWaalsContact C-N 3.35Å; L737-S740 PolarHBondContact O-OG 3.24Å; L737-S740 VanDerWaalsContact O-OG 3.05Å; L737-K741 HydrophobicContact CD1-CD 3.87Å; L737-K741 HydrophobicContact CD1-CG 4.27Å; L737-K741 HydrophobicContact CG-CD 4.01Å; L737-K741 WeakPolarHBondContact O-CB 2.69Å; L737-K741 WeakPolarHBondContact O-CD 3.36Å; L737-K741 WeakPolarHBondContact O-CG 3.46Å; L737-K741 PolarHBondContact O-N 3.16Å; L737-K741 VanDerWaalsContact O-N 3.15Å
738I92.2Very high87.5Confident2 Ų246.3 Ų46.31%0.0124%0.235CC..Hα-helixtrans-65.3-40.4174.8-69.9165000110.9Y734 A735 Y736 L742 F749 L758 M761 V762 L765 F783Y734-I738 WeakPolarHBondContact O-CG1 3.5Å; Y734-I738 PolarHBondContact O-N 2.88Å; Y734-I738 VanDerWaalsContact O-N 3.11Å; A735-I738 PolarHBondContact O-N 2.97Å; Y736-I738 VanDerWaalsContact C-N 3.29Å; Y736-I738 PolarHBondContact O-N 3.32Å; I738-L742 HydrophobicContact CG2-CD1 4.03Å; I738-L742 VanDerWaalsContact O-CG 3.3Å; I738-L742 WeakPolarHBondContact O-CG 3.41Å; I738-L742 PolarHBondContact O-N 3.04Å; I738-L742 VanDerWaalsContact O-N 3.16Å; I738-F749 HydrophobicContact CG1-CZ 4.42Å; I738-L758 HydrophobicContact CD1-CD1 3.87Å; I738-L758 HydrophobicContact CG1-CD1 4.03Å; I738-L758 HydrophobicContact CG2-CD1 3.88Å; I738-M761 HydrophobicContact CD1-SD 4.2Å; I738-V762 HydrophobicContact CD1-CG2 3.86Å; I738-V762 HydrophobicContact CG2-CG2 4.13Å; I738-L765 HydrophobicContact CD1-CD1 3.8Å; I738-F783 HydrophobicContact CG2-CZ 4.43Å
739L93.3Very high86.2Confident0 Ų045.6 Ų45.60%023%0.231CC..Hα-helixtrans-65.5-48.9178-73.2167.6000112.2A735 Y736 L737 K741 L742 E743 F783 R786 I787 I790A735-L739 PolarHBondContact O-N 2.85Å; Y736-L739 HydrophobicContact CD1-CD1 3.81Å; Y736-L739 HydrophobicContact CE1-CD1 4.16Å; Y736-L739 WeakPolarHBondContact O-CB 3.44Å; Y736-L739 PolarHBondContact O-N 3.34Å; Y736-L739 VanDerWaalsContact O-N 3.12Å; L737-L739 VanDerWaalsContact C-N 3.35Å; L739-K741 VanDerWaalsContact C-N 3.29Å; L739-K741 PolarHBondContact O-N 3.37Å; L739-L742 PolarHBondContact O-N 3Å; L739-L742 VanDerWaalsContact O-N 3.13Å; L739-E743 WeakPolarHBondContact O-CG 3.4Å; L739-E743 PolarHBondContact O-N 3.02Å; L739-F783 HydrophobicContact CD1-CD2 3.55Å; L739-F783 HydrophobicContact CD1-CE2 3.99Å; L739-F783 HydrophobicContact CD1-CG 4.26Å; L739-F783 HydrophobicContact CD2-CD2 4.09Å; L739-F783 HydrophobicContact CD2-CE2 4Å; L739-F783 HydrophobicContact CD2-CG 4.49Å; L739-F783 HydrophobicContact CD2-CZ 4.3Å; L739-F783 HydrophobicContact CG-CD2 3.76Å; L739-F783 HydrophobicContact CG-CE2 3.66Å; L739-F783 HydrophobicContact CG-CZ 4.4Å; L739-R786 HydrophobicContact CD1-CB 4.37Å; L739-R786 HydrophobicContact CD2-CB 3.98Å; L739-I787 HydrophobicContact CD2-CD1 3.64Å; L739-I787 HydrophobicContact CD2-CG1 3.73Å; L739-I790 HydrophobicContact CD2-CD1 3.82Å
740S92.4Very high84.8Confident42 Ų4247.4 Ų47.429%0.29424%0.235SC..Hα-helixtrans-59.1-45.1-179.8670000110.7Y736 L737 L742 E743 D744Y736-S740 PolarHBondContact O-N 3.26Å; Y736-S740 PolarHBondContact O-OG 3.49Å; L737-S740 PolarHBondContact O-OG 3.24Å; L737-S740 VanDerWaalsContact O-OG 3.05Å; S740-L742 VanDerWaalsContact C-N 3.29Å; S740-L742 PolarHBondContact O-N 2.89Å; S740-E743 WeakPolarHBondContact O-CB 2.99Å; S740-E743 PolarHBondContact O-N 2.97Å; S740-D744 WeakPolarHBondContact O-CB 3.31Å; S740-D744 PolarHBondContact O-N 3.1Å
741K89.8Confident82.8Confident50 Ų5050.5 Ų50.522%0.21725%0.25CS..Hα-helixtrans-57.1-37.2175.9-83-175.8155.8-145.30114.2L737 L739 E746 I748 F749L737-K741 HydrophobicContact CD1-CD 3.87Å; L737-K741 HydrophobicContact CD1-CG 4.27Å; L737-K741 HydrophobicContact CG-CD 4.01Å; L737-K741 WeakPolarHBondContact O-CB 2.69Å; L737-K741 WeakPolarHBondContact O-CD 3.36Å; L737-K741 WeakPolarHBondContact O-CG 3.46Å; L737-K741 PolarHBondContact O-N 3.16Å; L737-K741 VanDerWaalsContact O-N 3.15Å; L739-K741 VanDerWaalsContact C-N 3.29Å; L739-K741 PolarHBondContact O-N 3.37Å; K741-E746 PolarHBondContact O-N 3.26Å; K741-I748 HydrophobicContact CB-CD1 3.16Å; K741-I748 HydrophobicContact CB-CG1 4.46Å; K741-I748 HydrophobicContact CD-CD1 3.12Å; K741-I748 VanDerWaalsContact CE-CD1 3.48Å; K741-I748 HydrophobicContact CG-CD1 3.06Å; K741-F749 HydrophobicContact CB-CE2 4.29Å; K741-F749 HydrophobicContact CD-CZ 4.44Å
742L89.9Confident81.1Confident2 Ų252 Ų521%0.0126%0.259CS..Hα-helixtrans-79.4-32.7174.3-67.9168.5000112.4I738 L739 S740 G745 F749 I787 I790 V799 N802 I806I738-L742 HydrophobicContact CG2-CD1 4.03Å; I738-L742 VanDerWaalsContact O-CG 3.3Å; I738-L742 WeakPolarHBondContact O-CG 3.41Å; I738-L742 PolarHBondContact O-N 3.04Å; I738-L742 VanDerWaalsContact O-N 3.16Å; L739-L742 PolarHBondContact O-N 3Å; L739-L742 VanDerWaalsContact O-N 3.13Å; S740-L742 VanDerWaalsContact C-N 3.29Å; S740-L742 PolarHBondContact O-N 2.89Å; L742-G745 PolarHBondContact O-N 3.48Å; L742-F749 HydrophobicContact CD2-CD2 4.42Å; L742-I787 HydrophobicContact CD1-CD1 3.67Å; L742-I790 HydrophobicContact CB-CD1 4.45Å; L742-I790 HydrophobicContact CB-CG2 4.18Å; L742-V799 HydrophobicContact CB-CG1 4.46Å; L742-V799 HydrophobicContact CD2-CG1 4.31Å; L742-N802 HydrophobicContact CD2-CB 4.07Å; L742-I806 HydrophobicContact CD1-CD1 3.9Å
743E89.8Confident79Confident88 Ų8855.5 Ų55.541%0.41128%0.277SS..Hα-helixtrans-66.1-40.7175.3-76.7173.7164.900111.8L739 S740 G745 R786 I790L739-E743 WeakPolarHBondContact O-CG 3.4Å; L739-E743 PolarHBondContact O-N 3.02Å; S740-E743 WeakPolarHBondContact O-CB 2.99Å; S740-E743 PolarHBondContact O-N 2.97Å; E743-G745 PolarHBondContact O-N 3.26Å; E743-R786 IonicContact OE1-CZ 2.78Å; E743-R786 IonicContact OE1-NH1 2.82Å; E743-R786 PolarHBondContact OE1-NH1 2.85Å; E743-R786 IonicContact OE1-NH2 3.84Å; E743-R786 PolarHBondContact OE1-NH2 3.49Å; E743-R786 IonicContact OE2-CZ 3.27Å; E743-R786 IonicContact OE2-NH1 3.23Å; E743-R786 PolarHBondContact OE2-NH1 3.28Å; E743-R786 IonicContact OE2-NH2 3.42Å; E743-I790 HydrophobicContact CG-CD1 3.53Å; E743-I790 HydrophobicContact CG-CG1 3.59Å
744D85.9Confident76.7Confident118 Ų11862.7 Ų62.763%0.63130%0.3SS*.THydrogen-bonded Turntrans-71.5-5.5178.9-64.6-28.6000113S740 E746S740-D744 WeakPolarHBondContact O-CB 3.31Å; S740-D744 PolarHBondContact O-N 3.1Å; D744-E746 HydrophobicContact CB-CG 4.23Å; D744-E746 PolarHBondContact O-N 3.25Å
745G77.6Confident75Confident33 Ų3363.1 Ų63.134%0.3431%0.306SS..THydrogen-bonded Turntrans75.99.9179.800000114.2L742 E743 E747L742-G745 PolarHBondContact O-N 3.48Å; E743-G745 PolarHBondContact O-N 3.26Å; G745-E747 PolarHBondContact O-N 3.28Å
746E69.5Low73.7Confident98 Ų9863.4 Ų63.446%0.45831%0.308SS..  trans-67.7126.1-179.7-63.3-171.1164.600110.7K741 D744 I748K741-E746 PolarHBondContact O-N 3.26Å; D744-E746 HydrophobicContact CB-CG 4.23Å; D744-E746 PolarHBondContact O-N 3.25Å; E746-I748 HydrophobicContact CB-CD1 3.64Å; E746-I748 HydrophobicContact CB-CG1 3.21Å; E746-I748 HydrophobicContact CG-CD1 4.36Å; E746-I748 HydrophobicContact CG-CG1 4.25Å; E746-I748 PolarHBondContact O-N 3.35Å; E746-I748 WeakPolarHBondContact OE2-CD1 3.46Å; E746-I748 WeakPolarHBondContact OE2-CG1 3.33Å
747E66.2Low73Confident122 Ų12260.1 Ų60.157%0.5730%0.296SS*.  trans-79.750.5170.6-64.7-164.9161.200111.8G745 F749G745-E747 PolarHBondContact O-N 3.28Å; E747-F749 PolarHBondContact O-N 3.35Å; E747-F749 VanDerWaalsContact O-N 3.13Å
748I57.3Low72.7Confident54 Ų5457.3 Ų57.328%0.27728%0.281SS..  trans-65.9-20.5-174.3-39.9174.3000111.9K741 E746K741-I748 HydrophobicContact CB-CD1 3.16Å; K741-I748 HydrophobicContact CB-CG1 4.46Å; K741-I748 HydrophobicContact CD-CD1 3.12Å; K741-I748 VanDerWaalsContact CE-CD1 3.48Å; K741-I748 HydrophobicContact CG-CD1 3.06Å; E746-I748 HydrophobicContact CB-CD1 3.64Å; E746-I748 HydrophobicContact CB-CG1 3.21Å; E746-I748 HydrophobicContact CG-CD1 4.36Å; E746-I748 HydrophobicContact CG-CG1 4.25Å; E746-I748 PolarHBondContact O-N 3.35Å; E746-I748 WeakPolarHBondContact OE2-CD1 3.46Å; E746-I748 WeakPolarHBondContact OE2-CG1 3.33Å
749F63.6Low72.5Confident6 Ų657.3 Ų57.33%0.02628%0.282CS..SBendtrans-115.8121.2-167.9-54-75.5000109.7L695 T699 I738 K741 L742 E747 L751 L758L695-F749 HydrophobicContact CD1-CE1 4.35Å; T699-F749 HydrophobicContact CG2-CD1 3.28Å; T699-F749 HydrophobicContact CG2-CE1 3.28Å; I738-F749 HydrophobicContact CG1-CZ 4.42Å; K741-F749 HydrophobicContact CB-CE2 4.29Å; K741-F749 HydrophobicContact CD-CZ 4.44Å; L742-F749 HydrophobicContact CD2-CD2 4.42Å; E747-F749 PolarHBondContact O-N 3.35Å; E747-F749 VanDerWaalsContact O-N 3.13Å; F749-L751 PolarHBondContact O-N 2.94Å; F749-L758 HydrophobicContact CB-CD2 4.01Å; F749-L758 HydrophobicContact CD1-CB 4.16Å; F749-L758 HydrophobicContact CD1-CD1 3.97Å; F749-L758 HydrophobicContact CD1-CD2 3.97Å; F749-L758 HydrophobicContact CD1-CG 4.25Å; F749-L758 HydrophobicContact CD2-CD2 3.6Å; F749-L758 HydrophobicContact CE1-CD1 3.66Å; F749-L758 HydrophobicContact CE1-CD2 4.31Å; F749-L758 HydrophobicContact CE1-CG 4.42Å; F749-L758 HydrophobicContact CE2-CD1 4.34Å; F749-L758 HydrophobicContact CE2-CD2 3.96Å; F749-L758 HydrophobicContact CG-CB 4.41Å; F749-L758 HydrophobicContact CG-CD1 4.44Å; F749-L758 HydrophobicContact CG-CD2 3.6Å; F749-L758 HydrophobicContact CG-CG 4.36Å; F749-L758 HydrophobicContact CZ-CD1 3.87Å; F749-L758 HydrophobicContact CZ-CD2 4.31Å
750R62.4Low72.2Confident105 Ų10557.9 Ų57.940%0.39628%0.284SS..  trans-53.1131.9-179.8-72.4-173.9178.8-170.1-0.9111.2Q620 S700 N752Q620-R750 VanDerWaalsContact CD-NH2 3.31Å; S700-R750 PolarHBondContact O-NH1 3.27Å; R750-N752 PolarHBondContact O-N 3.02Å; R750-N752 PolarHBondContact O-OD1 3.46Å
751L54.3Low72.1Confident67 Ų6755.9 Ų55.935%0.35127%0.27SS..  trans-82.3107.2177.2-67.4165.2000110.4F749 G798 V801F749-L751 PolarHBondContact O-N 2.94Å; L751-G798 WeakPolarHBondContact CD2-O 3.47Å; L751-V801 HydrophobicContact CD2-CB 3.93Å; L751-V801 HydrophobicContact CD2-CG1 3.86Å
752N54.9Low72.1Confident34 Ų3453.6 Ų53.618%0.18226%0.26CS..  trans-120.2130.6169.719.330.2000110.5N702 R750 R754 G756N702-N752 PolarHBondContact OD1-ND2 3.02Å; R750-N752 PolarHBondContact O-N 3.02Å; R750-N752 PolarHBondContact O-OD1 3.46Å; N752-R754 PolarHBondContact O-N 3.22Å; N752-G756 WeakPolarHBondContact OD1-CA 3.47Å; N752-G756 PolarHBondContact OD1-N 3.17Å
753M49Very low72Confident129 Ų12953.7 Ų53.764%0.63526%0.262SS*.SBendtrans-58.5-17.6-178.5-58-178.3-152.400114.4W840M753-W840 HydrophobicContact CE-CH2 3.72Å; M753-W840 HydrophobicContact CE-CZ3 3.83Å; M753-W840 HydrophobicContact CG-CH2 4.39Å; M753-W840 HydrophobicContact CG-CZ3 4.33Å; M753-W840 HydrophobicContact SD-CH2 3.42Å; M753-W840 WeakPolarHBondContact SD-CH2 3.3Å; M753-W840 HydrophobicContact SD-CZ3 3.83Å
754R48Very low72Confident214 Ų21449.5 Ų49.581%0.80824%0.242SC*.SBendtrans-124.382.3-174.3-64.7-179.2180178.70.8109N752N752-R754 PolarHBondContact O-N 3.22Å
755S56.8Low72.2Confident27 Ų2744 Ų4419%0.18921%0.212CC..  trans42.689.9172.961.70000114.9F707F707-S755 WeakPolarHBondContact CZ-O 3.36Å
756G66.2Low72.7Confident5 Ų542.6 Ų42.65%0.05220%0.197CC..  trans-58.3168.2169.300000113.3N752 L758 P759N752-G756 WeakPolarHBondContact OD1-CA 3.47Å; N752-G756 PolarHBondContact OD1-N 3.17Å; G756-L758 VanDerWaalsContact C-N 3.27Å; G756-L758 PolarHBondContact O-N 3.29Å; G756-P759 VanDerWaalsContact O-CD 3.24Å; G756-P759 WeakPolarHBondContact O-CD 3.17Å
757G81.4Confident73.2Confident3 Ų339.1 Ų39.13%0.03118%0.181CC..Hα-helixtrans-67.3-25.3178.100000113.5F698 F760 M761F698-G757 VanDerWaalsContact CD1-O 3.25Å; F698-G757 WeakPolarHBondContact CD1-O 3.33Å; F698-G757 CarbonylContact O-C 3.5Å; F698-G757 WeakPolarHBondContact O-CA 3.42Å; G757-F760 WeakPolarHBondContact O-CA 3.38Å; G757-F760 WeakPolarHBondContact O-CB 3.4Å; G757-F760 PolarHBondContact O-N 2.7Å; G757-M761 PolarHBondContact O-N 3.15Å
758L86.7Confident73.4Confident4 Ų433.6 Ų33.62%0.02116%0.156CC..Hα-helixtrans-55.9-52.7177.6174.368.6000113.2I738 F749 G756 F760 M761 V762 N802 I806I738-L758 HydrophobicContact CD1-CD1 3.87Å; I738-L758 HydrophobicContact CG1-CD1 4.03Å; I738-L758 HydrophobicContact CG2-CD1 3.88Å; F749-L758 HydrophobicContact CB-CD2 4.01Å; F749-L758 HydrophobicContact CD1-CB 4.16Å; F749-L758 HydrophobicContact CD1-CD1 3.97Å; F749-L758 HydrophobicContact CD1-CD2 3.97Å; F749-L758 HydrophobicContact CD1-CG 4.25Å; F749-L758 HydrophobicContact CD2-CD2 3.6Å; F749-L758 HydrophobicContact CE1-CD1 3.66Å; F749-L758 HydrophobicContact CE1-CD2 4.31Å; F749-L758 HydrophobicContact CE1-CG 4.42Å; F749-L758 HydrophobicContact CE2-CD1 4.34Å; F749-L758 HydrophobicContact CE2-CD2 3.96Å; F749-L758 HydrophobicContact CG-CB 4.41Å; F749-L758 HydrophobicContact CG-CD1 4.44Å; F749-L758 HydrophobicContact CG-CD2 3.6Å; F749-L758 HydrophobicContact CG-CG 4.36Å; F749-L758 HydrophobicContact CZ-CD1 3.87Å; F749-L758 HydrophobicContact CZ-CD2 4.31Å; G756-L758 VanDerWaalsContact C-N 3.27Å; G756-L758 PolarHBondContact O-N 3.29Å; L758-F760 PolarHBondContact O-N 3.35Å; L758-M761 WeakPolarHBondContact O-CB 3.39Å; L758-M761 PolarHBondContact O-N 3.45Å; L758-M761 VanDerWaalsContact O-N 3.07Å; L758-V762 HydrophobicContact CD1-CG2 4.19Å; L758-V762 PolarHBondContact O-N 2.95Å; L758-N802 HydrophobicContact CD2-CB 4.46Å; L758-I806 HydrophobicContact CD2-CD1 3.88Å; L758-I806 HydrophobicContact CD2-CG1 4.47Å; L758-I806 HydrophobicContact CG-CD1 4.19Å; L758-I806 HydrophobicContact CG-CG1 4.45Å
759P87.7Confident74Confident2 Ų233 Ų331%0.01315%0.152CC..Hα-helixtrans-51.5-37.7172.5-27.125.6000114.2G756 A763 N805 I806 K809G756-P759 VanDerWaalsContact O-CD 3.24Å; G756-P759 WeakPolarHBondContact O-CD 3.17Å; P759-A763 VanDerWaalsContact O-CB 3.31Å; P759-A763 WeakPolarHBondContact O-CB 3.48Å; P759-A763 PolarHBondContact O-N 3.24Å; P759-N805 HydrophobicContact CG-CB 3.82Å; P759-I806 HydrophobicContact CG-CG1 4.29Å; P759-K809 HydrophobicContact CB-CB 3.54Å; P759-K809 HydrophobicContact CB-CG 3.83Å; P759-K809 WeakPolarHBondContact O-CG 3.44Å
760F86.9Confident74Confident13 Ų1333.9 Ų33.96%0.05716%0.158CC..Hα-helixtrans-66.4-43.8176.6-80.6-101.6000112F698 F707 E708 G757 L758 A763 C764 K809F698-F760 HydrophobicContact CD1-CB 4.13Å; F698-F760 HydrophobicContact CE1-CB 3.81Å; F707-F760 HydrophobicContact CD2-CD1 4.3Å; F707-F760 AromaticContact CD2-CD2 3.64Å; F707-F760 HydrophobicContact CD2-CD2 3.64Å; F707-F760 HydrophobicContact CD2-CE1 4.07Å; F707-F760 AromaticContact CD2-CE2 3.4Å; F707-F760 HydrophobicContact CD2-CE2 3.4Å; F707-F760 HydrophobicContact CD2-CG 4.08Å; F707-F760 AromaticContact CD2-CZ 3.6Å; F707-F760 HydrophobicContact CD2-CZ 3.6Å; F707-F760 AromaticContact CE2-CD2 3.9Å; F707-F760 HydrophobicContact CE2-CD2 3.9Å; F707-F760 HydrophobicContact CE2-CE1 4.4Å; F707-F760 AromaticContact CE2-CE2 3.23Å; F707-F760 HydrophobicContact CE2-CE2 3.23Å; F707-F760 AromaticContact CE2-CZ 3.51Å; F707-F760 HydrophobicContact CE2-CZ 3.51Å; F707-F760 HydrophobicContact CG-CD2 4.49Å; F707-F760 HydrophobicContact CZ-CE2 4.28Å; E708-F760 HydrophobicContact CG-CE1 3.72Å; E708-F760 HydrophobicContact CG-CZ 3.8Å; G757-F760 WeakPolarHBondContact O-CA 3.38Å; G757-F760 WeakPolarHBondContact O-CB 3.4Å; G757-F760 PolarHBondContact O-N 2.7Å; L758-F760 PolarHBondContact O-N 3.35Å; F760-A763 PolarHBondContact O-N 3.45Å; F760-C764 PolarHBondContact O-N 2.79Å; F760-C764 VanDerWaalsContact O-N 3.09Å; F760-C764 PolarHBondContact O-SG 3.38Å; F760-K809 VanDerWaalsContact CE2-NZ 3.29Å
761M89.8Confident73.9Confident0 Ų035.5 Ų35.50%017%0.168CC..Hα-helixtrans-60.2-50.7176.7-169.5-179.4178.800111.3L695 F698 F714 Y734 I738 G757 L758 A763 C764 L765L695-M761 HydrophobicContact CB-CE 3.96Å; L695-M761 HydrophobicContact CB-SD 4.28Å; L695-M761 HydrophobicContact CD1-CE 3.9Å; L695-M761 HydrophobicContact CD1-SD 3.55Å; L695-M761 VanDerWaalsContact CD1-SD 3.55Å; F698-M761 HydrophobicContact CB-CB 4.12Å; F698-M761 HydrophobicContact CB-SD 4.49Å; F698-M761 HydrophobicContact CD1-CB 4.4Å; F698-M761 HydrophobicContact CD2-CB 3.53Å; F698-M761 HydrophobicContact CD2-CG 3.66Å; F698-M761 HydrophobicContact CD2-SD 4.04Å; F698-M761 HydrophobicContact CE2-CB 4.01Å; F698-M761 HydrophobicContact CE2-CG 4.07Å; F698-M761 HydrophobicContact CG-CB 3.78Å; F698-M761 HydrophobicContact CG-CG 4.37Å; F714-M761 HydrophobicContact CD1-CG 4.26Å; F714-M761 HydrophobicContact CE1-CE 4.2Å; F714-M761 HydrophobicContact CE1-CG 3.67Å; F714-M761 HydrophobicContact CZ-CE 3.96Å; F714-M761 HydrophobicContact CZ-CG 4.37Å; Y734-M761 HydrophobicContact CD1-CE 4.05Å; I738-M761 HydrophobicContact CD1-SD 4.2Å; G757-M761 PolarHBondContact O-N 3.15Å; L758-M761 WeakPolarHBondContact O-CB 3.39Å; L758-M761 PolarHBondContact O-N 3.45Å; L758-M761 VanDerWaalsContact O-N 3.07Å; M761-A763 VanDerWaalsContact C-N 3.31Å; M761-A763 PolarHBondContact O-N 3.06Å; M761-C764 WeakPolarHBondContact O-CB 3.45Å; M761-C764 PolarHBondContact O-N 3.26Å; M761-L765 HydrophobicContact CE-CD1 4.42Å; M761-L765 HydrophobicContact CG-CD1 4.31Å; M761-L765 WeakPolarHBondContact O-CG 3.23Å; M761-L765 PolarHBondContact O-N 2.99Å
762V90.3Very high73.8Confident1 Ų137.9 Ų37.91%0.00618%0.181CC..Hα-helixtrans-57.3-45.7178.11720000110.8I738 L758 C764 L765 L766 F783 I806 I810I738-V762 HydrophobicContact CD1-CG2 3.86Å; I738-V762 HydrophobicContact CG2-CG2 4.13Å; L758-V762 HydrophobicContact CD1-CG2 4.19Å; L758-V762 PolarHBondContact O-N 2.95Å; V762-C764 PolarHBondContact O-N 3.15Å; V762-L765 PolarHBondContact O-N 3.06Å; V762-L766 HydrophobicContact CG1-CD1 3.7Å; V762-L766 HydrophobicContact CG1-CG 4.21Å; V762-L766 WeakPolarHBondContact O-CB 3.43Å; V762-L766 VanDerWaalsContact O-CG 3.3Å; V762-L766 WeakPolarHBondContact O-CG 3.42Å; V762-L766 PolarHBondContact O-N 3.33Å; V762-F783 HydrophobicContact CB-CZ 4.35Å; V762-F783 HydrophobicContact CG1-CD1 4.29Å; V762-F783 HydrophobicContact CG1-CE1 3.4Å; V762-F783 HydrophobicContact CG1-CE2 4.38Å; V762-F783 HydrophobicContact CG1-CZ 3.46Å; V762-F783 VanDerWaalsContact CG1-CZ 3.46Å; V762-F783 HydrophobicContact CG2-CZ 3.89Å; V762-I806 HydrophobicContact CB-CG2 4.4Å; V762-I806 HydrophobicContact CG1-CG2 3.84Å; V762-I806 HydrophobicContact CG2-CD1 4.3Å; V762-I806 HydrophobicContact CG2-CG1 4.34Å; V762-I810 HydrophobicContact CG1-CD1 4.38Å
763A88Confident73.7Confident5 Ų546.3 Ų46.34%0.04121%0.21CC..Hα-helixtrans-60.1-34.5178.100000112.6P759 F760 M761 H767 K809 F813P759-A763 VanDerWaalsContact O-CB 3.31Å; P759-A763 WeakPolarHBondContact O-CB 3.48Å; P759-A763 PolarHBondContact O-N 3.24Å; F760-A763 PolarHBondContact O-N 3.45Å; M761-A763 VanDerWaalsContact C-N 3.31Å; M761-A763 PolarHBondContact O-N 3.06Å; A763-H767 VanDerWaalsContact O-CB 3.3Å; A763-H767 WeakPolarHBondContact O-CB 3.4Å; A763-H767 PolarHBondContact O-N 2.75Å; A763-K809 HydrophobicContact CB-CG 3.97Å; A763-F813 HydrophobicContact CB-CB 4.11Å; A763-F813 HydrophobicContact CB-CD1 3.69Å; A763-F813 HydrophobicContact CB-CD2 4.47Å; A763-F813 HydrophobicContact CB-CE1 4.14Å; A763-F813 HydrophobicContact CB-CG 3.86Å
764C89.6Confident73.7Confident0 Ų049.2 Ų49.20%022%0.222CC..Hα-helixtrans-72.3-45.6175-63.40000112.3G711 F714 K715 F760 M761 V762 L766 H767G711-C764 PolarHBondContact O-SG 3.11Å; G711-C764 VanDerWaalsContact O-SG 3.41Å; F714-C764 HydrophobicContact CD1-CB 3.57Å; F714-C764 HydrophobicContact CE1-CB 4.18Å; K715-C764 HydrophobicContact CB-CB 4.46Å; F760-C764 PolarHBondContact O-N 2.79Å; F760-C764 VanDerWaalsContact O-N 3.09Å; F760-C764 PolarHBondContact O-SG 3.38Å; M761-C764 WeakPolarHBondContact O-CB 3.45Å; M761-C764 PolarHBondContact O-N 3.26Å; V762-C764 PolarHBondContact O-N 3.15Å; C764-L766 PolarHBondContact O-N 3.42Å; C764-H767 PolarHBondContact O-N 3.27Å
765L90.7Very high73.5Confident1 Ų142.1 Ų42.11%0.00521%0.209CC..Hα-helixtrans-56.5-37.7176.5-69.7171.9000111.8F714 R731 A735 I738 M761 V762F714-L765 HydrophobicContact CE1-CD2 3.92Å; F714-L765 HydrophobicContact CE1-CG 4.05Å; F714-L765 HydrophobicContact CZ-CD2 3.91Å; R731-L765 WeakPolarHBondContact CD-O 3.41Å; R731-L765 HydrophobicContact CG-CD2 3.74Å; A735-L765 HydrophobicContact CB-CD1 4.35Å; I738-L765 HydrophobicContact CD1-CD1 3.8Å; M761-L765 HydrophobicContact CE-CD1 4.42Å; M761-L765 HydrophobicContact CG-CD1 4.31Å; M761-L765 WeakPolarHBondContact O-CG 3.23Å; M761-L765 PolarHBondContact O-N 2.99Å; V762-L765 PolarHBondContact O-N 3.06Å
766L87.1Confident73.1Confident4 Ų446.5 Ų46.52%0.02124%0.238CC..Hα-helixtrans-85.8-21.9-178.9-64.2-177.8000113.6V762 C764 S768 E769 L779 F780 F783 I810V762-L766 HydrophobicContact CG1-CD1 3.7Å; V762-L766 HydrophobicContact CG1-CG 4.21Å; V762-L766 WeakPolarHBondContact O-CB 3.43Å; V762-L766 VanDerWaalsContact O-CG 3.3Å; V762-L766 WeakPolarHBondContact O-CG 3.42Å; V762-L766 PolarHBondContact O-N 3.33Å; C764-L766 PolarHBondContact O-N 3.42Å; L766-S768 PolarHBondContact O-N 3.39Å; L766-E769 PolarHBondContact O-N 3.32Å; L766-L779 HydrophobicContact CD2-CD2 4.4Å; L766-L779 HydrophobicContact CD2-CG 4.25Å; L766-F780 HydrophobicContact CB-CD2 4.06Å; L766-F780 HydrophobicContact CD1-CD2 3.9Å; L766-F780 HydrophobicContact CD1-CE2 4.16Å; L766-F780 HydrophobicContact CD2-CD2 4.42Å; L766-F780 HydrophobicContact CG-CD2 4.34Å; L766-F783 HydrophobicContact CD1-CD1 3.83Å; L766-F783 HydrophobicContact CD1-CE1 4.22Å; L766-F783 HydrophobicContact CD1-CG 4.25Å; L766-F783 HydrophobicContact CD2-CB 4.26Å; L766-F783 HydrophobicContact CD2-CG 4.27Å; L766-I810 HydrophobicContact CD1-CD1 3.93Å; L766-I810 HydrophobicContact CD1-CG1 4.28Å
767H80.3Confident73.1Confident25 Ų2547 Ų4712%0.11624%0.241CC..Hα-helixtrans-61.9-40.1-172.1-179.875000114.1K715 A763 C764 E769 V770 F813K715-H767 WeakPolarHBondContact CE-CD2 3.13Å; K715-H767 VanDerWaalsContact CE-CE1 3.45Å; K715-H767 WeakPolarHBondContact CE-CE1 3.32Å; K715-H767 WeakPolarHBondContact CE-NE2 3.37Å; A763-H767 VanDerWaalsContact O-CB 3.3Å; A763-H767 WeakPolarHBondContact O-CB 3.4Å; A763-H767 PolarHBondContact O-N 2.75Å; C764-H767 PolarHBondContact O-N 3.27Å; H767-E769 VanDerWaalsContact C-N 3.28Å; H767-E769 PolarHBondContact O-N 2.96Å; H767-V770 PolarHBondContact O-N 3.44Å; H767-F813 HydrophobicContact CB-CE1 4.47Å
768S71.2Confident72.9Confident7 Ų754 Ų545%0.04927%0.271CS..Hα-helixtrans-67.1-24.7-173.545.10000114R731 L766R731-S768 PolarHBondContact NE-OG 2.87Å; R731-S768 PolarHBondContact NH1-OG 3.47Å; L766-S768 PolarHBondContact O-N 3.39Å
769E69.2Low72.8Confident40 Ų4054.1 Ų54.119%0.18727%0.272CS..Hα-helixtrans-76.9-25.8175.8-65.5-79156.100111.9R731 L766 H767 L779R731-E769 IonicContact CZ-OE1 3.84Å; R731-E769 IonicContact NH2-OE1 2.84Å; R731-E769 PolarHBondContact NH2-OE1 2.86Å; L766-E769 PolarHBondContact O-N 3.32Å; H767-E769 VanDerWaalsContact C-N 3.28Å; H767-E769 PolarHBondContact O-N 2.96Å; E769-L779 HydrophobicContact CG-CD2 4.46Å
770V63.1Low72.7Confident26 Ų2654.2 Ų54.216%0.15827%0.272CS..Hα-helixtrans-80.1-25.1-171.4171.50000113.5H767 D772 L816H767-V770 PolarHBondContact O-N 3.44Å; V770-D772 PolarHBondContact O-N 2.78Å; V770-L816 HydrophobicContact CB-CD2 3.93Å; V770-L816 HydrophobicContact CB-CG 4.3Å; V770-L816 HydrophobicContact CG1-CB 4.44Å; V770-L816 HydrophobicContact CG1-CD2 3.47Å; V770-L816 VanDerWaalsContact CG1-CD2 3.47Å; V770-L816 HydrophobicContact CG1-CG 3.61Å; V770-L816 HydrophobicContact CG2-CD1 4.24Å; V770-L816 HydrophobicContact CG2-CD2 3.25Å; V770-L816 HydrophobicContact CG2-CG 3.73Å
771K59.7Low72.6Confident139 Ų13956 Ų5660%0.60428%0.28SS*.THydrogen-bonded Turntrans-62.1-26.6-178.8-83.7-175.7174.2178.50112.2
772D53.8Low72.6Confident117 Ų11757.8 Ų57.863%0.62629%0.289SS*.  trans-93.897.7-178.6-134-22.5000110.5V770 Q774V770-D772 PolarHBondContact O-N 2.78Å; D772-Q774 PolarHBondContact O-N 3.07Å; D772-Q774 VanDerWaalsContact O-N 3.1Å
773R51.3Low72.7Confident211 Ų21157.8 Ų57.880%0.79629%0.289SS*.THydrogen-bonded Turntrans-64.4-15.9-170.7-75-177.3175179.5-1.1114.7
774Q49.9Very low72.8Confident190 Ų19057.5 Ų57.589%0.88829%0.287SS*.THydrogen-bonded Turntrans-110.3-17.6-163.4-95.9166.9-24.500115.5D772D772-Q774 PolarHBondContact O-N 3.07Å; D772-Q774 VanDerWaalsContact O-N 3.1Å
775A44.8Very low73Confident64 Ų6461 Ų6153%0.52931%0.306SS..SBendtrans-120110.3-174.500000111.2S777A775-S777 PolarHBondContact O-N 2.83Å
776C46.7Very low73.2Confident119 Ų11965.2 Ų65.280%0.80432%0.322SS*.  trans9.491.6159.1-59.90000117F778C776-F778 PolarHBondContact O-N 2.94Å
777S66.1Low73.6Confident17 Ų1765 Ų6512%0.11932%0.321CS..  trans-74.864.2165.273.30000110.2A775 L779 F780 F781A775-S777 PolarHBondContact O-N 2.83Å; S777-L779 VanDerWaalsContact C-N 3.28Å; S777-L779 PolarHBondContact O-N 3.47Å; S777-F780 PolarHBondContact O-N 2.98Å; S777-F780 VanDerWaalsContact O-N 3.14Å; S777-F780 WeakPolarHBondContact OG-CB 3.34Å; S777-F781 WeakPolarHBondContact O-CD2 3.38Å; S777-F781 PolarHBondContact O-N 3.5Å; S777-F781 WeakPolarHBondContact OG-CD2 3.49Å; S777-F781 WeakPolarHBondContact OG-CE2 3.32Å
778F77.7Confident74.3Confident150 Ų15064.2 Ų64.266%0.65832%0.317SS*.Hα-helixtrans-54.7-47.8-179.4177.9-93.4000109.9C776 F780 F781 D782C776-F778 PolarHBondContact O-N 2.94Å; F778-F780 PolarHBondContact O-N 3.35Å; F778-F781 PolarHBondContact O-N 3.01Å; F778-D782 HydrophobicContact CD1-CB 4.45Å; F778-D782 HydrophobicContact CE1-CB 4.25Å; F778-D782 WeakPolarHBondContact O-CB 3.19Å; F778-D782 PolarHBondContact O-N 2.98Å
779L84.7Confident75.4Confident5 Ų567.1 Ų67.13%0.02633%0.334CS..Hα-helixtrans-56.3-46.9176.3179.266.9000112.2K732 A735 Y736 L766 E769 S777 F783K732-L779 HydrophobicContact CG-CD1 4.24Å; K732-L779 HydrophobicContact CG-CD2 3.95Å; A735-L779 HydrophobicContact CB-CD1 4.18Å; Y736-L779 HydrophobicContact CE2-CD1 3.98Å; L766-L779 HydrophobicContact CD2-CD2 4.4Å; L766-L779 HydrophobicContact CD2-CG 4.25Å; E769-L779 HydrophobicContact CG-CD2 4.46Å; S777-L779 VanDerWaalsContact C-N 3.28Å; S777-L779 PolarHBondContact O-N 3.47Å; L779-F783 WeakPolarHBondContact O-CB 3.34Å; L779-F783 PolarHBondContact O-N 3.33Å
780F85.6Confident76.7Confident4 Ų465.8 Ų65.82%0.01833%0.328CS..Hα-helixtrans-62.8-48.7-177.7174.2-98.9000111.9L766 S777 F778 F783 V784 I810 L816 F819L766-F780 HydrophobicContact CB-CD2 4.06Å; L766-F780 HydrophobicContact CD1-CD2 3.9Å; L766-F780 HydrophobicContact CD1-CE2 4.16Å; L766-F780 HydrophobicContact CD2-CD2 4.42Å; L766-F780 HydrophobicContact CG-CD2 4.34Å; S777-F780 PolarHBondContact O-N 2.98Å; S777-F780 VanDerWaalsContact O-N 3.14Å; S777-F780 WeakPolarHBondContact OG-CB 3.34Å; F778-F780 PolarHBondContact O-N 3.35Å; F780-F783 PolarHBondContact O-N 3.02Å; F780-V784 HydrophobicContact CE1-CG2 4.12Å; F780-V784 HydrophobicContact CE2-CG2 4.04Å; F780-V784 HydrophobicContact CZ-CG2 3.76Å; F780-V784 VanDerWaalsContact O-CG2 3.3Å; F780-V784 WeakPolarHBondContact O-CG2 3.28Å; F780-V784 PolarHBondContact O-N 3.33Å; F780-I810 HydrophobicContact CE2-CG2 3.91Å; F780-I810 HydrophobicContact CZ-CG2 3.91Å; F780-L816 HydrophobicContact CD1-CD2 4.28Å; F780-L816 HydrophobicContact CD2-CD1 4.29Å; F780-L816 HydrophobicContact CE1-CD1 3.96Å; F780-L816 HydrophobicContact CE1-CD2 3.98Å; F780-L816 HydrophobicContact CE2-CD1 3.4Å; F780-L816 HydrophobicContact CE2-CD2 4.4Å; F780-L816 HydrophobicContact CZ-CD1 3.22Å; F780-L816 HydrophobicContact CZ-CD2 4.08Å; F780-L816 HydrophobicContact CZ-CG 4.31Å; F780-F819 AromaticContact CE1-CE1 3.97Å; F780-F819 HydrophobicContact CE1-CE1 3.97Å; F780-F819 HydrophobicContact CE1-CZ 4.15Å; F780-F819 AromaticContact CZ-CE1 3.82Å; F780-F819 HydrophobicContact CZ-CE1 3.82Å; F780-F819 AromaticContact CZ-CZ 3.64Å; F780-F819 HydrophobicContact CZ-CZ 3.64Å
781F85.8Confident78.1Confident50 Ų5064.6 Ų64.622%0.21932%0.321CS..Hα-helixtrans-73.7-38.2-177.2-70.7-46000112.6S777 F778 V784 N785 R823S777-F781 WeakPolarHBondContact O-CD2 3.38Å; S777-F781 PolarHBondContact O-N 3.5Å; S777-F781 WeakPolarHBondContact OG-CD2 3.49Å; S777-F781 WeakPolarHBondContact OG-CE2 3.32Å; F778-F781 PolarHBondContact O-N 3.01Å; F781-V784 PolarHBondContact O-N 2.79Å; F781-N785 WeakPolarHBondContact O-CB 3.46Å; F781-N785 PolarHBondContact O-N 2.99Å; F781-N785 PolarHBondContact O-ND2 3.24Å; F781-R823 VanDerWaalsContact CB-NH1 3.25Å
782D89.8Confident79.7Confident38 Ų3863.6 Ų63.620%0.20332%0.317CS..Hα-helixtrans-59.2-48.4171-177.849000110.6Y736 F778 V784 N785 R786Y736-D782 WeakPolarHBondContact CE1-OD2 3.45Å; Y736-D782 PolarHBondContact OH-OD2 2.89Å; F778-D782 HydrophobicContact CD1-CB 4.45Å; F778-D782 HydrophobicContact CE1-CB 4.25Å; F778-D782 WeakPolarHBondContact O-CB 3.19Å; F778-D782 PolarHBondContact O-N 2.98Å; D782-V784 PolarHBondContact O-N 3.27Å; D782-N785 PolarHBondContact O-N 2.79Å; D782-R786 WeakPolarHBondContact O-CB 3.28Å; D782-R786 WeakPolarHBondContact O-CG 3.25Å; D782-R786 PolarHBondContact O-N 3.34Å
783F91.9Very high81.6Confident1 Ų167.7 Ų67.70%0.00432%0.324CS..Hα-helixtrans-59.8-47.4177.3-171.7-78.6000112.2A735 I738 L739 V762 L766 L779 F780 N785 R786 I787 I806 I810A735-F783 HydrophobicContact CB-CD2 4.17Å; A735-F783 HydrophobicContact CB-CE2 4.28Å; A735-F783 WeakPolarHBondContact O-CE2 3.31Å; I738-F783 HydrophobicContact CG2-CZ 4.43Å; L739-F783 HydrophobicContact CD1-CD2 3.55Å; L739-F783 HydrophobicContact CD1-CE2 3.99Å; L739-F783 HydrophobicContact CD1-CG 4.26Å; L739-F783 HydrophobicContact CD2-CD2 4.09Å; L739-F783 HydrophobicContact CD2-CE2 4Å; L739-F783 HydrophobicContact CD2-CG 4.49Å; L739-F783 HydrophobicContact CD2-CZ 4.3Å; L739-F783 HydrophobicContact CG-CD2 3.76Å; L739-F783 HydrophobicContact CG-CE2 3.66Å; L739-F783 HydrophobicContact CG-CZ 4.4Å; V762-F783 HydrophobicContact CB-CZ 4.35Å; V762-F783 HydrophobicContact CG1-CD1 4.29Å; V762-F783 HydrophobicContact CG1-CE1 3.4Å; V762-F783 HydrophobicContact CG1-CE2 4.38Å; V762-F783 HydrophobicContact CG1-CZ 3.46Å; V762-F783 VanDerWaalsContact CG1-CZ 3.46Å; V762-F783 HydrophobicContact CG2-CZ 3.89Å; L766-F783 HydrophobicContact CD1-CD1 3.83Å; L766-F783 HydrophobicContact CD1-CE1 4.22Å; L766-F783 HydrophobicContact CD1-CG 4.25Å; L766-F783 HydrophobicContact CD2-CB 4.26Å; L766-F783 HydrophobicContact CD2-CG 4.27Å; L779-F783 WeakPolarHBondContact O-CB 3.34Å; L779-F783 PolarHBondContact O-N 3.33Å; F780-F783 PolarHBondContact O-N 3.02Å; F783-N785 PolarHBondContact O-N 3.25Å; F783-R786 PolarHBondContact O-N 2.94Å; F783-I787 HydrophobicContact CD1-CG1 3.85Å; F783-I787 HydrophobicContact CE1-CD1 4.14Å; F783-I787 HydrophobicContact CE1-CG1 3.47Å; F783-I787 VanDerWaalsContact CE1-CG1 3.47Å; F783-I787 HydrophobicContact CZ-CD1 4.25Å; F783-I787 HydrophobicContact CZ-CG1 4.03Å; F783-I787 WeakPolarHBondContact O-CB 2.92Å; F783-I787 WeakPolarHBondContact O-CG1 3.44Å; F783-I787 PolarHBondContact O-N 3.43Å; F783-I806 HydrophobicContact CE1-CG2 3.96Å; F783-I810 HydrophobicContact CD1-CD1 4.5Å; F783-I810 HydrophobicContact CE1-CD1 4.44Å
784V90.6Very high83.5Confident0 Ų058.5 Ų58.50%029%0.292CS..Hα-helixtrans-61.4-44.3177.2169.20000111.1F780 F781 D782 I787 L788 I810F780-V784 HydrophobicContact CE1-CG2 4.12Å; F780-V784 HydrophobicContact CE2-CG2 4.04Å; F780-V784 HydrophobicContact CZ-CG2 3.76Å; F780-V784 VanDerWaalsContact O-CG2 3.3Å; F780-V784 WeakPolarHBondContact O-CG2 3.28Å; F780-V784 PolarHBondContact O-N 3.33Å; F781-V784 PolarHBondContact O-N 2.79Å; D782-V784 PolarHBondContact O-N 3.27Å; V784-I787 PolarHBondContact O-N 2.95Å; V784-L788 HydrophobicContact CG1-CD1 4.05Å; V784-L788 WeakPolarHBondContact O-CB 3.45Å; V784-L788 VanDerWaalsContact O-CG 3.29Å; V784-L788 WeakPolarHBondContact O-CG 3.44Å; V784-L788 PolarHBondContact O-N 3Å; V784-I810 HydrophobicContact CG2-CD1 4.22Å
785N92.9Very high85.2Confident73 Ų7356 Ų5639%0.3929%0.29SS..Hα-helixtrans-65.2-44.1179.7-73.4-19000111.8F781 D782 F783 L788 V789F781-N785 WeakPolarHBondContact O-CB 3.46Å; F781-N785 PolarHBondContact O-N 2.99Å; F781-N785 PolarHBondContact O-ND2 3.24Å; D782-N785 PolarHBondContact O-N 2.79Å; F783-N785 PolarHBondContact O-N 3.25Å; N785-L788 PolarHBondContact O-N 3.25Å; N785-V789 WeakPolarHBondContact O-CG2 3.5Å; N785-V789 PolarHBondContact O-N 3.24Å
786R95.5Very high87.1Confident90 Ų9055.2 Ų55.234%0.3428%0.279SS..Hα-helixtrans-64.4-44.7176.7-70.2-178.3118.3-121.4-8.3111.2L739 E743 D782 F783 L788 V789 I790L739-R786 HydrophobicContact CD1-CB 4.37Å; L739-R786 HydrophobicContact CD2-CB 3.98Å; E743-R786 IonicContact OE1-CZ 2.78Å; E743-R786 IonicContact OE1-NH1 2.82Å; E743-R786 PolarHBondContact OE1-NH1 2.85Å; E743-R786 IonicContact OE1-NH2 3.84Å; E743-R786 PolarHBondContact OE1-NH2 3.49Å; E743-R786 IonicContact OE2-CZ 3.27Å; E743-R786 IonicContact OE2-NH1 3.23Å; E743-R786 PolarHBondContact OE2-NH1 3.28Å; E743-R786 IonicContact OE2-NH2 3.42Å; D782-R786 WeakPolarHBondContact O-CB 3.28Å; D782-R786 WeakPolarHBondContact O-CG 3.25Å; D782-R786 PolarHBondContact O-N 3.34Å; F783-R786 PolarHBondContact O-N 2.94Å; R786-L788 VanDerWaalsContact C-N 3.33Å; R786-L788 PolarHBondContact O-N 3.48Å; R786-V789 PolarHBondContact O-N 2.84Å; R786-V789 VanDerWaalsContact O-N 3.09Å; R786-I790 WeakPolarHBondContact O-CD1 3.2Å; R786-I790 WeakPolarHBondContact O-CG1 3.37Å; R786-I790 PolarHBondContact O-N 3.28Å
787I94.5Very high89.1Confident0 Ų051.4 Ų51.40%025%0.254CS..Hα-helixtrans-58.8-41.6173.7-73.8-65.2000112.2L739 L742 F783 V784 V789 I790 A791 C803 I806 L807L739-I787 HydrophobicContact CD2-CD1 3.64Å; L739-I787 HydrophobicContact CD2-CG1 3.73Å; L742-I787 HydrophobicContact CD1-CD1 3.67Å; F783-I787 HydrophobicContact CD1-CG1 3.85Å; F783-I787 HydrophobicContact CE1-CD1 4.14Å; F783-I787 HydrophobicContact CE1-CG1 3.47Å; F783-I787 VanDerWaalsContact CE1-CG1 3.47Å; F783-I787 HydrophobicContact CZ-CD1 4.25Å; F783-I787 HydrophobicContact CZ-CG1 4.03Å; F783-I787 WeakPolarHBondContact O-CB 2.92Å; F783-I787 WeakPolarHBondContact O-CG1 3.44Å; F783-I787 PolarHBondContact O-N 3.43Å; V784-I787 PolarHBondContact O-N 2.95Å; I787-V789 VanDerWaalsContact C-N 3.3Å; I787-V789 PolarHBondContact O-N 3.05Å; I787-I790 HydrophobicContact CD1-CD1 4.35Å; I787-I790 PolarHBondContact O-N 3.05Å; I787-A791 WeakPolarHBondContact O-CB 3.37Å; I787-A791 PolarHBondContact O-N 3.06Å; I787-C803 HydrophobicContact CG2-CB 4.09Å; I787-I806 HydrophobicContact CD1-CD1 4.27Å; I787-L807 HydrophobicContact CG2-CD1 3.99Å; I787-L807 HydrophobicContact CG2-CD2 3.78Å; I787-L807 HydrophobicContact CG2-CG 3.68Å
788L95.2Very high90Very high8 Ų850.6 Ų50.64%0.04225%0.248CC..Hα-helixtrans-62.6-37.4176.1-76.1170.2000112.1V784 N785 R786 K792 L807 M827 L830V784-L788 HydrophobicContact CG1-CD1 4.05Å; V784-L788 WeakPolarHBondContact O-CB 3.45Å; V784-L788 VanDerWaalsContact O-CG 3.29Å; V784-L788 WeakPolarHBondContact O-CG 3.44Å; V784-L788 PolarHBondContact O-N 3Å; N785-L788 PolarHBondContact O-N 3.25Å; R786-L788 VanDerWaalsContact C-N 3.33Å; R786-L788 PolarHBondContact O-N 3.48Å; L788-K792 VanDerWaalsContact O-CG 3.24Å; L788-K792 WeakPolarHBondContact O-CG 3.3Å; L788-K792 PolarHBondContact O-N 3.46Å; L788-L807 HydrophobicContact CD2-CD1 3.87Å; L788-L807 HydrophobicContact CD2-CD2 4.45Å; L788-L807 HydrophobicContact CG-CD2 4.5Å; L788-M827 HydrophobicContact CD1-CG 4.22Å; L788-M827 HydrophobicContact CD2-CG 3.93Å; L788-L830 HydrophobicContact CD2-CD2 3.69Å
789V95.6Very high90.6Very high67 Ų6743.6 Ų43.641%0.40622%0.218SC..Hα-helixtrans-70-45175.9172.20000111N785 R786 I787 K792 R793N785-V789 WeakPolarHBondContact O-CG2 3.5Å; N785-V789 PolarHBondContact O-N 3.24Å; R786-V789 PolarHBondContact O-N 2.84Å; R786-V789 VanDerWaalsContact O-N 3.09Å; I787-V789 VanDerWaalsContact C-N 3.3Å; I787-V789 PolarHBondContact O-N 3.05Å; V789-K792 PolarHBondContact O-N 3.29Å; V789-R793 WeakPolarHBondContact O-CG 3.41Å; V789-R793 PolarHBondContact O-N 3.03Å; V789-R793 VanDerWaalsContact O-N 3.07Å
790I94.6Very high90.8Very high12 Ų1245.3 Ų45.36%0.06223%0.225CC..Hα-helixtrans-59.3-50.1177.6-64.6160.7000109.9L739 L742 E743 R786 I787 K792 R793 A794 V799L739-I790 HydrophobicContact CD2-CD1 3.82Å; L742-I790 HydrophobicContact CB-CD1 4.45Å; L742-I790 HydrophobicContact CB-CG2 4.18Å; E743-I790 HydrophobicContact CG-CD1 3.53Å; E743-I790 HydrophobicContact CG-CG1 3.59Å; R786-I790 WeakPolarHBondContact O-CD1 3.2Å; R786-I790 WeakPolarHBondContact O-CG1 3.37Å; R786-I790 PolarHBondContact O-N 3.28Å; I787-I790 HydrophobicContact CD1-CD1 4.35Å; I787-I790 PolarHBondContact O-N 3.05Å; I790-K792 VanDerWaalsContact C-N 3.27Å; I790-K792 PolarHBondContact O-N 3.08Å; I790-R793 PolarHBondContact O-N 3.45Å; I790-R793 VanDerWaalsContact O-N 3.09Å; I790-A794 VanDerWaalsContact O-CB 3.26Å; I790-A794 WeakPolarHBondContact O-CB 3.26Å; I790-A794 PolarHBondContact O-N 3.36Å; I790-V799 HydrophobicContact CG2-CG1 3.93Å
791A93.7Very high91Very high1 Ų145.4 Ų45.41%0.00823%0.226CC..Hα-helixtrans-57.2-39.9179.600000112.9I787 C803 L830I787-A791 WeakPolarHBondContact O-CB 3.37Å; I787-A791 PolarHBondContact O-N 3.06Å; A791-C803 HydrophobicContact CB-CB 3.71Å; A791-L830 HydrophobicContact CB-CD1 4.15Å; A791-L830 HydrophobicContact CB-CD2 3.67Å
792K93.7Very high91.2Very high118 Ų11843.3 Ų43.351%0.51322%0.217SC..Hα-helixtrans-70.3-32.1178.3-73.7174.1-177.3178.40113.3L788 V789 I790 L830L788-K792 VanDerWaalsContact O-CG 3.24Å; L788-K792 WeakPolarHBondContact O-CG 3.3Å; L788-K792 PolarHBondContact O-N 3.46Å; V789-K792 PolarHBondContact O-N 3.29Å; I790-K792 VanDerWaalsContact C-N 3.27Å; I790-K792 PolarHBondContact O-N 3.08Å; K792-L830 HydrophobicContact CG-CD1 3.9Å
793R93.6Very high91.4Very high204 Ų20441.5 Ų41.577%0.7721%0.207SC*.Hα-helixtrans-94.9-19.3-176.5-70.2-178175.7-179.8-1.5113.5V789 I790 T795V789-R793 WeakPolarHBondContact O-CG 3.41Å; V789-R793 PolarHBondContact O-N 3.03Å; V789-R793 VanDerWaalsContact O-N 3.07Å; I790-R793 PolarHBondContact O-N 3.45Å; I790-R793 VanDerWaalsContact O-N 3.09Å; R793-T795 PolarHBondContact O-N 3.18Å
794A90.1Very high91.4Very high17 Ų1741.5 Ų41.514%0.1421%0.207CC..  trans-58.6128.2-176.200000110.9I790 V799 K800I790-A794 VanDerWaalsContact O-CB 3.26Å; I790-A794 WeakPolarHBondContact O-CB 3.26Å; I790-A794 PolarHBondContact O-N 3.36Å; A794-V799 HydrophobicContact CB-CB 4.16Å; A794-V799 HydrophobicContact CB-CG1 3.82Å; A794-K800 HydrophobicContact CB-CG 3.65Å; A794-K800 WeakPolarHBondContact O-CE 3.28Å
795T85.3Confident91.4Very high137 Ų13741.8 Ų41.884%0.8421%0.209SC*.  trans-93.1-27.2176.151.60000111.9R793R793-T795 PolarHBondContact O-N 3.18Å
796T86.6Confident91.4Very high48 Ų4838.3 Ų38.329%0.29419%0.191SC..SBendtrans-87133.7177.857.70000111.4G798 V799 K800T796-G798 PolarHBondContact O-N 2.91Å; T796-V799 PolarHBondContact O-N 3.27Å; T796-V799 WeakPolarHBondContact OG1-CB 3.4Å; T796-V799 WeakPolarHBondContact OG1-CG2 3.4Å; T796-K800 PolarHBondContact O-N 3.15Å
797S87.4Confident91.2Very high39 Ų3934 Ų3427%0.27317%0.174SC..Hα-helixtrans-60.3-34.8177.8-61.10000112.6K800 V801 D839S797-K800 PolarHBondContact O-N 3Å; S797-V801 WeakPolarHBondContact O-CB 3.36Å; S797-V801 VanDerWaalsContact O-CG2 3.26Å; S797-V801 WeakPolarHBondContact O-CG2 3.28Å; S797-V801 PolarHBondContact O-N 3.14Å; S797-D839 WeakPolarHBondContact CB-OD2 3.39Å; S797-D839 PolarHBondContact OG-OD2 3.27Å
798G85.6Confident91Very high1 Ų134.6 Ų34.61%0.0118%0.177CC..Hα-helixtrans-61.8-47.118000000113.3L751 T796 V801 N802L751-G798 WeakPolarHBondContact CD2-O 3.47Å; T796-G798 PolarHBondContact O-N 2.91Å; G798-V801 PolarHBondContact O-N 3Å; G798-N802 PolarHBondContact O-N 3.5Å; G798-N802 PolarHBondContact O-ND2 2.88Å
799V89.3Confident90.7Very high3 Ų335.5 Ų35.52%0.01818%0.181CC..Hα-helixtrans-63.3-44.6177.3174.80000110.6L742 I790 A794 T796 V801 N802 C803L742-V799 HydrophobicContact CB-CG1 4.46Å; L742-V799 HydrophobicContact CD2-CG1 4.31Å; I790-V799 HydrophobicContact CG2-CG1 3.93Å; A794-V799 HydrophobicContact CB-CB 4.16Å; A794-V799 HydrophobicContact CB-CG1 3.82Å; T796-V799 PolarHBondContact O-N 3.27Å; T796-V799 WeakPolarHBondContact OG1-CB 3.4Å; T796-V799 WeakPolarHBondContact OG1-CG2 3.4Å; V799-V801 PolarHBondContact O-N 2.97Å; V799-N802 PolarHBondContact O-N 3.04Å; V799-C803 PolarHBondContact O-N 3.31Å; V799-C803 PolarHBondContact O-SG 2.83Å
800K90.5Very high90.3Very high40 Ų4032.6 Ų32.617%0.17416%0.163CC..Hα-helixtrans-56.7-49.6175.6-76.8-169.1177.2-159.10112.5A794 T796 S797 N802 C803 L804 E834 V842A794-K800 HydrophobicContact CB-CG 3.65Å; A794-K800 WeakPolarHBondContact O-CE 3.28Å; T796-K800 PolarHBondContact O-N 3.15Å; S797-K800 PolarHBondContact O-N 3Å; K800-N802 VanDerWaalsContact C-N 3.3Å; K800-N802 PolarHBondContact O-N 3.35Å; K800-C803 PolarHBondContact O-N 3.1Å; K800-L804 VanDerWaalsContact O-CG 3.28Å; K800-L804 WeakPolarHBondContact O-CG 3.42Å; K800-L804 PolarHBondContact O-N 2.89Å; K800-E834 WeakPolarHBondContact CD-OE2 3.43Å; K800-E834 IonicContact NZ-OE1 3.48Å; K800-E834 PolarHBondContact NZ-OE1 3.44Å; K800-E834 IonicContact NZ-OE2 3.45Å; K800-E834 PolarHBondContact NZ-OE2 2.87Å; K800-V842 HydrophobicContact CB-CG2 4.18Å; K800-V842 HydrophobicContact CD-CG1 4.27Å; K800-V842 HydrophobicContact CD-CG2 4.37Å
801V90Very high89.9Confident7 Ų732.1 Ų32.14%0.04216%0.161CC..Hα-helixtrans-59-43.4179.3168.30000110.9L751 S797 G798 V799 L804 N805 M841 V842 A845L751-V801 HydrophobicContact CD2-CB 3.93Å; L751-V801 HydrophobicContact CD2-CG1 3.86Å; S797-V801 WeakPolarHBondContact O-CB 3.36Å; S797-V801 VanDerWaalsContact O-CG2 3.26Å; S797-V801 WeakPolarHBondContact O-CG2 3.28Å; S797-V801 PolarHBondContact O-N 3.14Å; G798-V801 PolarHBondContact O-N 3Å; V799-V801 PolarHBondContact O-N 2.97Å; V801-L804 PolarHBondContact O-N 3.37Å; V801-N805 WeakPolarHBondContact O-CB 3.38Å; V801-N805 VanDerWaalsContact O-CG 3.24Å; V801-N805 PolarHBondContact O-N 3.01Å; V801-N805 PolarHBondContact O-ND2 3.27Å; V801-M841 HydrophobicContact CG2-CB 3.89Å; V801-V842 HydrophobicContact CG2-CG2 4.07Å; V801-A845 HydrophobicContact CB-CB 4.47Å; V801-A845 HydrophobicContact CG1-CB 4.2Å; V801-A845 HydrophobicContact CG2-CB 4.33Å
802N89.6Confident89.5Confident5 Ų537.1 Ų37.13%0.02718%0.179CC..Hα-helixtrans-62.7-46.7176.5-80.2-39.6000112.3L742 L758 G798 V799 K800 L804 N805 I806L742-N802 HydrophobicContact CD2-CB 4.07Å; L758-N802 HydrophobicContact CD2-CB 4.46Å; G798-N802 PolarHBondContact O-N 3.5Å; G798-N802 PolarHBondContact O-ND2 2.88Å; V799-N802 PolarHBondContact O-N 3.04Å; K800-N802 VanDerWaalsContact C-N 3.3Å; K800-N802 PolarHBondContact O-N 3.35Å; N802-L804 PolarHBondContact O-N 3.28Å; N802-N805 PolarHBondContact O-N 3.47Å; N802-I806 VanDerWaalsContact O-CG1 3.27Å; N802-I806 WeakPolarHBondContact O-CG1 3.43Å; N802-I806 PolarHBondContact O-N 3Å
803C92.4Very high88.4Confident0 Ų034.8 Ų34.80%017%0.169CC..Hα-helixtrans-59.9-45.4176.5-66.90000112.2I787 A791 V799 K800 N805 I806 L807I787-C803 HydrophobicContact CG2-CB 4.09Å; A791-C803 HydrophobicContact CB-CB 3.71Å; V799-C803 PolarHBondContact O-N 3.31Å; V799-C803 PolarHBondContact O-SG 2.83Å; K800-C803 PolarHBondContact O-N 3.1Å; C803-N805 PolarHBondContact O-N 2.81Å; C803-I806 PolarHBondContact O-N 3.41Å; C803-L807 WeakPolarHBondContact O-CG 3.48Å; C803-L807 PolarHBondContact O-N 3.39Å
804L93.4Very high86.5Confident1 Ų125.8 Ų25.81%0.00514%0.138CC..Hα-helixtrans-63.4-41.6178.3-68171.2000111.8K800 V801 N802 L807 D808 L830 E834 V842 A845 A846 F849K800-L804 VanDerWaalsContact O-CG 3.28Å; K800-L804 WeakPolarHBondContact O-CG 3.42Å; K800-L804 PolarHBondContact O-N 2.89Å; V801-L804 PolarHBondContact O-N 3.37Å; N802-L804 PolarHBondContact O-N 3.28Å; L804-L807 PolarHBondContact O-N 3.46Å; L804-D808 WeakPolarHBondContact O-CB 3.36Å; L804-D808 PolarHBondContact O-N 2.84Å; L804-L830 HydrophobicContact CD2-CD2 4.18Å; L804-L830 HydrophobicContact CD2-CG 4.22Å; L804-E834 HydrophobicContact CD1-CB 4.19Å; L804-E834 HydrophobicContact CD1-CG 4.43Å; L804-V842 HydrophobicContact CD1-CG1 4.19Å; L804-A845 HydrophobicContact CB-CB 3.89Å; L804-A845 HydrophobicContact CD1-CB 3.97Å; L804-A846 HydrophobicContact CD1-CB 4.13Å; L804-F849 HydrophobicContact CD2-CD1 3.78Å; L804-F849 HydrophobicContact CD2-CE1 4.26Å
805N90.9Very high84.8Confident7 Ų731.9 Ų31.94%0.03717%0.169CC..Hα-helixtrans-67-35.9176.4-75.5-27.5000112.8P759 V801 N802 C803 K809P759-N805 HydrophobicContact CG-CB 3.82Å; V801-N805 WeakPolarHBondContact O-CB 3.38Å; V801-N805 VanDerWaalsContact O-CG 3.24Å; V801-N805 PolarHBondContact O-N 3.01Å; V801-N805 PolarHBondContact O-ND2 3.27Å; N802-N805 PolarHBondContact O-N 3.47Å; C803-N805 PolarHBondContact O-N 2.81Å; N805-K809 WeakPolarHBondContact O-CB 3.49Å; N805-K809 PolarHBondContact O-N 2.83Å
806I91.2Very high83.2Confident0 Ų026.4 Ų26.40%013%0.134CC..Hα-helixtrans-62.8-48.5172.6-72.8165000110L742 L758 P759 V762 F783 I787 N802 C803 K809 I810L742-I806 HydrophobicContact CD1-CD1 3.9Å; L758-I806 HydrophobicContact CD2-CD1 3.88Å; L758-I806 HydrophobicContact CD2-CG1 4.47Å; L758-I806 HydrophobicContact CG-CD1 4.19Å; L758-I806 HydrophobicContact CG-CG1 4.45Å; P759-I806 HydrophobicContact CG-CG1 4.29Å; V762-I806 HydrophobicContact CB-CG2 4.4Å; V762-I806 HydrophobicContact CG1-CG2 3.84Å; V762-I806 HydrophobicContact CG2-CD1 4.3Å; V762-I806 HydrophobicContact CG2-CG1 4.34Å; F783-I806 HydrophobicContact CE1-CG2 3.96Å; I787-I806 HydrophobicContact CD1-CD1 4.27Å; N802-I806 VanDerWaalsContact O-CG1 3.27Å; N802-I806 WeakPolarHBondContact O-CG1 3.43Å; N802-I806 PolarHBondContact O-N 3Å; C803-I806 PolarHBondContact O-N 3.41Å; I806-K809 PolarHBondContact O-N 3.2Å; I806-I810 HydrophobicContact CG2-CD1 3.73Å; I806-I810 HydrophobicContact CG2-CG1 4.4Å; I806-I810 WeakPolarHBondContact O-CB 3.4Å; I806-I810 VanDerWaalsContact O-CG1 3.29Å; I806-I810 WeakPolarHBondContact O-CG1 3.23Å; I806-I810 PolarHBondContact O-N 2.81Å
807L92.4Very high81.5Confident0 Ų029.2 Ų29.20%015%0.151CC..Hα-helixtrans-64-40.7178.7-66.8169.8000112.1I787 L788 C803 L804 K809 I810 L811 M827 L830 F849I787-L807 HydrophobicContact CG2-CD1 3.99Å; I787-L807 HydrophobicContact CG2-CD2 3.78Å; I787-L807 HydrophobicContact CG2-CG 3.68Å; L788-L807 HydrophobicContact CD2-CD1 3.87Å; L788-L807 HydrophobicContact CD2-CD2 4.45Å; L788-L807 HydrophobicContact CG-CD2 4.5Å; C803-L807 WeakPolarHBondContact O-CG 3.48Å; C803-L807 PolarHBondContact O-N 3.39Å; L804-L807 PolarHBondContact O-N 3.46Å; L807-K809 VanDerWaalsContact C-N 3.33Å; L807-K809 PolarHBondContact O-N 3.35Å; L807-I810 PolarHBondContact O-N 3.03Å; L807-L811 WeakPolarHBondContact O-CG 3.42Å; L807-L811 PolarHBondContact O-N 3.12Å; L807-M827 HydrophobicContact CB-CE 4.44Å; L807-M827 HydrophobicContact CD2-CE 4.26Å; L807-L830 HydrophobicContact CD1-CD2 3.78Å; L807-F849 HydrophobicContact CB-CD2 3.78Å; L807-F849 HydrophobicContact CB-CE2 3.38Å; L807-F849 HydrophobicContact CB-CZ 3.78Å; L807-F849 HydrophobicContact CD1-CE1 4.27Å; L807-F849 HydrophobicContact CD1-CE2 4.41Å; L807-F849 HydrophobicContact CD1-CZ 3.94Å; L807-F849 HydrophobicContact CG-CE2 4.45Å; L807-F849 HydrophobicContact CG-CZ 4.44Å
808D90.8Very high80Confident11 Ų1131.2 Ų31.26%0.05916%0.164CC..Hα-helixtrans-54-50.2170.6172.181.3000111L804 I810 L811 R812 L848 F849 A852L804-D808 WeakPolarHBondContact O-CB 3.36Å; L804-D808 PolarHBondContact O-N 2.84Å; D808-I810 PolarHBondContact O-N 3.22Å; D808-L811 WeakPolarHBondContact O-CB 3.29Å; D808-L811 PolarHBondContact O-N 3.11Å; D808-R812 WeakPolarHBondContact O-CG 3.4Å; D808-R812 PolarHBondContact O-N 2.93Å; D808-R812 IonicContact OD1-CZ 3.11Å; D808-R812 VanDerWaalsContact OD1-CZ 3.25Å; D808-R812 IonicContact OD1-NE 2.7Å; D808-R812 PolarHBondContact OD1-NE 2.94Å; D808-R812 IonicContact OD1-NH2 2.67Å; D808-R812 PolarHBondContact OD1-NH2 3.24Å; D808-R812 WeakPolarHBondContact OD2-CD 3.44Å; D808-R812 IonicContact OD2-CZ 3.35Å; D808-R812 IonicContact OD2-NE 2.7Å; D808-R812 PolarHBondContact OD2-NE 3.15Å; D808-R812 IonicContact OD2-NH2 3.6Å; D808-L848 VanDerWaalsContact OD1-C 3.22Å; D808-F849 HydrophobicContact CB-CB 4.2Å; D808-F849 HydrophobicContact CB-CD2 4.42Å; D808-A852 VanDerWaalsContact OD1-CB 3.26Å; D808-A852 WeakPolarHBondContact OD1-CB 3.45Å
809K88Confident79.2Confident27 Ų2732.5 Ų32.512%0.11717%0.17CC..Hα-helixtrans-66.7-41.1-177.9-170.265.6169.2-169.60112.3P759 F760 A763 N805 I806 L807 L811 R812 F813P759-K809 HydrophobicContact CB-CB 3.54Å; P759-K809 HydrophobicContact CB-CG 3.83Å; P759-K809 WeakPolarHBondContact O-CG 3.44Å; F760-K809 VanDerWaalsContact CE2-NZ 3.29Å; A763-K809 HydrophobicContact CB-CG 3.97Å; N805-K809 WeakPolarHBondContact O-CB 3.49Å; N805-K809 PolarHBondContact O-N 2.83Å; I806-K809 PolarHBondContact O-N 3.2Å; L807-K809 VanDerWaalsContact C-N 3.33Å; L807-K809 PolarHBondContact O-N 3.35Å; K809-L811 VanDerWaalsContact C-N 3.27Å; K809-L811 PolarHBondContact O-N 3.03Å; K809-R812 PolarHBondContact O-N 3.4Å; K809-R812 VanDerWaalsContact O-N 3.09Å; K809-F813 VanDerWaalsContact O-CB 3.26Å; K809-F813 WeakPolarHBondContact O-CB 3.22Å; K809-F813 PolarHBondContact O-N 3.34Å
810I87.7Confident78.6Confident6 Ų635.4 Ų35.43%0.03119%0.185CC..Hα-helixtrans-56.9-44173.9-73.3169.8000110.2V762 L766 F780 F783 V784 I806 L807 D808 R812 F819V762-I810 HydrophobicContact CG1-CD1 4.38Å; L766-I810 HydrophobicContact CD1-CD1 3.93Å; L766-I810 HydrophobicContact CD1-CG1 4.28Å; F780-I810 HydrophobicContact CE2-CG2 3.91Å; F780-I810 HydrophobicContact CZ-CG2 3.91Å; F783-I810 HydrophobicContact CD1-CD1 4.5Å; F783-I810 HydrophobicContact CE1-CD1 4.44Å; V784-I810 HydrophobicContact CG2-CD1 4.22Å; I806-I810 HydrophobicContact CG2-CD1 3.73Å; I806-I810 HydrophobicContact CG2-CG1 4.4Å; I806-I810 WeakPolarHBondContact O-CB 3.4Å; I806-I810 VanDerWaalsContact O-CG1 3.29Å; I806-I810 WeakPolarHBondContact O-CG1 3.23Å; I806-I810 PolarHBondContact O-N 2.81Å; L807-I810 PolarHBondContact O-N 3.03Å; D808-I810 PolarHBondContact O-N 3.22Å; I810-R812 VanDerWaalsContact C-N 3.33Å; I810-R812 PolarHBondContact O-N 3.26Å; I810-F819 HydrophobicContact CG2-CZ 3.83Å
811L86.4Confident78.2Confident3 Ų334.2 Ų34.22%0.01618%0.184CC..Hα-helixtrans-66.5-30.2176.3-75.2174.9000113.5L807 D808 K809 F819 M827 F849 A852 W853 R856L807-L811 WeakPolarHBondContact O-CG 3.42Å; L807-L811 PolarHBondContact O-N 3.12Å; D808-L811 WeakPolarHBondContact O-CB 3.29Å; D808-L811 PolarHBondContact O-N 3.11Å; K809-L811 VanDerWaalsContact C-N 3.27Å; K809-L811 PolarHBondContact O-N 3.03Å; L811-F819 HydrophobicContact CD2-CE2 4.39Å; L811-M827 HydrophobicContact CD1-CE 3.71Å; L811-M827 HydrophobicContact CD2-CE 3.66Å; L811-M827 HydrophobicContact CG-CE 3.54Å; L811-F849 HydrophobicContact CD1-CD2 3.7Å; L811-F849 HydrophobicContact CD1-CE2 3.37Å; L811-F849 HydrophobicContact CD1-CZ 4.46Å; L811-F849 HydrophobicContact CG-CE2 4.31Å; L811-A852 HydrophobicContact CB-CB 3.72Å; L811-A852 HydrophobicContact CD1-CB 4.05Å; L811-W853 HydrophobicContact CD1-CB 3.8Å; L811-R856 HydrophobicContact CD2-CB 4.2Å; L811-R856 HydrophobicContact CD2-CG 4.07Å; L811-R856 PolarHBondContact O-NE 2.94Å; L811-R856 VanDerWaalsContact O-NE 3.15Å; L811-R856 PolarHBondContact O-NH2 3.04Å
812R84.1Confident78.1Confident105 Ų10537.9 Ų37.940%0.39621%0.208SC..Hα-helixtrans-85.1-35.4-179.8-68.9177.1-167-85.3-10.1114.4D808 K809 I810 L848 A852D808-R812 WeakPolarHBondContact O-CG 3.4Å; D808-R812 PolarHBondContact O-N 2.93Å; D808-R812 IonicContact OD1-CZ 3.11Å; D808-R812 VanDerWaalsContact OD1-CZ 3.25Å; D808-R812 IonicContact OD1-NE 2.7Å; D808-R812 PolarHBondContact OD1-NE 2.94Å; D808-R812 IonicContact OD1-NH2 2.67Å; D808-R812 PolarHBondContact OD1-NH2 3.24Å; D808-R812 WeakPolarHBondContact OD2-CD 3.44Å; D808-R812 IonicContact OD2-CZ 3.35Å; D808-R812 IonicContact OD2-NE 2.7Å; D808-R812 PolarHBondContact OD2-NE 3.15Å; D808-R812 IonicContact OD2-NH2 3.6Å; K809-R812 PolarHBondContact O-N 3.4Å; K809-R812 VanDerWaalsContact O-N 3.09Å; I810-R812 VanDerWaalsContact C-N 3.33Å; I810-R812 PolarHBondContact O-N 3.26Å; R812-L848 PolarHBondContact NH2-O 3.31Å; R812-L848 VanDerWaalsContact NH2-O 3.1Å; R812-A852 HydrophobicContact CG-CB 3.84Å
813F72.1Confident78Confident69 Ų6939.3 Ų39.330%0.30321%0.213SC..Hα-helixtrans-85.3-12.5-162.9-161.3-107.5000114.9K715 A763 H767 K809K715-F813 HydrophobicContact CD-CZ 4.39Å; A763-F813 HydrophobicContact CB-CB 4.11Å; A763-F813 HydrophobicContact CB-CD1 3.69Å; A763-F813 HydrophobicContact CB-CD2 4.47Å; A763-F813 HydrophobicContact CB-CE1 4.14Å; A763-F813 HydrophobicContact CB-CG 3.86Å; H767-F813 HydrophobicContact CB-CE1 4.47Å; K809-F813 VanDerWaalsContact O-CB 3.26Å; K809-F813 WeakPolarHBondContact O-CB 3.22Å; K809-F813 PolarHBondContact O-N 3.34Å
814A53.7Low77.9Confident15 Ų1540 Ų4012%0.12422%0.217CC..  trans-109.1141.4-15800000117.3L816 R856A814-L816 HydrophobicContact CB-CB 3.53Å; A814-L816 HydrophobicContact CB-CD1 3.29Å; A814-L816 HydrophobicContact CB-CG 3.43Å; A814-L816 VanDerWaalsContact CB-CG 3.43Å; A814-L816 PolarHBondContact O-N 3.21Å; A814-R856 PolarHBondContact O-NH1 3.37Å; A814-R856 VanDerWaalsContact O-NH1 3.16Å; A814-R856 PolarHBondContact O-NH2 3.32Å
815N53.9Low77.9Confident146 Ų14640.7 Ų40.778%0.78122%0.221SC*.  trans-75.728.4152.9-85.6-5.5000112.1T817N815-T817 PolarHBondContact O-N 3.24Å
816L51.9Low78Confident22 Ų2242.2 Ų42.212%0.11523%0.232CC..  trans-79.774.2-173.9-86166.5000112.2V770 F780 A814 C818 F819V770-L816 HydrophobicContact CB-CD2 3.93Å; V770-L816 HydrophobicContact CB-CG 4.3Å; V770-L816 HydrophobicContact CG1-CB 4.44Å; V770-L816 HydrophobicContact CG1-CD2 3.47Å; V770-L816 VanDerWaalsContact CG1-CD2 3.47Å; V770-L816 HydrophobicContact CG1-CG 3.61Å; V770-L816 HydrophobicContact CG2-CD1 4.24Å; V770-L816 HydrophobicContact CG2-CD2 3.25Å; V770-L816 HydrophobicContact CG2-CG 3.73Å; F780-L816 HydrophobicContact CD1-CD2 4.28Å; F780-L816 HydrophobicContact CD2-CD1 4.29Å; F780-L816 HydrophobicContact CE1-CD1 3.96Å; F780-L816 HydrophobicContact CE1-CD2 3.98Å; F780-L816 HydrophobicContact CE2-CD1 3.4Å; F780-L816 HydrophobicContact CE2-CD2 4.4Å; F780-L816 HydrophobicContact CZ-CD1 3.22Å; F780-L816 HydrophobicContact CZ-CD2 4.08Å; F780-L816 HydrophobicContact CZ-CG 4.31Å; A814-L816 HydrophobicContact CB-CB 3.53Å; A814-L816 HydrophobicContact CB-CD1 3.29Å; A814-L816 HydrophobicContact CB-CG 3.43Å; A814-L816 VanDerWaalsContact CB-CG 3.43Å; A814-L816 PolarHBondContact O-N 3.21Å; L816-C818 PolarHBondContact O-N 3.34Å; L816-F819 HydrophobicContact CB-CE2 4.13Å; L816-F819 HydrophobicContact CD1-CE2 4.14Å; L816-F819 HydrophobicContact CD1-CZ 4.17Å
817T50.7Low78.2Confident106 Ų10642.2 Ų42.265%0.6523%0.232SC*.THydrogen-bonded Turntrans-67.819.1-177.745.40000116.2N815N815-T817 PolarHBondContact O-N 3.24Å
818C55.7Low78.2Confident81 Ų8142.2 Ų42.255%0.54723%0.232SC..THydrogen-bonded Turntrans-144.731.8-171.1-440000115.5L816 D820L816-C818 PolarHBondContact O-N 3.34Å; C818-D820 PolarHBondContact O-N 3.28Å
819F68.7Low78.4Confident29 Ų2946.6 Ų46.613%0.12725%0.251CS..  trans-61.9125.3162.4-74.1-81.7000107.9F780 I810 L811 L816 L824 M827F780-F819 AromaticContact CE1-CE1 3.97Å; F780-F819 HydrophobicContact CE1-CE1 3.97Å; F780-F819 HydrophobicContact CE1-CZ 4.15Å; F780-F819 AromaticContact CZ-CE1 3.82Å; F780-F819 HydrophobicContact CZ-CE1 3.82Å; F780-F819 AromaticContact CZ-CZ 3.64Å; F780-F819 HydrophobicContact CZ-CZ 3.64Å; I810-F819 HydrophobicContact CG2-CZ 3.83Å; L811-F819 HydrophobicContact CD2-CE2 4.39Å; L816-F819 HydrophobicContact CB-CE2 4.13Å; L816-F819 HydrophobicContact CD1-CE2 4.14Å; L816-F819 HydrophobicContact CD1-CZ 4.17Å; F819-L824 HydrophobicContact CB-CD1 4.35Å; F819-L824 HydrophobicContact CB-CD2 3.87Å; F819-L824 HydrophobicContact CB-CG 3.89Å; F819-L824 HydrophobicContact CG-CD2 4.24Å; F819-M827 HydrophobicContact CD1-SD 4.48Å; F819-M827 HydrophobicContact CE1-SD 4.27Å
820D76.2Confident78.8Confident63 Ų6345.4 Ų45.434%0.33725%0.246SC..  trans-74.1158.91726111.6000110.8C818 P822 R823 L824C818-D820 PolarHBondContact O-N 3.28Å; D820-P822 VanDerWaalsContact C-CD 3.49Å; D820-R823 VanDerWaalsContact CG-NE 3.29Å; D820-R823 PolarHBondContact O-N 3.03Å; D820-R823 VanDerWaalsContact OD1-CB 3.27Å; D820-R823 WeakPolarHBondContact OD1-CB 3.43Å; D820-R823 WeakPolarHBondContact OD1-CG 3.48Å; D820-R823 IonicContact OD1-CZ 3.64Å; D820-R823 PolarHBondContact OD1-N 3.42Å; D820-R823 VanDerWaalsContact OD1-N 3.12Å; D820-R823 IonicContact OD1-NE 3.5Å; D820-R823 PolarHBondContact OD1-NE 3.45Å; D820-R823 IonicContact OD1-NH2 2.72Å; D820-R823 IonicContact OD2-CZ 2.65Å; D820-R823 IonicContact OD2-NE 3.09Å; D820-R823 PolarHBondContact OD2-NE 2.74Å; D820-R823 IonicContact OD2-NH2 3.56Å; D820-R823 PolarHBondContact OD2-NH2 3.33Å; D820-L824 PolarHBondContact O-N 3.23Å
821G82.4Confident79.1Confident15 Ų1545.1 Ų45.116%0.15524%0.244CC..Hα-helixtrans-53.1-44.2178.500000114R823 L824 V825 L882G821-R823 PolarHBondContact O-N 3.13Å; G821-L824 PolarHBondContact O-N 2.88Å; G821-V825 VanDerWaalsContact O-CG2 3.27Å; G821-V825 WeakPolarHBondContact O-CG2 3.47Å; G821-V825 PolarHBondContact O-N 2.96Å; G821-L882 WeakPolarHBondContact CA-O 3.33Å
822P87.8Confident79.4Confident84 Ų8445.6 Ų45.655%0.54525%0.247SC..Hα-helixtrans-58.8-38.4179.7-28.336.4000115D820 S826D820-P822 VanDerWaalsContact C-CD 3.49Å; P822-S826 WeakPolarHBondContact O-CB 3.3Å; P822-S826 PolarHBondContact O-N 3.42Å; P822-S826 PolarHBondContact O-OG 3.39Å
823R88.4Confident79.8Confident36 Ų3644.7 Ų44.714%0.13625%0.253CS..Hα-helixtrans-72.9-41.2176.9-78.4174.7-80.8-141.15111.9F781 D820 G821 V825 S826 M827F781-R823 VanDerWaalsContact CB-NH1 3.25Å; D820-R823 VanDerWaalsContact CG-NE 3.29Å; D820-R823 PolarHBondContact O-N 3.03Å; D820-R823 VanDerWaalsContact OD1-CB 3.27Å; D820-R823 WeakPolarHBondContact OD1-CB 3.43Å; D820-R823 WeakPolarHBondContact OD1-CG 3.48Å; D820-R823 IonicContact OD1-CZ 3.64Å; D820-R823 PolarHBondContact OD1-N 3.42Å; D820-R823 VanDerWaalsContact OD1-N 3.12Å; D820-R823 IonicContact OD1-NE 3.5Å; D820-R823 PolarHBondContact OD1-NE 3.45Å; D820-R823 IonicContact OD1-NH2 2.72Å; D820-R823 IonicContact OD2-CZ 2.65Å; D820-R823 IonicContact OD2-NE 3.09Å; D820-R823 PolarHBondContact OD2-NE 2.74Å; D820-R823 IonicContact OD2-NH2 3.56Å; D820-R823 PolarHBondContact OD2-NH2 3.33Å; G821-R823 PolarHBondContact O-N 3.13Å; R823-V825 VanDerWaalsContact C-N 3.27Å; R823-V825 PolarHBondContact O-N 2.91Å; R823-S826 PolarHBondContact O-N 2.96Å; R823-S826 VanDerWaalsContact O-N 3.14Å; R823-M827 WeakPolarHBondContact O-CB 3.49Å; R823-M827 VanDerWaalsContact O-CG 3.24Å; R823-M827 WeakPolarHBondContact O-CG 3.41Å; R823-M827 PolarHBondContact O-N 3.38Å
824L89.6Confident80.8Confident15 Ų1542 Ų428%0.07924%0.241CC..Hα-helixtrans-58.8-41.3174.1-69.6177.3000111.5F819 D820 G821 F828 W853F819-L824 HydrophobicContact CB-CD1 4.35Å; F819-L824 HydrophobicContact CB-CD2 3.87Å; F819-L824 HydrophobicContact CB-CG 3.89Å; F819-L824 HydrophobicContact CG-CD2 4.24Å; D820-L824 PolarHBondContact O-N 3.23Å; G821-L824 PolarHBondContact O-N 2.88Å; L824-F828 VanDerWaalsContact O-CB 3.32Å; L824-F828 WeakPolarHBondContact O-CB 3.41Å; L824-F828 PolarHBondContact O-N 3.05Å; L824-W853 PolarHBondContact O-NE1 3.35Å
825V93.2Very high82.7Confident14 Ų1441.4 Ų41.49%0.08524%0.236CC..Hα-helixtrans-65.1-43.1174.8171.30000111.3G821 R823 M827 F828 K829 C883 P884 I889G821-V825 VanDerWaalsContact O-CG2 3.27Å; G821-V825 WeakPolarHBondContact O-CG2 3.47Å; G821-V825 PolarHBondContact O-N 2.96Å; R823-V825 VanDerWaalsContact C-N 3.27Å; R823-V825 PolarHBondContact O-N 2.91Å; V825-M827 PolarHBondContact O-N 2.9Å; V825-F828 PolarHBondContact O-N 3.23Å; V825-K829 HydrophobicContact CG1-CD 4.23Å; V825-K829 HydrophobicContact CG1-CG 4.44Å; V825-K829 WeakPolarHBondContact O-CB 3.2Å; V825-K829 WeakPolarHBondContact O-CG 3.49Å; V825-K829 PolarHBondContact O-N 2.86Å; V825-C883 HydrophobicContact CG2-CB 4.04Å; V825-P884 WeakPolarHBondContact CG2-O 3.23Å; V825-I889 HydrophobicContact CG1-CD1 3.88Å
826S93.7Very high84.3Confident39 Ų3938 Ų3827%0.27322%0.221SC..Hα-helixtrans-63.6-40.6178.4-64.70000112.7P822 R823 L830P822-S826 WeakPolarHBondContact O-CB 3.3Å; P822-S826 PolarHBondContact O-N 3.42Å; P822-S826 PolarHBondContact O-OG 3.39Å; R823-S826 PolarHBondContact O-N 2.96Å; R823-S826 VanDerWaalsContact O-N 3.14Å; S826-L830 PolarHBondContact O-N 3.09Å; S826-L830 VanDerWaalsContact O-N 3.09Å
827M94Very high86.1Confident0 Ų038.2 Ų38.20%022%0.224CC..Hα-helixtrans-64.7-44.8174.5-73172.98300111.3L788 L807 L811 F819 R823 V825 L830 A831 F849L788-M827 HydrophobicContact CD1-CG 4.22Å; L788-M827 HydrophobicContact CD2-CG 3.93Å; L807-M827 HydrophobicContact CB-CE 4.44Å; L807-M827 HydrophobicContact CD2-CE 4.26Å; L811-M827 HydrophobicContact CD1-CE 3.71Å; L811-M827 HydrophobicContact CD2-CE 3.66Å; L811-M827 HydrophobicContact CG-CE 3.54Å; F819-M827 HydrophobicContact CD1-SD 4.48Å; F819-M827 HydrophobicContact CE1-SD 4.27Å; R823-M827 WeakPolarHBondContact O-CB 3.49Å; R823-M827 VanDerWaalsContact O-CG 3.24Å; R823-M827 WeakPolarHBondContact O-CG 3.41Å; R823-M827 PolarHBondContact O-N 3.38Å; V825-M827 PolarHBondContact O-N 2.9Å; M827-L830 PolarHBondContact O-N 2.79Å; M827-A831 PolarHBondContact O-N 3.45Å; M827-F849 HydrophobicContact CB-CZ 3.71Å; M827-F849 HydrophobicContact CE-CE2 3.59Å; M827-F849 HydrophobicContact CE-CZ 3.84Å; M827-F849 HydrophobicContact CG-CZ 4.08Å; M827-F849 WeakPolarHBondContact O-CE1 3.39Å
828F94.4Very high87.9Confident1 Ų142.3 Ų42.30%0.00424%0.236CC..Hα-helixtrans-63-45.8177.4-178.4-119000112.3L824 V825 L830 A831 L832 L850 W853 I886 I889 L890 I913L824-F828 VanDerWaalsContact O-CB 3.32Å; L824-F828 WeakPolarHBondContact O-CB 3.41Å; L824-F828 PolarHBondContact O-N 3.05Å; V825-F828 PolarHBondContact O-N 3.23Å; F828-L830 VanDerWaalsContact C-N 3.35Å; F828-L830 PolarHBondContact O-N 3.37Å; F828-A831 PolarHBondContact O-N 2.04Å; F828-L832 HydrophobicContact CD1-CD1 4.02Å; F828-L832 HydrophobicContact CD2-CG 4.38Å; F828-L832 HydrophobicContact CE1-CD1 3.38Å; F828-L832 HydrophobicContact CE1-CG 4.17Å; F828-L832 HydrophobicContact CE2-CD1 3.99Å; F828-L832 HydrophobicContact CE2-CD2 4.17Å; F828-L832 HydrophobicContact CE2-CG 3.87Å; F828-L832 HydrophobicContact CZ-CD1 3.36Å; F828-L832 HydrophobicContact CZ-CD2 4.09Å; F828-L832 HydrophobicContact CZ-CG 3.77Å; F828-L832 PolarHBondContact O-N 3.49Å; F828-L850 HydrophobicContact CD2-CD1 3.99Å; F828-L850 HydrophobicContact CE2-CD1 3.92Å; F828-W853 HydrophobicContact CB-CZ2 3.89Å; F828-W853 HydrophobicContact CD2-CD2 4.17Å; F828-W853 HydrophobicContact CD2-CE3 4.09Å; F828-W853 HydrophobicContact CD2-CH2 4.06Å; F828-W853 HydrophobicContact CD2-CZ2 4.08Å; F828-W853 HydrophobicContact CD2-CZ3 4.04Å; F828-W853 HydrophobicContact CE2-CH2 4.5Å; F828-W853 HydrophobicContact CE2-CZ3 4.3Å; F828-W853 HydrophobicContact CG-CH2 4.29Å; F828-W853 HydrophobicContact CG-CZ2 4.01Å; F828-I886 HydrophobicContact CD1-CD1 4.37Å; F828-I886 HydrophobicContact CD1-CG1 4.2Å; F828-I886 HydrophobicContact CE1-CD1 4.22Å; F828-I886 HydrophobicContact CE1-CG1 3.89Å; F828-I889 HydrophobicContact CD1-CD1 4.36Å; F828-I889 HydrophobicContact CD1-CG2 4.3Å; F828-I889 HydrophobicContact CE1-CB 4.47Å; F828-I889 HydrophobicContact CE1-CG2 3.93Å; F828-L890 HydrophobicContact CE1-CD2 4.21Å; F828-L890 HydrophobicContact CZ-CD2 3.84Å; F828-I913 HydrophobicContact CD2-CD1 4.47Å; F828-I913 HydrophobicContact CE2-CD1 3.32Å; F828-I913 HydrophobicContact CZ-CD1 3.42Å; F828-I913 VanDerWaalsContact CZ-CD1 3.42Å
829K94.3Very high89.5Confident102 Ų10240.6 Ų40.644%0.44322%0.221SC..Hα-helixtrans-57.4-47.1175-75.1-178.4179.5-176.50111.5V825 A831 L832 T833 I889V825-K829 HydrophobicContact CG1-CD 4.23Å; V825-K829 HydrophobicContact CG1-CG 4.44Å; V825-K829 WeakPolarHBondContact O-CB 3.2Å; V825-K829 WeakPolarHBondContact O-CG 3.49Å; V825-K829 PolarHBondContact O-N 2.86Å; K829-A831 PolarHBondContact O-N 3.24Å; K829-L832 PolarHBondContact O-N 3.12Å; K829-T833 PolarHBondContact O-N 3.13Å; K829-T833 PolarHBondContact O-OG1 2.76Å; K829-T833 VanDerWaalsContact O-OG1 3.06Å; K829-I889 HydrophobicContact CD-CD1 4.18Å; K829-I889 HydrophobicContact CG-CD1 3.79Å; K829-I889 HydrophobicContact CG-CG1 4.47Å
830L96.2Very high90.3Very high3 Ų345.4 Ų45.42%0.01624%0.239CC..Hα-helixtrans-59.4-47.2176.7177.664.8000111.4L788 A791 K792 L804 L807 S826 M827 F828 L832 T833 E834L788-L830 HydrophobicContact CD2-CD2 3.69Å; A791-L830 HydrophobicContact CB-CD1 4.15Å; A791-L830 HydrophobicContact CB-CD2 3.67Å; K792-L830 HydrophobicContact CG-CD1 3.9Å; L804-L830 HydrophobicContact CD2-CD2 4.18Å; L804-L830 HydrophobicContact CD2-CG 4.22Å; L807-L830 HydrophobicContact CD1-CD2 3.78Å; S826-L830 PolarHBondContact O-N 3.09Å; S826-L830 VanDerWaalsContact O-N 3.09Å; M827-L830 PolarHBondContact O-N 2.79Å; F828-L830 VanDerWaalsContact C-N 3.35Å; F828-L830 PolarHBondContact O-N 3.37Å; L830-L832 PolarHBondContact O-N 3.47Å; L830-T833 PolarHBondContact O-N 2.69Å; L830-E834 HydrophobicContact CD1-CG 3.8Å; L830-E834 HydrophobicContact CG-CG 4.4Å; L830-E834 WeakPolarHBondContact O-CG 3.32Å; L830-E834 PolarHBondContact O-N 2.8Å
831A94.6Very high90.9Very high0 Ų046 Ų460%024%0.24CC..Hα-helixtrans-59.2-46178.500000112M827 F828 K829 E834 L835 F849 L850M827-A831 PolarHBondContact O-N 3.45Å; F828-A831 PolarHBondContact O-N 2.04Å; K829-A831 PolarHBondContact O-N 3.24Å; A831-E834 PolarHBondContact O-N 2.85Å; A831-L835 WeakPolarHBondContact O-CB 3.42Å; A831-L835 WeakPolarHBondContact O-CG 3.22Å; A831-L835 PolarHBondContact O-N 3.42Å; A831-F849 HydrophobicContact CB-CD1 3.66Å; A831-F849 HydrophobicContact CB-CE1 3.79Å; A831-L850 HydrophobicContact CB-CB 4.31Å; A831-L850 HydrophobicContact CB-CD1 4.35Å
832L92.5Very high91.3Very high12 Ų1245.4 Ų45.46%0.06323%0.233CC..Hα-helixtrans-62.5-43.5177.5-76.8-179.7000112.6F828 K829 L830 L835 I889 D906 V909F828-L832 HydrophobicContact CD1-CD1 4.02Å; F828-L832 HydrophobicContact CD2-CG 4.38Å; F828-L832 HydrophobicContact CE1-CD1 3.38Å; F828-L832 HydrophobicContact CE1-CG 4.17Å; F828-L832 HydrophobicContact CE2-CD1 3.99Å; F828-L832 HydrophobicContact CE2-CD2 4.17Å; F828-L832 HydrophobicContact CE2-CG 3.87Å; F828-L832 HydrophobicContact CZ-CD1 3.36Å; F828-L832 HydrophobicContact CZ-CD2 4.09Å; F828-L832 HydrophobicContact CZ-CG 3.77Å; F828-L832 PolarHBondContact O-N 3.49Å; K829-L832 PolarHBondContact O-N 3.12Å; L830-L832 PolarHBondContact O-N 3.47Å; L832-L835 HydrophobicContact CD2-CD1 4.49Å; L832-L835 PolarHBondContact O-N 3.5Å; L832-I889 HydrophobicContact CD1-CG2 3.52Å; L832-D906 HydrophobicContact CD2-CB 4.01Å; L832-V909 HydrophobicContact CD2-CB 4.29Å; L832-V909 HydrophobicContact CD2-CG1 3.72Å
833T92.4Very high91.4Very high86 Ų8644.9 Ų44.953%0.52822%0.221SC..Hα-helixtrans-64.7-43.2178.1-60.60000112K829 L830 L835 T836K829-T833 PolarHBondContact O-N 3.13Å; K829-T833 PolarHBondContact O-OG1 2.76Å; K829-T833 VanDerWaalsContact O-OG1 3.06Å; L830-T833 PolarHBondContact O-N 2.69Å; T833-L835 VanDerWaalsContact C-N 3.31Å; T833-L835 PolarHBondContact O-N 2.83Å; T833-T836 PolarHBondContact O-N 3.4Å; T833-T836 PolarHBondContact O-OG1 3.42Å
834E93.5Very high91.4Very high13 Ų1344.6 Ų44.66%0.06122%0.224CC..Hα-helixtrans-77.9-16.8-177.6-62.2-58.1153.700113K800 L804 L830 A831 T836 S837 V842 A846K800-E834 WeakPolarHBondContact CD-OE2 3.43Å; K800-E834 IonicContact NZ-OE1 3.48Å; K800-E834 PolarHBondContact NZ-OE1 3.44Å; K800-E834 IonicContact NZ-OE2 3.45Å; K800-E834 PolarHBondContact NZ-OE2 2.87Å; L804-E834 HydrophobicContact CD1-CB 4.19Å; L804-E834 HydrophobicContact CD1-CG 4.43Å; L830-E834 HydrophobicContact CD1-CG 3.8Å; L830-E834 HydrophobicContact CG-CG 4.4Å; L830-E834 WeakPolarHBondContact O-CG 3.32Å; L830-E834 PolarHBondContact O-N 2.8Å; A831-E834 PolarHBondContact O-N 2.85Å; E834-T836 PolarHBondContact O-N 2.72Å; E834-S837 WeakPolarHBondContact O-CB 3.5Å; E834-S837 PolarHBondContact O-N 3.3Å; E834-V842 HydrophobicContact CB-CG1 3.98Å; E834-V842 HydrophobicContact CG-CG1 4.46Å; E834-V842 VanDerWaalsContact OE2-CG1 3.28Å; E834-V842 WeakPolarHBondContact OE2-CG1 3.36Å; E834-A846 HydrophobicContact CB-CB 3.87Å
835L91.8Very high91.5Very high3 Ų344.1 Ų44.12%0.01622%0.222CC..THydrogen-bonded Turntrans-65.7-22.4169.6-81.9168.8000113.4A831 L832 T833 R843 A846 Q847 L850 M905 V909A831-L835 WeakPolarHBondContact O-CB 3.42Å; A831-L835 WeakPolarHBondContact O-CG 3.22Å; A831-L835 PolarHBondContact O-N 3.42Å; L832-L835 HydrophobicContact CD2-CD1 4.49Å; L832-L835 PolarHBondContact O-N 3.5Å; T833-L835 VanDerWaalsContact C-N 3.31Å; T833-L835 PolarHBondContact O-N 2.83Å; L835-R843 WeakPolarHBondContact O-CD 3.18Å; L835-R843 WeakPolarHBondContact O-CG 3.14Å; L835-A846 HydrophobicContact CD2-CB 4.16Å; L835-A846 HydrophobicContact CG-CB 4.02Å; L835-Q847 HydrophobicContact CD2-CB 4.09Å; L835-L850 HydrophobicContact CD1-CD2 3.83Å; L835-M905 HydrophobicContact CB-CB 4.33Å; L835-M905 HydrophobicContact CD2-CB 4.47Å; L835-V909 HydrophobicContact CD1-CB 4.42Å; L835-V909 HydrophobicContact CD1-CG2 3.77Å
836T88.6Confident91.5Very high74 Ų7443.4 Ų43.445%0.45422%0.218SC..THydrogen-bonded Turntrans-95.17.6175.765.40000112.9T833 E834 D906T833-T836 PolarHBondContact O-N 3.4Å; T833-T836 PolarHBondContact O-OG1 3.42Å; E834-T836 PolarHBondContact O-N 2.72Å; T836-D906 HydrophobicContact CG2-CB 4Å; T836-D906 VanDerWaalsContact CG2-OD1 3.31Å; T836-D906 WeakPolarHBondContact CG2-OD1 3.37Å
837S90.1Very high91.4Very high27 Ų2746.3 Ų46.319%0.18923%0.227CC..  trans-61.2146.3176.6179.60000111.8E834 D839 R843E834-S837 WeakPolarHBondContact O-CB 3.5Å; E834-S837 PolarHBondContact O-N 3.3Å; S837-D839 VanDerWaalsContact C-N 3.28Å; S837-D839 PolarHBondContact OG-N 2.86Å; S837-R843 WeakPolarHBondContact O-CD 3.33Å; S837-R843 WeakPolarHBondContact O-CG 3.04Å; S837-R843 PolarHBondContact O-NH1 3.27Å
838E87.1Confident91.3Very high192 Ų19249.5 Ų49.590%0.89724%0.244SC*.SBendtrans-72-23.7172.9-65-173.3171.100112.4W840 R843E838-W840 PolarHBondContact O-N 2.91Å; E838-R843 PolarHBondContact O-NH1 3.46Å
839D89.1Confident91.2Very high44 Ų4449.4 Ų49.424%0.23524%0.243CC..  trans-80120.9176.6-168.7-41.7000111.4S797 S837 M841 V842 R843S797-D839 WeakPolarHBondContact CB-OD2 3.39Å; S797-D839 PolarHBondContact OG-OD2 3.27Å; S837-D839 VanDerWaalsContact C-N 3.28Å; S837-D839 PolarHBondContact OG-N 2.86Å; D839-M841 VanDerWaalsContact C-N 3.33Å; D839-M841 PolarHBondContact O-N 2.87Å; D839-M841 WeakPolarHBondContact OD1-CB 3.37Å; D839-M841 PolarHBondContact OD1-N 3.44Å; D839-V842 HydrophobicContact CB-CB 4.17Å; D839-V842 HydrophobicContact CB-CG2 3.89Å; D839-V842 PolarHBondContact O-N 3.26Å; D839-R843 WeakPolarHBondContact O-CG 3.44Å; D839-R843 PolarHBondContact O-N 3.31Å
840W86.9Confident91.1Very high131 Ų13144.9 Ų44.950%0.49622%0.224SC..Hα-helixtrans-61.6-35.3179.4176.786.3000114M753 E838 R843 S844M753-W840 HydrophobicContact CE-CH2 3.72Å; M753-W840 HydrophobicContact CE-CZ3 3.83Å; M753-W840 HydrophobicContact CG-CH2 4.39Å; M753-W840 HydrophobicContact CG-CZ3 4.33Å; M753-W840 HydrophobicContact SD-CH2 3.42Å; M753-W840 WeakPolarHBondContact SD-CH2 3.3Å; M753-W840 HydrophobicContact SD-CZ3 3.83Å; E838-W840 PolarHBondContact O-N 2.91Å; W840-R843 PolarHBondContact O-N 3.42Å; W840-S844 WeakPolarHBondContact O-CB 3.36Å; W840-S844 PolarHBondContact O-N 3.21Å; W840-S844 PolarHBondContact O-OG 3.29Å
841M87.8Confident90.8Very high76 Ų7648 Ų4837%0.37424%0.243SC..Hα-helixtrans-66.7-42.3178.1-63.9-171.5-74.700110.8V801 D839 S844 A845V801-M841 HydrophobicContact CG2-CB 3.89Å; D839-M841 VanDerWaalsContact C-N 3.33Å; D839-M841 PolarHBondContact O-N 2.87Å; D839-M841 WeakPolarHBondContact OD1-CB 3.37Å; D839-M841 PolarHBondContact OD1-N 3.44Å; M841-S844 PolarHBondContact O-N 3.35Å; M841-A845 PolarHBondContact O-N 3.36Å
842V91.1Very high90.6Very high1 Ų148.2 Ų48.21%0.00624%0.244CC..Hα-helixtrans-63.4-47.4176.81770000110.4K800 V801 L804 E834 D839 S844 A845 A846K800-V842 HydrophobicContact CB-CG2 4.18Å; K800-V842 HydrophobicContact CD-CG1 4.27Å; K800-V842 HydrophobicContact CD-CG2 4.37Å; V801-V842 HydrophobicContact CG2-CG2 4.07Å; L804-V842 HydrophobicContact CD1-CG1 4.19Å; E834-V842 HydrophobicContact CB-CG1 3.98Å; E834-V842 HydrophobicContact CG-CG1 4.46Å; E834-V842 VanDerWaalsContact OE2-CG1 3.28Å; E834-V842 WeakPolarHBondContact OE2-CG1 3.36Å; D839-V842 HydrophobicContact CB-CB 4.17Å; D839-V842 HydrophobicContact CB-CG2 3.89Å; D839-V842 PolarHBondContact O-N 3.26Å; V842-S844 VanDerWaalsContact C-N 3.3Å; V842-S844 PolarHBondContact O-N 2.89Å; V842-A845 PolarHBondContact O-N 2.95Å; V842-A846 WeakPolarHBondContact O-CB 3.19Å; V842-A846 PolarHBondContact O-N 3.21Å
843R91Very high90.5Very high74 Ų7447.6 Ų47.628%0.27924%0.241SC..Hα-helixtrans-57.5-42.9175.5-69.1-163.6-60.4-80.73.1112.3L835 S837 E838 D839 W840 A846 Q847L835-R843 WeakPolarHBondContact O-CD 3.18Å; L835-R843 WeakPolarHBondContact O-CG 3.14Å; S837-R843 WeakPolarHBondContact O-CD 3.33Å; S837-R843 WeakPolarHBondContact O-CG 3.04Å; S837-R843 PolarHBondContact O-NH1 3.27Å; E838-R843 PolarHBondContact O-NH1 3.46Å; D839-R843 WeakPolarHBondContact O-CG 3.44Å; D839-R843 PolarHBondContact O-N 3.31Å; W840-R843 PolarHBondContact O-N 3.42Å; R843-A846 PolarHBondContact O-N 3.35Å; R843-Q847 WeakPolarHBondContact O-CB 3.25Å; R843-Q847 PolarHBondContact O-N 3.28Å
844S88.4Confident90.4Very high30 Ų3045.3 Ų45.321%0.2123%0.226CC..Hα-helixtrans-66-42.8-179.3-61.60000112.1W840 M841 V842 Q847 L848W840-S844 WeakPolarHBondContact O-CB 3.36Å; W840-S844 PolarHBondContact O-N 3.21Å; W840-S844 PolarHBondContact O-OG 3.29Å; M841-S844 PolarHBondContact O-N 3.35Å; V842-S844 VanDerWaalsContact C-N 3.3Å; V842-S844 PolarHBondContact O-N 2.89Å; S844-Q847 PolarHBondContact O-N 2.92Å; S844-L848 PolarHBondContact O-N 3.26Å; S844-L848 VanDerWaalsContact O-N 3.14Å
845A90.7Very high90Very high4 Ų451.2 Ų51.23%0.03325%0.248CC..Hα-helixtrans-65.5-41.3174.800000111.8V801 L804 M841 V842 Q847 L848 F849V801-A845 HydrophobicContact CB-CB 4.47Å; V801-A845 HydrophobicContact CG1-CB 4.2Å; V801-A845 HydrophobicContact CG2-CB 4.33Å; L804-A845 HydrophobicContact CB-CB 3.89Å; L804-A845 HydrophobicContact CD1-CB 3.97Å; M841-A845 PolarHBondContact O-N 3.36Å; V842-A845 PolarHBondContact O-N 2.95Å; A845-Q847 VanDerWaalsContact C-N 3.31Å; A845-Q847 PolarHBondContact O-N 2.93Å; A845-L848 PolarHBondContact O-N 3.3Å; A845-F849 WeakPolarHBondContact O-CB 3.4Å; A845-F849 PolarHBondContact O-N 3.28Å
846A93.7Very high89.5Confident0 Ų055.4 Ų55.40%026%0.263CS..Hα-helixtrans-62.2-38.3175.900000111.9L804 E834 L835 V842 R843 F849 L850L804-A846 HydrophobicContact CD1-CB 4.13Å; E834-A846 HydrophobicContact CB-CB 3.87Å; L835-A846 HydrophobicContact CD2-CB 4.16Å; L835-A846 HydrophobicContact CG-CB 4.02Å; V842-A846 WeakPolarHBondContact O-CB 3.19Å; V842-A846 PolarHBondContact O-N 3.21Å; R843-A846 PolarHBondContact O-N 3.35Å; A846-F849 PolarHBondContact O-N 3.29Å; A846-L850 VanDerWaalsContact O-CB 3.3Å; A846-L850 WeakPolarHBondContact O-CB 3.26Å; A846-L850 PolarHBondContact O-N 3.31Å
847Q92.4Very high89.4Confident100 Ų10052.7 Ų52.747%0.46725%0.246SC..Hα-helixtrans-64.2-45.6174.9-174.8179.6-4.100112.1L835 R843 S844 A845 L850 V851L835-Q847 HydrophobicContact CD2-CB 4.09Å; R843-Q847 WeakPolarHBondContact O-CB 3.25Å; R843-Q847 PolarHBondContact O-N 3.28Å; S844-Q847 PolarHBondContact O-N 2.92Å; A845-Q847 VanDerWaalsContact C-N 3.31Å; A845-Q847 PolarHBondContact O-N 2.93Å; Q847-L850 PolarHBondContact O-N 2.9Å; Q847-V851 WeakPolarHBondContact O-CG2 3.33Å; Q847-V851 PolarHBondContact O-N 3.47Å
848L90.7Very high89.1Confident66 Ų6652.4 Ų52.435%0.34624%0.242SC..Hα-helixtrans-61.7-46.5176.5-71.6174.6000111.2D808 R812 S844 A845 L850 V851 A852D808-L848 VanDerWaalsContact OD1-C 3.22Å; R812-L848 PolarHBondContact NH2-O 3.31Å; R812-L848 VanDerWaalsContact NH2-O 3.1Å; S844-L848 PolarHBondContact O-N 3.26Å; S844-L848 VanDerWaalsContact O-N 3.14Å; A845-L848 PolarHBondContact O-N 3.3Å; L848-L850 PolarHBondContact O-N 3.11Å; L848-V851 WeakPolarHBondContact O-CB 3.46Å; L848-V851 PolarHBondContact O-N 3.02Å; L848-V851 VanDerWaalsContact O-N 3.14Å; L848-A852 PolarHBondContact O-N 3.46Å
849F93Very high88.6Confident0 Ų044.8 Ų44.80%021%0.214CC..Hα-helixtrans-57.1-46.2176.1172.4-135.9000112.3L804 L807 D808 L811 M827 A831 A845 A846 V851 A852 W853L804-F849 HydrophobicContact CD2-CD1 3.78Å; L804-F849 HydrophobicContact CD2-CE1 4.26Å; L807-F849 HydrophobicContact CB-CD2 3.78Å; L807-F849 HydrophobicContact CB-CE2 3.38Å; L807-F849 HydrophobicContact CB-CZ 3.78Å; L807-F849 HydrophobicContact CD1-CE1 4.27Å; L807-F849 HydrophobicContact CD1-CE2 4.41Å; L807-F849 HydrophobicContact CD1-CZ 3.94Å; L807-F849 HydrophobicContact CG-CE2 4.45Å; L807-F849 HydrophobicContact CG-CZ 4.44Å; D808-F849 HydrophobicContact CB-CB 4.2Å; D808-F849 HydrophobicContact CB-CD2 4.42Å; L811-F849 HydrophobicContact CD1-CD2 3.7Å; L811-F849 HydrophobicContact CD1-CE2 3.37Å; L811-F849 HydrophobicContact CD1-CZ 4.46Å; L811-F849 HydrophobicContact CG-CE2 4.31Å; M827-F849 HydrophobicContact CB-CZ 3.71Å; M827-F849 HydrophobicContact CE-CE2 3.59Å; M827-F849 HydrophobicContact CE-CZ 3.84Å; M827-F849 HydrophobicContact CG-CZ 4.08Å; M827-F849 WeakPolarHBondContact O-CE1 3.39Å; A831-F849 HydrophobicContact CB-CD1 3.66Å; A831-F849 HydrophobicContact CB-CE1 3.79Å; A845-F849 WeakPolarHBondContact O-CB 3.4Å; A845-F849 PolarHBondContact O-N 3.28Å; A846-F849 PolarHBondContact O-N 3.29Å; F849-V851 VanDerWaalsContact C-N 3.35Å; F849-V851 PolarHBondContact O-N 2.87Å; F849-A852 WeakPolarHBondContact O-CB 3.36Å; F849-A852 PolarHBondContact O-N 3.48Å; F849-W853 PolarHBondContact O-N 2.9Å
850L92.2Very high87.6Confident6 Ų646 Ų463%0.03122%0.224CC..Hα-helixtrans-62.6-40.6175.9179.270.1000111.9F828 A831 L835 A846 Q847 L848 A852 W853 L854 V909F828-L850 HydrophobicContact CD2-CD1 3.99Å; F828-L850 HydrophobicContact CE2-CD1 3.92Å; A831-L850 HydrophobicContact CB-CB 4.31Å; A831-L850 HydrophobicContact CB-CD1 4.35Å; L835-L850 HydrophobicContact CD1-CD2 3.83Å; A846-L850 VanDerWaalsContact O-CB 3.3Å; A846-L850 WeakPolarHBondContact O-CB 3.26Å; A846-L850 PolarHBondContact O-N 3.31Å; Q847-L850 PolarHBondContact O-N 2.9Å; L848-L850 PolarHBondContact O-N 3.11Å; L850-A852 VanDerWaalsContact C-N 3.28Å; L850-A852 PolarHBondContact O-N 3.35Å; L850-W853 HydrophobicContact CD1-CE3 4.3Å; L850-W853 CarbonylContact O-C 3.41Å; L850-W853 WeakPolarHBondContact O-CA 3.41Å; L850-W853 WeakPolarHBondContact O-CB 3.48Å; L850-W853 PolarHBondContact O-N 3.07Å; L850-L854 HydrophobicContact CD1-CG 4.48Å; L850-L854 HydrophobicContact CG-CD1 4.25Å; L850-L854 HydrophobicContact CG-CG 4.35Å; L850-L854 WeakPolarHBondContact O-CG 3.48Å; L850-L854 PolarHBondContact O-N 3.5Å; L850-V909 HydrophobicContact CD1-CG1 4.24Å; L850-V909 HydrophobicContact CD2-CB 3.9Å; L850-V909 HydrophobicContact CD2-CG1 3.31Å; L850-V909 HydrophobicContact CD2-CG2 3.28Å; L850-V909 HydrophobicContact CG-CG1 4.36Å
851V90.3Very high86.3Confident70 Ų7042.6 Ų42.642%0.42422%0.218SC..Hα-helixtrans-61.6-39175.91690000111Q847 L848 F849 W853 R855Q847-V851 WeakPolarHBondContact O-CG2 3.33Å; Q847-V851 PolarHBondContact O-N 3.47Å; L848-V851 WeakPolarHBondContact O-CB 3.46Å; L848-V851 PolarHBondContact O-N 3.02Å; L848-V851 VanDerWaalsContact O-N 3.14Å; F849-V851 VanDerWaalsContact C-N 3.35Å; F849-V851 PolarHBondContact O-N 2.87Å; V851-W853 VanDerWaalsContact C-N 3.33Å; V851-R855 WeakPolarHBondContact O-CB 3.31Å; V851-R855 PolarHBondContact O-N 2.94Å
852A89.3Confident84.5Confident3 Ų344.6 Ų44.63%0.02523%0.231CC..Hα-helixtrans-65-37.3172.600000112.2D808 L811 R812 L848 F849 L850 R856D808-A852 VanDerWaalsContact OD1-CB 3.26Å; D808-A852 WeakPolarHBondContact OD1-CB 3.45Å; L811-A852 HydrophobicContact CB-CB 3.72Å; L811-A852 HydrophobicContact CD1-CB 4.05Å; R812-A852 HydrophobicContact CG-CB 3.84Å; L848-A852 PolarHBondContact O-N 3.46Å; F849-A852 WeakPolarHBondContact O-CB 3.36Å; F849-A852 PolarHBondContact O-N 3.48Å; L850-A852 VanDerWaalsContact C-N 3.28Å; L850-A852 PolarHBondContact O-N 3.35Å; A852-R856 WeakPolarHBondContact O-CB 3.4Å; A852-R856 PolarHBondContact O-N 3.5Å; A852-R856 VanDerWaalsContact O-N 3.08Å
853W91.5Very high82.4Confident0 Ų051.9 Ų51.90%027%0.268CS..Hα-helixtrans-66-46.9176.7-176.197.7000111.5L811 L824 F828 F849 L850 V851 R855 R856 V857 F858 I886 I913L811-W853 HydrophobicContact CD1-CB 3.8Å; L824-W853 PolarHBondContact O-NE1 3.35Å; F828-W853 HydrophobicContact CB-CZ2 3.89Å; F828-W853 HydrophobicContact CD2-CD2 4.17Å; F828-W853 HydrophobicContact CD2-CE3 4.09Å; F828-W853 HydrophobicContact CD2-CH2 4.06Å; F828-W853 HydrophobicContact CD2-CZ2 4.08Å; F828-W853 HydrophobicContact CD2-CZ3 4.04Å; F828-W853 HydrophobicContact CE2-CH2 4.5Å; F828-W853 HydrophobicContact CE2-CZ3 4.3Å; F828-W853 HydrophobicContact CG-CH2 4.29Å; F828-W853 HydrophobicContact CG-CZ2 4.01Å; F849-W853 PolarHBondContact O-N 2.9Å; L850-W853 HydrophobicContact CD1-CE3 4.3Å; L850-W853 CarbonylContact O-C 3.41Å; L850-W853 WeakPolarHBondContact O-CA 3.41Å; L850-W853 WeakPolarHBondContact O-CB 3.48Å; L850-W853 PolarHBondContact O-N 3.07Å; V851-W853 VanDerWaalsContact C-N 3.33Å; W853-R855 VanDerWaalsContact C-N 3.34Å; W853-R855 PolarHBondContact O-N 3.42Å; W853-R856 WeakPolarHBondContact O-CA 3.32Å; W853-R856 WeakPolarHBondContact O-CB 3.34Å; W853-R856 PolarHBondContact O-N 3.33Å; W853-V857 HydrophobicContact CD2-CG2 3.88Å; W853-V857 HydrophobicContact CE3-CG2 4.08Å; W853-V857 HydrophobicContact CH2-CB 4.22Å; W853-V857 HydrophobicContact CH2-CG1 4.22Å; W853-V857 HydrophobicContact CH2-CG2 3.7Å; W853-V857 HydrophobicContact CZ2-CG2 3.51Å; W853-V857 HydrophobicContact CZ3-CB 4.26Å; W853-V857 HydrophobicContact CZ3-CG2 4Å; W853-V857 PolarHBondContact O-N 3.2Å; W853-F858 HydrophobicContact CZ3-CE2 4.26Å; W853-I886 HydrophobicContact CH2-CD1 3.69Å; W853-I886 HydrophobicContact CZ2-CD1 4.28Å; W853-I913 HydrophobicContact CZ3-CD1 4.36Å
854L88.4Confident79.9Confident38 Ų3851.6 Ų51.620%0.19927%0.274CS..Hα-helixtrans-58.2-46.5176.5-72.5171.5000111.2L850 R856 V857 F858 I913L850-L854 HydrophobicContact CD1-CG 4.48Å; L850-L854 HydrophobicContact CG-CD1 4.25Å; L850-L854 HydrophobicContact CG-CG 4.35Å; L850-L854 WeakPolarHBondContact O-CG 3.48Å; L850-L854 PolarHBondContact O-N 3.5Å; L854-R856 PolarHBondContact O-N 2.75Å; L854-V857 PolarHBondContact O-N 3.48Å; L854-F858 HydrophobicContact CD2-CD2 4.01Å; L854-F858 HydrophobicContact CD2-CE2 3.91Å; L854-F858 WeakPolarHBondContact O-CB 3.44Å; L854-F858 PolarHBondContact O-N 3.24Å; L854-I913 HydrophobicContact CD2-CD1 4.21Å; L854-I913 HydrophobicContact CD2-CG1 3.63Å
855R85.3Confident77.6Confident137 Ų13760.7 Ų60.752%0.51731%0.31SS..Hα-helixtrans-62.9-29.9176.9-170.5175.1-175.9174.6-0.3112.3V851 W853 G859 T860V851-R855 WeakPolarHBondContact O-CB 3.31Å; V851-R855 PolarHBondContact O-N 2.94Å; W853-R855 VanDerWaalsContact C-N 3.34Å; W853-R855 PolarHBondContact O-N 3.42Å; R855-G859 CarbonylContact O-C 3.6Å; R855-G859 WeakPolarHBondContact O-CA 3.31Å; R855-G859 PolarHBondContact O-N 3.11Å; R855-T860 PolarHBondContact NE-OG1 2.96Å; R855-T860 PolarHBondContact NH2-OG1 3.11Å; R855-T860 VanDerWaalsContact NH2-OG1 3.12Å
856R82.7Confident75Confident90 Ų9064.2 Ų64.234%0.3433%0.334SS..Hα-helixtrans-77.5-38.9178.7-174.257.763.5169.64.9112.5L811 A814 A852 W853 L854L811-R856 HydrophobicContact CD2-CB 4.2Å; L811-R856 HydrophobicContact CD2-CG 4.07Å; L811-R856 PolarHBondContact O-NE 2.94Å; L811-R856 VanDerWaalsContact O-NE 3.15Å; L811-R856 PolarHBondContact O-NH2 3.04Å; A814-R856 PolarHBondContact O-NH1 3.37Å; A814-R856 VanDerWaalsContact O-NH1 3.16Å; A814-R856 PolarHBondContact O-NH2 3.32Å; A852-R856 WeakPolarHBondContact O-CB 3.4Å; A852-R856 PolarHBondContact O-N 3.5Å; A852-R856 VanDerWaalsContact O-N 3.08Å; W853-R856 WeakPolarHBondContact O-CA 3.32Å; W853-R856 WeakPolarHBondContact O-CB 3.34Å; W853-R856 PolarHBondContact O-N 3.33Å; L854-R856 PolarHBondContact O-N 2.75Å
857V85.8Confident72.7Confident17 Ų1776.3 Ų76.310%0.10338%0.38CS..Hα-helixtrans-80.3-48.3180173.50000111.5W853 L854 L874 L879W853-V857 HydrophobicContact CD2-CG2 3.88Å; W853-V857 HydrophobicContact CE3-CG2 4.08Å; W853-V857 HydrophobicContact CH2-CB 4.22Å; W853-V857 HydrophobicContact CH2-CG1 4.22Å; W853-V857 HydrophobicContact CH2-CG2 3.7Å; W853-V857 HydrophobicContact CZ2-CG2 3.51Å; W853-V857 HydrophobicContact CZ3-CB 4.26Å; W853-V857 HydrophobicContact CZ3-CG2 4Å; W853-V857 PolarHBondContact O-N 3.2Å; L854-V857 PolarHBondContact O-N 3.48Å; V857-L874 HydrophobicContact CG1-CD1 3.88Å; V857-L879 HydrophobicContact CG1-CD1 3.72Å
858F83.8Confident70.4Confident22 Ų2276.7 Ų76.710%0.09638%0.382CS..Hα-helixtrans-94.1-23.8-174.8-65.1-84.9000113.5W853 L854 C872 L874 L879 I913 T916 V917W853-F858 HydrophobicContact CZ3-CE2 4.26Å; L854-F858 HydrophobicContact CD2-CD2 4.01Å; L854-F858 HydrophobicContact CD2-CE2 3.91Å; L854-F858 WeakPolarHBondContact O-CB 3.44Å; L854-F858 PolarHBondContact O-N 3.24Å; F858-C872 WeakPolarHBondContact O-CB 3.5Å; F858-L874 HydrophobicContact CD1-CB 4.29Å; F858-L874 HydrophobicContact CD1-CD1 4Å; F858-L874 HydrophobicContact CD1-CG 3.95Å; F858-L874 HydrophobicContact CE1-CB 4.1Å; F858-L874 HydrophobicContact CE1-CD1 4.06Å; F858-L874 HydrophobicContact CE1-CG 4.17Å; F858-L879 HydrophobicContact CZ-CD1 4.03Å; F858-L879 HydrophobicContact CZ-CD2 4.08Å; F858-I913 HydrophobicContact CE2-CG2 4.42Å; F858-I913 HydrophobicContact CZ-CG2 4.11Å; F858-T916 WeakPolarHBondContact CE1-OG1 3.12Å; F858-T916 VanDerWaalsContact CZ-OG1 3.29Å; F858-T916 WeakPolarHBondContact CZ-OG1 3.39Å; F858-V917 HydrophobicContact CE1-CG2 4.41Å
859G76.7Confident68.1Low31 Ų3177.4 Ų77.432%0.3239%0.39SS..  trans98.1-172.2-176.700000114.1R855R855-G859 CarbonylContact O-C 3.6Å; R855-G859 WeakPolarHBondContact O-CA 3.31Å; R855-G859 PolarHBondContact O-N 3.11Å
860T68.6Low66Low70 Ų7084.4 Ų84.443%0.42942%0.421SS..  trans-99.9125.1178.7-48.20000109.7R855 N862 C872R855-T860 PolarHBondContact NE-OG1 2.96Å; R855-T860 PolarHBondContact NH2-OG1 3.11Å; R855-T860 VanDerWaalsContact NH2-OG1 3.12Å; T860-N862 PolarHBondContact O-N 3.45Å; T860-C872 VanDerWaalsContact C-SG 3.57Å; T860-C872 PolarHBondContact O-SG 2.87Å
861P59.8Low64.3Low59 Ų5987.8 Ų87.838%0.38344%0.444SS..  trans-63.5129177.523.4-30.9000110.9I863 P869 K870P861-I863 PolarHBondContact O-N 3.37Å; P861-P869 HydrophobicContact CB-CB 4.46Å; P861-K870 WeakPolarHBondContact CB-O 3.4Å
862N48.3Very low63.2Low119 Ų11986.6 Ų86.664%0.63644%0.438SS*.BIsolated β-bridgetrans-73.9112.9173.9-83.2-17000109.4T860 T864T860-N862 PolarHBondContact O-N 3.45Å; N862-T864 VanDerWaalsContact C-N 3.33Å; N862-T864 PolarHBondContact O-N 3.28Å; N862-T864 VanDerWaalsContact O-N 3.15Å
863I46.7Very low62.7Low153 Ų15390.9 Ų90.979%0.78545%0.454SS*.  trans-8281.3168.9-52.7172.3000107.7P861P861-I863 PolarHBondContact O-N 3.37Å
864T39.3Very low62.3Low68 Ų6892.3 Ų92.342%0.41746%0.462SS..  trans-72.5152.1161.846.60000109.8N862 S866N862-T864 VanDerWaalsContact C-N 3.33Å; N862-T864 PolarHBondContact O-N 3.28Å; N862-T864 VanDerWaalsContact O-N 3.15Å; T864-S866 PolarHBondContact O-N 3.42Å; T864-S866 PolarHBondContact OG1-OG 2.98Å
865K40.5Very low62.1Low222 Ų22291.1 Ų91.197%0.96546%0.456SS*.SBendtrans-56.4-12.6-177.7-72-177.4-179.1175.70115.4
866S36.6Very low62Low77 Ų7784.6 Ų84.654%0.53843%0.432SS..SBendtrans-66.1134.716952.20000109.3T864 Q868T864-S866 PolarHBondContact O-N 3.42Å; T864-S866 PolarHBondContact OG1-OG 2.98Å; S866-Q868 PolarHBondContact O-N 3.08Å
867R44.2Very low62Low255 Ų25583.6 Ų83.696%0.96244%0.435SS*.SBendtrans-59.410.3-164.4-79.7-179.9172.3170.8-0.2117.4
868Q43.8Very low62Low107 Ų10785.6 Ų85.650%0.544%0.444SS..SBendtrans-135131.5176.6-63.5-157.1-8.800113.1S866 K870 Q1008S866-Q868 PolarHBondContact O-N 3.08Å; Q868-K870 PolarHBondContact O-N 3.39Å; Q868-Q1008 PolarHBondContact OE1-O 3.33Å
869P42.4Very low62.3Low81 Ų8184.6 Ų84.653%0.52644%0.439SS..  trans-63.5122.6172.125.9-30.4000109P861 C871P861-P869 HydrophobicContact CB-CB 4.46Å; P869-C871 PolarHBondContact O-N 3.21Å
870K50Low62.8Low147 Ų14785.4 Ų85.464%0.63944%0.436SS*.BIsolated β-bridgetrans-65.6100.9165.1-72.5-175.8178.5-177.10107P861 Q868 C872P861-K870 WeakPolarHBondContact CB-O 3.4Å; Q868-K870 PolarHBondContact O-N 3.39Å; K870-C872 PolarHBondContact O-N 3.39Å
871C55.3Low63.6Low78 Ų7890.7 Ų90.753%0.52745%0.448SS..  trans-58.7128.8170.3-81.30000108.7P869 R873P869-C871 PolarHBondContact O-N 3.21Å; C871-R873 PolarHBondContact O-N 2.89Å
872C67.6Low64.8Low44 Ų4490.8 Ų90.830%0.29745%0.445SS..  trans-69120.7170.7-60.30000108.4F858 T860 K870F858-C872 WeakPolarHBondContact O-CB 3.5Å; T860-C872 VanDerWaalsContact C-SG 3.57Å; T860-C872 PolarHBondContact O-SG 2.87Å; K870-C872 PolarHBondContact O-N 3.39Å
873R78.9Confident66.8Low93 Ų9385.1 Ų85.135%0.35142%0.415SS..  trans-115146.9-178.2-60.8-174.8-68.4175.31.4110.6C871 T916 Y918C871-R873 PolarHBondContact O-N 2.89Å; R873-T916 WeakPolarHBondContact CA-O 3.31Å; R873-T916 VanDerWaalsContact CB-O 3.31Å; R873-T916 WeakPolarHBondContact CB-O 3.38Å; R873-Y918 HydrophobicContact CB-CD1 3.92Å; R873-Y918 HydrophobicContact CB-CE1 4.47Å
874L83.5Confident68.8Low31 Ų3181.2 Ų81.216%0.16240%0.4CS..EExtended strand (participates in β ladder)trans-111.8152.8170.8-70.8174.8000110.2V857 F858 E878 L879 L882 T916 V917 Y918V857-L874 HydrophobicContact CG1-CD1 3.88Å; F858-L874 HydrophobicContact CD1-CB 4.29Å; F858-L874 HydrophobicContact CD1-CD1 4Å; F858-L874 HydrophobicContact CD1-CG 3.95Å; F858-L874 HydrophobicContact CE1-CB 4.1Å; F858-L874 HydrophobicContact CE1-CD1 4.06Å; F858-L874 HydrophobicContact CE1-CG 4.17Å; L874-E878 HydrophobicContact CD2-CG 4.18Å; L874-L879 HydrophobicContact CB-CB 4.38Å; L874-L879 HydrophobicContact CD1-CD1 4.2Å; L874-L882 HydrophobicContact CD1-CD1 3.95Å; L874-T916 PolarHBondContact N-O 2.82Å; L874-T916 VanDerWaalsContact N-O 3.14Å; L874-V917 WeakPolarHBondContact O-CA 3.42Å; L874-Y918 VanDerWaalsContact C-CD1 3.47Å; L874-Y918 VanDerWaalsContact O-CD1 3.24Å; L874-Y918 WeakPolarHBondContact O-CD1 3.4Å; L874-Y918 PolarHBondContact O-N 2.64Å
875S83.5Confident71.2Confident12 Ų1279.1 Ų79.18%0.08439%0.391CS..EExtended strand (participates in β ladder)trans-67.8154.3165.962.40000109.5V877 E878 L879 Y918S875-V877 PolarHBondContact O-N 3.36Å; S875-E878 PolarHBondContact O-N 2.86Å; S875-E878 VanDerWaalsContact OG-CB 3.29Å; S875-E878 WeakPolarHBondContact OG-CB 3.31Å; S875-E878 PolarHBondContact OG-N 3.11Å; S875-L879 WeakPolarHBondContact O-CB 3.38Å; S875-L879 PolarHBondContact O-N 2.93Å; S875-Y918 WeakPolarHBondContact CA-O 3.08Å
876D83.1Confident73.7Confident0 Ų068.5 Ų68.50%035%0.345CS..Hα-helixtrans-53.2-42.6169.156.5-18.7000112.9N880 F887 V917 Y918 N920 S921 L938D876-N880 WeakPolarHBondContact O-CB 3.08Å; D876-N880 PolarHBondContact O-N 3.49Å; D876-F887 HydrophobicContact CB-CE2 4.2Å; D876-F887 HydrophobicContact CB-CZ 3.91Å; D876-F887 WeakPolarHBondContact O-CE2 3.38Å; D876-V917 HydrophobicContact CB-CG1 3.97Å; D876-Y918 PolarHBondContact N-O 3.16Å; D876-Y918 VanDerWaalsContact N-O 3.12Å; D876-N920 WeakPolarHBondContact OD1-CA 3.22Å; D876-N920 WeakPolarHBondContact OD1-CB 2.99Å; D876-N920 PolarHBondContact OD1-N 3.26Å; D876-S921 PolarHBondContact OD1-N 3.32Å; D876-S921 VanDerWaalsContact OD1-N 3.14Å; D876-S921 WeakPolarHBondContact OD2-CB 3.03Å; D876-S921 PolarHBondContact OD2-N 2.96Å; D876-S921 PolarHBondContact OD2-OG 2.97Å; D876-L938 HydrophobicContact CB-CD1 3.9Å; D876-L938 HydrophobicContact CB-CD2 4.15Å; D876-L938 HydrophobicContact CB-CG 4.01Å
877V84.3Confident76.3Confident69 Ų6965.1 Ų65.142%0.41832%0.321SS..Hα-helixtrans-62.2-47177-179.70000111.9S875 N880 R881S875-V877 PolarHBondContact O-N 3.36Å; V877-N880 PolarHBondContact O-N 3.48Å; V877-R881 WeakPolarHBondContact O-CB 3.36Å; V877-R881 PolarHBondContact O-N 3.37Å
878E84.7Confident78.6Confident60 Ų6058.3 Ų58.328%0.2830%0.304SS..Hα-helixtrans-70.8-37.5-178.3-171.759.2-158.600111.5L874 S875 R881 L882L874-E878 HydrophobicContact CD2-CG 4.18Å; S875-E878 PolarHBondContact O-N 2.86Å; S875-E878 VanDerWaalsContact OG-CB 3.29Å; S875-E878 WeakPolarHBondContact OG-CB 3.31Å; S875-E878 PolarHBondContact OG-N 3.11Å; E878-R881 WeakPolarHBondContact O-CB 3.37Å; E878-R881 PolarHBondContact O-N 3.42Å; E878-R881 IonicContact OE1-NE 2.69Å; E878-R881 PolarHBondContact OE1-NE 3.28Å; E878-R881 IonicContact OE1-NH2 2.74Å; E878-R881 IonicContact OE2-NE 3.76Å; E878-R881 PolarHBondContact OE2-NE 3.23Å; E878-L882 HydrophobicContact CG-CD1 4.06Å; E878-L882 HydrophobicContact CG-CG 4.44Å; E878-L882 WeakPolarHBondContact O-CB 3.45Å; E878-L882 WeakPolarHBondContact O-CG 3.37Å; E878-L882 PolarHBondContact O-N 3.23Å
879L89.7Confident80.9Confident0 Ų054.6 Ų54.60%029%0.287CS..Hα-helixtrans-63.6-42.8175.6-178.460.7000111.5V857 F858 L874 S875 R881 L882 C883 I886 F887 I913 V917V857-L879 HydrophobicContact CG1-CD1 3.72Å; F858-L879 HydrophobicContact CZ-CD1 4.03Å; F858-L879 HydrophobicContact CZ-CD2 4.08Å; L874-L879 HydrophobicContact CB-CB 4.38Å; L874-L879 HydrophobicContact CD1-CD1 4.2Å; S875-L879 WeakPolarHBondContact O-CB 3.38Å; S875-L879 PolarHBondContact O-N 2.93Å; L879-R881 VanDerWaalsContact C-N 3.33Å; L879-L882 PolarHBondContact O-N 2.93Å; L879-C883 PolarHBondContact O-N 3.37Å; L879-I886 HydrophobicContact CD1-CD1 4.08Å; L879-I886 HydrophobicContact CD2-CD1 4.33Å; L879-I886 HydrophobicContact CD2-CG2 4.34Å; L879-I886 HydrophobicContact CG-CD1 4.3Å; L879-I886 HydrophobicContact CG-CG2 4.01Å; L879-F887 HydrophobicContact CB-CZ 4.4Å; L879-F887 HydrophobicContact CD2-CE1 4.14Å; L879-F887 HydrophobicContact CD2-CZ 4Å; L879-F887 HydrophobicContact CG-CZ 4.44Å; L879-I913 HydrophobicContact CD2-CG2 4.42Å; L879-V917 HydrophobicContact CD2-CG2 3.44Å; L879-V917 VanDerWaalsContact CD2-CG2 3.44Å
880N88.7Confident83.3Confident48 Ų4850.7 Ų50.726%0.25726%0.262SS..Hα-helixtrans-67.1-34.7175.8-169.250.6000112.3D876 V877 C883 P884 G885 F887 L937D876-N880 WeakPolarHBondContact O-CB 3.08Å; D876-N880 PolarHBondContact O-N 3.49Å; V877-N880 PolarHBondContact O-N 3.48Å; N880-C883 CarbonylContact O-C 3.6Å; N880-C883 VanDerWaalsContact O-C 3.28Å; N880-P884 WeakPolarHBondContact O-CA 3.46Å; N880-P884 VanDerWaalsContact O-N 3.1Å; N880-G885 PolarHBondContact OD1-N 2.96Å; N880-F887 HydrophobicContact CB-CD2 4.27Å; N880-F887 HydrophobicContact CB-CE2 3.95Å; N880-L937 HydrophobicContact CB-CD1 4.07Å
881R84.8Confident85.3Confident181 Ų18144.4 Ų44.468%0.68324%0.236SC*.Hα-helixtrans-64.4-43.4174.5-174-178.8114.2116.15.3111.9V877 E878 L879V877-R881 WeakPolarHBondContact O-CB 3.36Å; V877-R881 PolarHBondContact O-N 3.37Å; E878-R881 WeakPolarHBondContact O-CB 3.37Å; E878-R881 PolarHBondContact O-N 3.42Å; E878-R881 IonicContact OE1-NE 2.69Å; E878-R881 PolarHBondContact OE1-NE 3.28Å; E878-R881 IonicContact OE1-NH2 2.74Å; E878-R881 IonicContact OE2-NE 3.76Å; E878-R881 PolarHBondContact OE2-NE 3.23Å; L879-R881 VanDerWaalsContact C-N 3.33Å
882L86Confident86.9Confident61 Ų6143.8 Ų43.832%0.31923%0.232SC..Hα-helixtrans-73.7-35.9178.4-70.9170.8000112.5G821 L874 E878 L879G821-L882 WeakPolarHBondContact CA-O 3.33Å; L874-L882 HydrophobicContact CD1-CD1 3.95Å; E878-L882 HydrophobicContact CG-CD1 4.06Å; E878-L882 HydrophobicContact CG-CG 4.44Å; E878-L882 WeakPolarHBondContact O-CB 3.45Å; E878-L882 WeakPolarHBondContact O-CG 3.37Å; E878-L882 PolarHBondContact O-N 3.23Å; L879-L882 PolarHBondContact O-N 2.93Å
883C89.5Confident87.9Confident0 Ų042 Ų420%022%0.22CC..SBendtrans-134.480-177.1-67.90000110.3V825 L879 N880 G885 I886V825-C883 HydrophobicContact CG2-CB 4.04Å; L879-C883 PolarHBondContact O-N 3.37Å; N880-C883 CarbonylContact O-C 3.6Å; N880-C883 VanDerWaalsContact O-C 3.28Å; C883-G885 PolarHBondContact O-N 2.86Å; C883-I886 HydrophobicContact CB-CB 4.03Å; C883-I886 HydrophobicContact CB-CD1 4Å; C883-I886 HydrophobicContact CB-CG2 4.27Å; C883-I886 VanDerWaalsContact O-CB 3.25Å; C883-I886 WeakPolarHBondContact O-CB 3.45Å; C883-I886 WeakPolarHBondContact O-CG2 3.38Å; C883-I886 PolarHBondContact O-N 2.65Å
884P89.3Confident88.5Confident72 Ų7237.6 Ų37.647%0.46820%0.203SC..THydrogen-bonded Turntrans-57.7133.5-176.9-25.935000113V825 N880 I886V825-P884 WeakPolarHBondContact CG2-O 3.23Å; N880-P884 WeakPolarHBondContact O-CA 3.46Å; N880-P884 VanDerWaalsContact O-N 3.1Å; P884-I886 VanDerWaalsContact C-N 3.27Å; P884-I886 PolarHBondContact O-N 3.42Å
885G89.6Confident88.7Confident23 Ų2340.5 Ų40.524%0.23722%0.216CC..THydrogen-bonded Turntrans7511.7179.100000114.3N880 C883 F887 D888 I889N880-G885 PolarHBondContact OD1-N 2.96Å; C883-G885 PolarHBondContact O-N 2.86Å; G885-F887 VanDerWaalsContact C-N 3.29Å; G885-F887 PolarHBondContact O-N 3.41Å; G885-D888 PolarHBondContact O-N 3.25Å; G885-I889 WeakPolarHBondContact O-CG1 3.07Å; G885-I889 PolarHBondContact O-N 3.49Å
886I91.9Very high88.5Confident0 Ų045.9 Ų45.90%024%0.238CC..Hα-helixtrans-60.4-38.3177.6-170167.1000112.5F828 W853 L879 C883 P884 D888 I889 L890F828-I886 HydrophobicContact CD1-CD1 4.37Å; F828-I886 HydrophobicContact CD1-CG1 4.2Å; F828-I886 HydrophobicContact CE1-CD1 4.22Å; F828-I886 HydrophobicContact CE1-CG1 3.89Å; W853-I886 HydrophobicContact CH2-CD1 3.69Å; W853-I886 HydrophobicContact CZ2-CD1 4.28Å; L879-I886 HydrophobicContact CD1-CD1 4.08Å; L879-I886 HydrophobicContact CD2-CD1 4.33Å; L879-I886 HydrophobicContact CD2-CG2 4.34Å; L879-I886 HydrophobicContact CG-CD1 4.3Å; L879-I886 HydrophobicContact CG-CG2 4.01Å; C883-I886 HydrophobicContact CB-CB 4.03Å; C883-I886 HydrophobicContact CB-CD1 4Å; C883-I886 HydrophobicContact CB-CG2 4.27Å; C883-I886 VanDerWaalsContact O-CB 3.25Å; C883-I886 WeakPolarHBondContact O-CB 3.45Å; C883-I886 WeakPolarHBondContact O-CG2 3.38Å; C883-I886 PolarHBondContact O-N 2.65Å; P884-I886 VanDerWaalsContact C-N 3.27Å; P884-I886 PolarHBondContact O-N 3.42Å; I886-D888 VanDerWaalsContact C-N 3.31Å; I886-D888 PolarHBondContact O-N 3.34Å; I886-I889 WeakPolarHBondContact O-CB 3.32Å; I886-I889 PolarHBondContact O-N 3.16Å; I886-L890 HydrophobicContact CG1-CD1 4.27Å; I886-L890 HydrophobicContact CG1-CG 4.35Å; I886-L890 VanDerWaalsContact O-CG 3.3Å; I886-L890 WeakPolarHBondContact O-CG 3.21Å; I886-L890 PolarHBondContact O-N 3.04Å
887F91.9Very high88.2Confident5 Ų546.2 Ų46.22%0.02224%0.24CC..Hα-helixtrans-66.6-32.1179.6-64.5-59.5000112.7D876 L879 N880 G885 L890 T891 L914 V917 L937 L938 L941D876-F887 HydrophobicContact CB-CE2 4.2Å; D876-F887 HydrophobicContact CB-CZ 3.91Å; D876-F887 WeakPolarHBondContact O-CE2 3.38Å; L879-F887 HydrophobicContact CB-CZ 4.4Å; L879-F887 HydrophobicContact CD2-CE1 4.14Å; L879-F887 HydrophobicContact CD2-CZ 4Å; L879-F887 HydrophobicContact CG-CZ 4.44Å; N880-F887 HydrophobicContact CB-CD2 4.27Å; N880-F887 HydrophobicContact CB-CE2 3.95Å; G885-F887 VanDerWaalsContact C-N 3.29Å; G885-F887 PolarHBondContact O-N 3.41Å; F887-L890 HydrophobicContact CD1-CD1 4.15Å; F887-L890 PolarHBondContact O-N 2.83Å; F887-T891 VanDerWaalsContact O-CB 3.31Å; F887-T891 WeakPolarHBondContact O-CB 3.41Å; F887-T891 PolarHBondContact O-N 2.91Å; F887-T891 PolarHBondContact O-OG1 3Å; F887-L914 HydrophobicContact CE1-CD2 4.48Å; F887-V917 HydrophobicContact CE1-CG1 4.49Å; F887-V917 HydrophobicContact CZ-CG1 4.35Å; F887-L937 HydrophobicContact CD2-CB 3.96Å; F887-L937 HydrophobicContact CD2-CD1 4.43Å; F887-L937 HydrophobicContact CD2-CD2 4.48Å; F887-L937 HydrophobicContact CE2-CB 4.2Å; F887-L937 HydrophobicContact CE2-CD1 4.25Å; F887-L938 HydrophobicContact CD1-CD2 4.15Å; F887-L938 HydrophobicContact CE1-CD2 3.7Å; F887-L938 HydrophobicContact CZ-CD2 4.07Å; F887-L941 HydrophobicContact CB-CD1 4.09Å; F887-L941 HydrophobicContact CD1-CD1 3.57Å; F887-L941 HydrophobicContact CE1-CD1 4.42Å; F887-L941 HydrophobicContact CG-CD1 4.2Å
888D91.5Very high87.8Confident113 Ų11345 Ų4560%0.60423%0.23SC*.Hα-helixtrans-67.1-39174.1-55.3-38.6000111.4G885 I886 T891 S892G885-D888 PolarHBondContact O-N 3.25Å; I886-D888 VanDerWaalsContact C-N 3.31Å; I886-D888 PolarHBondContact O-N 3.34Å; D888-T891 PolarHBondContact O-N 3.3Å; D888-S892 WeakPolarHBondContact O-CB 3.26Å; D888-S892 PolarHBondContact O-N 3.03Å; D888-S892 PolarHBondContact O-OG 2.78Å
889I92.2Very high87.3Confident28 Ų2847.7 Ų47.714%0.14425%0.251CS..Hα-helixtrans-65.1-46.1176.4-59.8165000110.3V825 F828 K829 L832 G885 I886 S892 S893V825-I889 HydrophobicContact CG1-CD1 3.88Å; F828-I889 HydrophobicContact CD1-CD1 4.36Å; F828-I889 HydrophobicContact CD1-CG2 4.3Å; F828-I889 HydrophobicContact CE1-CB 4.47Å; F828-I889 HydrophobicContact CE1-CG2 3.93Å; K829-I889 HydrophobicContact CD-CD1 4.18Å; K829-I889 HydrophobicContact CG-CD1 3.79Å; K829-I889 HydrophobicContact CG-CG1 4.47Å; L832-I889 HydrophobicContact CD1-CG2 3.52Å; G885-I889 WeakPolarHBondContact O-CG1 3.07Å; G885-I889 PolarHBondContact O-N 3.49Å; I886-I889 WeakPolarHBondContact O-CB 3.32Å; I886-I889 PolarHBondContact O-N 3.16Å; I889-S892 PolarHBondContact O-N 3.2Å; I889-S893 PolarHBondContact O-N 2.93Å
890L93.2Very high86.5Confident0 Ų052.7 Ų52.70%028%0.278CS..Hα-helixtrans-62.8-44.4177-66.1175.7000110.9F828 I886 F887 S892 S893 L894 S910 I913 L914 L941F828-L890 HydrophobicContact CE1-CD2 4.21Å; F828-L890 HydrophobicContact CZ-CD2 3.84Å; I886-L890 HydrophobicContact CG1-CD1 4.27Å; I886-L890 HydrophobicContact CG1-CG 4.35Å; I886-L890 VanDerWaalsContact O-CG 3.3Å; I886-L890 WeakPolarHBondContact O-CG 3.21Å; I886-L890 PolarHBondContact O-N 3.04Å; F887-L890 HydrophobicContact CD1-CD1 4.15Å; F887-L890 PolarHBondContact O-N 2.83Å; L890-S892 VanDerWaalsContact C-N 3.35Å; L890-S892 PolarHBondContact O-N 2.94Å; L890-S893 PolarHBondContact O-N 3.26Å; L890-L894 WeakPolarHBondContact O-CB 3.33Å; L890-L894 VanDerWaalsContact O-CG 3.26Å; L890-L894 WeakPolarHBondContact O-CG 3.44Å; L890-L894 PolarHBondContact O-N 3.44Å; L890-S910 WeakPolarHBondContact CD2-OG 3.46Å; L890-I913 HydrophobicContact CD1-CG2 3.98Å; L890-I913 HydrophobicContact CD2-CD1 4.19Å; L890-L914 HydrophobicContact CD1-CD2 4.06Å; L890-L914 HydrophobicContact CD1-CG 4.47Å; L890-L941 HydrophobicContact CB-CD2 4.06Å
891T91.3Very high85.5Confident15 Ų1558.5 Ų58.59%0.09230%0.3CS..Hα-helixtrans-60.2-46.7177.8-580000110.6F887 D888 S893 L894 Q895 P940 L941F887-T891 VanDerWaalsContact O-CB 3.31Å; F887-T891 WeakPolarHBondContact O-CB 3.41Å; F887-T891 PolarHBondContact O-N 2.91Å; F887-T891 PolarHBondContact O-OG1 3Å; D888-T891 PolarHBondContact O-N 3.3Å; T891-S893 PolarHBondContact O-N 3.26Å; T891-L894 PolarHBondContact O-N 3.01Å; T891-Q895 HydrophobicContact CG2-CG 4.21Å; T891-Q895 WeakPolarHBondContact O-CB 3.33Å; T891-Q895 VanDerWaalsContact O-CG 3.3Å; T891-Q895 WeakPolarHBondContact O-CG 3.16Å; T891-Q895 PolarHBondContact O-N 3.41Å; T891-P940 HydrophobicContact CG2-CB 4.19Å; T891-L941 VanDerWaalsContact OG1-CD2 3.26Å; T891-L941 WeakPolarHBondContact OG1-CD2 3.34Å; T891-L941 WeakPolarHBondContact OG1-CG 3.48Å
892S90Very high84.9Confident64 Ų6453.8 Ų53.845%0.44829%0.291SS..Hα-helixtrans-61.6-41177.9-58.40000112.6D888 I889 L890 K896D888-S892 WeakPolarHBondContact O-CB 3.26Å; D888-S892 PolarHBondContact O-N 3.03Å; D888-S892 PolarHBondContact O-OG 2.78Å; I889-S892 PolarHBondContact O-N 3.2Å; L890-S892 VanDerWaalsContact C-N 3.35Å; L890-S892 PolarHBondContact O-N 2.94Å; S892-K896 WeakPolarHBondContact O-CG 3.39Å; S892-K896 PolarHBondContact O-N 3Å
893S89Confident84.4Confident7 Ų752.9 Ų52.95%0.04929%0.29CS..Hα-helixtrans-64.8-46.1176172.50000111.4I889 L890 T891 K896 D906 V907 S910I889-S893 PolarHBondContact O-N 2.93Å; L890-S893 PolarHBondContact O-N 3.26Å; T891-S893 PolarHBondContact O-N 3.26Å; S893-K896 PolarHBondContact O-N 3.03Å; S893-D906 PolarHBondContact OG-O 3.43Å; S893-D906 PolarHBondContact OG-OD2 3.07Å; S893-V907 WeakPolarHBondContact O-CG2 3.43Å; S893-S910 PolarHBondContact OG-OG 3.12Å
894L90.2Very high84.1Confident0 Ų055 Ų550%030%0.303CS..Hα-helixtrans-69.3-36.1-179.9-64.7174.7000112.6L890 T891 K896 H897 V907 L911 L914 L941 V944 V945 I948L890-L894 WeakPolarHBondContact O-CB 3.33Å; L890-L894 VanDerWaalsContact O-CG 3.26Å; L890-L894 WeakPolarHBondContact O-CG 3.44Å; L890-L894 PolarHBondContact O-N 3.44Å; T891-L894 PolarHBondContact O-N 3.01Å; L894-K896 VanDerWaalsContact C-N 3.34Å; L894-K896 PolarHBondContact O-N 2.8Å; L894-H897 WeakPolarHBondContact O-CB 3.42Å; L894-H897 PolarHBondContact O-N 3.41Å; L894-H897 VanDerWaalsContact O-N 3.17Å; L894-V907 HydrophobicContact CD2-CB 4.44Å; L894-V907 HydrophobicContact CD2-CG1 3.79Å; L894-L911 HydrophobicContact CD2-CD2 3.99Å; L894-L911 HydrophobicContact CD2-CG 4.05Å; L894-L914 HydrophobicContact CD1-CD1 3.85Å; L894-L941 HydrophobicContact CD1-CD2 3.72Å; L894-V944 HydrophobicContact CB-CG1 3.48Å; L894-V944 VanDerWaalsContact CB-CG1 3.48Å; L894-V945 HydrophobicContact CD1-CG2 3.85Å; L894-I948 HydrophobicContact CB-CD1 4.4Å; L894-I948 HydrophobicContact CD2-CD1 3.9Å
895Q87.9Confident84Confident93 Ų9355.1 Ų55.144%0.43530%0.298SS..Hα-helixtrans-65.7-33.4177.3-78.2176.5-18.700112.7T891 H897 L898 V899 V944T891-Q895 HydrophobicContact CG2-CG 4.21Å; T891-Q895 WeakPolarHBondContact O-CB 3.33Å; T891-Q895 VanDerWaalsContact O-CG 3.3Å; T891-Q895 WeakPolarHBondContact O-CG 3.16Å; T891-Q895 PolarHBondContact O-N 3.41Å; Q895-H897 PolarHBondContact O-N 3.29Å; Q895-L898 WeakPolarHBondContact O-CB 3.44Å; Q895-L898 PolarHBondContact O-N 3.01Å; Q895-V899 PolarHBondContact O-N 3.27Å; Q895-V944 HydrophobicContact CG-CG2 3.86Å
896K80.7Confident84Confident124 Ų12454.5 Ų54.554%0.53929%0.289SS..Hα-helixtrans-57-35.1172.8-72.9175.9-177.1-176.20112.2S892 S893 L894 L898 V899 D900S892-K896 WeakPolarHBondContact O-CG 3.39Å; S892-K896 PolarHBondContact O-N 3Å; S893-K896 PolarHBondContact O-N 3.03Å; L894-K896 VanDerWaalsContact C-N 3.34Å; L894-K896 PolarHBondContact O-N 2.8Å; K896-L898 VanDerWaalsContact C-N 3.31Å; K896-L898 PolarHBondContact O-N 2.86Å; K896-V899 PolarHBondContact O-N 2.74Å; K896-D900 PolarHBondContact O-N 2.69Å
897H75.4Confident83.9Confident8 Ų854.5 Ų54.54%0.03729%0.289CS..Hα-helixtrans-60.3-40.3173.9-174.266.4000112.6L894 Q895 V899 K901 V902 C903 V907L894-H897 WeakPolarHBondContact O-CB 3.42Å; L894-H897 PolarHBondContact O-N 3.41Å; L894-H897 VanDerWaalsContact O-N 3.17Å; Q895-H897 PolarHBondContact O-N 3.29Å; H897-V899 VanDerWaalsContact C-N 3.32Å; H897-K901 WeakPolarHBondContact O-CA 3.27Å; H897-K901 PolarHBondContact O-N 2.6Å; H897-V902 PolarHBondContact ND1-O 2.9Å; H897-C903 VanDerWaalsContact CE1-SG 3.55Å; H897-V907 HydrophobicContact CB-CG1 4.17Å; H897-V907 HydrophobicContact CB-CG2 3.9Å
898L75.9Confident83.8Confident43 Ų4356.9 Ų56.923%0.22530%0.299CS..Hα-helixtrans-67.8-35.3-179.2-59.2-176.5000111.8Q895 K896 V944 E947 I948Q895-L898 WeakPolarHBondContact O-CB 3.44Å; Q895-L898 PolarHBondContact O-N 3.01Å; K896-L898 VanDerWaalsContact C-N 3.31Å; K896-L898 PolarHBondContact O-N 2.86Å; L898-V944 HydrophobicContact CD1-CB 4.25Å; L898-V944 HydrophobicContact CD1-CG1 3.79Å; L898-V944 HydrophobicContact CD1-CG2 4.05Å; L898-V944 HydrophobicContact CG-CG1 4.09Å; L898-E947 WeakPolarHBondContact CD1-OE2 3.42Å; L898-E947 HydrophobicContact CD2-CB 3.99Å; L898-E947 VanDerWaalsContact CD2-CD 3.49Å; L898-E947 HydrophobicContact CD2-CG 3.76Å; L898-I948 HydrophobicContact CD2-CG1 4.39Å
899V74.5Confident83.7Confident116 Ų11652.1 Ų52.170%0.70327%0.273SS*.Hα-helixtrans-75.8-54.5179.4-179.60000111.2Q895 K896 H897Q895-V899 PolarHBondContact O-N 3.27Å; K896-V899 PolarHBondContact O-N 2.74Å; H897-V899 VanDerWaalsContact C-N 3.32Å
900D72.1Confident83.8Confident106 Ų10650.8 Ų50.857%0.56727%0.267SS*.Hα-helixtrans-86.9-16.9-170.5-60.3-31.3000112.7K896 V902K896-D900 PolarHBondContact O-N 2.69Å; D900-V902 HydrophobicContact CB-CB 4.36Å; D900-V902 HydrophobicContact CB-CG2 4Å; D900-V902 WeakPolarHBondContact O-CG2 3.29Å; D900-V902 PolarHBondContact O-N 2.7Å; D900-V902 VanDerWaalsContact O-N 3.11Å
901K68.1Low83.8Confident170 Ų17050.8 Ų50.874%0.73927%0.267SS*.  trans5421.4-169.6-62.3-175.7178.3177.70114H897H897-K901 WeakPolarHBondContact O-CA 3.27Å; H897-K901 PolarHBondContact O-N 2.6Å
902V72.2Confident83.7Confident81 Ų8151.8 Ų51.849%0.49127%0.273SS..  trans-94.7131.2178.3-175.60000110.4H897 D900 T904H897-V902 PolarHBondContact ND1-O 2.9Å; D900-V902 HydrophobicContact CB-CB 4.36Å; D900-V902 HydrophobicContact CB-CG2 4Å; D900-V902 WeakPolarHBondContact O-CG2 3.29Å; D900-V902 PolarHBondContact O-N 2.7Å; D900-V902 VanDerWaalsContact O-N 3.11Å; V902-T904 HydrophobicContact CB-CG2 4.32Å; V902-T904 HydrophobicContact CG1-CG2 3.75Å; V902-T904 PolarHBondContact O-N 3.4Å
903C75.3Confident83.8Confident43 Ų4348.7 Ų48.729%0.29125%0.251SS..  trans-84.989.9176-66.20000110.6H897 V954 F957H897-C903 VanDerWaalsContact CE1-SG 3.55Å; C903-V954 HydrophobicContact CB-CG2 3.99Å; C903-V954 WeakPolarHBondContact SG-CG2 3.2Å; C903-F957 HydrophobicContact CB-CD2 4.25Å; C903-F957 HydrophobicContact CB-CE1 4.27Å; C903-F957 HydrophobicContact CB-CE2 3.69Å; C903-F957 HydrophobicContact CB-CZ 3.69Å
904T84.5Confident83.9Confident45 Ų4548.4 Ų48.428%0.27625%0.249SC..  trans-96.2160.7-178.854.40000112.8V902 D906 V907 Y908 F957V902-T904 HydrophobicContact CB-CG2 4.32Å; V902-T904 HydrophobicContact CG1-CG2 3.75Å; V902-T904 PolarHBondContact O-N 3.4Å; T904-D906 WeakPolarHBondContact CB-OD1 3.44Å; T904-D906 PolarHBondContact O-N 3.48Å; T904-D906 PolarHBondContact OG1-OD1 2.9Å; T904-V907 PolarHBondContact O-N 3.07Å; T904-V907 WeakPolarHBondContact OG1-CG2 3.13Å; T904-Y908 PolarHBondContact O-N 3.36Å; T904-F957 WeakPolarHBondContact O-CZ 2.86Å
905M87.5Confident83.9Confident74 Ų7449.5 Ų49.537%0.36526%0.257SS..Hα-helixtrans-68.6-30.2-176.6-75.5-64-6900113.6L835 V907 Y908 V909L835-M905 HydrophobicContact CB-CB 4.33Å; L835-M905 HydrophobicContact CD2-CB 4.47Å; M905-V907 VanDerWaalsContact C-N 3.33Å; M905-Y908 PolarHBondContact O-N 2.85Å; M905-V909 WeakPolarHBondContact O-CB 3.3Å; M905-V909 WeakPolarHBondContact O-CG2 3.43Å; M905-V909 PolarHBondContact O-N 2.83Å
906D87.8Confident83.8Confident10 Ų1046.1 Ų46.15%0.05324%0.242CC..Hα-helixtrans-65-36.1175.764.3-53.1000111.9L832 T836 S893 T904 V909 S910L832-D906 HydrophobicContact CD2-CB 4.01Å; T836-D906 HydrophobicContact CG2-CB 4Å; T836-D906 VanDerWaalsContact CG2-OD1 3.31Å; T836-D906 WeakPolarHBondContact CG2-OD1 3.37Å; S893-D906 PolarHBondContact OG-O 3.43Å; S893-D906 PolarHBondContact OG-OD2 3.07Å; T904-D906 WeakPolarHBondContact CB-OD1 3.44Å; T904-D906 PolarHBondContact O-N 3.48Å; T904-D906 PolarHBondContact OG1-OD1 2.9Å; D906-V909 PolarHBondContact O-N 2.83Å; D906-S910 WeakPolarHBondContact O-CB 3.45Å; D906-S910 PolarHBondContact O-N 3.47Å; D906-S910 PolarHBondContact O-OG 2.94Å
907V89.8Confident84.2Confident0 Ų040.2 Ų40.20%022%0.217CC..Hα-helixtrans-65.9-46.2173.9174.60000110.2S893 L894 H897 T904 M905 V909 S910 L911 I948 F957S893-V907 WeakPolarHBondContact O-CG2 3.43Å; L894-V907 HydrophobicContact CD2-CB 4.44Å; L894-V907 HydrophobicContact CD2-CG1 3.79Å; H897-V907 HydrophobicContact CB-CG1 4.17Å; H897-V907 HydrophobicContact CB-CG2 3.9Å; T904-V907 PolarHBondContact O-N 3.07Å; T904-V907 WeakPolarHBondContact OG1-CG2 3.13Å; M905-V907 VanDerWaalsContact C-N 3.33Å; V907-V909 VanDerWaalsContact C-N 3.31Å; V907-V909 PolarHBondContact O-N 3.04Å; V907-S910 PolarHBondContact O-N 3.5Å; V907-L911 WeakPolarHBondContact O-CG 3.42Å; V907-L911 PolarHBondContact O-N 2.8Å; V907-I948 HydrophobicContact CG1-CD1 4.34Å; V907-F957 HydrophobicContact CB-CE1 3.81Å; V907-F957 HydrophobicContact CG1-CD1 3.74Å; V907-F957 HydrophobicContact CG1-CE1 3.51Å
908Y90.1Very high84.5Confident55 Ų5544.1 Ų44.122%0.21623%0.232CC..Hα-helixtrans-60.2-41.2176.4179.4-95.7000112.2T904 M905 T912 R956 M960T904-Y908 PolarHBondContact O-N 3.36Å; M905-Y908 PolarHBondContact O-N 2.85Å; Y908-T912 WeakPolarHBondContact O-CB 3.41Å; Y908-T912 PolarHBondContact O-N 3.45Å; Y908-T912 PolarHBondContact O-OG1 2.91Å; Y908-R956 HydrophobicContact CD2-CG 4.37Å; Y908-R956 HydrophobicContact CE2-CG 3.75Å; Y908-R956 PolarHBondContact OH-NE 3.16Å; Y908-R956 PolarHBondContact OH-NH2 2.78Å; Y908-R956 VanDerWaalsContact OH-NH2 3.12Å; Y908-M960 HydrophobicContact CD2-CG 3.91Å; Y908-M960 HydrophobicContact CE1-CE 4.3Å; Y908-M960 HydrophobicContact CE2-CE 3.67Å; Y908-M960 HydrophobicContact CE2-CG 3.46Å; Y908-M960 VanDerWaalsContact CE2-CG 3.46Å; Y908-M960 HydrophobicContact CE2-SD 4.43Å; Y908-M960 VanDerWaalsContact CZ-CE 3.42Å; Y908-M960 WeakPolarHBondContact OH-CE 3.27Å
909V90.9Very high84.6Confident12 Ų1243.2 Ų43.27%0.07323%0.229CC..Hα-helixtrans-64.2-43.1174.7160.50000111.6L832 L835 L850 M905 D906 V907 L911 T912 I913L832-V909 HydrophobicContact CD2-CB 4.29Å; L832-V909 HydrophobicContact CD2-CG1 3.72Å; L835-V909 HydrophobicContact CD1-CB 4.42Å; L835-V909 HydrophobicContact CD1-CG2 3.77Å; L850-V909 HydrophobicContact CD1-CG1 4.24Å; L850-V909 HydrophobicContact CD2-CB 3.9Å; L850-V909 HydrophobicContact CD2-CG1 3.31Å; L850-V909 HydrophobicContact CD2-CG2 3.28Å; L850-V909 HydrophobicContact CG-CG1 4.36Å; M905-V909 WeakPolarHBondContact O-CB 3.3Å; M905-V909 WeakPolarHBondContact O-CG2 3.43Å; M905-V909 PolarHBondContact O-N 2.83Å; D906-V909 PolarHBondContact O-N 2.83Å; V907-V909 VanDerWaalsContact C-N 3.31Å; V907-V909 PolarHBondContact O-N 3.04Å; V909-L911 VanDerWaalsContact C-N 3.33Å; V909-L911 PolarHBondContact O-N 3.46Å; V909-T912 WeakPolarHBondContact O-CA 3.4Å; V909-T912 WeakPolarHBondContact O-CB 3.27Å; V909-T912 PolarHBondContact O-N 3.37Å; V909-T912 VanDerWaalsContact O-N 3.07Å; V909-I913 HydrophobicContact CG1-CD1 3.89Å; V909-I913 WeakPolarHBondContact O-CG1 3.41Å; V909-I913 PolarHBondContact O-N 3.13Å
910S92.8Very high84.6Confident0 Ų040.9 Ų40.90%021%0.212CC..Hα-helixtrans-60.4-44.9179.2-65.10000111.1L890 S893 D906 V907 T912 I913 L914L890-S910 WeakPolarHBondContact CD2-OG 3.46Å; S893-S910 PolarHBondContact OG-OG 3.12Å; D906-S910 WeakPolarHBondContact O-CB 3.45Å; D906-S910 PolarHBondContact O-N 3.47Å; D906-S910 PolarHBondContact O-OG 2.94Å; V907-S910 PolarHBondContact O-N 3.5Å; S910-T912 VanDerWaalsContact C-N 3.33Å; S910-T912 PolarHBondContact O-N 3.22Å; S910-I913 PolarHBondContact O-N 3.45Å; S910-L914 WeakPolarHBondContact O-CG 3.43Å; S910-L914 PolarHBondContact O-N 3.1Å
911L93Very high84.1Confident0 Ų038.4 Ų38.40%020%0.203CC..Hα-helixtrans-62.4-39172.8-62.9174000112.4L894 V907 V909 I913 L914 S915 V945 I948 F957 M960 A961 A964L894-L911 HydrophobicContact CD2-CD2 3.99Å; L894-L911 HydrophobicContact CD2-CG 4.05Å; V907-L911 WeakPolarHBondContact O-CG 3.42Å; V907-L911 PolarHBondContact O-N 2.8Å; V909-L911 VanDerWaalsContact C-N 3.33Å; V909-L911 PolarHBondContact O-N 3.46Å; L911-I913 PolarHBondContact O-N 3.33Å; L911-L914 PolarHBondContact O-N 3.35Å; L911-S915 PolarHBondContact O-N 3.26Å; L911-V945 HydrophobicContact CD2-CG1 4Å; L911-V945 HydrophobicContact CD2-CG2 3.95Å; L911-I948 HydrophobicContact CD1-CG2 4.28Å; L911-F957 HydrophobicContact CD1-CD1 4.12Å; L911-M960 HydrophobicContact CB-CB 3.77Å; L911-M960 HydrophobicContact CD1-CB 3.87Å; L911-M960 HydrophobicContact CG-CB 4.46Å; L911-A961 HydrophobicContact CD1-CB 4.48Å; L911-A961 HydrophobicContact CD2-CB 4.31Å; L911-A964 HydrophobicContact CD2-CB 4.35Å
912T90.5Very high83.3Confident36 Ų3635.2 Ų35.222%0.22119%0.186CC..Hα-helixtrans-62.1-43177.2-580000111.3Y908 V909 S910 S915Y908-T912 WeakPolarHBondContact O-CB 3.41Å; Y908-T912 PolarHBondContact O-N 3.45Å; Y908-T912 PolarHBondContact O-OG1 2.91Å; V909-T912 WeakPolarHBondContact O-CA 3.4Å; V909-T912 WeakPolarHBondContact O-CB 3.27Å; V909-T912 PolarHBondContact O-N 3.37Å; V909-T912 VanDerWaalsContact O-N 3.07Å; S910-T912 VanDerWaalsContact C-N 3.33Å; S910-T912 PolarHBondContact O-N 3.22Å; T912-S915 PolarHBondContact O-N 3.42Å; T912-S915 PolarHBondContact O-OG 2.92Å
913I91Very high82Confident0 Ų034.2 Ų34.20%018%0.183CC..Hα-helixtrans-63.9-45.1176.2-71.4166.8000110.6F828 W853 L854 F858 L879 L890 V909 S910 L911 S915 T916F828-I913 HydrophobicContact CD2-CD1 4.47Å; F828-I913 HydrophobicContact CE2-CD1 3.32Å; F828-I913 HydrophobicContact CZ-CD1 3.42Å; F828-I913 VanDerWaalsContact CZ-CD1 3.42Å; W853-I913 HydrophobicContact CZ3-CD1 4.36Å; L854-I913 HydrophobicContact CD2-CD1 4.21Å; L854-I913 HydrophobicContact CD2-CG1 3.63Å; F858-I913 HydrophobicContact CE2-CG2 4.42Å; F858-I913 HydrophobicContact CZ-CG2 4.11Å; L879-I913 HydrophobicContact CD2-CG2 4.42Å; L890-I913 HydrophobicContact CD1-CG2 3.98Å; L890-I913 HydrophobicContact CD2-CD1 4.19Å; V909-I913 HydrophobicContact CG1-CD1 3.89Å; V909-I913 WeakPolarHBondContact O-CG1 3.41Å; V909-I913 PolarHBondContact O-N 3.13Å; S910-I913 PolarHBondContact O-N 3.45Å; L911-I913 PolarHBondContact O-N 3.33Å; I913-S915 VanDerWaalsContact C-N 3.26Å; I913-S915 PolarHBondContact O-N 2.94Å; I913-T916 WeakPolarHBondContact O-CA 3.27Å; I913-T916 PolarHBondContact O-N 3.12Å; I913-T916 PolarHBondContact O-OG1 2.68Å
914L92.1Very high80.1Confident0 Ų035.4 Ų35.40%019%0.192CC..Hα-helixtrans-62.7-32.7178.5-66.2173000112.7F887 L890 L894 S910 L911 T916 V917 L941 V945 A964 I968F887-L914 HydrophobicContact CE1-CD2 4.48Å; L890-L914 HydrophobicContact CD1-CD2 4.06Å; L890-L914 HydrophobicContact CD1-CG 4.47Å; L894-L914 HydrophobicContact CD1-CD1 3.85Å; S910-L914 WeakPolarHBondContact O-CG 3.43Å; S910-L914 PolarHBondContact O-N 3.1Å; L911-L914 PolarHBondContact O-N 3.35Å; L914-T916 PolarHBondContact O-N 3.41Å; L914-T916 VanDerWaalsContact O-N 3.09Å; L914-V917 PolarHBondContact O-N 3.16Å; L914-V917 VanDerWaalsContact O-N 3.08Å; L914-L941 HydrophobicContact CD1-CD2 4.21Å; L914-L941 HydrophobicContact CD2-CD1 3.85Å; L914-V945 HydrophobicContact CD1-CG2 3.81Å; L914-A964 HydrophobicContact CB-CB 3.7Å; L914-I968 HydrophobicContact CB-CG2 4.23Å; L914-I968 HydrophobicContact CD2-CG2 4.41Å; L914-I968 WeakPolarHBondContact O-CG2 3.35Å
915S89Confident78.2Confident24 Ų2438.4 Ų38.417%0.16821%0.211CC..THydrogen-bonded Turntrans-64.7-10.3172.979.90000114.3L911 T912 I913 S967L911-S915 PolarHBondContact O-N 3.26Å; T912-S915 PolarHBondContact O-N 3.42Å; T912-S915 PolarHBondContact O-OG 2.92Å; I913-S915 VanDerWaalsContact C-N 3.26Å; I913-S915 PolarHBondContact O-N 2.94Å; S915-S967 PolarHBondContact O-OG 2.84Å
916T87.3Confident75.7Confident21 Ų2144 Ų4413%0.12923%0.233CC..THydrogen-bonded Turntrans-108.17.4176600000113.8F858 R873 L874 I913 L914F858-T916 WeakPolarHBondContact CE1-OG1 3.12Å; F858-T916 VanDerWaalsContact CZ-OG1 3.29Å; F858-T916 WeakPolarHBondContact CZ-OG1 3.39Å; R873-T916 WeakPolarHBondContact CA-O 3.31Å; R873-T916 VanDerWaalsContact CB-O 3.31Å; R873-T916 WeakPolarHBondContact CB-O 3.38Å; L874-T916 PolarHBondContact N-O 2.82Å; L874-T916 VanDerWaalsContact N-O 3.14Å; I913-T916 WeakPolarHBondContact O-CA 3.27Å; I913-T916 PolarHBondContact O-N 3.12Å; I913-T916 PolarHBondContact O-OG1 2.68Å; L914-T916 PolarHBondContact O-N 3.41Å; L914-T916 VanDerWaalsContact O-N 3.09Å
917V87.8Confident73.2Confident0 Ų048.6 Ų48.60%027%0.272CS..EExtended strand (participates in β ladder)trans-110.7134.7179.2177.20000110.2F858 L874 D876 L879 F887 L914 L938 S967 I968F858-V917 HydrophobicContact CE1-CG2 4.41Å; L874-V917 WeakPolarHBondContact O-CA 3.42Å; D876-V917 HydrophobicContact CB-CG1 3.97Å; L879-V917 HydrophobicContact CD2-CG2 3.44Å; L879-V917 VanDerWaalsContact CD2-CG2 3.44Å; F887-V917 HydrophobicContact CE1-CG1 4.49Å; F887-V917 HydrophobicContact CZ-CG1 4.35Å; L914-V917 PolarHBondContact O-N 3.16Å; L914-V917 VanDerWaalsContact O-N 3.08Å; V917-L938 HydrophobicContact CG1-CD2 4.36Å; V917-S967 CarbonylContact O-C 3.53Å; V917-S967 VanDerWaalsContact O-C 3.27Å; V917-S967 WeakPolarHBondContact O-CB 3.2Å; V917-S967 VanDerWaalsContact O-O 3.1Å; V917-S967 PolarHBondContact O-OG 3.04Å; V917-I968 HydrophobicContact CB-CG2 4.31Å
918Y82.7Confident70.9Confident90 Ų9054.9 Ų54.935%0.35331%0.311SS..EExtended strand (participates in β ladder)trans-113.2146.3171.969.4-92000111.9R873 L874 S875 D876 N920R873-Y918 HydrophobicContact CB-CD1 3.92Å; R873-Y918 HydrophobicContact CB-CE1 4.47Å; L874-Y918 VanDerWaalsContact C-CD1 3.47Å; L874-Y918 VanDerWaalsContact O-CD1 3.24Å; L874-Y918 WeakPolarHBondContact O-CD1 3.4Å; L874-Y918 PolarHBondContact O-N 2.64Å; S875-Y918 WeakPolarHBondContact CA-O 3.08Å; D876-Y918 PolarHBondContact N-O 3.16Å; D876-Y918 VanDerWaalsContact N-O 3.12Å; Y918-N920 HydrophobicContact CE2-CB 4.25Å; Y918-N920 PolarHBondContact O-N 3.01Å
919P78.8Confident68Low25 Ų2563.1 Ų63.116%0.16234%0.342CS..  trans-75.2119.1-176.229.4-34.1000110.6W922 L938 S967 I968P919-W922 HydrophobicContact CB-CG 4.07Å; P919-L938 HydrophobicContact CB-CD1 4.02Å; P919-S967 WeakPolarHBondContact CD-O 3.5Å; P919-I968 WeakPolarHBondContact CB-O 3.34Å; P919-I968 WeakPolarHBondContact CG-O 3.46Å
920N74Confident65Low67 Ų6766.6 Ų66.636%0.35837%0.365SS..  trans-120.1-19.6171-161.378.3000112.5D876 Y918 W922 S923D876-N920 WeakPolarHBondContact OD1-CA 3.22Å; D876-N920 WeakPolarHBondContact OD1-CB 2.99Å; D876-N920 PolarHBondContact OD1-N 3.26Å; Y918-N920 HydrophobicContact CE2-CB 4.25Å; Y918-N920 PolarHBondContact O-N 3.01Å; N920-W922 PolarHBondContact O-N 2.72Å; N920-S923 PolarHBondContact O-N 3.2Å; N920-S923 PolarHBondContact O-OG 3.41Å; N920-S923 VanDerWaalsContact O-OG 3.11Å; N920-S923 PolarHBondContact OD1-OG 3.14Å
921S60.1Low62.2Low53 Ų5371.9 Ų71.937%0.37141%0.409SS..THydrogen-bonded Turntrans-55.7-14.3167.155.40000113.6D876D876-S921 PolarHBondContact OD1-N 3.32Å; D876-S921 VanDerWaalsContact OD1-N 3.14Å; D876-S921 WeakPolarHBondContact OD2-CB 3.03Å; D876-S921 PolarHBondContact OD2-N 2.96Å; D876-S921 PolarHBondContact OD2-OG 2.97Å
922W52.5Low59.5Low103 Ų10379.1 Ų79.139%0.3945%0.448SS..THydrogen-bonded Turntrans-87.2-27.7179.4-72.163.1000113.6P919 N920 S924 W942 P970 W972 K973P919-W922 HydrophobicContact CB-CG 4.07Å; N920-W922 PolarHBondContact O-N 2.72Å; W922-S924 PolarHBondContact O-N 3.31Å; W922-S924 VanDerWaalsContact O-N 3.11Å; W922-W942 AromaticContact CE2-CH2 3.32Å; W922-W942 AromaticContact CE2-CZ2 3.9Å; W922-W942 AromaticContact CH2-CH2 3.95Å; W922-W942 HydrophobicContact CH2-CH2 3.95Å; W922-W942 HydrophobicContact CH2-CZ3 4.19Å; W922-W942 AromaticContact CZ2-CH2 3.03Å; W922-W942 HydrophobicContact CZ2-CH2 3.03Å; W922-W942 HydrophobicContact CZ2-CZ2 4.04Å; W922-W942 AromaticContact CZ2-CZ3 3.62Å; W922-W942 HydrophobicContact CZ2-CZ3 3.62Å; W922-W942 AromaticContact NE1-CH2 3.47Å; W922-W942 AromaticContact NE1-CZ2 3.68Å; W922-P970 HydrophobicContact CE3-CG 4.08Å; W922-W972 HydrophobicContact CE3-CZ2 4.3Å; W922-W972 HydrophobicContact CZ3-CH2 4.35Å; W922-W972 AromaticContact CZ3-CZ2 3.9Å; W922-W972 HydrophobicContact CZ3-CZ2 3.9Å; W922-K973 HydrophobicContact CH2-CD 4.24Å; W922-K973 HydrophobicContact CZ3-CD 3.97Å
923S44.7Very low57Low61 Ų6181.1 Ų81.143%0.42746%0.463SS..SBendtrans-82.797.3-174.967.10000110N920N920-S923 PolarHBondContact O-N 3.2Å; N920-S923 PolarHBondContact O-OG 3.41Å; N920-S923 VanDerWaalsContact O-OG 3.11Å; N920-S923 PolarHBondContact OD1-OG 3.14Å
924S35.8Very low54.4Low67 Ų6786.1 Ų86.147%0.46950%0.496SS..SBendtrans77.3128.7149.469.80000119.3W922 F926W922-S924 PolarHBondContact O-N 3.31Å; W922-S924 VanDerWaalsContact O-N 3.11Å; S924-F926 PolarHBondContact O-N 3.19Å
925T44.5Very low52.2Low109 Ų10992.5 Ų92.567%0.66953%0.53SS*.SBendtrans71-0.3142.69.20000123
926F35.4Very low51.1Low192 Ų19292.8 Ų92.884%0.84254%0.537SS*.  trans-902170.9-79.2-80.8000115.4S924 T928 R929S924-F926 PolarHBondContact O-N 3.19Å; F926-T928 PolarHBondContact O-N 3.35Å; F926-T928 VanDerWaalsContact O-N 3.09Å; F926-R929 PolarHBondContact O-N 3.49Å
927A35.4Very low50.6Low106 Ų10694.2 Ų94.288%0.87654%0.543SS*.THydrogen-bonded Turntrans-68.9-5.9-175.900000115.3
928T39.8Very low50.4Low132 Ų13294.2 Ų94.281%0.8154%0.543SS*.THydrogen-bonded Turntrans-96.9-1.1177.836.80000115.7F926F926-T928 PolarHBondContact O-N 3.35Å; F926-T928 VanDerWaalsContact O-N 3.09Å
929R29.1Very low50.3Low227 Ų22793.2 Ų93.286%0.85754%0.544SS*.SBendtrans-148.485169.8-71.2-169.4-175.1176.92113.2F926F926-R929 PolarHBondContact O-N 3.49Å
930C29.2Very low50.5Low85 Ų8595 Ų9557%0.57456%0.555SS**  trans161.7110.2133.8-95.70000108.1D932 S933C930-D932 PolarHBondContact O-N 2.73Å; C930-D932 VanDerWaalsContact O-N 3.12Å; C930-S933 PolarHBondContact O-N 3.28Å; C930-S933 VanDerWaalsContact O-N 3.12Å; C930-S933 PolarHBondContact O-OG 3.12Å
931A34.1Very low51.2Low111 Ų11191.8 Ų91.892%0.91754%0.538SS*.THydrogen-bonded Turntrans-61.9-10.716600000112.4
932D35.3Very low52.4Low152 Ų15290.3 Ų90.381%0.81352%0.524SS*.THydrogen-bonded Turntrans-98.511.1175.2-59.5-36.2000113.8C930 P934C930-D932 PolarHBondContact O-N 2.73Å; C930-D932 VanDerWaalsContact O-N 3.12Å; D932-P934 WeakPolarHBondContact O-CD 3.36Å
933S38.5Very low53.8Low78 Ų7892.2 Ų92.255%0.54554%0.538SS..SBendtrans-70.4117.9168.371.10000107.8C930 D935C930-S933 PolarHBondContact O-N 3.28Å; C930-S933 VanDerWaalsContact O-N 3.12Å; C930-S933 PolarHBondContact O-OG 3.12Å; S933-D935 PolarHBondContact O-N 3.4Å; S933-D935 VanDerWaalsContact O-N 3.12Å
934P36.9Very low55.9Low105 Ų10589.7 Ų89.768%0.68252%0.52SS*.  trans-56.8125.7-17722.9-31.1000108.3D932 G936D932-P934 WeakPolarHBondContact O-CD 3.36Å; P934-G936 PolarHBondContact O-N 3.14Å
935D46.3Very low58.6Low135 Ų13586.5 Ų86.572%0.72250%0.497SS*.SBendtrans-35.9127174.7-70.3-51.4000109.8S933 L937 L939S933-D935 PolarHBondContact O-N 3.4Å; S933-D935 VanDerWaalsContact O-N 3.12Å; D935-L937 PolarHBondContact O-N 3.41Å; D935-L939 HydrophobicContact CB-CD2 4.04Å
936G65.5Low60.7Low30 Ų3083.3 Ų83.331%0.30948%0.476SS..  trans-38.5132-158.200000114.1P934 L938 L939P934-G936 PolarHBondContact O-N 3.14Å; G936-L938 PolarHBondContact O-N 3.46Å; G936-L939 VanDerWaalsContact O-CB 3.31Å; G936-L939 WeakPolarHBondContact O-CB 3.08Å; G936-L939 PolarHBondContact O-N 2.65Å
937L76Confident63.3Low51 Ų5178.3 Ų78.327%0.26746%0.456SS..THydrogen-bonded Turntrans-43-23.1-171.2-66168.3000116.5N880 F887 D935N880-L937 HydrophobicContact CB-CD1 4.07Å; F887-L937 HydrophobicContact CD2-CB 3.96Å; F887-L937 HydrophobicContact CD2-CD1 4.43Å; F887-L937 HydrophobicContact CD2-CD2 4.48Å; F887-L937 HydrophobicContact CE2-CB 4.2Å; F887-L937 HydrophobicContact CE2-CD1 4.25Å; D935-L937 PolarHBondContact O-N 3.41Å
938L83.9Confident65.9Low0 Ų073.3 Ų73.30%041%0.414CS..THydrogen-bonded Turntrans-97.7-11.9-177.9-60.8173.3000114.3D876 F887 V917 P919 G936 L941 W942 I968D876-L938 HydrophobicContact CB-CD1 3.9Å; D876-L938 HydrophobicContact CB-CD2 4.15Å; D876-L938 HydrophobicContact CB-CG 4.01Å; F887-L938 HydrophobicContact CD1-CD2 4.15Å; F887-L938 HydrophobicContact CE1-CD2 3.7Å; F887-L938 HydrophobicContact CZ-CD2 4.07Å; V917-L938 HydrophobicContact CG1-CD2 4.36Å; P919-L938 HydrophobicContact CB-CD1 4.02Å; G936-L938 PolarHBondContact O-N 3.46Å; L938-L941 HydrophobicContact CD2-CD1 4.24Å; L938-L941 WeakPolarHBondContact O-CB 3.4Å; L938-L941 PolarHBondContact O-N 3.33Å; L938-W942 HydrophobicContact CB-CZ2 3.81Å; L938-W942 VanDerWaalsContact O-CD1 3.23Å; L938-W942 PolarHBondContact O-N 3.3Å; L938-W942 PolarHBondContact O-NE1 2.6Å; L938-I968 HydrophobicContact CD1-CB 4.19Å; L938-I968 HydrophobicContact CD2-CG2 4.46Å
939L81.3Confident68.3Low69 Ų6967 Ų6736%0.36138%0.375SS..Hα-helixtrans-60-48.5-173.6-175.970.9000112.6D935 G936 L941 W942D935-L939 HydrophobicContact CB-CD2 4.04Å; G936-L939 VanDerWaalsContact O-CB 3.31Å; G936-L939 WeakPolarHBondContact O-CB 3.08Å; G936-L939 PolarHBondContact O-N 2.65Å; L939-L941 PolarHBondContact O-N 2.98Å; L939-W942 HydrophobicContact CB-CZ3 4.47Å; L939-W942 HydrophobicContact CD1-CE3 3.63Å; L939-W942 HydrophobicContact CD1-CH2 4.47Å; L939-W942 HydrophobicContact CD1-CZ3 3.49Å; L939-W942 VanDerWaalsContact CD1-CZ3 3.49Å; L939-W942 PolarHBondContact O-N 3.32Å; L939-W942 VanDerWaalsContact O-N 3.11Å
940P83.1Confident71Confident62 Ų6257.4 Ų57.440%0.40334%0.34SS..Hα-helixtrans-61.9-30.4177.8-21.834.2000112.9T891 W942 V944T891-P940 HydrophobicContact CG2-CB 4.19Å; P940-W942 VanDerWaalsContact C-N 3.35Å; P940-V944 WeakPolarHBondContact O-CG2 3.39Å
941L88Confident73.7Confident0 Ų056.8 Ų56.80%033%0.334CS..Hα-helixtrans-72.6-29.6179.6-69.9160.5000111.7F887 L890 T891 L894 L914 L938 L939 V945F887-L941 HydrophobicContact CB-CD1 4.09Å; F887-L941 HydrophobicContact CD1-CD1 3.57Å; F887-L941 HydrophobicContact CE1-CD1 4.42Å; F887-L941 HydrophobicContact CG-CD1 4.2Å; L890-L941 HydrophobicContact CB-CD2 4.06Å; T891-L941 VanDerWaalsContact OG1-CD2 3.26Å; T891-L941 WeakPolarHBondContact OG1-CD2 3.34Å; T891-L941 WeakPolarHBondContact OG1-CG 3.48Å; L894-L941 HydrophobicContact CD1-CD2 3.72Å; L914-L941 HydrophobicContact CD1-CD2 4.21Å; L914-L941 HydrophobicContact CD2-CD1 3.85Å; L938-L941 HydrophobicContact CD2-CD1 4.24Å; L938-L941 WeakPolarHBondContact O-CB 3.4Å; L938-L941 PolarHBondContact O-N 3.33Å; L939-L941 PolarHBondContact O-N 2.98Å; L941-V945 VanDerWaalsContact O-CB 3.3Å; L941-V945 WeakPolarHBondContact O-CB 3.42Å; L941-V945 WeakPolarHBondContact O-CG2 3.28Å; L941-V945 PolarHBondContact O-N 3.18Å
942W84.8Confident76.3Confident21 Ų2151.5 Ų51.58%0.0829%0.29CS..Hα-helixtrans-66.1-47.1-179-65.5-11.6000112.6W922 L938 L939 P940 V944 V945 N946 I968 L969W922-W942 AromaticContact CE2-CH2 3.32Å; W922-W942 AromaticContact CE2-CZ2 3.9Å; W922-W942 AromaticContact CH2-CH2 3.95Å; W922-W942 HydrophobicContact CH2-CH2 3.95Å; W922-W942 HydrophobicContact CH2-CZ3 4.19Å; W922-W942 AromaticContact CZ2-CH2 3.03Å; W922-W942 HydrophobicContact CZ2-CH2 3.03Å; W922-W942 HydrophobicContact CZ2-CZ2 4.04Å; W922-W942 AromaticContact CZ2-CZ3 3.62Å; W922-W942 HydrophobicContact CZ2-CZ3 3.62Å; W922-W942 AromaticContact NE1-CH2 3.47Å; W922-W942 AromaticContact NE1-CZ2 3.68Å; L938-W942 HydrophobicContact CB-CZ2 3.81Å; L938-W942 VanDerWaalsContact O-CD1 3.23Å; L938-W942 PolarHBondContact O-N 3.3Å; L938-W942 PolarHBondContact O-NE1 2.6Å; L939-W942 HydrophobicContact CB-CZ3 4.47Å; L939-W942 HydrophobicContact CD1-CE3 3.63Å; L939-W942 HydrophobicContact CD1-CH2 4.47Å; L939-W942 HydrophobicContact CD1-CZ3 3.49Å; L939-W942 VanDerWaalsContact CD1-CZ3 3.49Å; L939-W942 PolarHBondContact O-N 3.32Å; L939-W942 VanDerWaalsContact O-N 3.11Å; P940-W942 VanDerWaalsContact C-N 3.35Å; W942-V944 VanDerWaalsContact C-N 3.26Å; W942-V944 PolarHBondContact O-N 3.49Å; W942-V945 PolarHBondContact O-N 3.08Å; W942-N946 WeakPolarHBondContact O-CB 3.43Å; W942-N946 PolarHBondContact O-N 2.92Å; W942-I968 VanDerWaalsContact CD1-CD1 3.44Å; W942-L969 HydrophobicContact CD2-CD2 3.65Å; W942-L969 HydrophobicContact CE3-CD2 4.05Å; W942-L969 HydrophobicContact CG-CD2 4.17Å; W942-L969 HydrophobicContact CZ2-CD2 3.99Å; W942-L969 HydrophobicContact CZ3-CD2 4.5Å
943E82.9Confident78.7Confident143 Ų14348.3 Ų48.367%0.66828%0.277SS*.Hα-helixtrans-57.2-46.7-179.2-64.7-176.8167.100110.3E947E943-E947 WeakPolarHBondContact O-CB 3.47Å; E943-E947 PolarHBondContact O-N 3.04Å
944V89Confident81Confident8 Ų847.2 Ų47.25%0.04827%0.268CS..Hα-helixtrans-68.3-46.1-179.1-177.50000112.1L894 Q895 L898 P940 W942 N946 E947 I948L894-V944 HydrophobicContact CB-CG1 3.48Å; L894-V944 VanDerWaalsContact CB-CG1 3.48Å; Q895-V944 HydrophobicContact CG-CG2 3.86Å; L898-V944 HydrophobicContact CD1-CB 4.25Å; L898-V944 HydrophobicContact CD1-CG1 3.79Å; L898-V944 HydrophobicContact CD1-CG2 4.05Å; L898-V944 HydrophobicContact CG-CG1 4.09Å; P940-V944 WeakPolarHBondContact O-CG2 3.39Å; W942-V944 VanDerWaalsContact C-N 3.26Å; W942-V944 PolarHBondContact O-N 3.49Å; V944-N946 VanDerWaalsContact C-N 3.33Å; V944-N946 PolarHBondContact O-N 2.99Å; V944-E947 PolarHBondContact O-N 3.07Å; V944-I948 HydrophobicContact CG1-CD1 4.21Å; V944-I948 VanDerWaalsContact O-CG1 3.31Å; V944-I948 WeakPolarHBondContact O-CG1 3.26Å; V944-I948 PolarHBondContact O-N 3.37Å
945V92.2Very high83.5Confident0 Ų047 Ų470%026%0.257CS..Hα-helixtrans-68-36.8179.7178.20000111.1L894 L911 L914 L941 W942 I948 L949 A961 A964 L965L894-V945 HydrophobicContact CD1-CG2 3.85Å; L911-V945 HydrophobicContact CD2-CG1 4Å; L911-V945 HydrophobicContact CD2-CG2 3.95Å; L914-V945 HydrophobicContact CD1-CG2 3.81Å; L941-V945 VanDerWaalsContact O-CB 3.3Å; L941-V945 WeakPolarHBondContact O-CB 3.42Å; L941-V945 WeakPolarHBondContact O-CG2 3.28Å; L941-V945 PolarHBondContact O-N 3.18Å; W942-V945 PolarHBondContact O-N 3.08Å; V945-I948 PolarHBondContact O-N 3.09Å; V945-L949 PolarHBondContact O-N 2.9Å; V945-A961 HydrophobicContact CG1-CB 3.83Å; V945-A964 HydrophobicContact CG1-CB 4.09Å; V945-L965 HydrophobicContact CB-CD2 4.33Å; V945-L965 HydrophobicContact CB-CG 4.48Å; V945-L965 HydrophobicContact CG1-CD1 4.14Å; V945-L965 HydrophobicContact CG1-CD2 4.04Å; V945-L965 HydrophobicContact CG1-CG 3.67Å
946N89.2Confident85.5Confident43 Ų4346.4 Ų46.423%0.2325%0.245CC..Hα-helixtrans-63.3-43.2175-166.159.1000110.7W942 V944 L949 F950W942-N946 WeakPolarHBondContact O-CB 3.43Å; W942-N946 PolarHBondContact O-N 2.92Å; V944-N946 VanDerWaalsContact C-N 3.33Å; V944-N946 PolarHBondContact O-N 2.99Å; N946-L949 WeakPolarHBondContact O-CB 3.38Å; N946-L949 PolarHBondContact O-N 3.04Å; N946-F950 WeakPolarHBondContact O-CD2 3.44Å; N946-F950 PolarHBondContact O-N 3.28Å; N946-F950 VanDerWaalsContact OD1-CE2 3.22Å; N946-F950 WeakPolarHBondContact OD1-CE2 3.35Å
947E88.3Confident86.8Confident87 Ų8745.8 Ų45.841%0.40723%0.234SC..Hα-helixtrans-61-46.1174-168.8172173.300111.6L898 E943 V944 L949 F950 T951L898-E947 WeakPolarHBondContact CD1-OE2 3.42Å; L898-E947 HydrophobicContact CD2-CB 3.99Å; L898-E947 VanDerWaalsContact CD2-CD 3.49Å; L898-E947 HydrophobicContact CD2-CG 3.76Å; E943-E947 WeakPolarHBondContact O-CB 3.47Å; E943-E947 PolarHBondContact O-N 3.04Å; V944-E947 PolarHBondContact O-N 3.07Å; E947-L949 VanDerWaalsContact C-N 3.29Å; E947-L949 PolarHBondContact O-N 3.46Å; E947-F950 PolarHBondContact O-N 3.33Å; E947-T951 HydrophobicContact CG-CG2 3.82Å; E947-T951 WeakPolarHBondContact O-CB 3.35Å; E947-T951 WeakPolarHBondContact O-CG2 3.13Å; E947-T951 PolarHBondContact O-N 3.12Å; E947-T951 PolarHBondContact O-OG1 3.39Å
948I90.5Very high87.5Confident0 Ų044 Ų440%022%0.224CC..Hα-helixtrans-57.2-41.4176-67.1167.4000111.7L894 L898 V907 L911 V944 V945 F950 S952 F957 A961L894-I948 HydrophobicContact CB-CD1 4.4Å; L894-I948 HydrophobicContact CD2-CD1 3.9Å; L898-I948 HydrophobicContact CD2-CG1 4.39Å; V907-I948 HydrophobicContact CG1-CD1 4.34Å; L911-I948 HydrophobicContact CD1-CG2 4.28Å; V944-I948 HydrophobicContact CG1-CD1 4.21Å; V944-I948 VanDerWaalsContact O-CG1 3.31Å; V944-I948 WeakPolarHBondContact O-CG1 3.26Å; V944-I948 PolarHBondContact O-N 3.37Å; V945-I948 PolarHBondContact O-N 3.09Å; I948-F950 PolarHBondContact O-N 3.32Å; I948-S952 WeakPolarHBondContact O-CB 3.49Å; I948-S952 PolarHBondContact O-N 3.03Å; I948-S952 VanDerWaalsContact O-N 3.17Å; I948-F957 HydrophobicContact CG2-CB 4.23Å; I948-A961 HydrophobicContact CB-CB 4.4Å; I948-A961 HydrophobicContact CG2-CB 4.02Å
949L90.5Very high87.9Confident0 Ų046.7 Ų46.70%023%0.234CC..Hα-helixtrans-56.6-36.4177.6-177.467.8000112V945 N946 E947 R958 A961 A962 L965 G998V945-L949 PolarHBondContact O-N 2.9Å; N946-L949 WeakPolarHBondContact O-CB 3.38Å; N946-L949 PolarHBondContact O-N 3.04Å; E947-L949 VanDerWaalsContact C-N 3.29Å; E947-L949 PolarHBondContact O-N 3.46Å; L949-R958 HydrophobicContact CD1-CB 4.47Å; L949-R958 VanDerWaalsContact CD1-O 3.27Å; L949-R958 WeakPolarHBondContact CD1-O 3.03Å; L949-R958 VanDerWaalsContact O-CD 3.27Å; L949-R958 WeakPolarHBondContact O-CD 3.31Å; L949-R958 WeakPolarHBondContact O-CG 3.47Å; L949-A961 HydrophobicContact CB-CB 4.06Å; L949-A961 HydrophobicContact CD1-CB 4.25Å; L949-A962 HydrophobicContact CD1-CB 3.87Å; L949-L965 HydrophobicContact CB-CD1 4.27Å; L949-L965 HydrophobicContact CD2-CD1 3.7Å; L949-L965 HydrophobicContact CG-CD1 4.47Å; L949-G998 WeakPolarHBondContact CD1-O 3.37Å
950F86.4Confident88.5Confident25 Ų2544.3 Ų44.311%0.1122%0.221CC..Hα-helixtrans-98-33.8-172.7-68.1-58.1000114.7N946 E947 I948 L981 N994 A995 L999N946-F950 WeakPolarHBondContact O-CD2 3.44Å; N946-F950 PolarHBondContact O-N 3.28Å; N946-F950 VanDerWaalsContact OD1-CE2 3.22Å; N946-F950 WeakPolarHBondContact OD1-CE2 3.35Å; E947-F950 PolarHBondContact O-N 3.33Å; I948-F950 PolarHBondContact O-N 3.32Å; F950-L981 HydrophobicContact CE1-CD1 4.29Å; F950-L981 HydrophobicContact CE1-CD2 4.37Å; F950-L981 HydrophobicContact CE2-CD1 3.61Å; F950-L981 HydrophobicContact CE2-CD2 3.84Å; F950-L981 HydrophobicContact CE2-CG 4.34Å; F950-L981 HydrophobicContact CZ-CB 4.45Å; F950-L981 HydrophobicContact CZ-CD1 3.25Å; F950-L981 HydrophobicContact CZ-CD2 3.8Å; F950-L981 HydrophobicContact CZ-CG 4Å; F950-N994 WeakPolarHBondContact O-CB 3.25Å; F950-A995 HydrophobicContact CB-CB 4.4Å; F950-A995 HydrophobicContact CD1-CB 3.53Å; F950-A995 HydrophobicContact CE1-CB 4.31Å; F950-A995 HydrophobicContact CG-CB 4.39Å; F950-L999 HydrophobicContact CE1-CD2 3.98Å; F950-L999 HydrophobicContact CE1-CG 4.08Å; F950-L999 HydrophobicContact CZ-CD2 4.04Å
951T85.5Confident89Confident72 Ų7241.3 Ų41.344%0.44220%0.202SC..Hα-helixtrans-104.4-25.5-169.366.90000112.8E947E947-T951 HydrophobicContact CG-CG2 3.82Å; E947-T951 WeakPolarHBondContact O-CB 3.35Å; E947-T951 WeakPolarHBondContact O-CG2 3.13Å; E947-T951 PolarHBondContact O-N 3.12Å; E947-T951 PolarHBondContact O-OG1 3.39Å
952S88.7Confident89.2Confident0 Ų041.3 Ų41.30%020%0.202CC..  trans-59.8129.5-174.3-174.10000110.5I948 V954 F957 R958I948-S952 WeakPolarHBondContact O-CB 3.49Å; I948-S952 PolarHBondContact O-N 3.03Å; I948-S952 VanDerWaalsContact O-N 3.17Å; S952-V954 VanDerWaalsContact C-N 3.28Å; S952-V954 PolarHBondContact O-N 3.35Å; S952-V954 PolarHBondContact OG-N 3.25Å; S952-F957 WeakPolarHBondContact OG-CB 3.43Å; S952-R958 PolarHBondContact O-NH1 3.35Å
953P85Confident89.6Confident85 Ų8541.1 Ų41.155%0.55220%0.202SC*.SBendtrans-72.1-23.9176.228.1-33000112.1R958P953-R958 VanDerWaalsContact C-NH1 3.31Å; P953-R958 PolarHBondContact O-NH1 3.14Å
954V87.9Confident90Very high56 Ų5634.3 Ų34.334%0.33917%0.17SC..  trans-89.1115-176.8-177.90000110.7C903 S952 R956 F957 R958C903-V954 HydrophobicContact CB-CG2 3.99Å; C903-V954 WeakPolarHBondContact SG-CG2 3.2Å; S952-V954 VanDerWaalsContact C-N 3.28Å; S952-V954 PolarHBondContact O-N 3.35Å; S952-V954 PolarHBondContact OG-N 3.25Å; V954-R956 HydrophobicContact CG1-CB 4.11Å; V954-R956 PolarHBondContact O-N 3.05Å; V954-R956 VanDerWaalsContact O-N 3.15Å; V954-F957 HydrophobicContact CB-CD2 3.76Å; V954-F957 HydrophobicContact CB-CE2 4.45Å; V954-F957 HydrophobicContact CB-CG 4.49Å; V954-F957 HydrophobicContact CG1-CD2 3.59Å; V954-F957 HydrophobicContact CG1-CE2 4.13Å; V954-F957 WeakPolarHBondContact O-CB 3.38Å; V954-F957 PolarHBondContact O-N 2.86Å; V954-R958 PolarHBondContact O-N 2.84Å
955E87.8Confident90.1Very high99 Ų9934 Ų3446%0.46317%0.168SC..Hα-helixtrans-52.7-39.8-179.8-179175.6-165.800113.3F957 R958 Y959 H1001E955-F957 PolarHBondContact O-N 3.25Å; E955-R958 WeakPolarHBondContact O-CB 3.37Å; E955-R958 PolarHBondContact O-N 3.33Å; E955-R958 VanDerWaalsContact O-N 3.12Å; E955-Y959 PolarHBondContact O-N 3.05Å; E955-H1001 WeakPolarHBondContact CG-NE2 3.33Å; E955-H1001 IonicContact OE1-CE1 3.58Å; E955-H1001 IonicContact OE1-NE2 2.79Å; E955-H1001 PolarHBondContact OE1-NE2 3.01Å
956R90Very high89.9Confident124 Ų12434.5 Ų34.547%0.46817%0.172SC..Hα-helixtrans-61.1-31.8-179.2-171.560.9175.7-175.31.7113Y908 V954 M960Y908-R956 HydrophobicContact CD2-CG 4.37Å; Y908-R956 HydrophobicContact CE2-CG 3.75Å; Y908-R956 PolarHBondContact OH-NE 3.16Å; Y908-R956 PolarHBondContact OH-NH2 2.78Å; Y908-R956 VanDerWaalsContact OH-NH2 3.12Å; V954-R956 HydrophobicContact CG1-CB 4.11Å; V954-R956 PolarHBondContact O-N 3.05Å; V954-R956 VanDerWaalsContact O-N 3.15Å; R956-M960 WeakPolarHBondContact O-CG 3.39Å; R956-M960 PolarHBondContact O-N 3.15Å
957F91.2Very high89.8Confident16 Ų1632.7 Ų32.77%0.0716%0.162CC..Hα-helixtrans-75.2-39.7176.1-78-108.3000110.9C903 T904 V907 L911 I948 S952 V954 E955 Y959 M960 A961C903-F957 HydrophobicContact CB-CD2 4.25Å; C903-F957 HydrophobicContact CB-CE1 4.27Å; C903-F957 HydrophobicContact CB-CE2 3.69Å; C903-F957 HydrophobicContact CB-CZ 3.69Å; T904-F957 WeakPolarHBondContact O-CZ 2.86Å; V907-F957 HydrophobicContact CB-CE1 3.81Å; V907-F957 HydrophobicContact CG1-CD1 3.74Å; V907-F957 HydrophobicContact CG1-CE1 3.51Å; L911-F957 HydrophobicContact CD1-CD1 4.12Å; I948-F957 HydrophobicContact CG2-CB 4.23Å; S952-F957 WeakPolarHBondContact OG-CB 3.43Å; V954-F957 HydrophobicContact CB-CD2 3.76Å; V954-F957 HydrophobicContact CB-CE2 4.45Å; V954-F957 HydrophobicContact CB-CG 4.49Å; V954-F957 HydrophobicContact CG1-CD2 3.59Å; V954-F957 HydrophobicContact CG1-CE2 4.13Å; V954-F957 WeakPolarHBondContact O-CB 3.38Å; V954-F957 PolarHBondContact O-N 2.86Å; E955-F957 PolarHBondContact O-N 3.25Å; F957-Y959 VanDerWaalsContact C-N 3.34Å; F957-Y959 PolarHBondContact O-N 2.82Å; F957-M960 PolarHBondContact O-N 2.95Å; F957-A961 VanDerWaalsContact O-CB 3.27Å; F957-A961 WeakPolarHBondContact O-CB 3.38Å; F957-A961 PolarHBondContact O-N 2.68Å
958R91.8Very high89.8Confident15 Ų1528.5 Ų28.56%0.05714%0.143CC..Hα-helixtrans-60.5-43.7171.6-60.7-170.2-64-93.73.7111.7L949 S952 P953 V954 E955 M960 A961 A962 N994 N997L949-R958 HydrophobicContact CD1-CB 4.47Å; L949-R958 VanDerWaalsContact CD1-O 3.27Å; L949-R958 WeakPolarHBondContact CD1-O 3.03Å; L949-R958 VanDerWaalsContact O-CD 3.27Å; L949-R958 WeakPolarHBondContact O-CD 3.31Å; L949-R958 WeakPolarHBondContact O-CG 3.47Å; S952-R958 PolarHBondContact O-NH1 3.35Å; P953-R958 VanDerWaalsContact C-NH1 3.31Å; P953-R958 PolarHBondContact O-NH1 3.14Å; V954-R958 PolarHBondContact O-N 2.84Å; E955-R958 WeakPolarHBondContact O-CB 3.37Å; E955-R958 PolarHBondContact O-N 3.33Å; E955-R958 VanDerWaalsContact O-N 3.12Å; R958-M960 PolarHBondContact O-N 2.89Å; R958-A961 PolarHBondContact O-N 3.36Å; R958-A962 WeakPolarHBondContact O-CB 3.4Å; R958-A962 PolarHBondContact O-N 3.29Å; R958-N994 WeakPolarHBondContact CD-O 3.15Å; R958-N994 PolarHBondContact NH1-OD1 3.26Å; R958-N997 VanDerWaalsContact CZ-OD1 3.31Å; R958-N997 PolarHBondContact NE-OD1 3.05Å; R958-N997 PolarHBondContact NH2-OD1 2.95Å
959Y92.9Very high89.5Confident56 Ų5629.2 Ų29.222%0.2215%0.147CC..Hα-helixtrans-57.5-48.5173.2170.3-96000112E955 F957 A962 Q963 H1001E955-Y959 PolarHBondContact O-N 3.05Å; F957-Y959 VanDerWaalsContact C-N 3.34Å; F957-Y959 PolarHBondContact O-N 2.82Å; Y959-A962 WeakPolarHBondContact O-CB 3.24Å; Y959-A962 PolarHBondContact O-N 3.49Å; Y959-Q963 HydrophobicContact CE1-CG 4.08Å; Y959-Q963 HydrophobicContact CE2-CG 4.32Å; Y959-Q963 WeakPolarHBondContact O-CG 3.41Å; Y959-Q963 PolarHBondContact O-N 3.49Å; Y959-Q963 VanDerWaalsContact O-N 3.07Å; Y959-Q963 PolarHBondContact OH-NE2 2.95Å; Y959-H1001 AromaticContact CD2-ND1 3.54Å
960M92.8Very high88.8Confident18 Ų1830.2 Ų30.29%0.08915%0.153CC..Hα-helixtrans-70.1-33.5179.1-74.6-54.4-163.400113.2Y908 L911 R956 F957 R958 Q963 A964Y908-M960 HydrophobicContact CD2-CG 3.91Å; Y908-M960 HydrophobicContact CE1-CE 4.3Å; Y908-M960 HydrophobicContact CE2-CE 3.67Å; Y908-M960 HydrophobicContact CE2-CG 3.46Å; Y908-M960 VanDerWaalsContact CE2-CG 3.46Å; Y908-M960 HydrophobicContact CE2-SD 4.43Å; Y908-M960 VanDerWaalsContact CZ-CE 3.42Å; Y908-M960 WeakPolarHBondContact OH-CE 3.27Å; L911-M960 HydrophobicContact CB-CB 3.77Å; L911-M960 HydrophobicContact CD1-CB 3.87Å; L911-M960 HydrophobicContact CG-CB 4.46Å; R956-M960 WeakPolarHBondContact O-CG 3.39Å; R956-M960 PolarHBondContact O-N 3.15Å; F957-M960 PolarHBondContact O-N 2.95Å; R958-M960 PolarHBondContact O-N 2.89Å; M960-Q963 PolarHBondContact O-N 3.47Å; M960-A964 WeakPolarHBondContact O-CB 3.5Å; M960-A964 PolarHBondContact O-N 3.06Å
961A93.4Very high88.4Confident0 Ų031.5 Ų31.50%016%0.164CC..Hα-helixtrans-63.9-41172.600000111.4L911 V945 I948 L949 F957 R958 Q963 A964 L965L911-A961 HydrophobicContact CD1-CB 4.48Å; L911-A961 HydrophobicContact CD2-CB 4.31Å; V945-A961 HydrophobicContact CG1-CB 3.83Å; I948-A961 HydrophobicContact CB-CB 4.4Å; I948-A961 HydrophobicContact CG2-CB 4.02Å; L949-A961 HydrophobicContact CB-CB 4.06Å; L949-A961 HydrophobicContact CD1-CB 4.25Å; F957-A961 VanDerWaalsContact O-CB 3.27Å; F957-A961 WeakPolarHBondContact O-CB 3.38Å; F957-A961 PolarHBondContact O-N 2.68Å; R958-A961 PolarHBondContact O-N 3.36Å; A961-Q963 PolarHBondContact O-N 3.17Å; A961-A964 PolarHBondContact O-N 3.31Å; A961-L965 WeakPolarHBondContact O-CB 3.34Å; A961-L965 WeakPolarHBondContact O-CG 3.46Å; A961-L965 PolarHBondContact O-N 3.28Å
962A92.9Very high87.9Confident0 Ų035 Ų350%017%0.169CC..Hα-helixtrans-61.3-42.6173.200000112.7L949 R958 Y959 S966 H1001 L1002 A1005L949-A962 HydrophobicContact CD1-CB 3.87Å; R958-A962 WeakPolarHBondContact O-CB 3.4Å; R958-A962 PolarHBondContact O-N 3.29Å; Y959-A962 WeakPolarHBondContact O-CB 3.24Å; Y959-A962 PolarHBondContact O-N 3.49Å; A962-S966 VanDerWaalsContact O-CB 3.29Å; A962-S966 WeakPolarHBondContact O-CB 3.49Å; A962-S966 PolarHBondContact O-N 3.34Å; A962-S966 PolarHBondContact O-OG 3.3Å; A962-H1001 VanDerWaalsContact CB-C 3.42Å; A962-H1001 HydrophobicContact CB-CB 3.76Å; A962-H1001 WeakPolarHBondContact CB-O 3.22Å; A962-L1002 HydrophobicContact CB-CB 4.38Å; A962-L1002 HydrophobicContact CB-CD1 4.49Å; A962-A1005 HydrophobicContact CB-CB 4.14Å
963Q91.8Very high87.5Confident16 Ų1637.1 Ų37.18%0.07518%0.178CC..Hα-helixtrans-64.6-43.9174.8-67.4-71.5-11.700111.8Y959 M960 A961 S966 S967 A1005Y959-Q963 HydrophobicContact CE1-CG 4.08Å; Y959-Q963 HydrophobicContact CE2-CG 4.32Å; Y959-Q963 WeakPolarHBondContact O-CG 3.41Å; Y959-Q963 PolarHBondContact O-N 3.49Å; Y959-Q963 VanDerWaalsContact O-N 3.07Å; Y959-Q963 PolarHBondContact OH-NE2 2.95Å; M960-Q963 PolarHBondContact O-N 3.47Å; A961-Q963 PolarHBondContact O-N 3.17Å; Q963-S966 PolarHBondContact O-N 3.41Å; Q963-S967 WeakPolarHBondContact O-CB 3.29Å; Q963-S967 PolarHBondContact O-N 3.25Å; Q963-S967 VanDerWaalsContact O-N 3.11Å; Q963-A1005 HydrophobicContact CG-CB 4.22Å
964A92Very high87.4Confident0 Ų033.4 Ų33.40%015%0.154CC..Hα-helixtrans-59.7-52.8175.300000111.2L911 L914 V945 M960 A961 S966 S967 I968L911-A964 HydrophobicContact CD2-CB 4.35Å; L914-A964 HydrophobicContact CB-CB 3.7Å; V945-A964 HydrophobicContact CG1-CB 4.09Å; M960-A964 WeakPolarHBondContact O-CB 3.5Å; M960-A964 PolarHBondContact O-N 3.06Å; A961-A964 PolarHBondContact O-N 3.31Å; A964-S966 PolarHBondContact O-N 3.21Å; A964-S967 WeakPolarHBondContact O-CB 3.47Å; A964-S967 PolarHBondContact O-N 3.1Å; A964-I968 VanDerWaalsContact O-CG1 3.27Å; A964-I968 WeakPolarHBondContact O-CG1 3.33Å; A964-I968 PolarHBondContact O-N 3.36Å
965L91.3Very high87.3Confident1 Ų133.5 Ų33.51%0.00515%0.148CC..Hα-helixtrans-58.9-44.8178.3-73.2166.3000112V945 L949 A961 S967 I968 L969 L974 L1002V945-L965 HydrophobicContact CB-CD2 4.33Å; V945-L965 HydrophobicContact CB-CG 4.48Å; V945-L965 HydrophobicContact CG1-CD1 4.14Å; V945-L965 HydrophobicContact CG1-CD2 4.04Å; V945-L965 HydrophobicContact CG1-CG 3.67Å; L949-L965 HydrophobicContact CB-CD1 4.27Å; L949-L965 HydrophobicContact CD2-CD1 3.7Å; L949-L965 HydrophobicContact CG-CD1 4.47Å; A961-L965 WeakPolarHBondContact O-CB 3.34Å; A961-L965 WeakPolarHBondContact O-CG 3.46Å; A961-L965 PolarHBondContact O-N 3.28Å; L965-S967 PolarHBondContact O-N 2.87Å; L965-I968 PolarHBondContact O-N 3.01Å; L965-L969 HydrophobicContact CB-CD1 4.3Å; L965-L969 HydrophobicContact CD2-CD1 3.8Å; L965-L969 HydrophobicContact CD2-CG 4.42Å; L965-L969 VanDerWaalsContact O-CB 3.27Å; L965-L969 WeakPolarHBondContact O-CB 3.36Å; L965-L969 PolarHBondContact O-N 2.86Å; L965-L974 HydrophobicContact CB-CD2 4.41Å; L965-L1002 HydrophobicContact CB-CD1 4.04Å
966S88.1Confident87.1Confident12 Ų1232.4 Ų32.48%0.08415%0.145CC..Hα-helixtrans-61.7-26.1177.7-59.90000112.8A962 Q963 A964 A1005A962-S966 VanDerWaalsContact O-CB 3.29Å; A962-S966 WeakPolarHBondContact O-CB 3.49Å; A962-S966 PolarHBondContact O-N 3.34Å; A962-S966 PolarHBondContact O-OG 3.3Å; Q963-S966 PolarHBondContact O-N 3.41Å; A964-S966 PolarHBondContact O-N 3.21Å; S966-A1005 WeakPolarHBondContact OG-CB 3.47Å
967S87.3Confident86.8Confident4 Ų427.8 Ų27.83%0.02813%0.13CC..Hα-helixtrans-86.7-43.3177.9-164.30000112.6S915 V917 P919 Q963 A964 L965S915-S967 PolarHBondContact O-OG 2.84Å; V917-S967 CarbonylContact O-C 3.53Å; V917-S967 VanDerWaalsContact O-C 3.27Å; V917-S967 WeakPolarHBondContact O-CB 3.2Å; V917-S967 VanDerWaalsContact O-O 3.1Å; V917-S967 PolarHBondContact O-OG 3.04Å; P919-S967 WeakPolarHBondContact CD-O 3.5Å; Q963-S967 WeakPolarHBondContact O-CB 3.29Å; Q963-S967 PolarHBondContact O-N 3.25Å; Q963-S967 VanDerWaalsContact O-N 3.11Å; A964-S967 WeakPolarHBondContact O-CB 3.47Å; A964-S967 PolarHBondContact O-N 3.1Å; L965-S967 PolarHBondContact O-N 2.87Å
968I87.3Confident86.6Confident0 Ų027 Ų270%013%0.126CC..Hα-helixtrans-90.8-12.6-172.670.3-170.4000114.4L914 V917 P919 L938 W942 A964 L965L914-I968 HydrophobicContact CB-CG2 4.23Å; L914-I968 HydrophobicContact CD2-CG2 4.41Å; L914-I968 WeakPolarHBondContact O-CG2 3.35Å; V917-I968 HydrophobicContact CB-CG2 4.31Å; P919-I968 WeakPolarHBondContact CB-O 3.34Å; P919-I968 WeakPolarHBondContact CG-O 3.46Å; L938-I968 HydrophobicContact CD1-CB 4.19Å; L938-I968 HydrophobicContact CD2-CG2 4.46Å; W942-I968 VanDerWaalsContact CD1-CD1 3.44Å; A964-I968 VanDerWaalsContact O-CG1 3.27Å; A964-I968 WeakPolarHBondContact O-CG1 3.33Å; A964-I968 PolarHBondContact O-N 3.36Å; L965-I968 PolarHBondContact O-N 3.01Å
969L84.5Confident86.3Confident15 Ų1530.2 Ų30.28%0.07914%0.14CC..SBendtrans-104.5142.8175.4-70172.7000111.7W942 L965 K973 L974 L977W942-L969 HydrophobicContact CD2-CD2 3.65Å; W942-L969 HydrophobicContact CE3-CD2 4.05Å; W942-L969 HydrophobicContact CG-CD2 4.17Å; W942-L969 HydrophobicContact CZ2-CD2 3.99Å; W942-L969 HydrophobicContact CZ3-CD2 4.5Å; L965-L969 HydrophobicContact CB-CD1 4.3Å; L965-L969 HydrophobicContact CD2-CD1 3.8Å; L965-L969 HydrophobicContact CD2-CG 4.42Å; L965-L969 VanDerWaalsContact O-CB 3.27Å; L965-L969 WeakPolarHBondContact O-CB 3.36Å; L965-L969 PolarHBondContact O-N 2.86Å; L969-K973 HydrophobicContact CB-CB 4.43Å; L969-K973 HydrophobicContact CD2-CB 4.26Å; L969-K973 HydrophobicContact CD2-CD 3.91Å; L969-L974 HydrophobicContact CB-CD1 4.5Å; L969-L974 HydrophobicContact CB-CD2 3.91Å; L969-L974 HydrophobicContact CB-CG 3.84Å; L969-L974 HydrophobicContact CD1-CD2 3.81Å; L969-L974 HydrophobicContact CD1-CG 4.45Å; L969-L974 HydrophobicContact CG-CD2 4.49Å; L969-L977 HydrophobicContact CD1-CD2 4.04Å
970P77.3Confident85.9Confident20 Ų2033.3 Ų33.313%0.1316%0.157CC..  trans-67.9152.117029.3-34.1000111.3W922 W972 K973 L974W922-P970 HydrophobicContact CE3-CG 4.08Å; P970-W972 VanDerWaalsContact C-N 3.28Å; P970-W972 HydrophobicContact CG-CZ2 4.24Å; P970-W972 PolarHBondContact O-N 3.49Å; P970-W972 VanDerWaalsContact O-N 3.14Å; P970-K973 HydrophobicContact CG-CB 3.95Å; P970-K973 HydrophobicContact CG-CD 3.98Å; P970-K973 HydrophobicContact CG-CG 3.88Å; P970-K973 PolarHBondContact O-N 3.32Å; P970-L974 PolarHBondContact O-N 3.36Å; P970-L974 VanDerWaalsContact O-N 3.15Å
971P76.2Confident85.1Confident52 Ų5233.9 Ų33.934%0.33816%0.16SC..Hα-helixtrans-53.6-38.8-175.7-28.934.9000114.7K973 L974 Y975 L1018P971-K973 VanDerWaalsContact C-N 3.34Å; P971-K973 PolarHBondContact O-N 2.96Å; P971-L974 WeakPolarHBondContact O-CB 3.34Å; P971-L974 PolarHBondContact O-N 3.09Å; P971-Y975 PolarHBondContact O-N 2.8Å; P971-L1018 WeakPolarHBondContact O-CD2 3.47Å
972W75.4Confident84.6Confident145 Ų14535.2 Ų35.255%0.54917%0.166SC..Hα-helixtrans-65.5-35.6178.967.5-95.8000112.6W922 P970 Y975 L976W922-W972 HydrophobicContact CE3-CZ2 4.3Å; W922-W972 HydrophobicContact CZ3-CH2 4.35Å; W922-W972 AromaticContact CZ3-CZ2 3.9Å; W922-W972 HydrophobicContact CZ3-CZ2 3.9Å; P970-W972 VanDerWaalsContact C-N 3.28Å; P970-W972 HydrophobicContact CG-CZ2 4.24Å; P970-W972 PolarHBondContact O-N 3.49Å; P970-W972 VanDerWaalsContact O-N 3.14Å; W972-Y975 PolarHBondContact O-N 3.41Å; W972-L976 HydrophobicContact CE3-CD1 3.55Å; W972-L976 HydrophobicContact CE3-CG 4.43Å; W972-L976 HydrophobicContact CZ3-CD1 3.55Å; W972-L976 WeakPolarHBondContact O-CG 3.27Å; W972-L976 PolarHBondContact O-N 3.1Å
973K80.1Confident84.1Confident45 Ų4544 Ų4420%0.19620%0.199CC..Hα-helixtrans-70.5-38.2174.1-83.1-167.3163.4-168.10112W922 L969 P970 P971 Y975 L976 L977W922-K973 HydrophobicContact CH2-CD 4.24Å; W922-K973 HydrophobicContact CZ3-CD 3.97Å; L969-K973 HydrophobicContact CB-CB 4.43Å; L969-K973 HydrophobicContact CD2-CB 4.26Å; L969-K973 HydrophobicContact CD2-CD 3.91Å; P970-K973 HydrophobicContact CG-CB 3.95Å; P970-K973 HydrophobicContact CG-CD 3.98Å; P970-K973 HydrophobicContact CG-CG 3.88Å; P970-K973 PolarHBondContact O-N 3.32Å; P971-K973 VanDerWaalsContact C-N 3.34Å; P971-K973 PolarHBondContact O-N 2.96Å; K973-Y975 VanDerWaalsContact C-N 3.25Å; K973-Y975 PolarHBondContact O-N 3.13Å; K973-L976 PolarHBondContact O-N 2.91Å; K973-L977 VanDerWaalsContact O-CB 3.25Å; K973-L977 WeakPolarHBondContact O-CB 3.27Å; K973-L977 PolarHBondContact O-N 2.94Å
974L83.5Confident83.4Confident7 Ų747.3 Ų47.34%0.03722%0.215CC..Hα-helixtrans-60.6-38.9173.5-69.9167.3000111.3L965 L969 P970 P971 L977 W978 L1002 L1018L965-L974 HydrophobicContact CB-CD2 4.41Å; L969-L974 HydrophobicContact CB-CD1 4.5Å; L969-L974 HydrophobicContact CB-CD2 3.91Å; L969-L974 HydrophobicContact CB-CG 3.84Å; L969-L974 HydrophobicContact CD1-CD2 3.81Å; L969-L974 HydrophobicContact CD1-CG 4.45Å; L969-L974 HydrophobicContact CG-CD2 4.49Å; P970-L974 PolarHBondContact O-N 3.36Å; P970-L974 VanDerWaalsContact O-N 3.15Å; P971-L974 WeakPolarHBondContact O-CB 3.34Å; P971-L974 PolarHBondContact O-N 3.09Å; L974-L977 PolarHBondContact O-N 3.06Å; L974-W978 WeakPolarHBondContact O-CB 3.24Å; L974-W978 PolarHBondContact O-N 2.73Å; L974-L1002 HydrophobicContact CD2-CD1 3.91Å; L974-L1018 HydrophobicContact CB-CD2 4.08Å
975Y84.8Confident82.7Confident59 Ų5947.8 Ų47.823%0.23122%0.217CC..Hα-helixtrans-68.8-40.3175.5-173.1-121.9000112.8P971 W972 K973 W978 K979 L1018 E1023P971-Y975 PolarHBondContact O-N 2.8Å; W972-Y975 PolarHBondContact O-N 3.41Å; K973-Y975 VanDerWaalsContact C-N 3.25Å; K973-Y975 PolarHBondContact O-N 3.13Å; Y975-W978 PolarHBondContact O-N 2.67Å; Y975-K979 HydrophobicContact CD1-CD 4.27Å; Y975-K979 HydrophobicContact CE1-CD 3.83Å; Y975-K979 PolarHBondContact O-N 3.19Å; Y975-K979 WeakPolarHBondContact OH-CE 3.43Å; Y975-K979 PolarHBondContact OH-NZ 3.21Å; Y975-L1018 HydrophobicContact CD2-CG 4.15Å; Y975-L1018 HydrophobicContact CG-CD1 4.43Å; Y975-L1018 HydrophobicContact CG-CG 4.41Å; Y975-E1023 PolarHBondContact OH-OE1 2.99Å; Y975-E1023 VanDerWaalsContact OH-OE1 3.13Å
976L83.6Confident82Confident75 Ų7551 Ų5139%0.39323%0.231SC..Hα-helixtrans-62.2-45.2172.6-71.7176.5000111.3W972 K973 W978 K979 E980W972-L976 HydrophobicContact CE3-CD1 3.55Å; W972-L976 HydrophobicContact CE3-CG 4.43Å; W972-L976 HydrophobicContact CZ3-CD1 3.55Å; W972-L976 WeakPolarHBondContact O-CG 3.27Å; W972-L976 PolarHBondContact O-N 3.1Å; K973-L976 PolarHBondContact O-N 2.91Å; L976-W978 PolarHBondContact O-N 3.32Å; L976-K979 WeakPolarHBondContact O-CB 3.06Å; L976-K979 PolarHBondContact O-N 3.38Å; L976-K979 VanDerWaalsContact O-N 3.08Å; L976-E980 WeakPolarHBondContact O-CB 3.48Å; L976-E980 WeakPolarHBondContact O-CG 3.01Å; L976-E980 PolarHBondContact O-N 2.98Å
977L84.2Confident81.4Confident27 Ų2754.6 Ų54.614%0.14126%0.256CS..Hα-helixtrans-56.6-50.1175.4-172.368.3000110.2L969 K973 L974 K979 L981 L1002L969-L977 HydrophobicContact CD1-CD2 4.04Å; K973-L977 VanDerWaalsContact O-CB 3.25Å; K973-L977 WeakPolarHBondContact O-CB 3.27Å; K973-L977 PolarHBondContact O-N 2.94Å; L974-L977 PolarHBondContact O-N 3.06Å; L977-K979 VanDerWaalsContact C-N 3.34Å; L977-K979 PolarHBondContact O-N 3.25Å; L977-L981 HydrophobicContact CB-CD1 4.48Å; L977-L981 HydrophobicContact CD1-CD1 3.33Å; L977-L981 HydrophobicContact CD1-CG 4.42Å; L977-L981 HydrophobicContact CG-CD1 3.49Å; L977-L981 VanDerWaalsContact CG-CD1 3.49Å; L977-L981 VanDerWaalsContact O-CB 3.26Å; L977-L981 WeakPolarHBondContact O-CB 3.46Å; L977-L981 WeakPolarHBondContact O-CD1 3.44Å; L977-L981 WeakPolarHBondContact O-CG 3.46Å; L977-L981 PolarHBondContact O-N 3.12Å; L977-L1002 HydrophobicContact CD2-CD2 4.04Å
978W87.4Confident80.5Confident0 Ų061.3 Ų61.30%028%0.281CS..Hα-helixtrans-54.2-47.3172.6167.6-106.1000112.2L974 Y975 L976 K982 L999 V1003 I1019 E1023 L1024 F1027L974-W978 WeakPolarHBondContact O-CB 3.24Å; L974-W978 PolarHBondContact O-N 2.73Å; Y975-W978 PolarHBondContact O-N 2.67Å; L976-W978 PolarHBondContact O-N 3.32Å; W978-K982 HydrophobicContact CZ2-CD 4.13Å; W978-K982 WeakPolarHBondContact O-CB 3.34Å; W978-K982 PolarHBondContact O-N 3.38Å; W978-L999 HydrophobicContact CE3-CB 4.46Å; W978-L999 HydrophobicContact CE3-CD1 4.38Å; W978-L999 HydrophobicContact CE3-CD2 4.33Å; W978-L999 HydrophobicContact CZ3-CB 4.09Å; W978-L999 HydrophobicContact CZ3-CD1 4.25Å; W978-V1003 HydrophobicContact CE3-CG2 3.93Å; W978-V1003 HydrophobicContact CH2-CG2 4.19Å; W978-V1003 HydrophobicContact CZ3-CG2 3.61Å; W978-I1019 HydrophobicContact CB-CD1 4.17Å; W978-I1019 HydrophobicContact CD2-CD1 3.62Å; W978-I1019 HydrophobicContact CD2-CG1 4.15Å; W978-I1019 HydrophobicContact CD2-CG2 4.39Å; W978-I1019 HydrophobicContact CE3-CD1 3.88Å; W978-I1019 HydrophobicContact CG-CD1 3.74Å; W978-I1019 HydrophobicContact CG-CG1 4.01Å; W978-I1019 HydrophobicContact CH2-CG2 4.42Å; W978-I1019 HydrophobicContact CZ2-CG2 3.69Å; W978-I1019 HydrophobicContact CZ3-CD1 4.5Å; W978-E1023 PolarHBondContact NE1-OE2 3.39Å; W978-L1024 HydrophobicContact CH2-CD2 3.92Å; W978-L1024 HydrophobicContact CZ2-CD2 4.26Å; W978-F1027 HydrophobicContact CH2-CB 4.28Å; W978-F1027 HydrophobicContact CH2-CD1 4.17Å; W978-F1027 HydrophobicContact CH2-CD2 4.12Å; W978-F1027 AromaticContact CH2-CG 3.93Å; W978-F1027 HydrophobicContact CH2-CG 3.93Å; W978-F1027 HydrophobicContact CZ2-CB 4.47Å
979K86.5Confident78.9Confident82 Ų8267 Ų6736%0.35732%0.318SS..Hα-helixtrans-65.5-49.8-178.9-83.8-174.4163.7169.10113.4Y975 L976 L977 L981 R983Y975-K979 HydrophobicContact CD1-CD 4.27Å; Y975-K979 HydrophobicContact CE1-CD 3.83Å; Y975-K979 PolarHBondContact O-N 3.19Å; Y975-K979 WeakPolarHBondContact OH-CE 3.43Å; Y975-K979 PolarHBondContact OH-NZ 3.21Å; L976-K979 WeakPolarHBondContact O-CB 3.06Å; L976-K979 PolarHBondContact O-N 3.38Å; L976-K979 VanDerWaalsContact O-N 3.08Å; L977-K979 VanDerWaalsContact C-N 3.34Å; L977-K979 PolarHBondContact O-N 3.25Å; K979-L981 VanDerWaalsContact C-N 3.3Å; K979-L981 PolarHBondContact O-N 3.36Å; K979-R983 WeakPolarHBondContact O-CB 3.38Å; K979-R983 WeakPolarHBondContact O-CG 3.3Å; K979-R983 PolarHBondContact O-N 3.35Å
980E82.7Confident77.5Confident122 Ų12273.4 Ų73.457%0.5735%0.351SS*.Hα-helixtrans-61.8-42-179.2-74.8177.5177.100110.9L976 R983 H984L976-E980 WeakPolarHBondContact O-CB 3.48Å; L976-E980 WeakPolarHBondContact O-CG 3.01Å; L976-E980 PolarHBondContact O-N 2.98Å; E980-R983 WeakPolarHBondContact O-CB 3.48Å; E980-R983 PolarHBondContact O-N 3.5Å; E980-H984 PolarHBondContact O-N 3.31Å
981L78Confident76.7Confident30 Ų3072.7 Ų72.716%0.15735%0.346CS..Hα-helixtrans-80.7-35-177.4-68.3155.7000112.7F950 L977 K979 R983 H984 I985 L999F950-L981 HydrophobicContact CE1-CD1 4.29Å; F950-L981 HydrophobicContact CE1-CD2 4.37Å; F950-L981 HydrophobicContact CE2-CD1 3.61Å; F950-L981 HydrophobicContact CE2-CD2 3.84Å; F950-L981 HydrophobicContact CE2-CG 4.34Å; F950-L981 HydrophobicContact CZ-CB 4.45Å; F950-L981 HydrophobicContact CZ-CD1 3.25Å; F950-L981 HydrophobicContact CZ-CD2 3.8Å; F950-L981 HydrophobicContact CZ-CG 4Å; L977-L981 HydrophobicContact CB-CD1 4.48Å; L977-L981 HydrophobicContact CD1-CD1 3.33Å; L977-L981 HydrophobicContact CD1-CG 4.42Å; L977-L981 HydrophobicContact CG-CD1 3.49Å; L977-L981 VanDerWaalsContact CG-CD1 3.49Å; L977-L981 VanDerWaalsContact O-CB 3.26Å; L977-L981 WeakPolarHBondContact O-CB 3.46Å; L977-L981 WeakPolarHBondContact O-CD1 3.44Å; L977-L981 WeakPolarHBondContact O-CG 3.46Å; L977-L981 PolarHBondContact O-N 3.12Å; K979-L981 VanDerWaalsContact C-N 3.3Å; K979-L981 PolarHBondContact O-N 3.36Å; L981-R983 VanDerWaalsContact C-N 3.25Å; L981-R983 PolarHBondContact O-N 2.94Å; L981-H984 PolarHBondContact O-N 2.97Å; L981-H984 VanDerWaalsContact O-N 3.11Å; L981-I985 WeakPolarHBondContact O-CG1 3.3Å; L981-I985 PolarHBondContact O-N 2.83Å; L981-L999 HydrophobicContact CB-CD1 4.36Å; L981-L999 HydrophobicContact CB-CD2 4.03Å; L981-L999 HydrophobicContact CD1-CD2 4.27Å
982K82.8Confident76.7Confident28 Ų2873.3 Ų73.312%0.12235%0.352CS..Hα-helixtrans-55.5-44.7167.4177.5178.4172.8179.20110.1W978 I985 F986 F1027W978-K982 HydrophobicContact CZ2-CD 4.13Å; W978-K982 WeakPolarHBondContact O-CB 3.34Å; W978-K982 PolarHBondContact O-N 3.38Å; K982-I985 PolarHBondContact O-N 2.66Å; K982-F986 HydrophobicContact CD-CE2 4.3Å; K982-F986 HydrophobicContact CD-CZ 4.36Å; K982-F986 VanDerWaalsContact CE-CE2 3.44Å; K982-F986 HydrophobicContact CG-CD2 4.24Å; K982-F986 HydrophobicContact CG-CE1 4.25Å; K982-F986 HydrophobicContact CG-CE2 3.87Å; K982-F986 HydrophobicContact CG-CZ 3.87Å; K982-F986 WeakPolarHBondContact O-CB 3.25Å; K982-F986 WeakPolarHBondContact O-CD1 3.32Å; K982-F986 VanDerWaalsContact O-CG 3.24Å; K982-F986 WeakPolarHBondContact O-CG 3.28Å; K982-F986 PolarHBondContact O-N 2.56Å; K982-F1027 HydrophobicContact CG-CD2 4.33Å
983R82.2Confident77.2Confident184 Ų18469.8 Ų69.869%0.69434%0.342SS*.Hα-helixtrans-61.6-43.8173.3-75.1174.6177.2171.5-1.5112.1K979 E980 L981 F986 S987K979-R983 WeakPolarHBondContact O-CB 3.38Å; K979-R983 WeakPolarHBondContact O-CG 3.3Å; K979-R983 PolarHBondContact O-N 3.35Å; E980-R983 WeakPolarHBondContact O-CB 3.48Å; E980-R983 PolarHBondContact O-N 3.5Å; L981-R983 VanDerWaalsContact C-N 3.25Å; L981-R983 PolarHBondContact O-N 2.94Å; R983-F986 PolarHBondContact O-N 3.24Å; R983-S987 PolarHBondContact O-N 3.45Å; R983-S987 PolarHBondContact O-OG 3.4Å
984H76.3Confident77.4Confident86 Ų8670.1 Ų70.140%0.39835%0.346SS..Hα-helixtrans-65.1-37.3179.8-166.884.2000113.3E980 L981 S987 R988E980-H984 PolarHBondContact O-N 3.31Å; L981-H984 PolarHBondContact O-N 2.97Å; L981-H984 VanDerWaalsContact O-N 3.11Å; H984-S987 PolarHBondContact O-OG 3.43Å; H984-R988 VanDerWaalsContact NE2-CZ 3.29Å; H984-R988 PolarHBondContact NE2-NE 2.93Å; H984-R988 PolarHBondContact NE2-NH2 2.8Å
985I76.5Confident77.5Confident9 Ų970.4 Ų70.45%0.04635%0.349CS..Hα-helixtrans-69.9-41.7175.1-68.1177.4000110.2L981 K982 S987 R988 A995 I996 L999L981-I985 WeakPolarHBondContact O-CG1 3.3Å; L981-I985 PolarHBondContact O-N 2.83Å; K982-I985 PolarHBondContact O-N 2.66Å; I985-S987 VanDerWaalsContact C-N 3.27Å; I985-S987 PolarHBondContact O-N 3.5Å; I985-R988 PolarHBondContact O-N 2.95Å; I985-A995 HydrophobicContact CD1-CB 4.48Å; I985-I996 HydrophobicContact CD1-CG1 4.12Å; I985-I996 HydrophobicContact CG2-CG1 4.15Å; I985-L999 HydrophobicContact CD1-CD1 3.33Å; I985-L999 HydrophobicContact CD1-CG 4.15Å
986F77.1Confident77.7Confident70 Ų7067.6 Ų67.631%0.30734%0.338SS..Hα-helixtrans-70.4-20.9179.9-71.23.7000113.6K982 R983 F1027 H1030K982-F986 HydrophobicContact CD-CE2 4.3Å; K982-F986 HydrophobicContact CD-CZ 4.36Å; K982-F986 VanDerWaalsContact CE-CE2 3.44Å; K982-F986 HydrophobicContact CG-CD2 4.24Å; K982-F986 HydrophobicContact CG-CE1 4.25Å; K982-F986 HydrophobicContact CG-CE2 3.87Å; K982-F986 HydrophobicContact CG-CZ 3.87Å; K982-F986 WeakPolarHBondContact O-CB 3.25Å; K982-F986 WeakPolarHBondContact O-CD1 3.32Å; K982-F986 VanDerWaalsContact O-CG 3.24Å; K982-F986 WeakPolarHBondContact O-CG 3.28Å; K982-F986 PolarHBondContact O-N 2.56Å; R983-F986 PolarHBondContact O-N 3.24Å; F986-F1027 AromaticContact CE1-CD2 3.71Å; F986-F1027 HydrophobicContact CE1-CD2 3.71Å; F986-F1027 HydrophobicContact CE1-CE2 4.05Å; F986-F1027 AromaticContact CZ-CD2 3.92Å; F986-F1027 HydrophobicContact CZ-CD2 3.92Å; F986-H1030 HydrophobicContact CD1-CB 4.37Å; F986-H1030 AromaticContact CD1-CD2 3.23Å; F986-H1030 WeakPolarHBondContact CD1-CD2 3.09Å; F986-H1030 AromaticContact CD1-CE1 3.96Å; F986-H1030 AromaticContact CD1-CG 3.66Å; F986-H1030 AromaticContact CD1-NE2 3.45Å; F986-H1030 WeakPolarHBondContact CD1-NE2 3.41Å; F986-H1030 HydrophobicContact CE1-CB 3.67Å; F986-H1030 AromaticContact CE1-CD2 3.31Å; F986-H1030 WeakPolarHBondContact CE1-CD2 3.26Å; F986-H1030 AromaticContact CE1-CG 3.46Å; F986-H1030 VanDerWaalsContact CE1-CG 3.46Å; F986-H1030 AromaticContact CG-NE2 3.97Å; F986-H1030 HydrophobicContact CZ-CB 3.77Å; F986-H1030 AromaticContact CZ-CG 3.9Å
987S75.5Confident78Confident87 Ų8764.5 Ų64.561%0.60832%0.322SS*.THydrogen-bonded Turntrans-84.6-10.6177.467.20000114.1R983 H984 I985R983-S987 PolarHBondContact O-N 3.45Å; R983-S987 PolarHBondContact O-OG 3.4Å; H984-S987 PolarHBondContact O-OG 3.43Å; I985-S987 VanDerWaalsContact C-N 3.27Å; I985-S987 PolarHBondContact O-N 3.5Å
988R68.1Low78.3Confident145 Ų14563.2 Ų63.255%0.54732%0.315SS..SBendtrans-107.6129.3179.9-69.3-172174.5-167.41.3111H984 I985 I990H984-R988 VanDerWaalsContact NE2-CZ 3.29Å; H984-R988 PolarHBondContact NE2-NE 2.93Å; H984-R988 PolarHBondContact NE2-NH2 2.8Å; I985-R988 PolarHBondContact O-N 2.95Å; R988-I990 PolarHBondContact O-N 3.38Å
989P55.2Low78.4Confident120 Ų12063.2 Ų63.278%0.77932%0.315SS*.SBendtrans-66.2-20.3-179.524-31.7000113.5
990I54.7Low78.7Confident149 Ų14959.3 Ų59.376%0.76430%0.298SS*.SBendtrans-127.891.7172.9-54171.3000107.1R988R988-I990 PolarHBondContact O-N 3.38Å
991G60.6Low79.2Confident4 Ų454 Ų544%0.04127%0.273CS..  trans-63.3138.5170.600000110.9Q993G991-Q993 PolarHBondContact O-N 3.29Å
992S76.6Confident79.8Confident65 Ų6552.8 Ų52.846%0.45527%0.267SS..  trans-60.3121.9171.1168.50000109.4N994 A995 I996S992-N994 PolarHBondContact O-N 2.89Å; S992-A995 WeakPolarHBondContact O-CA 3.3Å; S992-A995 WeakPolarHBondContact O-CB 3.35Å; S992-A995 PolarHBondContact O-N 3.24Å; S992-A995 PolarHBondContact OG-N 3.38Å; S992-I996 PolarHBondContact O-N 2.67Å; S992-I996 VanDerWaalsContact O-N 3.1Å
993Q83.9Confident80.1Confident72 Ų7251.5 Ų51.534%0.33626%0.261SS..Hα-helixtrans-60.7-33.7-178.9-69.9-58.8-24.400113G991 A995 N997 N1040G991-Q993 PolarHBondContact O-N 3.29Å; Q993-A995 VanDerWaalsContact C-N 3.3Å; Q993-N997 WeakPolarHBondContact O-CB 3.26Å; Q993-N997 PolarHBondContact O-N 2.67Å; Q993-N1040 PolarHBondContact O-ND2 3.26Å; Q993-N1040 PolarHBondContact OE1-ND2 3.5Å
994N86.2Confident80.5Confident52 Ų5243.3 Ų43.328%0.27823%0.233SC..Hα-helixtrans-67-35173.7-68.3-15.4000111.1F950 R958 S992 N997 G998F950-N994 WeakPolarHBondContact O-CB 3.25Å; R958-N994 WeakPolarHBondContact CD-O 3.15Å; R958-N994 PolarHBondContact NH1-OD1 3.26Å; S992-N994 PolarHBondContact O-N 2.89Å; N994-N997 PolarHBondContact O-N 3.45Å; N994-G998 PolarHBondContact O-N 3.48Å
995A85.4Confident81Confident12 Ų1239.2 Ų39.210%0.09921%0.214CC..Hα-helixtrans-70.3-41179.200000113F950 I985 S992 Q993 N997 G998 L999F950-A995 HydrophobicContact CB-CB 4.4Å; F950-A995 HydrophobicContact CD1-CB 3.53Å; F950-A995 HydrophobicContact CE1-CB 4.31Å; F950-A995 HydrophobicContact CG-CB 4.39Å; I985-A995 HydrophobicContact CD1-CB 4.48Å; S992-A995 WeakPolarHBondContact O-CA 3.3Å; S992-A995 WeakPolarHBondContact O-CB 3.35Å; S992-A995 PolarHBondContact O-N 3.24Å; S992-A995 PolarHBondContact OG-N 3.38Å; Q993-A995 VanDerWaalsContact C-N 3.3Å; A995-N997 VanDerWaalsContact C-N 3.33Å; A995-G998 PolarHBondContact O-N 3.42Å; A995-L999 PolarHBondContact O-N 3.15Å
996I87.8Confident81.3Confident0 Ų040.2 Ų40.20%022%0.218CC..Hα-helixtrans-59.5-47.4171.6-64.7171.3000109.9I985 S992 G998 L999 L1000 F1027 M1031 T1035 N1040I985-I996 HydrophobicContact CD1-CG1 4.12Å; I985-I996 HydrophobicContact CG2-CG1 4.15Å; S992-I996 PolarHBondContact O-N 2.67Å; S992-I996 VanDerWaalsContact O-N 3.1Å; I996-G998 PolarHBondContact O-N 2.84Å; I996-L999 PolarHBondContact O-N 2.9Å; I996-L1000 HydrophobicContact CG2-CD1 4.49Å; I996-L1000 WeakPolarHBondContact O-CG 3.35Å; I996-L1000 PolarHBondContact O-N 3.06Å; I996-L1000 VanDerWaalsContact O-N 3.08Å; I996-F1027 HydrophobicContact CG2-CE1 4.2Å; I996-F1027 HydrophobicContact CG2-CZ 4.13Å; I996-M1031 HydrophobicContact CG2-CE 3.65Å; I996-M1031 HydrophobicContact CG2-CG 4.27Å; I996-M1031 HydrophobicContact CG2-SD 3.58Å; I996-M1031 VanDerWaalsContact CG2-SD 3.58Å; I996-T1035 HydrophobicContact CD1-CG2 4.33Å; I996-N1040 HydrophobicContact CG2-CB 4.06Å
997N89.4Confident81.4Confident10 Ų1037.9 Ų37.95%0.05321%0.209CC..Hα-helixtrans-60.8-43.3178.1-172.1-106.1000112.3R958 Q993 N994 A995 L1000 H1001 N1040R958-N997 VanDerWaalsContact CZ-OD1 3.31Å; R958-N997 PolarHBondContact NE-OD1 3.05Å; R958-N997 PolarHBondContact NH2-OD1 2.95Å; Q993-N997 WeakPolarHBondContact O-CB 3.26Å; Q993-N997 PolarHBondContact O-N 2.67Å; N994-N997 PolarHBondContact O-N 3.45Å; A995-N997 VanDerWaalsContact C-N 3.33Å; N997-L1000 PolarHBondContact O-N 3.16Å; N997-H1001 PolarHBondContact O-CD2 3.02Å; N997-H1001 VanDerWaalsContact O-CD2 3.29Å; N997-H1001 PolarHBondContact O-N 3.35Å; N997-H1001 PolarHBondContact OD1-CD2 2.83Å; N997-H1001 VanDerWaalsContact OD1-CD2 3.28Å; N997-H1001 PolarHBondContact OD1-NE2 3.4Å; N997-N1040 VanDerWaalsContact CB-OD1 3.22Å; N997-N1040 WeakPolarHBondContact CB-OD1 3.36Å; N997-N1040 PolarHBondContact ND2-OD1 3.46Å
998G91.1Very high81.3Confident0 Ų037.3 Ų37.30%020%0.197CC..Hα-helixtrans-59.1-45.1175.200000112.5L949 N994 A995 I996 L1000 H1001 L1002L949-G998 WeakPolarHBondContact CD1-O 3.37Å; N994-G998 PolarHBondContact O-N 3.48Å; A995-G998 PolarHBondContact O-N 3.42Å; I996-G998 PolarHBondContact O-N 2.84Å; G998-L1000 PolarHBondContact O-N 3.13Å; G998-H1001 PolarHBondContact O-N 3.12Å; G998-L1002 PolarHBondContact O-N 3.07Å
999L90.2Very high81.2Confident0 Ų032.5 Ų32.50%018%0.18CC..Hα-helixtrans-61.7-41.6175-75.7-171.2000112.9F950 W978 L981 I985 A995 I996 H1001 L1002 V1003 F1027F950-L999 HydrophobicContact CE1-CD2 3.98Å; F950-L999 HydrophobicContact CE1-CG 4.08Å; F950-L999 HydrophobicContact CZ-CD2 4.04Å; W978-L999 HydrophobicContact CE3-CB 4.46Å; W978-L999 HydrophobicContact CE3-CD1 4.38Å; W978-L999 HydrophobicContact CE3-CD2 4.33Å; W978-L999 HydrophobicContact CZ3-CB 4.09Å; W978-L999 HydrophobicContact CZ3-CD1 4.25Å; L981-L999 HydrophobicContact CB-CD1 4.36Å; L981-L999 HydrophobicContact CB-CD2 4.03Å; L981-L999 HydrophobicContact CD1-CD2 4.27Å; I985-L999 HydrophobicContact CD1-CD1 3.33Å; I985-L999 HydrophobicContact CD1-CG 4.15Å; A995-L999 PolarHBondContact O-N 3.15Å; I996-L999 PolarHBondContact O-N 2.9Å; L999-H1001 VanDerWaalsContact C-N 3.32Å; L999-H1001 PolarHBondContact O-N 2.87Å; L999-L1002 HydrophobicContact CD2-CD2 4.46Å; L999-L1002 WeakPolarHBondContact O-CB 3.34Å; L999-L1002 PolarHBondContact O-N 3.34Å; L999-V1003 VanDerWaalsContact O-CG2 3.26Å; L999-V1003 WeakPolarHBondContact O-CG2 3.48Å; L999-V1003 PolarHBondContact O-N 3.29Å; L999-F1027 HydrophobicContact CD1-CE2 4.33Å; L999-F1027 HydrophobicContact CD1-CZ 4.28Å
1000L91.6Very high81.2Confident0 Ų029.3 Ų29.30%015%0.154CC..Hα-helixtrans-62.8-40.6176.4-67.3177.1000111.6I996 N997 G998 L1002 V1003 A1004 F1027 N1040 F1043 L1044I996-L1000 HydrophobicContact CG2-CD1 4.49Å; I996-L1000 WeakPolarHBondContact O-CG 3.35Å; I996-L1000 PolarHBondContact O-N 3.06Å; I996-L1000 VanDerWaalsContact O-N 3.08Å; N997-L1000 PolarHBondContact O-N 3.16Å; G998-L1000 PolarHBondContact O-N 3.13Å; L1000-L1002 VanDerWaalsContact C-N 3.33Å; L1000-V1003 PolarHBondContact O-N 3.47Å; L1000-A1004 WeakPolarHBondContact O-CB 3.45Å; L1000-A1004 PolarHBondContact O-N 2.78Å; L1000-F1027 HydrophobicContact CD2-CD1 4.29Å; L1000-F1027 HydrophobicContact CD2-CE1 3.97Å; L1000-F1027 HydrophobicContact CG-CE1 4.43Å; L1000-N1040 HydrophobicContact CD1-CB 4.08Å; L1000-N1040 VanDerWaalsContact CD1-O 3.28Å; L1000-N1040 WeakPolarHBondContact CD1-O 3.5Å; L1000-F1043 HydrophobicContact CB-CD1 3.56Å; L1000-F1043 HydrophobicContact CB-CE1 3.58Å; L1000-F1043 HydrophobicContact CD1-CB 4.35Å; L1000-F1043 HydrophobicContact CD1-CD1 3.97Å; L1000-F1043 HydrophobicContact CD1-CG 4.49Å; L1000-F1043 HydrophobicContact CG-CD1 4.43Å; L1000-L1044 HydrophobicContact CD1-CB 4.27Å; L1000-L1044 HydrophobicContact CD2-CB 4.03Å; L1000-L1044 HydrophobicContact CD2-CD1 3.85Å; L1000-L1044 HydrophobicContact CD2-CG 4.44Å
1001H93Very high80.8Confident12 Ų1226.8 Ų26.86%0.05615%0.15CC..Hα-helixtrans-63.5-37.9173.2-82.2-58000112.1E955 Y959 A962 N997 G998 L999 A1004 A1005 F1043E955-H1001 WeakPolarHBondContact CG-NE2 3.33Å; E955-H1001 IonicContact OE1-CE1 3.58Å; E955-H1001 IonicContact OE1-NE2 2.79Å; E955-H1001 PolarHBondContact OE1-NE2 3.01Å; Y959-H1001 AromaticContact CD2-ND1 3.54Å; A962-H1001 VanDerWaalsContact CB-C 3.42Å; A962-H1001 HydrophobicContact CB-CB 3.76Å; A962-H1001 WeakPolarHBondContact CB-O 3.22Å; N997-H1001 PolarHBondContact O-CD2 3.02Å; N997-H1001 VanDerWaalsContact O-CD2 3.29Å; N997-H1001 PolarHBondContact O-N 3.35Å; N997-H1001 PolarHBondContact OD1-CD2 2.83Å; N997-H1001 VanDerWaalsContact OD1-CD2 3.28Å; N997-H1001 PolarHBondContact OD1-NE2 3.4Å; G998-H1001 PolarHBondContact O-N 3.12Å; L999-H1001 VanDerWaalsContact C-N 3.32Å; L999-H1001 PolarHBondContact O-N 2.87Å; H1001-A1004 PolarHBondContact O-N 2.96Å; H1001-A1005 VanDerWaalsContact O-CB 3.3Å; H1001-A1005 WeakPolarHBondContact O-CB 3.44Å; H1001-A1005 PolarHBondContact O-N 2.99Å; H1001-F1043 HydrophobicContact CB-CE1 4.42Å; H1001-F1043 AromaticContact CD2-CE1 3.82Å; H1001-F1043 AromaticContact CE1-CE1 3.44Å; H1001-F1043 VanDerWaalsContact CE1-CE1 3.44Å; H1001-F1043 WeakPolarHBondContact CE1-CE1 3.43Å; H1001-F1043 AromaticContact CE1-CZ 3.52Å; H1001-F1043 AromaticContact CG-CE1 3.69Å; H1001-F1043 AromaticContact ND1-CE1 3.47Å; H1001-F1043 WeakPolarHBondContact ND1-CE1 3.23Å; H1001-F1043 AromaticContact ND1-CZ 3.4Å; H1001-F1043 WeakPolarHBondContact ND1-CZ 3.47Å; H1001-F1043 AromaticContact NE2-CE1 3.66Å
1002L91.5Very high80.1Confident4 Ų430.7 Ų30.72%0.02117%0.169CC..Hα-helixtrans-61.1-45.1175.1-171.768.3000111.7A962 L965 L974 L977 G998 L999 L1000 A1005 H1006A962-L1002 HydrophobicContact CB-CB 4.38Å; A962-L1002 HydrophobicContact CB-CD1 4.49Å; L965-L1002 HydrophobicContact CB-CD1 4.04Å; L974-L1002 HydrophobicContact CD2-CD1 3.91Å; L977-L1002 HydrophobicContact CD2-CD2 4.04Å; G998-L1002 PolarHBondContact O-N 3.07Å; L999-L1002 HydrophobicContact CD2-CD2 4.46Å; L999-L1002 WeakPolarHBondContact O-CB 3.34Å; L999-L1002 PolarHBondContact O-N 3.34Å; L1000-L1002 VanDerWaalsContact C-N 3.33Å; L1002-A1005 PolarHBondContact O-N 3.06Å; L1002-H1006 WeakPolarHBondContact O-CB 3.34Å; L1002-H1006 PolarHBondContact O-N 3.32Å
1003V90.1Very high78.6Confident1 Ų134.5 Ų34.51%0.00618%0.178CC..Hα-helixtrans-63.2-45.6175.8-174.20000111W978 L999 L1000 A1005 H1006 D1007 I1019 L1024 L1047W978-V1003 HydrophobicContact CE3-CG2 3.93Å; W978-V1003 HydrophobicContact CH2-CG2 4.19Å; W978-V1003 HydrophobicContact CZ3-CG2 3.61Å; L999-V1003 VanDerWaalsContact O-CG2 3.26Å; L999-V1003 WeakPolarHBondContact O-CG2 3.48Å; L999-V1003 PolarHBondContact O-N 3.29Å; L1000-V1003 PolarHBondContact O-N 3.47Å; V1003-A1005 PolarHBondContact O-N 3.38Å; V1003-H1006 PolarHBondContact O-N 3.36Å; V1003-D1007 WeakPolarHBondContact O-CB 3.46Å; V1003-D1007 PolarHBondContact O-N 2.63Å; V1003-I1019 HydrophobicContact CB-CD1 4.14Å; V1003-I1019 HydrophobicContact CG1-CB 4.37Å; V1003-I1019 HydrophobicContact CG1-CD1 4.04Å; V1003-I1019 HydrophobicContact CG2-CD1 3.4Å; V1003-I1019 VanDerWaalsContact CG2-CD1 3.4Å; V1003-L1024 HydrophobicContact CG1-CD1 4.15Å; V1003-L1024 HydrophobicContact CG1-CD2 4.15Å; V1003-L1024 HydrophobicContact CG2-CD2 4.18Å; V1003-L1047 HydrophobicContact CB-CD2 4.05Å; V1003-L1047 HydrophobicContact CG1-CD2 3.78Å
1004A89.2Confident76.7Confident11 Ų1138.4 Ų38.49%0.09120%0.201CC..Hα-helixtrans-63.8-40.1179.900000112.3L1000 H1001 D1007 Q1008 F1043 L1047L1000-A1004 WeakPolarHBondContact O-CB 3.45Å; L1000-A1004 PolarHBondContact O-N 2.78Å; H1001-A1004 PolarHBondContact O-N 2.96Å; A1004-D1007 PolarHBondContact O-N 3.42Å; A1004-Q1008 WeakPolarHBondContact O-CG 3.42Å; A1004-Q1008 PolarHBondContact O-N 3.39Å; A1004-F1043 HydrophobicContact CB-CE2 4.45Å; A1004-F1043 HydrophobicContact CB-CZ 3.99Å; A1004-L1047 HydrophobicContact CB-CD1 3.95Å
1005A86.9Confident75.2Confident0 Ų038.7 Ų38.70%022%0.217CC..Hα-helixtrans-63.8-48.7175.600000111A962 Q963 S966 H1001 L1002 V1003 D1007 Q1008 F1009A962-A1005 HydrophobicContact CB-CB 4.14Å; Q963-A1005 HydrophobicContact CG-CB 4.22Å; S966-A1005 WeakPolarHBondContact OG-CB 3.47Å; H1001-A1005 VanDerWaalsContact O-CB 3.3Å; H1001-A1005 WeakPolarHBondContact O-CB 3.44Å; H1001-A1005 PolarHBondContact O-N 2.99Å; L1002-A1005 PolarHBondContact O-N 3.06Å; V1003-A1005 PolarHBondContact O-N 3.38Å; A1005-D1007 VanDerWaalsContact C-N 3.29Å; A1005-D1007 PolarHBondContact O-N 2.88Å; A1005-Q1008 WeakPolarHBondContact O-CB 3.11Å; A1005-Q1008 PolarHBondContact O-N 2.92Å; A1005-F1009 VanDerWaalsContact O-CD2 3.23Å; A1005-F1009 WeakPolarHBondContact O-CD2 3.29Å; A1005-F1009 PolarHBondContact O-N 3.27Å
1006H82.4Confident74.3Confident30 Ų3044.6 Ų44.614%0.13925%0.246CC..Hα-helixtrans-58.2-41.2175.6-179.1-77.1000112.3L1002 V1003 Q1008 F1009 K1010 L1018L1002-H1006 WeakPolarHBondContact O-CB 3.34Å; L1002-H1006 PolarHBondContact O-N 3.32Å; V1003-H1006 PolarHBondContact O-N 3.36Å; H1006-Q1008 PolarHBondContact O-N 3.07Å; H1006-F1009 PolarHBondContact O-N 3.44Å; H1006-K1010 PolarHBondContact O-N 3.44Å; H1006-L1018 WeakPolarHBondContact CE1-CB 3.48Å
1007D80.2Confident73.6Confident21 Ų2146.2 Ų46.211%0.11226%0.257CS..Hα-helixtrans-60.2-30.1176.6-81.9-11.8000113.8V1003 A1004 A1005 F1009 K1010 R1051V1003-D1007 WeakPolarHBondContact O-CB 3.46Å; V1003-D1007 PolarHBondContact O-N 2.63Å; A1004-D1007 PolarHBondContact O-N 3.42Å; A1005-D1007 VanDerWaalsContact C-N 3.29Å; A1005-D1007 PolarHBondContact O-N 2.88Å; D1007-F1009 VanDerWaalsContact C-N 3.35Å; D1007-K1010 HydrophobicContact CB-CD 4.39Å; D1007-K1010 WeakPolarHBondContact O-CB 3.33Å; D1007-K1010 WeakPolarHBondContact O-CD 3.49Å; D1007-K1010 VanDerWaalsContact O-CG 3.23Å; D1007-K1010 WeakPolarHBondContact O-CG 3.21Å; D1007-K1010 PolarHBondContact O-N 3.12Å; D1007-K1010 WeakPolarHBondContact OD1-CE 3.35Å; D1007-K1010 IonicContact OD1-NZ 3.49Å; D1007-K1010 PolarHBondContact OD1-NZ 3.36Å; D1007-K1010 IonicContact OD2-NZ 3.74Å; D1007-R1051 IonicContact OD1-CZ 3.81Å; D1007-R1051 IonicContact OD1-NE 2.64Å; D1007-R1051 IonicContact OD1-NH2 2.69Å; D1007-R1051 PolarHBondContact OD1-NH2 2.81Å; D1007-R1051 IonicContact OD2-CZ 2.69Å; D1007-R1051 IonicContact OD2-NE 3.59Å; D1007-R1051 PolarHBondContact OD2-NE 3.33Å; D1007-R1051 IonicContact OD2-NH2 3.24Å; D1007-R1051 PolarHBondContact OD2-NH2 3.37Å
1008Q72.9Confident73.1Confident75 Ų7548.3 Ų48.335%0.3527%0.268SS..Hα-helixtrans-72.5-30.3175.1-67.2171.65.100111.6Q868 A1004 A1005 H1006 K1010Q868-Q1008 PolarHBondContact OE1-O 3.33Å; A1004-Q1008 WeakPolarHBondContact O-CG 3.42Å; A1004-Q1008 PolarHBondContact O-N 3.39Å; A1005-Q1008 WeakPolarHBondContact O-CB 3.11Å; A1005-Q1008 PolarHBondContact O-N 2.92Å; H1006-Q1008 PolarHBondContact O-N 3.07Å; Q1008-K1010 PolarHBondContact O-N 2.98Å
1009F65.6Low72.9Confident44 Ų4448.6 Ų48.619%0.19327%0.269CS..G310 helixtrans-75.6-4.6174.8-73.4-78.1000114.3A1005 H1006 D1007 S1011 N1012A1005-F1009 VanDerWaalsContact O-CD2 3.23Å; A1005-F1009 WeakPolarHBondContact O-CD2 3.29Å; A1005-F1009 PolarHBondContact O-N 3.27Å; H1006-F1009 PolarHBondContact O-N 3.44Å; D1007-F1009 VanDerWaalsContact C-N 3.35Å; F1009-S1011 PolarHBondContact O-N 3.01Å; F1009-N1012 PolarHBondContact O-N 2.53Å
1010K55Low72.8Confident53 Ų5350.8 Ų50.823%0.2329%0.285CS..G310 helixtrans-52.3-18.4-179.9-84.9177.5-1801600116.4H1006 D1007 Q1008 N1012 P1017H1006-K1010 PolarHBondContact O-N 3.44Å; D1007-K1010 HydrophobicContact CB-CD 4.39Å; D1007-K1010 WeakPolarHBondContact O-CB 3.33Å; D1007-K1010 WeakPolarHBondContact O-CD 3.49Å; D1007-K1010 VanDerWaalsContact O-CG 3.23Å; D1007-K1010 WeakPolarHBondContact O-CG 3.21Å; D1007-K1010 PolarHBondContact O-N 3.12Å; D1007-K1010 WeakPolarHBondContact OD1-CE 3.35Å; D1007-K1010 IonicContact OD1-NZ 3.49Å; D1007-K1010 PolarHBondContact OD1-NZ 3.36Å; D1007-K1010 IonicContact OD2-NZ 3.74Å; Q1008-K1010 PolarHBondContact O-N 2.98Å; K1010-N1012 PolarHBondContact O-N 3.45Å; K1010-P1017 VanDerWaalsContact CE-CA 3.49Å; K1010-P1017 VanDerWaalsContact CE-CB 3.43Å
1011S47.9Very low72.6Confident97 Ų9753.2 Ų53.268%0.67830%0.297SS*.G310 helixtrans-62.9-7.5179.970.50000114F1009F1009-S1011 PolarHBondContact O-N 3.01Å
1012N45Very low72.4Confident85 Ų8559 Ų5946%0.45533%0.325SS..G310 helixtrans-117.3-10.4-170.5-60-24.3000115.9F1009 K1010F1009-N1012 PolarHBondContact O-N 2.53Å; K1010-N1012 PolarHBondContact O-N 3.45Å
1013F44.5Very low72.3Confident145 Ų14560.7 Ų60.764%0.63633%0.332SS*.THydrogen-bonded Turntrans-140.2104.8-174.6-66.9-81.3000111.3G1015F1013-G1015 PolarHBondContact O-N 2.89Å
1014D45.7Very low72.3Confident155 Ų15560.7 Ų60.783%0.82933%0.332SS*.THydrogen-bonded Turntrans34.926.1165-64.9-12.1000120.2N1016D1014-N1016 PolarHBondContact O-N 3.37Å
1015G54.7Low72.3Confident58 Ų5862.3 Ų62.360%0.59834%0.339SS*.SBendtrans72.1-25.6167.700000116.5F1013F1013-G1015 PolarHBondContact O-N 2.89Å
1016N65.2Low72.3Confident136 Ų13667.2 Ų67.273%0.72736%0.362SS*.SBendtrans-85.6133.4-177.1-72.2-33.7000112.1D1014 L1018D1014-N1016 PolarHBondContact O-N 3.37Å; N1016-L1018 PolarHBondContact O-N 3.19Å
1017P73.1Confident72.6Confident34 Ų3465.8 Ų65.822%0.22136%0.356CS..  trans-61.3136.317122.7-28.9000111.1K1010 I1019K1010-P1017 VanDerWaalsContact CE-CA 3.49Å; K1010-P1017 VanDerWaalsContact CE-CB 3.43Å; P1017-I1019 WeakPolarHBondContact CB-O 3.5Å; P1017-I1019 PolarHBondContact O-N 3.11Å; P1017-I1019 VanDerWaalsContact O-N 3.16Å
1018L79.4Confident72.9Confident53 Ų5364.8 Ų64.828%0.27735%0.35SS..SBendtrans-54.9-32.2173-175.972.9000112.5P971 L974 Y975 H1006 N1016P971-L1018 WeakPolarHBondContact O-CD2 3.47Å; L974-L1018 HydrophobicContact CB-CD2 4.08Å; Y975-L1018 HydrophobicContact CD2-CG 4.15Å; Y975-L1018 HydrophobicContact CG-CD1 4.43Å; Y975-L1018 HydrophobicContact CG-CG 4.41Å; H1006-L1018 WeakPolarHBondContact CE1-CB 3.48Å; N1016-L1018 PolarHBondContact O-N 3.19Å
1019I87Confident73.4Confident7 Ų766.3 Ų66.34%0.03636%0.357CS..SBendtrans-113.2111.4177.2-58.1161.2000107.6W978 V1003 P1017 E1023 L1024 R1051W978-I1019 HydrophobicContact CB-CD1 4.17Å; W978-I1019 HydrophobicContact CD2-CD1 3.62Å; W978-I1019 HydrophobicContact CD2-CG1 4.15Å; W978-I1019 HydrophobicContact CD2-CG2 4.39Å; W978-I1019 HydrophobicContact CE3-CD1 3.88Å; W978-I1019 HydrophobicContact CG-CD1 3.74Å; W978-I1019 HydrophobicContact CG-CG1 4.01Å; W978-I1019 HydrophobicContact CH2-CG2 4.42Å; W978-I1019 HydrophobicContact CZ2-CG2 3.69Å; W978-I1019 HydrophobicContact CZ3-CD1 4.5Å; V1003-I1019 HydrophobicContact CB-CD1 4.14Å; V1003-I1019 HydrophobicContact CG1-CB 4.37Å; V1003-I1019 HydrophobicContact CG1-CD1 4.04Å; V1003-I1019 HydrophobicContact CG2-CD1 3.4Å; V1003-I1019 VanDerWaalsContact CG2-CD1 3.4Å; P1017-I1019 WeakPolarHBondContact CB-O 3.5Å; P1017-I1019 PolarHBondContact O-N 3.11Å; P1017-I1019 VanDerWaalsContact O-N 3.16Å; I1019-E1023 HydrophobicContact CG2-CB 4.11Å; I1019-L1024 HydrophobicContact CG2-CD2 3.9Å; I1019-L1024 HydrophobicContact CG2-CG 3.96Å; I1019-R1051 PolarHBondContact O-NH1 2.91Å; I1019-R1051 PolarHBondContact O-NH2 3.17Å
1020S87.5Confident74.1Confident46 Ų4665.8 Ų65.832%0.32236%0.355SS..  trans-63.2156.7-174.676.60000112.3E1022 E1023 L1024S1020-E1022 PolarHBondContact O-N 3.39Å; S1020-E1023 PolarHBondContact O-N 3.17Å; S1020-E1023 WeakPolarHBondContact OG-CG 3.43Å; S1020-E1023 PolarHBondContact OG-N 3.22Å; S1020-L1024 PolarHBondContact O-N 3.26Å; S1020-L1024 VanDerWaalsContact O-N 3.12Å
1021N88.7Confident75.3Confident50 Ų5063.4 Ų63.427%0.26735%0.345SS..Hα-helixtrans-61.2-33.1173.7-69.7-17.2000111.4L1024 L1025 L1048 R1051N1021-L1024 PolarHBondContact O-N 2.78Å; N1021-L1025 WeakPolarHBondContact O-CB 3.39Å; N1021-L1025 VanDerWaalsContact O-CG 3.26Å; N1021-L1025 WeakPolarHBondContact O-CG 3.32Å; N1021-L1025 PolarHBondContact O-N 2.72Å; N1021-L1048 HydrophobicContact CB-CD2 4.45Å; N1021-R1051 WeakPolarHBondContact OD1-CD 3.46Å; N1021-R1051 PolarHBondContact OD1-NH1 3.14Å
1022E87.6Confident76.7Confident135 Ų13560.6 Ų60.663%0.63132%0.32SS*.Hα-helixtrans-66-44.8175.9-172.7171.8-172.100112.1S1020 L1024 L1025 Q1026S1020-E1022 PolarHBondContact O-N 3.39Å; E1022-L1024 VanDerWaalsContact C-N 3.28Å; E1022-L1024 PolarHBondContact O-N 3.4Å; E1022-L1025 PolarHBondContact O-N 3.29Å; E1022-Q1026 WeakPolarHBondContact O-CG 3.46Å; E1022-Q1026 PolarHBondContact O-N 3.38Å
1023E89.2Confident77.9Confident39 Ų3959.9 Ų59.918%0.18232%0.322CS..Hα-helixtrans-61.1-37.5175-79.5-169.3-165.200112.1Y975 W978 I1019 S1020 F1027Y975-E1023 PolarHBondContact OH-OE1 2.99Å; Y975-E1023 VanDerWaalsContact OH-OE1 3.13Å; W978-E1023 PolarHBondContact NE1-OE2 3.39Å; I1019-E1023 HydrophobicContact CG2-CB 4.11Å; S1020-E1023 PolarHBondContact O-N 3.17Å; S1020-E1023 WeakPolarHBondContact OG-CG 3.43Å; S1020-E1023 PolarHBondContact OG-N 3.22Å; E1023-F1027 WeakPolarHBondContact O-CB 3.41Å; E1023-F1027 PolarHBondContact O-N 3.46Å
1024L90.3Very high79Confident0 Ų059.4 Ų59.40%032%0.319CS..Hα-helixtrans-69.7-38.3175.8-75.2-176.2000113W978 V1003 I1019 S1020 N1021 E1022 F1027 G1028 L1044 L1047 L1048 R1051W978-L1024 HydrophobicContact CH2-CD2 3.92Å; W978-L1024 HydrophobicContact CZ2-CD2 4.26Å; V1003-L1024 HydrophobicContact CG1-CD1 4.15Å; V1003-L1024 HydrophobicContact CG1-CD2 4.15Å; V1003-L1024 HydrophobicContact CG2-CD2 4.18Å; I1019-L1024 HydrophobicContact CG2-CD2 3.9Å; I1019-L1024 HydrophobicContact CG2-CG 3.96Å; S1020-L1024 PolarHBondContact O-N 3.26Å; S1020-L1024 VanDerWaalsContact O-N 3.12Å; N1021-L1024 PolarHBondContact O-N 2.78Å; E1022-L1024 VanDerWaalsContact C-N 3.28Å; E1022-L1024 PolarHBondContact O-N 3.4Å; L1024-F1027 PolarHBondContact O-N 3.44Å; L1024-G1028 PolarHBondContact O-N 3.34Å; L1024-L1044 HydrophobicContact CB-CD1 4.17Å; L1024-L1044 HydrophobicContact CD2-CD1 4.19Å; L1024-L1047 HydrophobicContact CD1-CD2 4.09Å; L1024-L1048 HydrophobicContact CB-CD2 4.16Å; L1024-L1048 HydrophobicContact CD1-CD2 4.19Å; L1024-R1051 VanDerWaalsContact CD1-NH1 3.3Å
1025L90.2Very high80Confident45 Ų4552.4 Ų52.424%0.23628%0.282CS..Hα-helixtrans-65.5-41174.7-74.5169.8000111N1021 E1022 G1028 H1029 L1048 P1056 Y1059N1021-L1025 WeakPolarHBondContact O-CB 3.39Å; N1021-L1025 VanDerWaalsContact O-CG 3.26Å; N1021-L1025 WeakPolarHBondContact O-CG 3.32Å; N1021-L1025 PolarHBondContact O-N 2.72Å; E1022-L1025 PolarHBondContact O-N 3.29Å; L1025-G1028 PolarHBondContact O-N 3.24Å; L1025-H1029 WeakPolarHBondContact O-CB 3.16Å; L1025-H1029 PolarHBondContact O-N 2.97Å; L1025-L1048 HydrophobicContact CD2-CD1 3.8Å; L1025-L1048 HydrophobicContact CG-CD1 4.47Å; L1025-P1056 HydrophobicContact CD2-CG 3.83Å; L1025-Y1059 HydrophobicContact CD2-CE2 4.09Å; L1025-Y1059 PolarHBondContact O-OH 2.71Å
1026Q87.1Confident80.4Confident104 Ų10458.1 Ų58.149%0.48629%0.286SS..Hα-helixtrans-61.8-42.8172.4-70.2174.54.200111.9E1022 H1029 H1030E1022-Q1026 WeakPolarHBondContact O-CG 3.46Å; E1022-Q1026 PolarHBondContact O-N 3.38Å; Q1026-H1029 PolarHBondContact O-N 3.44Å; Q1026-H1030 PolarHBondContact O-N 3.27Å; Q1026-H1030 VanDerWaalsContact O-N 3.1Å
1027F88Confident80.9Confident0 Ų051.9 Ų51.90%025%0.253CS..Hα-helixtrans-61.1-44.9175-175.9-105.1000111.7W978 K982 F986 I996 L999 L1000 E1023 L1024 H1030 M1031W978-F1027 HydrophobicContact CH2-CB 4.28Å; W978-F1027 HydrophobicContact CH2-CD1 4.17Å; W978-F1027 HydrophobicContact CH2-CD2 4.12Å; W978-F1027 AromaticContact CH2-CG 3.93Å; W978-F1027 HydrophobicContact CH2-CG 3.93Å; W978-F1027 HydrophobicContact CZ2-CB 4.47Å; K982-F1027 HydrophobicContact CG-CD2 4.33Å; F986-F1027 AromaticContact CE1-CD2 3.71Å; F986-F1027 HydrophobicContact CE1-CD2 3.71Å; F986-F1027 HydrophobicContact CE1-CE2 4.05Å; F986-F1027 AromaticContact CZ-CD2 3.92Å; F986-F1027 HydrophobicContact CZ-CD2 3.92Å; I996-F1027 HydrophobicContact CG2-CE1 4.2Å; I996-F1027 HydrophobicContact CG2-CZ 4.13Å; L999-F1027 HydrophobicContact CD1-CE2 4.33Å; L999-F1027 HydrophobicContact CD1-CZ 4.28Å; L1000-F1027 HydrophobicContact CD2-CD1 4.29Å; L1000-F1027 HydrophobicContact CD2-CE1 3.97Å; L1000-F1027 HydrophobicContact CG-CE1 4.43Å; E1023-F1027 WeakPolarHBondContact O-CB 3.41Å; E1023-F1027 PolarHBondContact O-N 3.46Å; L1024-F1027 PolarHBondContact O-N 3.44Å; F1027-H1030 PolarHBondContact O-N 2.92Å; F1027-M1031 HydrophobicContact CD1-CG 4.46Å; F1027-M1031 HydrophobicContact CD1-SD 3.78Å; F1027-M1031 HydrophobicContact CE1-CG 4.19Å; F1027-M1031 HydrophobicContact CE1-SD 3.4Å; F1027-M1031 WeakPolarHBondContact CE1-SD 3.49Å; F1027-M1031 HydrophobicContact CZ-CG 4.46Å; F1027-M1031 HydrophobicContact CZ-SD 4.13Å; F1027-M1031 WeakPolarHBondContact O-CG 3.32Å; F1027-M1031 PolarHBondContact O-N 2.84Å
1028G87Confident81.2Confident0 Ų051.6 Ų51.60%025%0.251CS..Hα-helixtrans-61.5-44.3174.800000113.1L1024 L1025 H1030 M1031 F1032L1024-G1028 PolarHBondContact O-N 3.34Å; L1025-G1028 PolarHBondContact O-N 3.24Å; G1028-H1030 VanDerWaalsContact C-N 3.32Å; G1028-H1030 PolarHBondContact O-N 3.27Å; G1028-M1031 WeakPolarHBondContact O-CB 3.36Å; G1028-M1031 PolarHBondContact O-N 2.88Å; G1028-M1031 VanDerWaalsContact O-N 3.11Å; G1028-F1032 WeakPolarHBondContact O-CD2 3.46Å; G1028-F1032 PolarHBondContact O-N 3.43Å
1029H83.3Confident81.2Confident107 Ų10753.3 Ų53.350%0.49526%0.264SS..Hα-helixtrans-57.7-45.1176.6-175.574.8000111.6L1025 Q1026 M1031 F1032 C1033L1025-H1029 WeakPolarHBondContact O-CB 3.16Å; L1025-H1029 PolarHBondContact O-N 2.97Å; Q1026-H1029 PolarHBondContact O-N 3.44Å; H1029-M1031 PolarHBondContact O-N 3.08Å; H1029-F1032 PolarHBondContact O-N 2.71Å; H1029-C1033 PolarHBondContact O-N 3Å; H1029-C1033 PolarHBondContact O-SG 2.91Å; H1029-C1033 VanDerWaalsContact O-SG 3.33Å
1030H79.4Confident81.2Confident33 Ų3353.3 Ų53.315%0.15326%0.264CS..Hα-helixtrans-62.6-41.5174.8-171.887000112.2F986 Q1026 F1027 G1028 F1032 C1033 F1034F986-H1030 HydrophobicContact CD1-CB 4.37Å; F986-H1030 AromaticContact CD1-CD2 3.23Å; F986-H1030 WeakPolarHBondContact CD1-CD2 3.09Å; F986-H1030 AromaticContact CD1-CE1 3.96Å; F986-H1030 AromaticContact CD1-CG 3.66Å; F986-H1030 AromaticContact CD1-NE2 3.45Å; F986-H1030 WeakPolarHBondContact CD1-NE2 3.41Å; F986-H1030 HydrophobicContact CE1-CB 3.67Å; F986-H1030 AromaticContact CE1-CD2 3.31Å; F986-H1030 WeakPolarHBondContact CE1-CD2 3.26Å; F986-H1030 AromaticContact CE1-CG 3.46Å; F986-H1030 VanDerWaalsContact CE1-CG 3.46Å; F986-H1030 AromaticContact CG-NE2 3.97Å; F986-H1030 HydrophobicContact CZ-CB 3.77Å; F986-H1030 AromaticContact CZ-CG 3.9Å; Q1026-H1030 PolarHBondContact O-N 3.27Å; Q1026-H1030 VanDerWaalsContact O-N 3.1Å; F1027-H1030 PolarHBondContact O-N 2.92Å; G1028-H1030 VanDerWaalsContact C-N 3.32Å; G1028-H1030 PolarHBondContact O-N 3.27Å; H1030-F1032 VanDerWaalsContact C-N 3.34Å; H1030-F1032 PolarHBondContact O-N 2.91Å; H1030-C1033 PolarHBondContact O-N 3.36Å; H1030-F1034 HydrophobicContact CB-CD2 4.46Å; H1030-F1034 AromaticContact CE1-CD2 3.37Å; H1030-F1034 WeakPolarHBondContact CE1-CD2 3.4Å; H1030-F1034 AromaticContact CE1-CE2 3.91Å; H1030-F1034 AromaticContact CE1-CG 3.87Å; H1030-F1034 AromaticContact CG-CD2 3.73Å; H1030-F1034 AromaticContact ND1-CD2 3.21Å; H1030-F1034 WeakPolarHBondContact ND1-CD2 3.43Å; H1030-F1034 AromaticContact ND1-CE2 3.56Å; H1030-F1034 AromaticContact NE2-CD2 3.95Å; H1030-F1034 WeakPolarHBondContact O-CB 3.46Å; H1030-F1034 WeakPolarHBondContact O-CD2 3.31Å; H1030-F1034 PolarHBondContact O-N 3.42Å
1031M80.6Confident81.2Confident2 Ų251.2 Ų51.21%0.0125%0.249CC..Hα-helixtrans-58.2-45173.9-73.2175.155.400112.4I996 F1027 G1028 H1029 C1033 T1035 N1040I996-M1031 HydrophobicContact CG2-CE 3.65Å; I996-M1031 HydrophobicContact CG2-CG 4.27Å; I996-M1031 HydrophobicContact CG2-SD 3.58Å; I996-M1031 VanDerWaalsContact CG2-SD 3.58Å; F1027-M1031 HydrophobicContact CD1-CG 4.46Å; F1027-M1031 HydrophobicContact CD1-SD 3.78Å; F1027-M1031 HydrophobicContact CE1-CG 4.19Å; F1027-M1031 HydrophobicContact CE1-SD 3.4Å; F1027-M1031 WeakPolarHBondContact CE1-SD 3.49Å; F1027-M1031 HydrophobicContact CZ-CG 4.46Å; F1027-M1031 HydrophobicContact CZ-SD 4.13Å; F1027-M1031 WeakPolarHBondContact O-CG 3.32Å; F1027-M1031 PolarHBondContact O-N 2.84Å; G1028-M1031 WeakPolarHBondContact O-CB 3.36Å; G1028-M1031 PolarHBondContact O-N 2.88Å; G1028-M1031 VanDerWaalsContact O-N 3.11Å; H1029-M1031 PolarHBondContact O-N 3.08Å; M1031-C1033 PolarHBondContact O-N 3.3Å; M1031-T1035 WeakPolarHBondContact CA-OG1 3.31Å; M1031-T1035 CarbonylContact O-C 3.44Å; M1031-T1035 PolarHBondContact O-N 3.17Å; M1031-T1035 VanDerWaalsContact O-O 3.06Å; M1031-N1040 HydrophobicContact CE-CB 3.46Å; M1031-N1040 VanDerWaalsContact CE-CB 3.46Å
1032F76.5Confident81.1Confident38 Ų3849 Ų4917%0.16724%0.238CC..Hα-helixtrans-64.7-38.2178.3-78.9-67.9000113.3G1028 H1029 H1030 M1045 Y1059 F1062G1028-F1032 WeakPolarHBondContact O-CD2 3.46Å; G1028-F1032 PolarHBondContact O-N 3.43Å; H1029-F1032 PolarHBondContact O-N 2.71Å; H1030-F1032 VanDerWaalsContact C-N 3.34Å; H1030-F1032 PolarHBondContact O-N 2.91Å; F1032-M1045 HydrophobicContact CZ-CE 4.23Å; F1032-Y1059 HydrophobicContact CD2-CE1 4.35Å; F1032-Y1059 AromaticContact CE2-CD1 3.67Å; F1032-Y1059 HydrophobicContact CE2-CD1 3.67Å; F1032-Y1059 AromaticContact CE2-CE1 3.41Å; F1032-Y1059 HydrophobicContact CE2-CE1 3.41Å; F1032-Y1059 VanDerWaalsContact CE2-CE1 3.41Å; F1032-Y1059 HydrophobicContact CE2-CE2 4.44Å; F1032-Y1059 HydrophobicContact CE2-CG 4.36Å; F1032-Y1059 AromaticContact CE2-CZ 3.81Å; F1032-Y1059 AromaticContact CZ-CD1 3.99Å; F1032-Y1059 HydrophobicContact CZ-CD1 3.99Å; F1032-Y1059 HydrophobicContact CZ-CE1 4.15Å; F1032-F1062 HydrophobicContact CD1-CD2 4.08Å; F1032-F1062 HydrophobicContact CD1-CE2 4.29Å; F1032-F1062 HydrophobicContact CD1-CG 4.33Å; F1032-F1062 HydrophobicContact CE1-CB 4.11Å; F1032-F1062 AromaticContact CE1-CD1 3.57Å; F1032-F1062 HydrophobicContact CE1-CD1 3.57Å; F1032-F1062 AromaticContact CE1-CD2 3.5Å; F1032-F1062 HydrophobicContact CE1-CD2 3.5Å; F1032-F1062 AromaticContact CE1-CE1 3.77Å; F1032-F1062 HydrophobicContact CE1-CE1 3.77Å; F1032-F1062 AromaticContact CE1-CE2 3.7Å; F1032-F1062 HydrophobicContact CE1-CE2 3.7Å; F1032-F1062 AromaticContact CE1-CG 3.42Å; F1032-F1062 HydrophobicContact CE1-CG 3.42Å; F1032-F1062 VanDerWaalsContact CE1-CG 3.42Å; F1032-F1062 AromaticContact CE1-CZ 3.83Å; F1032-F1062 HydrophobicContact CE1-CZ 3.83Å; F1032-F1062 AromaticContact CZ-CD1 3.87Å; F1032-F1062 HydrophobicContact CZ-CD1 3.87Å; F1032-F1062 HydrophobicContact CZ-CE1 4.17Å; F1032-F1062 HydrophobicContact CZ-CG 4.06Å
1033C71.4Confident81.2Confident71 Ų7144.8 Ų44.848%0.4822%0.217SC..Hα-helixtrans-80-32.6-177-67.80000113.4H1029 H1030 M1031H1029-C1033 PolarHBondContact O-N 3Å; H1029-C1033 PolarHBondContact O-SG 2.91Å; H1029-C1033 VanDerWaalsContact O-SG 3.33Å; H1030-C1033 PolarHBondContact O-N 3.36Å; M1031-C1033 PolarHBondContact O-N 3.3Å
1034F68.1Low81.3Confident135 Ų13542.9 Ų42.959%0.59221%0.209SC*.Hα-helixtrans-127.1-28.5-165.5-58.3-77.3000115.2H1030H1030-F1034 HydrophobicContact CB-CD2 4.46Å; H1030-F1034 AromaticContact CE1-CD2 3.37Å; H1030-F1034 WeakPolarHBondContact CE1-CD2 3.4Å; H1030-F1034 AromaticContact CE1-CE2 3.91Å; H1030-F1034 AromaticContact CE1-CG 3.87Å; H1030-F1034 AromaticContact CG-CD2 3.73Å; H1030-F1034 AromaticContact ND1-CD2 3.21Å; H1030-F1034 WeakPolarHBondContact ND1-CD2 3.43Å; H1030-F1034 AromaticContact ND1-CE2 3.56Å; H1030-F1034 AromaticContact NE2-CD2 3.95Å; H1030-F1034 WeakPolarHBondContact O-CB 3.46Å; H1030-F1034 WeakPolarHBondContact O-CD2 3.31Å; H1030-F1034 PolarHBondContact O-N 3.42Å
1035T64.8Low81.4Confident7 Ų742.9 Ų42.94%0.04321%0.209CC..SBendtrans-129.371-176.350.80000110.2I996 M1031 A1037I996-T1035 HydrophobicContact CD1-CG2 4.33Å; M1031-T1035 WeakPolarHBondContact CA-OG1 3.31Å; M1031-T1035 CarbonylContact O-C 3.44Å; M1031-T1035 PolarHBondContact O-N 3.17Å; M1031-T1035 VanDerWaalsContact O-O 3.06Å; T1035-A1037 WeakPolarHBondContact O-CB 3.2Å; T1035-A1037 PolarHBondContact O-N 2.84Å
1036W64.9Low81.4Confident179 Ų17943.6 Ų43.668%0.67822%0.217SC*.  trans-55.2108.4-176.4-17468.3000111.9P1038W1036-P1038 HydrophobicContact CD2-CG 4.45Å; W1036-P1038 HydrophobicContact CH2-CG 4.3Å; W1036-P1038 HydrophobicContact CZ2-CG 3.87Å
1037A75.2Confident81.5Confident5 Ų539.1 Ų39.14%0.04120%0.197CC..  trans-146.585.6-172.800000112.1T1035 T1039 N1040 S1041T1035-A1037 WeakPolarHBondContact O-CB 3.2Å; T1035-A1037 PolarHBondContact O-N 2.84Å; A1037-T1039 VanDerWaalsContact C-N 3.34Å; A1037-T1039 PolarHBondContact O-N 3.34Å; A1037-N1040 HydrophobicContact CB-CB 4.14Å; A1037-N1040 PolarHBondContact O-N 3.39Å; A1037-S1041 PolarHBondContact O-N 2.82Å; A1037-S1041 PolarHBondContact O-OG 3.3Å
1038P78.3Confident81.6Confident27 Ų2739.1 Ų39.118%0.17520%0.197CC..Hα-helixtrans-56.4-41.9-169-26.734.2000114.5W1036 S1041 A1042 F1062 F1078W1036-P1038 HydrophobicContact CD2-CG 4.45Å; W1036-P1038 HydrophobicContact CH2-CG 4.3Å; W1036-P1038 HydrophobicContact CZ2-CG 3.87Å; P1038-S1041 PolarHBondContact O-N 2.97Å; P1038-A1042 PolarHBondContact O-N 3.08Å; P1038-F1062 HydrophobicContact CB-CZ 4.23Å; P1038-F1078 VanDerWaalsContact C-CZ 3.46Å; P1038-F1078 HydrophobicContact CB-CE1 4.44Å; P1038-F1078 HydrophobicContact CB-CE2 4.19Å; P1038-F1078 HydrophobicContact CB-CZ 3.49Å; P1038-F1078 VanDerWaalsContact CB-CZ 3.49Å; P1038-F1078 WeakPolarHBondContact O-CE1 3.47Å; P1038-F1078 WeakPolarHBondContact O-CZ 3.39Å
1039T81.2Confident81.6Confident90 Ų9040.9 Ų40.955%0.55221%0.206SC*.Hα-helixtrans-67-42.7-178.647.20000113A1037 S1041 A1042 F1043A1037-T1039 VanDerWaalsContact C-N 3.34Å; A1037-T1039 PolarHBondContact O-N 3.34Å; T1039-S1041 VanDerWaalsContact C-N 3.33Å; T1039-A1042 WeakPolarHBondContact O-CB 3.36Å; T1039-A1042 PolarHBondContact O-N 2.85Å; T1039-F1043 PolarHBondContact O-N 2.92Å
1040N86.8Confident81.6Confident6 Ų640.1 Ų40.13%0.03221%0.213CC..Hα-helixtrans-65.7-38.6175.5-74.1-27.5000111.2Q993 I996 N997 L1000 M1031 A1037 A1042 F1043 L1044Q993-N1040 PolarHBondContact O-ND2 3.26Å; Q993-N1040 PolarHBondContact OE1-ND2 3.5Å; I996-N1040 HydrophobicContact CG2-CB 4.06Å; N997-N1040 VanDerWaalsContact CB-OD1 3.22Å; N997-N1040 WeakPolarHBondContact CB-OD1 3.36Å; N997-N1040 PolarHBondContact ND2-OD1 3.46Å; L1000-N1040 HydrophobicContact CD1-CB 4.08Å; L1000-N1040 VanDerWaalsContact CD1-O 3.28Å; L1000-N1040 WeakPolarHBondContact CD1-O 3.5Å; M1031-N1040 HydrophobicContact CE-CB 3.46Å; M1031-N1040 VanDerWaalsContact CE-CB 3.46Å; A1037-N1040 HydrophobicContact CB-CB 4.14Å; A1037-N1040 PolarHBondContact O-N 3.39Å; N1040-A1042 PolarHBondContact O-N 3.45Å; N1040-F1043 PolarHBondContact O-N 3.32Å; N1040-L1044 PolarHBondContact O-N 2.84Å
1041S87.1Confident81.8Confident2 Ų240.5 Ų40.51%0.01421%0.213CC..Hα-helixtrans-61.4-42.3172.9-63.70000112A1037 P1038 T1039 F1043 L1044 M1045A1037-S1041 PolarHBondContact O-N 2.82Å; A1037-S1041 PolarHBondContact O-OG 3.3Å; P1038-S1041 PolarHBondContact O-N 2.97Å; T1039-S1041 VanDerWaalsContact C-N 3.33Å; S1041-F1043 PolarHBondContact O-N 3.43Å; S1041-L1044 PolarHBondContact O-N 3.47Å; S1041-M1045 VanDerWaalsContact C-CE 3.43Å; S1041-M1045 WeakPolarHBondContact O-CE 3.44Å; S1041-M1045 WeakPolarHBondContact O-CG 3.36Å; S1041-M1045 PolarHBondContact O-N 2.93Å
1042A87.2Confident81.8Confident3 Ų343.4 Ų43.43%0.02524%0.243CC..Hα-helixtrans-59.8-44.1174.300000112P1038 T1039 N1040 M1045 S1046 F1078P1038-A1042 PolarHBondContact O-N 3.08Å; T1039-A1042 WeakPolarHBondContact O-CB 3.36Å; T1039-A1042 PolarHBondContact O-N 2.85Å; N1040-A1042 PolarHBondContact O-N 3.45Å; A1042-M1045 PolarHBondContact O-N 3.47Å; A1042-S1046 WeakPolarHBondContact O-CB 3.2Å; A1042-S1046 PolarHBondContact O-N 2.97Å; A1042-F1078 HydrophobicContact CB-CD1 3.88Å; A1042-F1078 HydrophobicContact CB-CE1 3.62Å; A1042-F1078 HydrophobicContact CB-CZ 4.2Å
1043F89.6Confident82.3Confident47 Ų4742.4 Ų42.421%0.20624%0.241CC..Hα-helixtrans-64.1-44.5178.8-176.4-153.1000112.2L1000 H1001 A1004 T1039 N1040 S1041 M1045 S1046 L1047L1000-F1043 HydrophobicContact CB-CD1 3.56Å; L1000-F1043 HydrophobicContact CB-CE1 3.58Å; L1000-F1043 HydrophobicContact CD1-CB 4.35Å; L1000-F1043 HydrophobicContact CD1-CD1 3.97Å; L1000-F1043 HydrophobicContact CD1-CG 4.49Å; L1000-F1043 HydrophobicContact CG-CD1 4.43Å; H1001-F1043 HydrophobicContact CB-CE1 4.42Å; H1001-F1043 AromaticContact CD2-CE1 3.82Å; H1001-F1043 AromaticContact CE1-CE1 3.44Å; H1001-F1043 VanDerWaalsContact CE1-CE1 3.44Å; H1001-F1043 WeakPolarHBondContact CE1-CE1 3.43Å; H1001-F1043 AromaticContact CE1-CZ 3.52Å; H1001-F1043 AromaticContact CG-CE1 3.69Å; H1001-F1043 AromaticContact ND1-CE1 3.47Å; H1001-F1043 WeakPolarHBondContact ND1-CE1 3.23Å; H1001-F1043 AromaticContact ND1-CZ 3.4Å; H1001-F1043 WeakPolarHBondContact ND1-CZ 3.47Å; H1001-F1043 AromaticContact NE2-CE1 3.66Å; A1004-F1043 HydrophobicContact CB-CE2 4.45Å; A1004-F1043 HydrophobicContact CB-CZ 3.99Å; T1039-F1043 PolarHBondContact O-N 2.92Å; N1040-F1043 PolarHBondContact O-N 3.32Å; S1041-F1043 PolarHBondContact O-N 3.43Å; F1043-M1045 VanDerWaalsContact C-N 3.34Å; F1043-M1045 PolarHBondContact O-N 2.74Å; F1043-S1046 WeakPolarHBondContact O-CB 3.38Å; F1043-S1046 PolarHBondContact O-N 3.32Å; F1043-L1047 PolarHBondContact O-N 3.4Å
1044L91.5Very high83Confident0 Ų044.2 Ų44.20%024%0.242CC..Hα-helixtrans-58.5-44.1174.2175.462.9000112.1L1000 L1024 N1040 S1041 L1047 L1048L1000-L1044 HydrophobicContact CD1-CB 4.27Å; L1000-L1044 HydrophobicContact CD2-CB 4.03Å; L1000-L1044 HydrophobicContact CD2-CD1 3.85Å; L1000-L1044 HydrophobicContact CD2-CG 4.44Å; L1024-L1044 HydrophobicContact CB-CD1 4.17Å; L1024-L1044 HydrophobicContact CD2-CD1 4.19Å; N1040-L1044 PolarHBondContact O-N 2.84Å; S1041-L1044 PolarHBondContact O-N 3.47Å; L1044-L1047 WeakPolarHBondContact O-CB 3.48Å; L1044-L1047 PolarHBondContact O-N 3.3Å; L1044-L1048 HydrophobicContact CD1-CD1 4.37Å; L1044-L1048 HydrophobicContact CD1-CG 4.44Å; L1044-L1048 HydrophobicContact CG-CD1 4.23Å; L1044-L1048 WeakPolarHBondContact O-CG 3.23Å; L1044-L1048 PolarHBondContact O-N 3.44Å
1045M91.6Very high84Confident0 Ų038 Ų380%022%0.215CC..Hα-helixtrans-63.6-42.7177.1-75.8-178-9500112.3F1032 S1041 A1042 F1043 L1047 L1048 L1049 L1055 Y1059 F1062 L1063 V1081F1032-M1045 HydrophobicContact CZ-CE 4.23Å; S1041-M1045 VanDerWaalsContact C-CE 3.43Å; S1041-M1045 WeakPolarHBondContact O-CE 3.44Å; S1041-M1045 WeakPolarHBondContact O-CG 3.36Å; S1041-M1045 PolarHBondContact O-N 2.93Å; A1042-M1045 PolarHBondContact O-N 3.47Å; F1043-M1045 VanDerWaalsContact C-N 3.34Å; F1043-M1045 PolarHBondContact O-N 2.74Å; M1045-L1047 VanDerWaalsContact C-N 3.3Å; M1045-L1047 PolarHBondContact O-N 3.14Å; M1045-L1048 PolarHBondContact O-N 2.86Å; M1045-L1049 WeakPolarHBondContact O-CB 3.49Å; M1045-L1049 VanDerWaalsContact O-CG 3.3Å; M1045-L1049 WeakPolarHBondContact O-CG 3.03Å; M1045-L1049 PolarHBondContact O-N 3.34Å; M1045-L1055 HydrophobicContact CB-CD1 4.15Å; M1045-L1055 HydrophobicContact CG-CD1 4.19Å; M1045-L1055 HydrophobicContact CG-CD2 4.4Å; M1045-L1055 HydrophobicContact SD-CD1 4.46Å; M1045-Y1059 HydrophobicContact CE-CD1 4.44Å; M1045-Y1059 HydrophobicContact CG-CD1 3.42Å; M1045-Y1059 VanDerWaalsContact CG-CD1 3.42Å; M1045-Y1059 HydrophobicContact CG-CE1 4.04Å; M1045-Y1059 HydrophobicContact CG-CG 4.41Å; M1045-Y1059 HydrophobicContact SD-CD1 3.68Å; M1045-Y1059 HydrophobicContact SD-CG 4.32Å; M1045-F1062 HydrophobicContact CE-CD1 3.67Å; M1045-F1062 HydrophobicContact CE-CE1 3.73Å; M1045-L1063 HydrophobicContact CE-CD2 3.73Å; M1045-L1063 HydrophobicContact CE-CG 4.07Å; M1045-L1063 HydrophobicContact SD-CD1 3.67Å; M1045-L1063 HydrophobicContact SD-CD2 3.77Å; M1045-L1063 HydrophobicContact SD-CG 3.62Å; M1045-V1081 HydrophobicContact CB-CG1 3.46Å; M1045-V1081 VanDerWaalsContact CB-CG1 3.46Å; M1045-V1081 HydrophobicContact CG-CG1 4.44Å; M1045-V1081 HydrophobicContact SD-CG1 4.24Å
1046S89.4Confident85.2Confident59 Ų5940 Ų4041%0.41323%0.228SC..Hα-helixtrans-57.9-44.3174.1-171.90000111.5A1042 F1043 L1049 S1050A1042-S1046 WeakPolarHBondContact O-CB 3.2Å; A1042-S1046 PolarHBondContact O-N 2.97Å; F1043-S1046 WeakPolarHBondContact O-CB 3.38Å; F1043-S1046 PolarHBondContact O-N 3.32Å; S1046-L1049 PolarHBondContact O-N 3.05Å; S1046-S1050 WeakPolarHBondContact O-CB 3.23Å; S1046-S1050 PolarHBondContact O-N 3.42Å
1047L89Confident86.1Confident11 Ų1138.7 Ų38.76%0.05822%0.224CC..Hα-helixtrans-60.9-47.7176.4-175.764.9000111.6V1003 A1004 L1024 F1043 L1044 M1045 L1049 S1050 R1051V1003-L1047 HydrophobicContact CB-CD2 4.05Å; V1003-L1047 HydrophobicContact CG1-CD2 3.78Å; A1004-L1047 HydrophobicContact CB-CD1 3.95Å; L1024-L1047 HydrophobicContact CD1-CD2 4.09Å; F1043-L1047 PolarHBondContact O-N 3.4Å; L1044-L1047 WeakPolarHBondContact O-CB 3.48Å; L1044-L1047 PolarHBondContact O-N 3.3Å; M1045-L1047 VanDerWaalsContact C-N 3.3Å; M1045-L1047 PolarHBondContact O-N 3.14Å; L1047-L1049 PolarHBondContact O-N 3.37Å; L1047-S1050 PolarHBondContact O-N 3.08Å; L1047-S1050 PolarHBondContact O-OG 2.89Å; L1047-R1051 WeakPolarHBondContact O-CG 3.45Å; L1047-R1051 PolarHBondContact O-N 3.49Å
1048L90.8Very high86.6Confident0 Ų043.1 Ų43.10%025%0.246CC..Hα-helixtrans-61.8-43.3177-72.8169.8000112.3N1021 L1024 L1025 L1044 M1045 S1050 R1051 G1052 C1053 L1055N1021-L1048 HydrophobicContact CB-CD2 4.45Å; L1024-L1048 HydrophobicContact CB-CD2 4.16Å; L1024-L1048 HydrophobicContact CD1-CD2 4.19Å; L1025-L1048 HydrophobicContact CD2-CD1 3.8Å; L1025-L1048 HydrophobicContact CG-CD1 4.47Å; L1044-L1048 HydrophobicContact CD1-CD1 4.37Å; L1044-L1048 HydrophobicContact CD1-CG 4.44Å; L1044-L1048 HydrophobicContact CG-CD1 4.23Å; L1044-L1048 WeakPolarHBondContact O-CG 3.23Å; L1044-L1048 PolarHBondContact O-N 3.44Å; M1045-L1048 PolarHBondContact O-N 2.86Å; L1048-S1050 VanDerWaalsContact C-N 3.32Å; L1048-S1050 PolarHBondContact O-N 3.27Å; L1048-R1051 PolarHBondContact O-N 2.81Å; L1048-R1051 VanDerWaalsContact O-N 3.16Å; L1048-G1052 PolarHBondContact O-N 3.18Å; L1048-C1053 HydrophobicContact CB-CB 4.11Å; L1048-C1053 HydrophobicContact CD2-CB 4.2Å; L1048-C1053 WeakPolarHBondContact O-CB 3.5Å; L1048-C1053 PolarHBondContact O-N 2.74Å; L1048-L1055 HydrophobicContact CB-CD2 3.7Å; L1048-L1055 HydrophobicContact CD1-CD2 3.89Å; L1048-L1055 HydrophobicContact CG-CD2 4.47Å
1049L87.6Confident87.2Confident36 Ų3642.2 Ų42.219%0.18824%0.24CC..Hα-helixtrans-61.7-40.2175.5-72.6170.6000111.7M1045 S1046 L1047 R1051 G1052 L1055 V1081 Q1088M1045-L1049 WeakPolarHBondContact O-CB 3.49Å; M1045-L1049 VanDerWaalsContact O-CG 3.3Å; M1045-L1049 WeakPolarHBondContact O-CG 3.03Å; M1045-L1049 PolarHBondContact O-N 3.34Å; S1046-L1049 PolarHBondContact O-N 3.05Å; L1047-L1049 PolarHBondContact O-N 3.37Å; L1049-R1051 PolarHBondContact O-N 3.01Å; L1049-G1052 PolarHBondContact O-N 2.96Å; L1049-L1055 HydrophobicContact CD1-CD1 4.01Å; L1049-L1055 HydrophobicContact CD2-CD1 3.85Å; L1049-L1055 HydrophobicContact CD2-CG 3.94Å; L1049-L1055 HydrophobicContact CG-CD1 3.81Å; L1049-L1055 HydrophobicContact CG-CG 4.15Å; L1049-V1081 HydrophobicContact CD1-CG1 4.03Å; L1049-Q1088 HydrophobicContact CD2-CG 4.2Å; L1049-Q1088 VanDerWaalsContact CD2-NE2 3.29Å
1050S83.2Confident87.5Confident91 Ų9137.9 Ų37.964%0.63621%0.213SC*.Hα-helixtrans-64-26.2177.180.30000113.2S1046 L1047 L1048 G1052S1046-S1050 WeakPolarHBondContact O-CB 3.23Å; S1046-S1050 PolarHBondContact O-N 3.42Å; L1047-S1050 PolarHBondContact O-N 3.08Å; L1047-S1050 PolarHBondContact O-OG 2.89Å; L1048-S1050 VanDerWaalsContact C-N 3.32Å; L1048-S1050 PolarHBondContact O-N 3.27Å; S1050-G1052 VanDerWaalsContact C-N 3.3Å
1051R83.8Confident87.5Confident42 Ų4240.4 Ų40.416%0.15823%0.229CC..THydrogen-bonded Turntrans-84.92.7173.4-65-178.7176.5-167.7-0.5113.6D1007 I1019 N1021 L1024 L1047 L1048 L1049 C1053D1007-R1051 IonicContact OD1-CZ 3.81Å; D1007-R1051 IonicContact OD1-NE 2.64Å; D1007-R1051 IonicContact OD1-NH2 2.69Å; D1007-R1051 PolarHBondContact OD1-NH2 2.81Å; D1007-R1051 IonicContact OD2-CZ 2.69Å; D1007-R1051 IonicContact OD2-NE 3.59Å; D1007-R1051 PolarHBondContact OD2-NE 3.33Å; D1007-R1051 IonicContact OD2-NH2 3.24Å; D1007-R1051 PolarHBondContact OD2-NH2 3.37Å; I1019-R1051 PolarHBondContact O-NH1 2.91Å; I1019-R1051 PolarHBondContact O-NH2 3.17Å; N1021-R1051 WeakPolarHBondContact OD1-CD 3.46Å; N1021-R1051 PolarHBondContact OD1-NH1 3.14Å; L1024-R1051 VanDerWaalsContact CD1-NH1 3.3Å; L1047-R1051 WeakPolarHBondContact O-CG 3.45Å; L1047-R1051 PolarHBondContact O-N 3.49Å; L1048-R1051 PolarHBondContact O-N 2.81Å; L1048-R1051 VanDerWaalsContact O-N 3.16Å; L1049-R1051 PolarHBondContact O-N 3.01Å; R1051-C1053 VanDerWaalsContact C-N 3.25Å; R1051-C1053 PolarHBondContact O-N 3.28Å
1052G80.2Confident87.5Confident62 Ų6241.5 Ų41.564%0.63923%0.233SC*.THydrogen-bonded Turntrans71.715.4-174.900000114.3L1048 L1049 S1050L1048-G1052 PolarHBondContact O-N 3.18Å; L1049-G1052 PolarHBondContact O-N 2.96Å; S1050-G1052 VanDerWaalsContact C-N 3.3Å
1053C86.3Confident87.6Confident18 Ų1841.3 Ų41.312%0.12223%0.232CC..PPolyproline II helixtrans-73.8133.3-179.4-174.20000111.1L1048 R1051 L1055 Q1088L1048-C1053 HydrophobicContact CB-CB 4.11Å; L1048-C1053 HydrophobicContact CD2-CB 4.2Å; L1048-C1053 WeakPolarHBondContact O-CB 3.5Å; L1048-C1053 PolarHBondContact O-N 2.74Å; R1051-C1053 VanDerWaalsContact C-N 3.25Å; R1051-C1053 PolarHBondContact O-N 3.28Å; C1053-L1055 PolarHBondContact O-N 3.16Å; C1053-Q1088 PolarHBondContact O-NE2 3.45Å
1054Q86.3Confident87.5Confident108 Ų10840.7 Ų40.751%0.50523%0.23SC..PPolyproline II helixtrans-70.5116.2170.5-74.7-69.1-14.700109.7
1055L89.5Confident87.2Confident5 Ų548.7 Ų48.73%0.02626%0.26CS..PPolyproline II helixtrans-69.8133.5178.5-65.4-177.8000110.2M1045 L1048 L1049 C1053 C1085 K1092M1045-L1055 HydrophobicContact CB-CD1 4.15Å; M1045-L1055 HydrophobicContact CG-CD1 4.19Å; M1045-L1055 HydrophobicContact CG-CD2 4.4Å; M1045-L1055 HydrophobicContact SD-CD1 4.46Å; L1048-L1055 HydrophobicContact CB-CD2 3.7Å; L1048-L1055 HydrophobicContact CD1-CD2 3.89Å; L1048-L1055 HydrophobicContact CG-CD2 4.47Å; L1049-L1055 HydrophobicContact CD1-CD1 4.01Å; L1049-L1055 HydrophobicContact CD2-CD1 3.85Å; L1049-L1055 HydrophobicContact CD2-CG 3.94Å; L1049-L1055 HydrophobicContact CG-CD1 3.81Å; L1049-L1055 HydrophobicContact CG-CG 4.15Å; C1053-L1055 PolarHBondContact O-N 3.16Å; L1055-C1085 HydrophobicContact CD1-CB 4.25Å; L1055-K1092 WeakPolarHBondContact O-CE 3.02Å; L1055-K1092 PolarHBondContact O-NZ 3.12Å
1056P89Confident86.9Confident50 Ų5049.7 Ų49.733%0.32526%0.264SS..PPolyproline II helixtrans-59.6153.7173.9-2129.9000112.3L1025 L1058 Y1059 S1060L1025-P1056 HydrophobicContact CD2-CG 3.83Å; P1056-L1058 PolarHBondContact O-N 2.87Å; P1056-Y1059 HydrophobicContact CB-CD2 3.86Å; P1056-Y1059 HydrophobicContact CB-CE2 4.24Å; P1056-Y1059 HydrophobicContact CG-CD2 3.79Å; P1056-Y1059 HydrophobicContact CG-CE2 3.8Å; P1056-Y1059 WeakPolarHBondContact O-CB 3.22Å; P1056-Y1059 PolarHBondContact O-N 2.93Å; P1056-S1060 PolarHBondContact O-N 3.15Å
1057Y85.2Confident86.7Confident151 Ų15147.3 Ų47.359%0.59225%0.247SC*.Hα-helixtrans-56.5-36.9-177-169.3-103.1000112.9Y1059 S1060 T1061 L1095Y1057-Y1059 VanDerWaalsContact C-N 3.25Å; Y1057-Y1059 PolarHBondContact O-N 2.8Å; Y1057-S1060 WeakPolarHBondContact O-CA 3.3Å; Y1057-S1060 VanDerWaalsContact O-CB 3.28Å; Y1057-S1060 WeakPolarHBondContact O-CB 3.42Å; Y1057-S1060 PolarHBondContact O-N 3.45Å; Y1057-T1061 WeakPolarHBondContact CE1-OG1 3.19Å; Y1057-T1061 PolarHBondContact O-N 3.1Å; Y1057-T1061 PolarHBondContact O-OG1 3.14Å; Y1057-L1095 HydrophobicContact CE2-CD2 4.45Å
1058L85.5Confident86.3Confident97 Ų9750 Ų5051%0.50827%0.267SS..Hα-helixtrans-51.8-41.1175-179.266000113.2P1056 S1060 F1062P1056-L1058 PolarHBondContact O-N 2.87Å; L1058-S1060 VanDerWaalsContact C-N 3.33Å; L1058-F1062 WeakPolarHBondContact O-CB 3.32Å; L1058-F1062 PolarHBondContact O-N 3.39Å
1059Y89.7Confident85.6Confident8 Ų855.2 Ų55.23%0.03129%0.294CS..Hα-helixtrans-69-35.8178.2-70.7-107.4000111.2L1025 F1032 M1045 P1056 Y1057 F1062 L1063L1025-Y1059 HydrophobicContact CD2-CE2 4.09Å; L1025-Y1059 PolarHBondContact O-OH 2.71Å; F1032-Y1059 HydrophobicContact CD2-CE1 4.35Å; F1032-Y1059 AromaticContact CE2-CD1 3.67Å; F1032-Y1059 HydrophobicContact CE2-CD1 3.67Å; F1032-Y1059 AromaticContact CE2-CE1 3.41Å; F1032-Y1059 HydrophobicContact CE2-CE1 3.41Å; F1032-Y1059 VanDerWaalsContact CE2-CE1 3.41Å; F1032-Y1059 HydrophobicContact CE2-CE2 4.44Å; F1032-Y1059 HydrophobicContact CE2-CG 4.36Å; F1032-Y1059 AromaticContact CE2-CZ 3.81Å; F1032-Y1059 AromaticContact CZ-CD1 3.99Å; F1032-Y1059 HydrophobicContact CZ-CD1 3.99Å; F1032-Y1059 HydrophobicContact CZ-CE1 4.15Å; M1045-Y1059 HydrophobicContact CE-CD1 4.44Å; M1045-Y1059 HydrophobicContact CG-CD1 3.42Å; M1045-Y1059 VanDerWaalsContact CG-CD1 3.42Å; M1045-Y1059 HydrophobicContact CG-CE1 4.04Å; M1045-Y1059 HydrophobicContact CG-CG 4.41Å; M1045-Y1059 HydrophobicContact SD-CD1 3.68Å; M1045-Y1059 HydrophobicContact SD-CG 4.32Å; P1056-Y1059 HydrophobicContact CB-CD2 3.86Å; P1056-Y1059 HydrophobicContact CB-CE2 4.24Å; P1056-Y1059 HydrophobicContact CG-CD2 3.79Å; P1056-Y1059 HydrophobicContact CG-CE2 3.8Å; P1056-Y1059 WeakPolarHBondContact O-CB 3.22Å; P1056-Y1059 PolarHBondContact O-N 2.93Å; Y1057-Y1059 VanDerWaalsContact C-N 3.25Å; Y1057-Y1059 PolarHBondContact O-N 2.8Å; Y1059-F1062 PolarHBondContact O-N 2.98Å; Y1059-L1063 VanDerWaalsContact O-CG 3.3Å; Y1059-L1063 WeakPolarHBondContact O-CG 3.32Å; Y1059-L1063 PolarHBondContact O-N 2.84Å
1060S88.7Confident84.3Confident0 Ų054.8 Ų54.80%029%0.294CS..Hα-helixtrans-66.2-46.1177.8-47.30000110.2P1056 Y1057 L1058 F1062 L1063 H1064 C1085 K1092P1056-S1060 PolarHBondContact O-N 3.15Å; Y1057-S1060 WeakPolarHBondContact O-CA 3.3Å; Y1057-S1060 VanDerWaalsContact O-CB 3.28Å; Y1057-S1060 WeakPolarHBondContact O-CB 3.42Å; Y1057-S1060 PolarHBondContact O-N 3.45Å; L1058-S1060 VanDerWaalsContact C-N 3.33Å; S1060-F1062 VanDerWaalsContact C-N 3.33Å; S1060-F1062 PolarHBondContact O-N 3.01Å; S1060-L1063 PolarHBondContact O-N 3.14Å; S1060-H1064 WeakPolarHBondContact O-CB 3.49Å; S1060-H1064 PolarHBondContact O-N 2.93Å; S1060-C1085 PolarHBondContact OG-SG 3.29Å; S1060-K1092 WeakPolarHBondContact OG-CE 3.32Å
1061T87.2Confident82.8Confident58 Ų5858.3 Ų58.336%0.35631%0.305SS..Hα-helixtrans-63.2-38.9174.9-47.10000112Y1057 H1064 R1065Y1057-T1061 WeakPolarHBondContact CE1-OG1 3.19Å; Y1057-T1061 PolarHBondContact O-N 3.1Å; Y1057-T1061 PolarHBondContact O-OG1 3.14Å; T1061-H1064 PolarHBondContact O-N 3.4Å; T1061-R1065 WeakPolarHBondContact O-CB 3.5Å; T1061-R1065 PolarHBondContact O-N 3.08Å
1062F86.7Confident81.3Confident25 Ų2561.2 Ų61.211%0.1133%0.332CS..Hα-helixtrans-62.1-49.1175.2170.4-97.3000111.9F1032 P1038 M1045 L1058 Y1059 S1060 H1064 R1065 Q1066 F1078F1032-F1062 HydrophobicContact CD1-CD2 4.08Å; F1032-F1062 HydrophobicContact CD1-CE2 4.29Å; F1032-F1062 HydrophobicContact CD1-CG 4.33Å; F1032-F1062 HydrophobicContact CE1-CB 4.11Å; F1032-F1062 AromaticContact CE1-CD1 3.57Å; F1032-F1062 HydrophobicContact CE1-CD1 3.57Å; F1032-F1062 AromaticContact CE1-CD2 3.5Å; F1032-F1062 HydrophobicContact CE1-CD2 3.5Å; F1032-F1062 AromaticContact CE1-CE1 3.77Å; F1032-F1062 HydrophobicContact CE1-CE1 3.77Å; F1032-F1062 AromaticContact CE1-CE2 3.7Å; F1032-F1062 HydrophobicContact CE1-CE2 3.7Å; F1032-F1062 AromaticContact CE1-CG 3.42Å; F1032-F1062 HydrophobicContact CE1-CG 3.42Å; F1032-F1062 VanDerWaalsContact CE1-CG 3.42Å; F1032-F1062 AromaticContact CE1-CZ 3.83Å; F1032-F1062 HydrophobicContact CE1-CZ 3.83Å; F1032-F1062 AromaticContact CZ-CD1 3.87Å; F1032-F1062 HydrophobicContact CZ-CD1 3.87Å; F1032-F1062 HydrophobicContact CZ-CE1 4.17Å; F1032-F1062 HydrophobicContact CZ-CG 4.06Å; P1038-F1062 HydrophobicContact CB-CZ 4.23Å; M1045-F1062 HydrophobicContact CE-CD1 3.67Å; M1045-F1062 HydrophobicContact CE-CE1 3.73Å; L1058-F1062 WeakPolarHBondContact O-CB 3.32Å; L1058-F1062 PolarHBondContact O-N 3.39Å; Y1059-F1062 PolarHBondContact O-N 2.98Å; S1060-F1062 VanDerWaalsContact C-N 3.33Å; S1060-F1062 PolarHBondContact O-N 3.01Å; F1062-H1064 VanDerWaalsContact C-N 3.31Å; F1062-H1064 PolarHBondContact O-N 3.19Å; F1062-R1065 PolarHBondContact O-N 2.85Å; F1062-Q1066 HydrophobicContact CD1-CG 4.22Å; F1062-Q1066 HydrophobicContact CD2-CG 4.26Å; F1062-Q1066 HydrophobicContact CE1-CG 3.72Å; F1062-Q1066 HydrophobicContact CE2-CG 3.76Å; F1062-Q1066 HydrophobicContact CG-CG 4.48Å; F1062-Q1066 HydrophobicContact CZ-CG 3.46Å; F1062-Q1066 VanDerWaalsContact CZ-CG 3.46Å; F1062-Q1066 WeakPolarHBondContact O-CG 3.44Å; F1062-Q1066 PolarHBondContact O-N 3.18Å; F1062-F1078 HydrophobicContact CE1-CE1 4.05Å
1063L89Confident79.8Confident0 Ų066 Ų660%034%0.342CS..Hα-helixtrans-58.2-44.5176.9-73.4170.4000111.4M1045 Y1059 S1060 R1065 Q1066 L1067 F1078 V1081 C1085 F1096M1045-L1063 HydrophobicContact CE-CD2 3.73Å; M1045-L1063 HydrophobicContact CE-CG 4.07Å; M1045-L1063 HydrophobicContact SD-CD1 3.67Å; M1045-L1063 HydrophobicContact SD-CD2 3.77Å; M1045-L1063 HydrophobicContact SD-CG 3.62Å; Y1059-L1063 VanDerWaalsContact O-CG 3.3Å; Y1059-L1063 WeakPolarHBondContact O-CG 3.32Å; Y1059-L1063 PolarHBondContact O-N 2.84Å; S1060-L1063 PolarHBondContact O-N 3.14Å; L1063-R1065 PolarHBondContact O-N 2.8Å; L1063-Q1066 PolarHBondContact O-N 3.07Å; L1063-L1067 WeakPolarHBondContact O-CG 3.44Å; L1063-L1067 PolarHBondContact O-N 3.02Å; L1063-F1078 HydrophobicContact CD2-CD1 3.72Å; L1063-F1078 HydrophobicContact CD2-CE1 4.42Å; L1063-V1081 HydrophobicContact CD1-CG1 3.98Å; L1063-V1081 HydrophobicContact CD2-CB 4.45Å; L1063-V1081 HydrophobicContact CD2-CG1 3.99Å; L1063-C1085 HydrophobicContact CD1-CB 3.99Å; L1063-F1096 HydrophobicContact CB-CE1 3.81Å; L1063-F1096 HydrophobicContact CB-CZ 3.71Å; L1063-F1096 HydrophobicContact CD1-CZ 4.26Å
1064H87.9Confident78.1Confident34 Ų3467.3 Ų67.316%0.15736%0.355CS..Hα-helixtrans-58.7-47.1176.6178.4-85.8000111.6S1060 T1061 F1062 Q1066 L1067 S1068 L1095 F1096 D1098S1060-H1064 WeakPolarHBondContact O-CB 3.49Å; S1060-H1064 PolarHBondContact O-N 2.93Å; T1061-H1064 PolarHBondContact O-N 3.4Å; F1062-H1064 VanDerWaalsContact C-N 3.31Å; F1062-H1064 PolarHBondContact O-N 3.19Å; H1064-Q1066 PolarHBondContact O-N 3.46Å; H1064-L1067 PolarHBondContact O-N 2.92Å; H1064-S1068 PolarHBondContact CE1-OG 2.54Å; H1064-S1068 WeakPolarHBondContact O-CB 3.45Å; H1064-S1068 PolarHBondContact O-N 3Å; H1064-S1068 PolarHBondContact O-OG 3.27Å; H1064-L1095 HydrophobicContact CB-CD2 4.43Å; H1064-L1095 HydrophobicContact CB-CG 4.24Å; H1064-L1095 PolarHBondContact CD2-O 3.45Å; H1064-L1095 PolarHBondContact NE2-O 2.97Å; H1064-F1096 HydrophobicContact CB-CD1 4.3Å; H1064-F1096 HydrophobicContact CB-CE1 3.98Å; H1064-D1098 IonicContact CD2-OD1 3.64Å; H1064-D1098 PolarHBondContact CD2-OD1 3.42Å; H1064-D1098 IonicContact CE1-OD1 2.73Å; H1064-D1098 IonicContact CE1-OD2 3.98Å; H1064-D1098 VanDerWaalsContact NE2-CG 3.3Å; H1064-D1098 IonicContact NE2-OD1 3.68Å; H1064-D1098 PolarHBondContact NE2-OD1 3.41Å; H1064-D1098 IonicContact NE2-OD2 3.35Å; H1064-D1098 PolarHBondContact NE2-OD2 3.07Å
1065R85.5Confident76.9Confident167 Ų16763.7 Ų63.763%0.6334%0.338SS*.Hα-helixtrans-63.6-40177.4-172.3172.6-176.5-179.42112.4T1061 F1062 L1063 S1068 I1069T1061-R1065 WeakPolarHBondContact O-CB 3.5Å; T1061-R1065 PolarHBondContact O-N 3.08Å; F1062-R1065 PolarHBondContact O-N 2.85Å; L1063-R1065 PolarHBondContact O-N 2.8Å; R1065-S1068 PolarHBondContact O-N 3.39Å; R1065-I1069 HydrophobicContact CG-CD1 3.53Å; R1065-I1069 HydrophobicContact CG-CG1 4.3Å; R1065-I1069 WeakPolarHBondContact O-CB 3.26Å; R1065-I1069 VanDerWaalsContact O-CG1 3.23Å; R1065-I1069 WeakPolarHBondContact O-CG1 3.4Å; R1065-I1069 PolarHBondContact O-N 3.37Å
1066Q85.1Confident76Confident21 Ų2169.8 Ų69.810%0.09837%0.367CS..Hα-helixtrans-65.3-40.9176.5-69.1-53.9-51.500112.3F1062 L1063 H1064 S1068 I1069 S1070 F1078F1062-Q1066 HydrophobicContact CD1-CG 4.22Å; F1062-Q1066 HydrophobicContact CD2-CG 4.26Å; F1062-Q1066 HydrophobicContact CE1-CG 3.72Å; F1062-Q1066 HydrophobicContact CE2-CG 3.76Å; F1062-Q1066 HydrophobicContact CG-CG 4.48Å; F1062-Q1066 HydrophobicContact CZ-CG 3.46Å; F1062-Q1066 VanDerWaalsContact CZ-CG 3.46Å; F1062-Q1066 WeakPolarHBondContact O-CG 3.44Å; F1062-Q1066 PolarHBondContact O-N 3.18Å; L1063-Q1066 PolarHBondContact O-N 3.07Å; H1064-Q1066 PolarHBondContact O-N 3.46Å; Q1066-S1068 VanDerWaalsContact C-N 3.25Å; Q1066-S1068 PolarHBondContact O-N 2.91Å; Q1066-I1069 PolarHBondContact O-N 3.47Å; Q1066-S1070 WeakPolarHBondContact O-CB 3.39Å; Q1066-S1070 PolarHBondContact O-N 3.34Å; Q1066-S1070 PolarHBondContact O-OG 2.83Å; Q1066-F1078 HydrophobicContact CB-CD1 4.4Å; Q1066-F1078 HydrophobicContact CB-CE1 4.38Å; Q1066-F1078 HydrophobicContact CB-CG 4.5Å; Q1066-F1078 HydrophobicContact CG-CE1 4.19Å; Q1066-F1078 HydrophobicContact CG-CZ 4.28Å
1067L84.6Confident75.2Confident9 Ų971 Ų715%0.04737%0.373CS..Hα-helixtrans-67.4-27.1174.6-69.7171.2000112.5L1063 H1064 L1075 F1078 R1079 A1082 F1096 C1099 I1103 L1106L1063-L1067 WeakPolarHBondContact O-CG 3.44Å; L1063-L1067 PolarHBondContact O-N 3.02Å; H1064-L1067 PolarHBondContact O-N 2.92Å; L1067-L1075 HydrophobicContact CD2-CD2 3.82Å; L1067-F1078 HydrophobicContact CD2-CB 4.08Å; L1067-R1079 HydrophobicContact CD2-CG 4.46Å; L1067-A1082 HydrophobicContact CD1-CB 3.64Å; L1067-F1096 HydrophobicContact CD1-CD1 3.96Å; L1067-F1096 HydrophobicContact CD1-CE1 3.96Å; L1067-C1099 HydrophobicContact CD1-CB 4.45Å; L1067-I1103 HydrophobicContact CB-CD1 4.23Å; L1067-I1103 HydrophobicContact CD2-CD1 4.27Å; L1067-L1106 HydrophobicContact CD1-CD2 3.96Å
1068S81.7Confident75.2Confident67 Ų6763.9 Ų63.947%0.46935%0.345SS..Hα-helixtrans-82.7-25.4178.4-59.50000114.3H1064 R1065 Q1066H1064-S1068 PolarHBondContact CE1-OG 2.54Å; H1064-S1068 WeakPolarHBondContact O-CB 3.45Å; H1064-S1068 PolarHBondContact O-N 3Å; H1064-S1068 PolarHBondContact O-OG 3.27Å; R1065-S1068 PolarHBondContact O-N 3.39Å; Q1066-S1068 VanDerWaalsContact C-N 3.25Å; Q1066-S1068 PolarHBondContact O-N 2.91Å
1069I75.4Confident75.3Confident111 Ų11161.7 Ų61.757%0.56933%0.33SS*.Hα-helixtrans-94.3-28.9-174.9-68.2170.5000112.8R1065 Q1066R1065-I1069 HydrophobicContact CG-CD1 3.53Å; R1065-I1069 HydrophobicContact CG-CG1 4.3Å; R1065-I1069 WeakPolarHBondContact O-CB 3.26Å; R1065-I1069 VanDerWaalsContact O-CG1 3.23Å; R1065-I1069 WeakPolarHBondContact O-CG1 3.4Å; R1065-I1069 PolarHBondContact O-N 3.37Å; Q1066-I1069 PolarHBondContact O-N 3.47Å
1070S59.6Low75.1Confident27 Ų2765.6 Ų65.619%0.18935%0.352CS..  trans-98.7124.8-164.361.80000114Q1066Q1066-S1070 WeakPolarHBondContact O-CB 3.39Å; Q1066-S1070 PolarHBondContact O-N 3.34Å; Q1066-S1070 PolarHBondContact O-OG 2.83Å
1071D52.4Low75.1Confident165 Ų16565.9 Ų65.988%0.88235%0.353SS*.  trans-108.23.1-173.6-104-12.4000116.8
1072S51.4Low75.3Confident103 Ų10363.1 Ų63.172%0.7234%0.337SS*.SBendtrans-152-18.3-175.863.40000123.7
1073L49.6Very low75.5Confident161 Ų16162 Ų6284%0.84333%0.332SS*.SBendtrans-155.4-30.2178.6-118.9112000117L1075L1073-L1075 PolarHBondContact O-N 3.42Å; L1073-L1075 VanDerWaalsContact O-N 3.15Å
1074A51.2Low75.5Confident47 Ų4762.8 Ų62.839%0.38834%0.34SS..THydrogen-bonded Turntrans-71.1-6.2-179.900000114.2E1076 T1077 F1078A1074-E1076 VanDerWaalsContact C-N 3.34Å; A1074-E1076 PolarHBondContact O-N 2.84Å; A1074-T1077 PolarHBondContact O-OG1 3.26Å; A1074-F1078 HydrophobicContact CB-CD2 4.4Å; A1074-F1078 HydrophobicContact CB-CE2 4.18Å; A1074-F1078 WeakPolarHBondContact O-CD2 3.48Å
1075L60.7Low75.6Confident31 Ų3161.2 Ų61.216%0.16233%0.333CS..Hα-helixtrans-61.7-29.5-172-88.4146.4000114.3L1067 L1073 R1079 I1103L1067-L1075 HydrophobicContact CD2-CD2 3.82Å; L1073-L1075 PolarHBondContact O-N 3.42Å; L1073-L1075 VanDerWaalsContact O-N 3.15Å; L1075-R1079 VanDerWaalsContact O-CB 3.23Å; L1075-R1079 WeakPolarHBondContact O-CB 3.36Å; L1075-R1079 WeakPolarHBondContact O-CD 3.42Å; L1075-R1079 WeakPolarHBondContact O-CG 3.48Å; L1075-R1079 PolarHBondContact O-N 3.29Å; L1075-R1079 PolarHBondContact O-NE 3.46Å; L1075-I1103 HydrophobicContact CD2-CD1 4.03Å; L1075-I1103 HydrophobicContact CD2-CG2 4.41Å
1076E70Confident75.9Confident134 Ų13453.3 Ų53.363%0.62630%0.304SS*.Hα-helixtrans-65.2-49.7-173.5-155.2166.5-176.800114.2A1074 F1078 R1079 D1080A1074-E1076 VanDerWaalsContact C-N 3.34Å; A1074-E1076 PolarHBondContact O-N 2.84Å; E1076-F1078 PolarHBondContact O-N 2.63Å; E1076-R1079 VanDerWaalsContact N-NH2 3.14Å; E1076-R1079 PolarHBondContact O-N 3.28Å; E1076-D1080 PolarHBondContact O-N 2.92Å
1077T72.5Confident76Confident75 Ų7552.8 Ų52.846%0.4630%0.303SS..Hα-helixtrans-66.1-39.6-178.648.80000111.9A1074 V1081A1074-T1077 PolarHBondContact O-OG1 3.26Å; T1077-V1081 WeakPolarHBondContact O-CG2 3.38Å; T1077-V1081 PolarHBondContact O-N 2.96Å
1078F86Confident76.2Confident2 Ų253.8 Ų53.81%0.00931%0.307CS..Hα-helixtrans-69.6-33.8175.4-68.1-66.9000113P1038 A1042 F1062 L1063 Q1066 L1067 A1074 E1076 V1081 A1082P1038-F1078 VanDerWaalsContact C-CZ 3.46Å; P1038-F1078 HydrophobicContact CB-CE1 4.44Å; P1038-F1078 HydrophobicContact CB-CE2 4.19Å; P1038-F1078 HydrophobicContact CB-CZ 3.49Å; P1038-F1078 VanDerWaalsContact CB-CZ 3.49Å; P1038-F1078 WeakPolarHBondContact O-CE1 3.47Å; P1038-F1078 WeakPolarHBondContact O-CZ 3.39Å; A1042-F1078 HydrophobicContact CB-CD1 3.88Å; A1042-F1078 HydrophobicContact CB-CE1 3.62Å; A1042-F1078 HydrophobicContact CB-CZ 4.2Å; F1062-F1078 HydrophobicContact CE1-CE1 4.05Å; L1063-F1078 HydrophobicContact CD2-CD1 3.72Å; L1063-F1078 HydrophobicContact CD2-CE1 4.42Å; Q1066-F1078 HydrophobicContact CB-CD1 4.4Å; Q1066-F1078 HydrophobicContact CB-CE1 4.38Å; Q1066-F1078 HydrophobicContact CB-CG 4.5Å; Q1066-F1078 HydrophobicContact CG-CE1 4.19Å; Q1066-F1078 HydrophobicContact CG-CZ 4.28Å; L1067-F1078 HydrophobicContact CD2-CB 4.08Å; A1074-F1078 HydrophobicContact CB-CD2 4.4Å; A1074-F1078 HydrophobicContact CB-CE2 4.18Å; A1074-F1078 WeakPolarHBondContact O-CD2 3.48Å; E1076-F1078 PolarHBondContact O-N 2.63Å; F1078-V1081 PolarHBondContact O-N 3.43Å; F1078-A1082 WeakPolarHBondContact O-CB 3.42Å; F1078-A1082 PolarHBondContact O-N 3.4Å
1079R86Confident76.4Confident51 Ų5152.4 Ų52.419%0.19230%0.297CS..Hα-helixtrans-59.1-49.5179.4-83.6173.4-68.7176.71.7111.8L1067 L1075 E1076 A1082 A1083 S1105 L1106L1067-R1079 HydrophobicContact CD2-CG 4.46Å; L1075-R1079 VanDerWaalsContact O-CB 3.23Å; L1075-R1079 WeakPolarHBondContact O-CB 3.36Å; L1075-R1079 WeakPolarHBondContact O-CD 3.42Å; L1075-R1079 WeakPolarHBondContact O-CG 3.48Å; L1075-R1079 PolarHBondContact O-N 3.29Å; L1075-R1079 PolarHBondContact O-NE 3.46Å; E1076-R1079 VanDerWaalsContact N-NH2 3.14Å; E1076-R1079 PolarHBondContact O-N 3.28Å; R1079-A1082 PolarHBondContact O-N 3.2Å; R1079-A1083 VanDerWaalsContact O-CB 3.25Å; R1079-A1083 WeakPolarHBondContact O-CB 3.47Å; R1079-A1083 PolarHBondContact O-N 3.28Å; R1079-S1105 WeakPolarHBondContact CD-OG 3.35Å; R1079-S1105 PolarHBondContact NH1-OG 3.4Å; R1079-L1106 HydrophobicContact CB-CD1 4.23Å; R1079-L1106 HydrophobicContact CG-CB 4.06Å; R1079-L1106 HydrophobicContact CG-CD1 4.24Å; R1079-L1106 VanDerWaalsContact O-CD1 3.29Å; R1079-L1106 WeakPolarHBondContact O-CD1 3.41Å
1080D85.7Confident76.9Confident89 Ų8951.8 Ų51.848%0.47629%0.291SS..Hα-helixtrans-67.5-39-177.9-75.3-23.7000112.2E1076 G1084 A1109E1076-D1080 PolarHBondContact O-N 2.92Å; D1080-G1084 PolarHBondContact O-N 2.79Å; D1080-A1109 WeakPolarHBondContact OD1-CB 3.45Å
1081V89.8Confident78.2Confident6 Ų653.3 Ų53.34%0.03631%0.305CS..Hα-helixtrans-69.3-43177.3177.40000111.3M1045 L1049 L1063 T1077 F1078 G1084 C1085M1045-V1081 HydrophobicContact CB-CG1 3.46Å; M1045-V1081 VanDerWaalsContact CB-CG1 3.46Å; M1045-V1081 HydrophobicContact CG-CG1 4.44Å; M1045-V1081 HydrophobicContact SD-CG1 4.24Å; L1049-V1081 HydrophobicContact CD1-CG1 4.03Å; L1063-V1081 HydrophobicContact CD1-CG1 3.98Å; L1063-V1081 HydrophobicContact CD2-CB 4.45Å; L1063-V1081 HydrophobicContact CD2-CG1 3.99Å; T1077-V1081 WeakPolarHBondContact O-CG2 3.38Å; T1077-V1081 PolarHBondContact O-N 2.96Å; F1078-V1081 PolarHBondContact O-N 3.43Å; V1081-G1084 PolarHBondContact O-N 3.17Å; V1081-C1085 WeakPolarHBondContact O-CB 3.46Å; V1081-C1085 PolarHBondContact O-N 3.25Å
1082A90.5Very high80Confident1 Ų146.2 Ų46.21%0.00827%0.266CS..Hα-helixtrans-65.4-38.5175.900000111.7L1067 F1078 R1079 C1085 A1086 F1096 L1106L1067-A1082 HydrophobicContact CD1-CB 3.64Å; F1078-A1082 WeakPolarHBondContact O-CB 3.42Å; F1078-A1082 PolarHBondContact O-N 3.4Å; R1079-A1082 PolarHBondContact O-N 3.2Å; A1082-C1085 PolarHBondContact O-N 3.42Å; A1082-A1086 VanDerWaalsContact O-CB 3.24Å; A1082-A1086 WeakPolarHBondContact O-CB 3.35Å; A1082-A1086 PolarHBondContact O-N 2.83Å; A1082-F1096 HydrophobicContact CB-CD1 4.36Å; A1082-F1096 HydrophobicContact CB-CE1 3.91Å; A1082-F1096 HydrophobicContact CB-CZ 4.17Å; A1082-L1106 HydrophobicContact CB-CD1 3.9Å
1083A90.6Very high81.8Confident1 Ų141.5 Ų41.51%0.00823%0.233CC..Hα-helixtrans-60.1-45.4171.800000112R1079 C1085 A1087 A1109 L1110 V1113R1079-A1083 VanDerWaalsContact O-CB 3.25Å; R1079-A1083 WeakPolarHBondContact O-CB 3.47Å; R1079-A1083 PolarHBondContact O-N 3.28Å; A1083-C1085 VanDerWaalsContact C-N 3.34Å; A1083-C1085 PolarHBondContact O-N 3.11Å; A1083-A1087 WeakPolarHBondContact O-CB 3.34Å; A1083-A1087 PolarHBondContact O-N 3.29Å; A1083-A1087 VanDerWaalsContact O-N 3.15Å; A1083-A1109 HydrophobicContact CB-CB 3.91Å; A1083-L1110 HydrophobicContact CB-CB 4.12Å; A1083-V1113 HydrophobicContact CB-CG2 4.05Å
1084G89.3Confident83.7Confident17 Ų1737.9 Ų37.918%0.17521%0.212CC..Hα-helixtrans-62.8-38.117400000113.1D1080 V1081 Q1088D1080-G1084 PolarHBondContact O-N 2.79Å; V1081-G1084 PolarHBondContact O-N 3.17Å; G1084-Q1088 WeakPolarHBondContact O-CG 3.25Å
1085C91Very high85.7Confident0 Ų037.4 Ų37.40%020%0.202CC..Hα-helixtrans-69.9-47.6177.2-171.70000112.5L1055 S1060 L1063 V1081 A1082 A1083 A1087 Q1088 K1092 F1096L1055-C1085 HydrophobicContact CD1-CB 4.25Å; S1060-C1085 PolarHBondContact OG-SG 3.29Å; L1063-C1085 HydrophobicContact CD1-CB 3.99Å; V1081-C1085 WeakPolarHBondContact O-CB 3.46Å; V1081-C1085 PolarHBondContact O-N 3.25Å; A1082-C1085 PolarHBondContact O-N 3.42Å; A1083-C1085 VanDerWaalsContact C-N 3.34Å; A1083-C1085 PolarHBondContact O-N 3.11Å; C1085-A1087 PolarHBondContact O-N 3.44Å; C1085-Q1088 WeakPolarHBondContact O-CB 3.49Å; C1085-Q1088 PolarHBondContact O-N 3.42Å; C1085-K1092 WeakPolarHBondContact O-CD 3.34Å; C1085-F1096 HydrophobicContact CB-CE2 4.29Å
1086A90Very high87.1Confident2 Ų236 Ų362%0.01720%0.195CC..Hα-helixtrans-59.1-31.8177.300000111.9A1082 Q1088 L1093 F1096 L1110A1082-A1086 VanDerWaalsContact O-CB 3.24Å; A1082-A1086 WeakPolarHBondContact O-CB 3.35Å; A1082-A1086 PolarHBondContact O-N 2.83Å; A1086-Q1088 VanDerWaalsContact C-N 3.28Å; A1086-Q1088 PolarHBondContact O-N 3.45Å; A1086-L1093 HydrophobicContact CB-CD1 4.16Å; A1086-F1096 HydrophobicContact CB-CD2 3.79Å; A1086-F1096 HydrophobicContact CB-CE2 4.44Å; A1086-F1096 HydrophobicContact CB-CG 4.5Å; A1086-L1110 HydrophobicContact CB-CD1 4.36Å
1087A89Confident88.1Confident10 Ų1033.2 Ų33.28%0.08318%0.182CC..THydrogen-bonded Turntrans-74.7-7.8176.200000114.6A1083 C1085 L1110 V1113 L1114 I1120A1083-A1087 WeakPolarHBondContact O-CB 3.34Å; A1083-A1087 PolarHBondContact O-N 3.29Å; A1083-A1087 VanDerWaalsContact O-N 3.15Å; C1085-A1087 PolarHBondContact O-N 3.44Å; A1087-L1110 HydrophobicContact CB-CD1 4.28Å; A1087-V1113 HydrophobicContact CB-CG1 3.86Å; A1087-L1114 HydrophobicContact CB-CD2 4.39Å; A1087-I1120 HydrophobicContact CB-CD1 4.14Å; A1087-I1120 WeakPolarHBondContact O-CG2 3.26Å
1088Q87.3Confident88.8Confident29 Ų2932.7 Ų32.714%0.13618%0.177CC..THydrogen-bonded Turntrans-78.9-32.2-177.5-64.7-169.2-54.900113.9L1049 C1053 G1084 C1085 A1086 K1092L1049-Q1088 HydrophobicContact CD2-CG 4.2Å; L1049-Q1088 VanDerWaalsContact CD2-NE2 3.29Å; C1053-Q1088 PolarHBondContact O-NE2 3.45Å; G1084-Q1088 WeakPolarHBondContact O-CG 3.25Å; C1085-Q1088 WeakPolarHBondContact O-CB 3.49Å; C1085-Q1088 PolarHBondContact O-N 3.42Å; A1086-Q1088 VanDerWaalsContact C-N 3.28Å; A1086-Q1088 PolarHBondContact O-N 3.45Å; Q1088-K1092 HydrophobicContact CB-CD 4Å
1089S86.9Confident89Confident38 Ų3832.8 Ų32.827%0.26618%0.177SC..  trans-161.3158.6-179.673.40000112.5A1091 K1092 L1093S1089-A1091 PolarHBondContact O-N 2.98Å; S1089-K1092 PolarHBondContact O-N 3.12Å; S1089-K1092 PolarHBondContact OG-N 2.84Å; S1089-L1093 PolarHBondContact O-N 2.68Å
1090K85.5Confident89.2Confident99 Ų9930.5 Ų30.543%0.4317%0.169SC..Hα-helixtrans-56.1-45.5176.4-176.7-178.4173.9-174.30112.8K1092 L1093 E1094 P1126K1090-K1092 VanDerWaalsContact C-N 3.31Å; K1090-K1092 PolarHBondContact O-N 2.71Å; K1090-L1093 WeakPolarHBondContact O-CB 3.49Å; K1090-L1093 PolarHBondContact O-N 2.9Å; K1090-L1093 VanDerWaalsContact O-N 3.14Å; K1090-E1094 WeakPolarHBondContact CE-OE1 3.19Å; K1090-E1094 WeakPolarHBondContact O-CG 3.36Å; K1090-E1094 PolarHBondContact O-N 3.23Å; K1090-P1126 HydrophobicContact CG-CG 4.37Å
1091A86.9Confident89.3Confident59 Ų5930.2 Ų30.249%0.48817%0.17SC..Hα-helixtrans-62.1-37-18000000112.7S1089 L1095S1089-A1091 PolarHBondContact O-N 2.98Å; A1091-L1095 PolarHBondContact O-N 3.12Å; A1091-L1095 VanDerWaalsContact O-N 3.11Å
1092K89.5Confident89Confident15 Ų1537.6 Ų37.67%0.06520%0.202CC..Hα-helixtrans-69.6-39.6174.6-73.5172173.41730111.2L1055 S1060 C1085 Q1088 S1089 K1090 E1094 L1095 F1096L1055-K1092 WeakPolarHBondContact O-CE 3.02Å; L1055-K1092 PolarHBondContact O-NZ 3.12Å; S1060-K1092 WeakPolarHBondContact OG-CE 3.32Å; C1085-K1092 WeakPolarHBondContact O-CD 3.34Å; Q1088-K1092 HydrophobicContact CB-CD 4Å; S1089-K1092 PolarHBondContact O-N 3.12Å; S1089-K1092 PolarHBondContact OG-N 2.84Å; K1090-K1092 VanDerWaalsContact C-N 3.31Å; K1090-K1092 PolarHBondContact O-N 2.71Å; K1092-E1094 VanDerWaalsContact C-N 3.35Å; K1092-E1094 PolarHBondContact O-N 3.32Å; K1092-L1095 WeakPolarHBondContact O-CB 3.49Å; K1092-L1095 PolarHBondContact O-N 3.02Å; K1092-F1096 WeakPolarHBondContact O-CD2 3.2Å; K1092-F1096 PolarHBondContact O-N 3.38Å
1093L90.3Very high88.9Confident4 Ų438.8 Ų38.82%0.02121%0.207CC..Hα-helixtrans-61.6-42.3175.1-178.160.6000112.4A1086 S1089 K1090 F1096 Q1097 L1100 L1110 F1125 P1126 F1129A1086-L1093 HydrophobicContact CB-CD1 4.16Å; S1089-L1093 PolarHBondContact O-N 2.68Å; K1090-L1093 WeakPolarHBondContact O-CB 3.49Å; K1090-L1093 PolarHBondContact O-N 2.9Å; K1090-L1093 VanDerWaalsContact O-N 3.14Å; L1093-F1096 PolarHBondContact O-N 2.72Å; L1093-Q1097 PolarHBondContact O-N 3.25Å; L1093-L1100 HydrophobicContact CD1-CD1 3.69Å; L1093-L1110 HydrophobicContact CD1-CD2 3.83Å; L1093-F1125 HydrophobicContact CD2-CD1 3.53Å; L1093-F1125 HydrophobicContact CD2-CE1 4.01Å; L1093-P1126 VanDerWaalsContact CD2-CD 3.47Å; L1093-P1126 HydrophobicContact CD2-CG 4.14Å; L1093-P1126 HydrophobicContact CG-CG 4.37Å; L1093-F1129 HydrophobicContact CD1-CD2 4.38Å; L1093-F1129 HydrophobicContact CD2-CD1 4.31Å; L1093-F1129 HydrophobicContact CD2-CG 4.36Å
1094E90.3Very high88.7Confident86 Ų8641.9 Ų41.940%0.40223%0.228SC..Hα-helixtrans-63.7-39.1176.1-72.4173167.900112K1090 K1092 F1096 Q1097 P1126K1090-E1094 WeakPolarHBondContact CE-OE1 3.19Å; K1090-E1094 WeakPolarHBondContact O-CG 3.36Å; K1090-E1094 PolarHBondContact O-N 3.23Å; K1092-E1094 VanDerWaalsContact C-N 3.35Å; K1092-E1094 PolarHBondContact O-N 3.32Å; E1094-F1096 VanDerWaalsContact C-N 3.26Å; E1094-F1096 PolarHBondContact O-N 3.09Å; E1094-Q1097 WeakPolarHBondContact O-CB 3.44Å; E1094-Q1097 PolarHBondContact O-N 3.3Å; E1094-Q1097 VanDerWaalsContact O-N 3.1Å; E1094-P1126 HydrophobicContact CG-CB 4.2Å; E1094-P1126 HydrophobicContact CG-CG 3.54Å
1095L91.5Very high88.5Confident36 Ų3643.2 Ų43.219%0.18823%0.234CC..Hα-helixtrans-56.4-39174.5179.667.2000112.3Y1057 H1064 A1091 K1092Y1057-L1095 HydrophobicContact CE2-CD2 4.45Å; H1064-L1095 HydrophobicContact CB-CD2 4.43Å; H1064-L1095 HydrophobicContact CB-CG 4.24Å; H1064-L1095 PolarHBondContact CD2-O 3.45Å; H1064-L1095 PolarHBondContact NE2-O 2.97Å; A1091-L1095 PolarHBondContact O-N 3.12Å; A1091-L1095 VanDerWaalsContact O-N 3.11Å; K1092-L1095 WeakPolarHBondContact O-CB 3.49Å; K1092-L1095 PolarHBondContact O-N 3.02Å
1096F91.8Very high88.5Confident1 Ų143.3 Ų43.30%0.00424%0.235CC..THydrogen-bonded Turntrans-89.37.1180-66.4-74.9000114.2L1063 H1064 L1067 A1082 C1085 A1086 K1092 L1093 E1094 D1098 C1099 L1100L1063-F1096 HydrophobicContact CB-CE1 3.81Å; L1063-F1096 HydrophobicContact CB-CZ 3.71Å; L1063-F1096 HydrophobicContact CD1-CZ 4.26Å; H1064-F1096 HydrophobicContact CB-CD1 4.3Å; H1064-F1096 HydrophobicContact CB-CE1 3.98Å; L1067-F1096 HydrophobicContact CD1-CD1 3.96Å; L1067-F1096 HydrophobicContact CD1-CE1 3.96Å; A1082-F1096 HydrophobicContact CB-CD1 4.36Å; A1082-F1096 HydrophobicContact CB-CE1 3.91Å; A1082-F1096 HydrophobicContact CB-CZ 4.17Å; C1085-F1096 HydrophobicContact CB-CE2 4.29Å; A1086-F1096 HydrophobicContact CB-CD2 3.79Å; A1086-F1096 HydrophobicContact CB-CE2 4.44Å; A1086-F1096 HydrophobicContact CB-CG 4.5Å; K1092-F1096 WeakPolarHBondContact O-CD2 3.2Å; K1092-F1096 PolarHBondContact O-N 3.38Å; L1093-F1096 PolarHBondContact O-N 2.72Å; E1094-F1096 VanDerWaalsContact C-N 3.26Å; E1094-F1096 PolarHBondContact O-N 3.09Å; F1096-D1098 PolarHBondContact O-N 2.96Å; F1096-C1099 PolarHBondContact O-N 3.13Å; F1096-L1100 HydrophobicContact CB-CD1 4.46Å; F1096-L1100 WeakPolarHBondContact O-CB 3.48Å; F1096-L1100 WeakPolarHBondContact O-CG 3.3Å; F1096-L1100 PolarHBondContact O-N 3.4Å
1097Q89.8Confident88.5Confident77 Ų7744.4 Ų44.436%0.3624%0.239SC..Hα-helixtrans-59.5-44-171.5-178.2-179.5-41.800113.1L1093 E1094 L1100 V1101 A1128L1093-Q1097 PolarHBondContact O-N 3.25Å; E1094-Q1097 WeakPolarHBondContact O-CB 3.44Å; E1094-Q1097 PolarHBondContact O-N 3.3Å; E1094-Q1097 VanDerWaalsContact O-N 3.1Å; Q1097-L1100 PolarHBondContact O-N 3.46Å; Q1097-V1101 WeakPolarHBondContact O-CG2 3.45Å; Q1097-V1101 PolarHBondContact O-N 3.4Å; Q1097-V1101 VanDerWaalsContact O-N 3.13Å; Q1097-A1128 HydrophobicContact CG-CB 4.16Å
1098D88.5Confident88.5Confident64 Ų6445.5 Ų45.534%0.34224%0.243SC..Hα-helixtrans-64.5-43.717762.9-27.7000112.2H1064 F1096 L1100 V1101 K1102H1064-D1098 IonicContact CD2-OD1 3.64Å; H1064-D1098 PolarHBondContact CD2-OD1 3.42Å; H1064-D1098 IonicContact CE1-OD1 2.73Å; H1064-D1098 IonicContact CE1-OD2 3.98Å; H1064-D1098 VanDerWaalsContact NE2-CG 3.3Å; H1064-D1098 IonicContact NE2-OD1 3.68Å; H1064-D1098 PolarHBondContact NE2-OD1 3.41Å; H1064-D1098 IonicContact NE2-OD2 3.35Å; H1064-D1098 PolarHBondContact NE2-OD2 3.07Å; F1096-D1098 PolarHBondContact O-N 2.96Å; D1098-L1100 VanDerWaalsContact C-N 3.35Å; D1098-V1101 PolarHBondContact O-N 2.99Å; D1098-K1102 WeakPolarHBondContact O-CG 3.21Å; D1098-K1102 PolarHBondContact O-N 2.93Å
1099C89.2Confident88.6Confident3 Ų344.4 Ų44.42%0.0224%0.238CC..Hα-helixtrans-62.3-40.8174.7-71.50000111.6L1067 F1096 V1101 K1102 I1103 L1106L1067-C1099 HydrophobicContact CD1-CB 4.45Å; F1096-C1099 PolarHBondContact O-N 3.13Å; C1099-V1101 VanDerWaalsContact C-N 3.34Å; C1099-V1101 PolarHBondContact O-N 2.85Å; C1099-K1102 PolarHBondContact O-N 2.73Å; C1099-I1103 HydrophobicContact CB-CD1 4.33Å; C1099-I1103 VanDerWaalsContact O-CB 3.22Å; C1099-I1103 WeakPolarHBondContact O-CB 3.3Å; C1099-I1103 WeakPolarHBondContact O-CG1 3.26Å; C1099-I1103 PolarHBondContact O-N 2.76Å; C1099-L1106 HydrophobicContact CB-CD2 3.85Å
1100L89.6Confident88.8Confident4 Ų442.7 Ų42.72%0.02123%0.226CC..Hα-helixtrans-62.6-41.6176.9-75.5166.8000111.1L1093 F1096 Q1097 D1098 L1106 R1107 L1110 F1129 L1132L1093-L1100 HydrophobicContact CD1-CD1 3.69Å; F1096-L1100 HydrophobicContact CB-CD1 4.46Å; F1096-L1100 WeakPolarHBondContact O-CB 3.48Å; F1096-L1100 WeakPolarHBondContact O-CG 3.3Å; F1096-L1100 PolarHBondContact O-N 3.4Å; Q1097-L1100 PolarHBondContact O-N 3.46Å; D1098-L1100 VanDerWaalsContact C-N 3.35Å; L1100-L1106 HydrophobicContact CD2-CD2 4.01Å; L1100-L1106 HydrophobicContact CD2-CG 3.82Å; L1100-L1106 HydrophobicContact CG-CD2 4.23Å; L1100-R1107 HydrophobicContact CB-CG 4.2Å; L1100-R1107 HydrophobicContact CD2-CB 4.45Å; L1100-R1107 HydrophobicContact CD2-CG 3.91Å; L1100-R1107 WeakPolarHBondContact O-CD 3.32Å; L1100-R1107 WeakPolarHBondContact O-CG 3.24Å; L1100-L1110 HydrophobicContact CD1-CD2 3.95Å; L1100-L1110 HydrophobicContact CD2-CB 4.45Å; L1100-L1110 HydrophobicContact CD2-CD2 3.75Å; L1100-F1129 HydrophobicContact CD1-CD2 4.1Å; L1100-F1129 HydrophobicContact CD1-CE2 4.39Å; L1100-L1132 HydrophobicContact CB-CD2 3.97Å
1101V87.3Confident89.1Confident83 Ų8338 Ų3850%0.50321%0.206SC..Hα-helixtrans-66-43.5177174.10000111.5Q1097 D1098 C1099 L1132Q1097-V1101 WeakPolarHBondContact O-CG2 3.45Å; Q1097-V1101 PolarHBondContact O-N 3.4Å; Q1097-V1101 VanDerWaalsContact O-N 3.13Å; D1098-V1101 PolarHBondContact O-N 2.99Å; C1099-V1101 VanDerWaalsContact C-N 3.34Å; C1099-V1101 PolarHBondContact O-N 2.85Å; V1101-L1132 HydrophobicContact CG2-CD1 4.16Å; V1101-L1132 HydrophobicContact CG2-CD2 3.99Å
1102K85.2Confident89.2Confident161 Ų16139.5 Ų39.570%0.720%0.201SC*.Hα-helixtrans-76.4-27.8-177-69.4176.3-178.4176.50114.2D1098 C1099 P1104D1098-K1102 WeakPolarHBondContact O-CG 3.21Å; D1098-K1102 PolarHBondContact O-N 2.93Å; C1099-K1102 PolarHBondContact O-N 2.73Å; K1102-P1104 WeakPolarHBondContact O-CD 3.17Å
1103I87.8Confident89.1Confident25 Ų2540.5 Ų40.513%0.12821%0.209CC..  trans-119.991.9-167.9-50.5172.6000110.4L1067 L1075 C1099 S1105 L1106 R1107L1067-I1103 HydrophobicContact CB-CD1 4.23Å; L1067-I1103 HydrophobicContact CD2-CD1 4.27Å; L1075-I1103 HydrophobicContact CD2-CD1 4.03Å; L1075-I1103 HydrophobicContact CD2-CG2 4.41Å; C1099-I1103 HydrophobicContact CB-CD1 4.33Å; C1099-I1103 VanDerWaalsContact O-CB 3.22Å; C1099-I1103 WeakPolarHBondContact O-CB 3.3Å; C1099-I1103 WeakPolarHBondContact O-CG1 3.26Å; C1099-I1103 PolarHBondContact O-N 2.76Å; I1103-S1105 WeakPolarHBondContact CG2-OG 3.31Å; I1103-S1105 PolarHBondContact O-N 3.46Å; I1103-S1105 VanDerWaalsContact O-N 3.14Å; I1103-L1106 HydrophobicContact CB-CB 4Å; I1103-L1106 HydrophobicContact CG2-CB 3.86Å; I1103-L1106 WeakPolarHBondContact O-CB 3.37Å; I1103-L1106 PolarHBondContact O-N 2.87Å; I1103-L1106 VanDerWaalsContact O-N 3.09Å; I1103-R1107 PolarHBondContact O-N 2.79Å
1104P86.5Confident88.9Confident67 Ų6740.3 Ų40.344%0.43521%0.208SC..Hα-helixtrans-54.6-37.3-179-29.635.5000114.5K1102 R1107 L1108 F1145K1102-P1104 WeakPolarHBondContact O-CD 3.17Å; P1104-R1107 WeakPolarHBondContact O-CB 3.41Å; P1104-R1107 PolarHBondContact O-N 3.26Å; P1104-L1108 PolarHBondContact O-N 2.69Å; P1104-F1145 HydrophobicContact CB-CE2 4.3Å; P1104-F1145 VanDerWaalsContact O-CE2 3.26Å; P1104-F1145 WeakPolarHBondContact O-CE2 3.27Å; P1104-F1145 WeakPolarHBondContact O-CZ 3.46Å
1105S85.9Confident88.5Confident44 Ų4437.8 Ų37.831%0.30820%0.201SC..Hα-helixtrans-71.5-29.1-178.9540000114.2R1079 I1103 L1108 A1109R1079-S1105 WeakPolarHBondContact CD-OG 3.35Å; R1079-S1105 PolarHBondContact NH1-OG 3.4Å; I1103-S1105 WeakPolarHBondContact CG2-OG 3.31Å; I1103-S1105 PolarHBondContact O-N 3.46Å; I1103-S1105 VanDerWaalsContact O-N 3.14Å; S1105-L1108 PolarHBondContact O-N 3.44Å; S1105-A1109 PolarHBondContact O-N 3.11Å
1106L89.2Confident87.8Confident2 Ų244.6 Ų44.61%0.0123%0.23CC..Hα-helixtrans-65.1-42.9169.817763.5000110.2L1067 R1079 A1082 C1099 L1100 I1103 L1108 A1109 L1110L1067-L1106 HydrophobicContact CD1-CD2 3.96Å; R1079-L1106 HydrophobicContact CB-CD1 4.23Å; R1079-L1106 HydrophobicContact CG-CB 4.06Å; R1079-L1106 HydrophobicContact CG-CD1 4.24Å; R1079-L1106 VanDerWaalsContact O-CD1 3.29Å; R1079-L1106 WeakPolarHBondContact O-CD1 3.41Å; A1082-L1106 HydrophobicContact CB-CD1 3.9Å; C1099-L1106 HydrophobicContact CB-CD2 3.85Å; L1100-L1106 HydrophobicContact CD2-CD2 4.01Å; L1100-L1106 HydrophobicContact CD2-CG 3.82Å; L1100-L1106 HydrophobicContact CG-CD2 4.23Å; I1103-L1106 HydrophobicContact CB-CB 4Å; I1103-L1106 HydrophobicContact CG2-CB 3.86Å; I1103-L1106 WeakPolarHBondContact O-CB 3.37Å; I1103-L1106 PolarHBondContact O-N 2.87Å; I1103-L1106 VanDerWaalsContact O-N 3.09Å; L1106-L1108 VanDerWaalsContact C-N 3.31Å; L1106-L1108 PolarHBondContact O-N 3.23Å; L1106-A1109 PolarHBondContact O-N 3.01Å; L1106-L1110 PolarHBondContact O-N 3.29Å
1107R90.9Very high86.9Confident26 Ų2648.8 Ų48.810%0.09825%0.252CS..Hα-helixtrans-58.3-45.6174.6-59.3-176-64.9-179.311.2111.1L1100 I1103 P1104 A1109 L1110 Y1111 L1132 D1136 F1145L1100-R1107 HydrophobicContact CB-CG 4.2Å; L1100-R1107 HydrophobicContact CD2-CB 4.45Å; L1100-R1107 HydrophobicContact CD2-CG 3.91Å; L1100-R1107 WeakPolarHBondContact O-CD 3.32Å; L1100-R1107 WeakPolarHBondContact O-CG 3.24Å; I1103-R1107 PolarHBondContact O-N 2.79Å; P1104-R1107 WeakPolarHBondContact O-CB 3.41Å; P1104-R1107 PolarHBondContact O-N 3.26Å; R1107-A1109 VanDerWaalsContact C-N 3.33Å; R1107-A1109 PolarHBondContact O-N 3.16Å; R1107-L1110 PolarHBondContact O-N 3.19Å; R1107-Y1111 HydrophobicContact CB-CE2 4.08Å; R1107-Y1111 WeakPolarHBondContact O-CD1 3.47Å; R1107-Y1111 WeakPolarHBondContact O-CD2 3.21Å; R1107-Y1111 PolarHBondContact O-N 3.04Å; R1107-L1132 VanDerWaalsContact CD-CD2 3.43Å; R1107-L1132 HydrophobicContact CG-CD2 4.14Å; R1107-D1136 WeakPolarHBondContact CD-OD2 3.25Å; R1107-D1136 IonicContact CZ-OD1 3.56Å; R1107-D1136 IonicContact CZ-OD2 4Å; R1107-D1136 IonicContact NE-OD2 3.06Å; R1107-D1136 PolarHBondContact NE-OD2 2.86Å; R1107-D1136 VanDerWaalsContact NE-OD2 3.16Å; R1107-D1136 VanDerWaalsContact NH1-CG 3.26Å; R1107-D1136 IonicContact NH1-OD1 3.04Å; R1107-D1136 PolarHBondContact NH1-OD1 3.42Å; R1107-D1136 IonicContact NH1-OD2 2.78Å; R1107-D1136 PolarHBondContact NH1-OD2 3.31Å; R1107-D1136 VanDerWaalsContact NH2-CG 3.34Å; R1107-D1136 IonicContact NH2-OD1 2.93Å; R1107-D1136 PolarHBondContact NH2-OD1 3.34Å; R1107-D1136 IonicContact NH2-OD2 2.68Å; R1107-D1136 PolarHBondContact NH2-OD2 3.15Å; R1107-F1145 HydrophobicContact CB-CZ 4.16Å
1108L89.7Confident85.6Confident33 Ų3351.4 Ų51.417%0.17327%0.268CS..Hα-helixtrans-60.5-41.3177.4-174.658.5000112.5P1104 S1105 L1106 Y1111 K1112 F1145 K1148P1104-L1108 PolarHBondContact O-N 2.69Å; S1105-L1108 PolarHBondContact O-N 3.44Å; L1106-L1108 VanDerWaalsContact C-N 3.31Å; L1106-L1108 PolarHBondContact O-N 3.23Å; L1108-Y1111 PolarHBondContact O-N 3.05Å; L1108-K1112 WeakPolarHBondContact O-CG 3.07Å; L1108-K1112 PolarHBondContact O-N 2.94Å; L1108-F1145 HydrophobicContact CB-CD2 4.08Å; L1108-F1145 HydrophobicContact CB-CE2 3.76Å; L1108-F1145 HydrophobicContact CB-CZ 4.35Å; L1108-F1145 HydrophobicContact CD1-CD2 4.08Å; L1108-F1145 HydrophobicContact CD1-CE2 4.49Å; L1108-F1145 HydrophobicContact CD1-CG 4.25Å; L1108-F1145 HydrophobicContact CD2-CD2 4.15Å; L1108-F1145 HydrophobicContact CG-CD2 4.32Å; L1108-F1145 HydrophobicContact CG-CE2 4.49Å; L1108-K1148 HydrophobicContact CD1-CB 3.68Å; L1108-K1148 HydrophobicContact CD1-CG 3.86Å
1109A89Confident84.5Confident5 Ų555.3 Ų55.34%0.04129%0.289CS..Hα-helixtrans-63.2-45.317500000111.8D1080 A1083 S1105 L1106 R1107 Y1111 K1112 V1113D1080-A1109 WeakPolarHBondContact OD1-CB 3.45Å; A1083-A1109 HydrophobicContact CB-CB 3.91Å; S1105-A1109 PolarHBondContact O-N 3.11Å; L1106-A1109 PolarHBondContact O-N 3.01Å; R1107-A1109 VanDerWaalsContact C-N 3.33Å; R1107-A1109 PolarHBondContact O-N 3.16Å; A1109-Y1111 VanDerWaalsContact C-N 3.33Å; A1109-Y1111 PolarHBondContact O-N 3.3Å; A1109-K1112 WeakPolarHBondContact O-CB 3.38Å; A1109-K1112 PolarHBondContact O-N 2.82Å; A1109-K1112 VanDerWaalsContact O-N 3.08Å; A1109-V1113 PolarHBondContact O-N 3.43Å
1110L91.7Very high83.7Confident2 Ų256.3 Ų56.31%0.0129%0.294CS..Hα-helixtrans-58.2-44.2173.9179.659.1000111.3A1083 A1086 A1087 L1093 L1100 L1106 R1107 K1112 V1113 L1114 F1129A1083-L1110 HydrophobicContact CB-CB 4.12Å; A1086-L1110 HydrophobicContact CB-CD1 4.36Å; A1087-L1110 HydrophobicContact CB-CD1 4.28Å; L1093-L1110 HydrophobicContact CD1-CD2 3.83Å; L1100-L1110 HydrophobicContact CD1-CD2 3.95Å; L1100-L1110 HydrophobicContact CD2-CB 4.45Å; L1100-L1110 HydrophobicContact CD2-CD2 3.75Å; L1106-L1110 PolarHBondContact O-N 3.29Å; R1107-L1110 PolarHBondContact O-N 3.19Å; L1110-K1112 VanDerWaalsContact C-N 3.29Å; L1110-K1112 PolarHBondContact O-N 3.02Å; L1110-V1113 PolarHBondContact O-N 3.36Å; L1110-V1113 VanDerWaalsContact O-N 3.1Å; L1110-L1114 HydrophobicContact CD1-CD1 4.35Å; L1110-L1114 HydrophobicContact CD1-CD2 4.34Å; L1110-L1114 HydrophobicContact CD1-CG 4.05Å; L1110-L1114 HydrophobicContact CG-CD1 4.15Å; L1110-L1114 HydrophobicContact CG-CG 4.27Å; L1110-L1114 WeakPolarHBondContact O-CG 3.49Å; L1110-L1114 PolarHBondContact O-N 3.46Å; L1110-F1129 HydrophobicContact CD2-CD2 4.38Å; L1110-F1129 HydrophobicContact CD2-CE2 3.47Å; L1110-F1129 VanDerWaalsContact CD2-CE2 3.47Å; L1110-F1129 HydrophobicContact CD2-CZ 3.77Å; L1110-F1129 HydrophobicContact CG-CE2 4.47Å; L1110-F1129 HydrophobicContact CG-CZ 4.41Å
1111Y91Very high82.5Confident0 Ų063.8 Ų63.80%033%0.328CS..Hα-helixtrans-62.4-35.5175.7-58.3-22.8000112.5R1107 L1108 A1109 A1115 F1129 L1133 D1136 F1145 A1149 A1152R1107-Y1111 HydrophobicContact CB-CE2 4.08Å; R1107-Y1111 WeakPolarHBondContact O-CD1 3.47Å; R1107-Y1111 WeakPolarHBondContact O-CD2 3.21Å; R1107-Y1111 PolarHBondContact O-N 3.04Å; L1108-Y1111 PolarHBondContact O-N 3.05Å; A1109-Y1111 VanDerWaalsContact C-N 3.33Å; A1109-Y1111 PolarHBondContact O-N 3.3Å; Y1111-A1115 WeakPolarHBondContact O-CB 3.43Å; Y1111-A1115 PolarHBondContact O-N 3.33Å; Y1111-F1129 HydrophobicContact CD1-CZ 4.38Å; Y1111-F1129 AromaticContact CE1-CE2 3.9Å; Y1111-F1129 HydrophobicContact CE1-CE2 3.9Å; Y1111-F1129 AromaticContact CE1-CZ 3.74Å; Y1111-F1129 HydrophobicContact CE1-CZ 3.74Å; Y1111-L1133 HydrophobicContact CD1-CD1 4.07Å; Y1111-L1133 HydrophobicContact CD2-CD1 4.48Å; Y1111-L1133 HydrophobicContact CE1-CB 4.37Å; Y1111-L1133 HydrophobicContact CE1-CD1 3.52Å; Y1111-L1133 HydrophobicContact CE1-CG 4.4Å; Y1111-L1133 HydrophobicContact CE2-CD1 3.97Å; Y1111-L1133 VanDerWaalsContact CZ-CD1 3.46Å; Y1111-L1133 WeakPolarHBondContact OH-CA 3.26Å; Y1111-D1136 PolarHBondContact OH-OD2 3.36Å; Y1111-F1145 HydrophobicContact CD2-CE1 4.26Å; Y1111-F1145 AromaticContact CE2-CE1 3.74Å; Y1111-F1145 HydrophobicContact CE2-CE1 3.74Å; Y1111-F1145 HydrophobicContact CE2-CZ 4.22Å; Y1111-A1149 HydrophobicContact CD2-CB 3.7Å; Y1111-A1149 HydrophobicContact CE2-CB 3.8Å; Y1111-A1149 HydrophobicContact CG-CB 4.43Å; Y1111-A1152 HydrophobicContact CD1-CB 4.08Å; Y1111-A1152 HydrophobicContact CG-CB 4.26Å
1112K88.5Confident82Confident92 Ų9260.3 Ų60.340%0.431%0.307SS..Hα-helixtrans-65.1-39.2172.9-70.1170.2-175.3172.40112.1L1108 A1109 L1110 K1116 K1148L1108-K1112 WeakPolarHBondContact O-CG 3.07Å; L1108-K1112 PolarHBondContact O-N 2.94Å; A1109-K1112 WeakPolarHBondContact O-CB 3.38Å; A1109-K1112 PolarHBondContact O-N 2.82Å; A1109-K1112 VanDerWaalsContact O-N 3.08Å; L1110-K1112 VanDerWaalsContact C-N 3.29Å; L1110-K1112 PolarHBondContact O-N 3.02Å; K1112-K1116 WeakPolarHBondContact O-CG 3.23Å; K1112-K1116 PolarHBondContact O-N 3Å; K1112-K1148 HydrophobicContact CG-CD 4.05Å; K1112-K1148 HydrophobicContact CG-CG 4.25Å
1113V87.7Confident81.4Confident36 Ų3659.4 Ų59.422%0.21831%0.309CS..Hα-helixtrans-67.3-52.8177.2173.70000110.4A1083 A1087 A1109 L1110 A1115 K1116 N1117A1083-V1113 HydrophobicContact CB-CG2 4.05Å; A1087-V1113 HydrophobicContact CB-CG1 3.86Å; A1109-V1113 PolarHBondContact O-N 3.43Å; L1110-V1113 PolarHBondContact O-N 3.36Å; L1110-V1113 VanDerWaalsContact O-N 3.1Å; V1113-A1115 VanDerWaalsContact C-N 3.3Å; V1113-A1115 PolarHBondContact O-N 2.87Å; V1113-K1116 PolarHBondContact O-N 3.1Å; V1113-N1117 PolarHBondContact O-N 2.96Å
1114L86.9Confident81.1Confident0 Ų061.9 Ų61.90%033%0.326CS..Hα-helixtrans-57.2-42.5177.7-66.9-176.5000111.6A1087 L1110 K1116 I1120 F1125 F1129 A1152 H1156A1087-L1114 HydrophobicContact CB-CD2 4.39Å; L1110-L1114 HydrophobicContact CD1-CD1 4.35Å; L1110-L1114 HydrophobicContact CD1-CD2 4.34Å; L1110-L1114 HydrophobicContact CD1-CG 4.05Å; L1110-L1114 HydrophobicContact CG-CD1 4.15Å; L1110-L1114 HydrophobicContact CG-CG 4.27Å; L1110-L1114 WeakPolarHBondContact O-CG 3.49Å; L1110-L1114 PolarHBondContact O-N 3.46Å; L1114-K1116 VanDerWaalsContact C-N 3.26Å; L1114-K1116 PolarHBondContact O-N 3.36Å; L1114-I1120 HydrophobicContact CD2-CD1 3.33Å; L1114-F1125 HydrophobicContact CD1-CE1 4.14Å; L1114-F1125 HydrophobicContact CD1-CZ 4.43Å; L1114-F1125 HydrophobicContact CD2-CE1 4.3Å; L1114-F1125 HydrophobicContact CD2-CZ 4.21Å; L1114-F1129 HydrophobicContact CD1-CE1 4.25Å; L1114-F1129 HydrophobicContact CD1-CZ 3.96Å; L1114-A1152 HydrophobicContact CB-CB 3.8Å; L1114-A1152 HydrophobicContact CD1-CB 4.29Å; L1114-H1156 PolarHBondContact O-CD2 2.94Å; L1114-H1156 PolarHBondContact O-NE2 2.93Å
1115A80.6Confident81Confident32 Ų3258.9 Ų58.926%0.26431%0.306SS..Hα-helixtrans-67.6-20.6178.800000114.4Y1111 V1113 K1151Y1111-A1115 WeakPolarHBondContact O-CB 3.43Å; Y1111-A1115 PolarHBondContact O-N 3.33Å; V1113-A1115 VanDerWaalsContact C-N 3.3Å; V1113-A1115 PolarHBondContact O-N 2.87Å; A1115-K1151 HydrophobicContact CB-CB 3.74Å
1116K76.9Confident80.9Confident180 Ų18057.4 Ų57.478%0.78330%0.295SS*.Hα-helixtrans-98.5-27-179.1-79-177.3177.8-178.80113.6K1112 V1113 L1114K1112-K1116 WeakPolarHBondContact O-CG 3.23Å; K1112-K1116 PolarHBondContact O-N 3Å; V1113-K1116 PolarHBondContact O-N 3.1Å; L1114-K1116 VanDerWaalsContact C-N 3.26Å; L1114-K1116 PolarHBondContact O-N 3.36Å
1117N73.2Confident80.5Confident88 Ų8859.5 Ų59.547%0.47131%0.31SS..  trans-112.4107.7-169.9-131.9-5.5000110.2V1113 I1120 H1156V1113-N1117 PolarHBondContact O-N 2.96Å; N1117-I1120 HydrophobicContact CB-CD1 4.1Å; N1117-I1120 HydrophobicContact CB-CG1 4.12Å; N1117-H1156 PolarHBondContact O-CE1 3.43Å; N1117-H1156 PolarHBondContact O-NE2 2.86Å
1118L63.6Low80.1Confident132 Ų13259.4 Ų59.469%0.69132%0.315SS*.SBendtrans-82.9-17.9-179.4-64.6170.9000112.7I1120 A1155L1118-I1120 VanDerWaalsContact C-N 3.3Å; L1118-I1120 PolarHBondContact O-N 3Å; L1118-A1155 HydrophobicContact CD2-CB 4.28Å
1119N65.6Low79.9Confident147 Ų14758 Ų5879%0.78631%0.308SS*.  trans-92.634-175.1-65.9-5.2000113.2
1120I71.3Confident79.6Confident24 Ų2458.4 Ų58.412%0.12331%0.308CS..  trans-82.8124.4179.3-65.4178.6000109A1087 L1114 N1117 L1118 I1122A1087-I1120 HydrophobicContact CB-CD1 4.14Å; A1087-I1120 WeakPolarHBondContact O-CG2 3.26Å; L1114-I1120 HydrophobicContact CD2-CD1 3.33Å; N1117-I1120 HydrophobicContact CB-CD1 4.1Å; N1117-I1120 HydrophobicContact CB-CG1 4.12Å; L1118-I1120 VanDerWaalsContact C-N 3.3Å; L1118-I1120 PolarHBondContact O-N 3Å; I1120-I1122 HydrophobicContact CG2-CB 3.97Å; I1120-I1122 HydrophobicContact CG2-CD1 3.83Å; I1120-I1122 HydrophobicContact CG2-CG1 3.65Å; I1120-I1122 PolarHBondContact O-N 3.09Å; I1120-I1122 VanDerWaalsContact O-N 3.15Å
1121Q64.9Low79Confident160 Ų16064.1 Ų64.175%0.74833%0.33SS*.  trans-8639-178.2-61.8-179.4-13.400112.8
1122I75.8Confident78.8Confident11 Ų1165.2 Ų65.26%0.05634%0.335CS..  trans-101.995.3175.7-59.8175000108.1I1120 T1124 F1125I1120-I1122 HydrophobicContact CG2-CB 3.97Å; I1120-I1122 HydrophobicContact CG2-CD1 3.83Å; I1120-I1122 HydrophobicContact CG2-CG1 3.65Å; I1120-I1122 PolarHBondContact O-N 3.09Å; I1120-I1122 VanDerWaalsContact O-N 3.15Å; I1122-T1124 VanDerWaalsContact C-N 3.31Å; I1122-T1124 PolarHBondContact O-N 3.36Å; I1122-F1125 HydrophobicContact CB-CE2 4.24Å; I1122-F1125 HydrophobicContact CB-CZ 4.11Å; I1122-F1125 HydrophobicContact CD1-CE1 4.15Å; I1122-F1125 HydrophobicContact CD1-CZ 4.37Å; I1122-F1125 HydrophobicContact CG2-CD1 4.17Å; I1122-F1125 HydrophobicContact CG2-CD2 4.04Å; I1122-F1125 HydrophobicContact CG2-CE1 4.14Å; I1122-F1125 HydrophobicContact CG2-CE2 3.99Å; I1122-F1125 HydrophobicContact CG2-CG 4.12Å; I1122-F1125 HydrophobicContact CG2-CZ 4.05Å
1123D74Confident78.6Confident141 Ų14160.9 Ų60.975%0.75432%0.317SS*.SBendtrans-68.9-29.6-177.6-56.3-29.1000112.6G1159D1123-G1159 WeakPolarHBondContact O-CA 3.47Å
1124T80.2Confident78.1Confident77 Ų7759.5 Ų59.547%0.47231%0.308SS..SBendtrans-145.5118179.2-43.50000111I1122I1122-T1124 VanDerWaalsContact C-N 3.31Å; I1122-T1124 PolarHBondContact O-N 3.36Å
1125F84.7Confident77.8Confident5 Ų560.4 Ų60.42%0.02232%0.316CS..  trans-76.1143.6177.1-74.8-95000111L1093 L1114 I1122 F1129 Q1130 H1156 G1159 M1160L1093-F1125 HydrophobicContact CD2-CD1 3.53Å; L1093-F1125 HydrophobicContact CD2-CE1 4.01Å; L1114-F1125 HydrophobicContact CD1-CE1 4.14Å; L1114-F1125 HydrophobicContact CD1-CZ 4.43Å; L1114-F1125 HydrophobicContact CD2-CE1 4.3Å; L1114-F1125 HydrophobicContact CD2-CZ 4.21Å; I1122-F1125 HydrophobicContact CB-CE2 4.24Å; I1122-F1125 HydrophobicContact CB-CZ 4.11Å; I1122-F1125 HydrophobicContact CD1-CE1 4.15Å; I1122-F1125 HydrophobicContact CD1-CZ 4.37Å; I1122-F1125 HydrophobicContact CG2-CD1 4.17Å; I1122-F1125 HydrophobicContact CG2-CD2 4.04Å; I1122-F1125 HydrophobicContact CG2-CE1 4.14Å; I1122-F1125 HydrophobicContact CG2-CE2 3.99Å; I1122-F1125 HydrophobicContact CG2-CG 4.12Å; I1122-F1125 HydrophobicContact CG2-CZ 4.05Å; F1125-F1129 HydrophobicContact CB-CD1 4.1Å; F1125-F1129 AromaticContact CD1-CD1 3.53Å; F1125-F1129 HydrophobicContact CD1-CD1 3.53Å; F1125-F1129 AromaticContact CD1-CE1 3.49Å; F1125-F1129 HydrophobicContact CD1-CE1 3.49Å; F1125-F1129 VanDerWaalsContact CD1-CE1 3.49Å; F1125-F1129 HydrophobicContact CE1-CD1 4.37Å; F1125-F1129 AromaticContact CE1-CE1 3.9Å; F1125-F1129 HydrophobicContact CE1-CE1 3.9Å; F1125-F1129 HydrophobicContact CG-CD1 4.14Å; F1125-F1129 HydrophobicContact CG-CE1 4.32Å; F1125-Q1130 HydrophobicContact CB-CG 4.15Å; F1125-Q1130 PolarHBondContact O-NE2 2.89Å; F1125-H1156 HydrophobicContact CE2-CB 3.83Å; F1125-H1156 HydrophobicContact CZ-CB 4.13Å; F1125-G1159 PolarHBondContact N-O 3.45Å; F1125-M1160 HydrophobicContact CB-SD 4.06Å; F1125-M1160 HydrophobicContact CD1-CE 4.13Å; F1125-M1160 HydrophobicContact CD2-CE 3.81Å; F1125-M1160 HydrophobicContact CD2-SD 3.98Å; F1125-M1160 HydrophobicContact CE1-CE 4.23Å; F1125-M1160 HydrophobicContact CE2-CE 3.94Å; F1125-M1160 HydrophobicContact CG-CE 3.92Å; F1125-M1160 HydrophobicContact CG-SD 3.95Å; F1125-M1160 HydrophobicContact CZ-CE 4.14Å
1126P84.7Confident78.1Confident12 Ų1259.5 Ų59.58%0.07831%0.306CS..  trans-57.6140.1175.9-23.733.6000112.6K1090 L1093 E1094 A1128 F1129 Q1130K1090-P1126 HydrophobicContact CG-CG 4.37Å; L1093-P1126 VanDerWaalsContact CD2-CD 3.47Å; L1093-P1126 HydrophobicContact CD2-CG 4.14Å; L1093-P1126 HydrophobicContact CG-CG 4.37Å; E1094-P1126 HydrophobicContact CG-CB 4.2Å; E1094-P1126 HydrophobicContact CG-CG 3.54Å; P1126-A1128 PolarHBondContact O-N 3.35Å; P1126-A1128 VanDerWaalsContact O-N 3.15Å; P1126-F1129 WeakPolarHBondContact O-CB 3.41Å; P1126-F1129 PolarHBondContact O-N 3.31Å; P1126-Q1130 PolarHBondContact O-N 3.48Å; P1126-Q1130 VanDerWaalsContact O-N 3.11Å
1127S79.8Confident78Confident47 Ų4751.1 Ų51.133%0.32927%0.27SS..Hα-helixtrans-57.5-34.2-176.2-42.70000113.1Q1130 R1131S1127-Q1130 PolarHBondContact O-N 3.35Å; S1127-R1131 WeakPolarHBondContact O-CG 3.18Å; S1127-R1131 PolarHBondContact O-N 3Å
1128A81.7Confident77.9Confident23 Ų2348.1 Ų48.119%0.1925%0.254CS..Hα-helixtrans-64.1-40.3175.400000112.9Q1097 P1126 R1131 L1132Q1097-A1128 HydrophobicContact CG-CB 4.16Å; P1126-A1128 PolarHBondContact O-N 3.35Å; P1126-A1128 VanDerWaalsContact O-N 3.15Å; A1128-R1131 PolarHBondContact O-N 2.99Å; A1128-L1132 WeakPolarHBondContact O-CB 3.22Å; A1128-L1132 PolarHBondContact O-N 3.31Å
1129F86.6Confident78.5Confident5 Ų547.4 Ų47.42%0.02225%0.247CC..Hα-helixtrans-68.4-39.4176.1177.1-105.1000111.7L1093 L1100 L1110 Y1111 L1114 F1125 P1126 R1131 L1132 L1133 M1160L1093-F1129 HydrophobicContact CD1-CD2 4.38Å; L1093-F1129 HydrophobicContact CD2-CD1 4.31Å; L1093-F1129 HydrophobicContact CD2-CG 4.36Å; L1100-F1129 HydrophobicContact CD1-CD2 4.1Å; L1100-F1129 HydrophobicContact CD1-CE2 4.39Å; L1110-F1129 HydrophobicContact CD2-CD2 4.38Å; L1110-F1129 HydrophobicContact CD2-CE2 3.47Å; L1110-F1129 VanDerWaalsContact CD2-CE2 3.47Å; L1110-F1129 HydrophobicContact CD2-CZ 3.77Å; L1110-F1129 HydrophobicContact CG-CE2 4.47Å; L1110-F1129 HydrophobicContact CG-CZ 4.41Å; Y1111-F1129 HydrophobicContact CD1-CZ 4.38Å; Y1111-F1129 AromaticContact CE1-CE2 3.9Å; Y1111-F1129 HydrophobicContact CE1-CE2 3.9Å; Y1111-F1129 AromaticContact CE1-CZ 3.74Å; Y1111-F1129 HydrophobicContact CE1-CZ 3.74Å; L1114-F1129 HydrophobicContact CD1-CE1 4.25Å; L1114-F1129 HydrophobicContact CD1-CZ 3.96Å; F1125-F1129 HydrophobicContact CB-CD1 4.1Å; F1125-F1129 AromaticContact CD1-CD1 3.53Å; F1125-F1129 HydrophobicContact CD1-CD1 3.53Å; F1125-F1129 AromaticContact CD1-CE1 3.49Å; F1125-F1129 HydrophobicContact CD1-CE1 3.49Å; F1125-F1129 VanDerWaalsContact CD1-CE1 3.49Å; F1125-F1129 HydrophobicContact CE1-CD1 4.37Å; F1125-F1129 AromaticContact CE1-CE1 3.9Å; F1125-F1129 HydrophobicContact CE1-CE1 3.9Å; F1125-F1129 HydrophobicContact CG-CD1 4.14Å; F1125-F1129 HydrophobicContact CG-CE1 4.32Å; P1126-F1129 WeakPolarHBondContact O-CB 3.41Å; P1126-F1129 PolarHBondContact O-N 3.31Å; F1129-R1131 VanDerWaalsContact C-N 3.35Å; F1129-R1131 PolarHBondContact O-N 3.16Å; F1129-L1132 WeakPolarHBondContact O-CB 3.23Å; F1129-L1132 PolarHBondContact O-N 3.34Å; F1129-L1133 HydrophobicContact CE1-CD2 4.5Å; F1129-L1133 WeakPolarHBondContact O-CB 3.44Å; F1129-L1133 PolarHBondContact O-N 2.97Å; F1129-M1160 HydrophobicContact CE1-CE 3.97Å
1130Q81.5Confident79.1Confident13 Ų1341.8 Ų41.86%0.06122%0.219CC..Hα-helixtrans-58.9-46.7174.6-63.3-179.119.500111.2F1125 P1126 S1127 L1132 L1133 L1134 M1160 S1162F1125-Q1130 HydrophobicContact CB-CG 4.15Å; F1125-Q1130 PolarHBondContact O-NE2 2.89Å; P1126-Q1130 PolarHBondContact O-N 3.48Å; P1126-Q1130 VanDerWaalsContact O-N 3.11Å; S1127-Q1130 PolarHBondContact O-N 3.35Å; Q1130-L1132 VanDerWaalsContact C-N 3.31Å; Q1130-L1132 PolarHBondContact O-N 3.47Å; Q1130-L1133 PolarHBondContact O-N 3.42Å; Q1130-L1134 WeakPolarHBondContact O-CB 3.34Å; Q1130-L1134 PolarHBondContact O-N 3.35Å; Q1130-M1160 HydrophobicContact CG-SD 4.11Å; Q1130-M1160 PolarHBondContact OE1-O 3.47Å; Q1130-S1162 VanDerWaalsContact OE1-CB 3.27Å; Q1130-S1162 PolarHBondContact OE1-OG 2.95Å
1131R80.5Confident79.3Confident121 Ų12148.9 Ų48.946%0.45725%0.252SS..Hα-helixtrans-59.4-41.6175.4-74.1-171.9-69.4-156.5-1.1112.4S1127 A1128 F1129 L1134 A1135 E1168S1127-R1131 WeakPolarHBondContact O-CG 3.18Å; S1127-R1131 PolarHBondContact O-N 3Å; A1128-R1131 PolarHBondContact O-N 2.99Å; F1129-R1131 VanDerWaalsContact C-N 3.35Å; F1129-R1131 PolarHBondContact O-N 3.16Å; R1131-L1134 PolarHBondContact O-N 2.7Å; R1131-A1135 WeakPolarHBondContact O-CB 3.44Å; R1131-A1135 PolarHBondContact O-N 3.03Å; R1131-E1168 WeakPolarHBondContact CD-OE2 3.3Å; R1131-E1168 WeakPolarHBondContact CG-OE2 3.34Å
1132L85.7Confident80Confident23 Ų2345 Ų4512%0.1224%0.236CC..Hα-helixtrans-65.5-47.8-179.9-166.263.8000112.1L1100 V1101 R1107 A1128 F1129 Q1130 L1134 A1135 D1136L1100-L1132 HydrophobicContact CB-CD2 3.97Å; V1101-L1132 HydrophobicContact CG2-CD1 4.16Å; V1101-L1132 HydrophobicContact CG2-CD2 3.99Å; R1107-L1132 VanDerWaalsContact CD-CD2 3.43Å; R1107-L1132 HydrophobicContact CG-CD2 4.14Å; A1128-L1132 WeakPolarHBondContact O-CB 3.22Å; A1128-L1132 PolarHBondContact O-N 3.31Å; F1129-L1132 WeakPolarHBondContact O-CB 3.23Å; F1129-L1132 PolarHBondContact O-N 3.34Å; Q1130-L1132 VanDerWaalsContact C-N 3.31Å; Q1130-L1132 PolarHBondContact O-N 3.47Å; L1132-L1134 VanDerWaalsContact C-N 3.31Å; L1132-L1134 PolarHBondContact O-N 3.26Å; L1132-A1135 PolarHBondContact O-N 3.32Å; L1132-D1136 PolarHBondContact O-N 3.29Å
1133L84.9Confident79.7Confident1 Ų149.4 Ų49.41%0.00526%0.257CS..Hα-helixtrans-61.5-40.2175.5174.861.5000111.6Y1111 F1129 Q1130 D1136 V1137 A1149 Y1153 M1160Y1111-L1133 HydrophobicContact CD1-CD1 4.07Å; Y1111-L1133 HydrophobicContact CD2-CD1 4.48Å; Y1111-L1133 HydrophobicContact CE1-CB 4.37Å; Y1111-L1133 HydrophobicContact CE1-CD1 3.52Å; Y1111-L1133 HydrophobicContact CE1-CG 4.4Å; Y1111-L1133 HydrophobicContact CE2-CD1 3.97Å; Y1111-L1133 VanDerWaalsContact CZ-CD1 3.46Å; Y1111-L1133 WeakPolarHBondContact OH-CA 3.26Å; F1129-L1133 HydrophobicContact CE1-CD2 4.5Å; F1129-L1133 WeakPolarHBondContact O-CB 3.44Å; F1129-L1133 PolarHBondContact O-N 2.97Å; Q1130-L1133 PolarHBondContact O-N 3.42Å; L1133-D1136 PolarHBondContact O-N 3.18Å; L1133-V1137 HydrophobicContact CD1-CG2 4.33Å; L1133-V1137 VanDerWaalsContact O-CG2 3.26Å; L1133-V1137 WeakPolarHBondContact O-CG2 3.37Å; L1133-V1137 PolarHBondContact O-N 3.43Å; L1133-A1149 HydrophobicContact CD1-CB 3.72Å; L1133-Y1153 HydrophobicContact CD2-CD2 3.77Å; L1133-Y1153 HydrophobicContact CD2-CG 4.44Å; L1133-Y1153 HydrophobicContact CG-CD2 4.35Å; L1133-M1160 HydrophobicContact CD2-CE 3.64Å; L1133-M1160 HydrophobicContact CD2-SD 3.97Å
1134L76.7Confident79.7Confident8 Ų847.3 Ų47.34%0.04225%0.245CC..Hα-helixtrans-66.2-45.4177.2-174.774.3000112.1Q1130 R1131 L1132 D1136 V1137 L1138 T1169 L1199Q1130-L1134 WeakPolarHBondContact O-CB 3.34Å; Q1130-L1134 PolarHBondContact O-N 3.35Å; R1131-L1134 PolarHBondContact O-N 2.7Å; L1132-L1134 VanDerWaalsContact C-N 3.31Å; L1132-L1134 PolarHBondContact O-N 3.26Å; L1134-D1136 VanDerWaalsContact C-N 3.3Å; L1134-D1136 PolarHBondContact O-N 2.83Å; L1134-V1137 PolarHBondContact O-N 2.74Å; L1134-L1138 HydrophobicContact CD1-CD1 3.94Å; L1134-L1138 HydrophobicContact CD1-CG 4.34Å; L1134-L1138 HydrophobicContact CD2-CD1 4.38Å; L1134-L1138 HydrophobicContact CG-CD1 3.85Å; L1134-L1138 HydrophobicContact CG-CG 4.44Å; L1134-L1138 WeakPolarHBondContact O-CB 3.34Å; L1134-L1138 WeakPolarHBondContact O-CG 3.42Å; L1134-L1138 PolarHBondContact O-N 3.12Å; L1134-T1169 HydrophobicContact CD1-CG2 3.73Å; L1134-T1169 HydrophobicContact CD2-CG2 4.3Å; L1134-T1169 VanDerWaalsContact CD2-OG1 3.29Å; L1134-T1169 WeakPolarHBondContact CD2-OG1 3.35Å; L1134-L1199 HydrophobicContact CD1-CD1 3.69Å; L1134-L1199 HydrophobicContact CD1-CD2 3.98Å; L1134-L1199 HydrophobicContact CD1-CG 4.46Å
1135A81.8Confident79.8Confident19 Ų1944.2 Ų44.216%0.15723%0.225CC..Hα-helixtrans-57.8-45.7175.100000110.6R1131 L1132 V1137 L1138 E1139R1131-A1135 WeakPolarHBondContact O-CB 3.44Å; R1131-A1135 PolarHBondContact O-N 3.03Å; L1132-A1135 PolarHBondContact O-N 3.32Å; A1135-V1137 VanDerWaalsContact C-N 3.32Å; A1135-V1137 PolarHBondContact O-N 3.34Å; A1135-L1138 PolarHBondContact O-N 2.83Å; A1135-E1139 WeakPolarHBondContact O-CA 3.47Å; A1135-E1139 VanDerWaalsContact O-CB 3.23Å; A1135-E1139 WeakPolarHBondContact O-CB 3.35Å; A1135-E1139 PolarHBondContact O-N 3.21Å
1136D85.6Confident79.5Confident12 Ų1244.1 Ų44.16%0.06423%0.225CC..Hα-helixtrans-65-33.7178.3-73.3-22.5000113.3R1107 Y1111 L1132 L1133 L1134 C1140 F1145R1107-D1136 WeakPolarHBondContact CD-OD2 3.25Å; R1107-D1136 IonicContact CZ-OD1 3.56Å; R1107-D1136 IonicContact CZ-OD2 4Å; R1107-D1136 IonicContact NE-OD2 3.06Å; R1107-D1136 PolarHBondContact NE-OD2 2.86Å; R1107-D1136 VanDerWaalsContact NE-OD2 3.16Å; R1107-D1136 VanDerWaalsContact NH1-CG 3.26Å; R1107-D1136 IonicContact NH1-OD1 3.04Å; R1107-D1136 PolarHBondContact NH1-OD1 3.42Å; R1107-D1136 IonicContact NH1-OD2 2.78Å; R1107-D1136 PolarHBondContact NH1-OD2 3.31Å; R1107-D1136 VanDerWaalsContact NH2-CG 3.34Å; R1107-D1136 IonicContact NH2-OD1 2.93Å; R1107-D1136 PolarHBondContact NH2-OD1 3.34Å; R1107-D1136 IonicContact NH2-OD2 2.68Å; R1107-D1136 PolarHBondContact NH2-OD2 3.15Å; Y1111-D1136 PolarHBondContact OH-OD2 3.36Å; L1132-D1136 PolarHBondContact O-N 3.29Å; L1133-D1136 PolarHBondContact O-N 3.18Å; L1134-D1136 VanDerWaalsContact C-N 3.3Å; L1134-D1136 PolarHBondContact O-N 2.83Å; D1136-C1140 WeakPolarHBondContact O-CB 3.48Å; D1136-C1140 PolarHBondContact O-N 3.39Å; D1136-F1145 HydrophobicContact CB-CD1 4.18Å; D1136-F1145 HydrophobicContact CB-CE1 3.65Å; D1136-F1145 VanDerWaalsContact CG-CE1 3.48Å; D1136-F1145 WeakPolarHBondContact OD2-CE1 3.31Å
1137V75.6Confident79Confident4 Ų448.2 Ų48.22%0.02424%0.239CC..Hα-helixtrans-70.4-38.3175.6169.80000111.9L1133 L1134 A1135 A1149 V1150 A1195 L1199L1133-V1137 HydrophobicContact CD1-CG2 4.33Å; L1133-V1137 VanDerWaalsContact O-CG2 3.26Å; L1133-V1137 WeakPolarHBondContact O-CG2 3.37Å; L1133-V1137 PolarHBondContact O-N 3.43Å; L1134-V1137 PolarHBondContact O-N 2.74Å; A1135-V1137 VanDerWaalsContact C-N 3.32Å; A1135-V1137 PolarHBondContact O-N 3.34Å; V1137-A1149 HydrophobicContact CG2-CB 3.74Å; V1137-V1150 HydrophobicContact CG1-CG2 4.32Å; V1137-V1150 HydrophobicContact CG2-CG2 4.34Å; V1137-A1195 HydrophobicContact CG1-CB 3.51Å; V1137-L1199 HydrophobicContact CB-CD1 4.26Å; V1137-L1199 HydrophobicContact CG1-CD1 3.5Å; V1137-L1199 VanDerWaalsContact CG1-CD1 3.5Å
1138L71.5Confident79.1Confident26 Ų2649.1 Ų49.114%0.13624%0.237CC..Hα-helixtrans-91.9-32.2-172.5-64.4178.5000114L1134 A1135 R1172 L1199L1134-L1138 HydrophobicContact CD1-CD1 3.94Å; L1134-L1138 HydrophobicContact CD1-CG 4.34Å; L1134-L1138 HydrophobicContact CD2-CD1 4.38Å; L1134-L1138 HydrophobicContact CG-CD1 3.85Å; L1134-L1138 HydrophobicContact CG-CG 4.44Å; L1134-L1138 WeakPolarHBondContact O-CB 3.34Å; L1134-L1138 WeakPolarHBondContact O-CG 3.42Å; L1134-L1138 PolarHBondContact O-N 3.12Å; A1135-L1138 PolarHBondContact O-N 2.83Å; L1138-R1172 HydrophobicContact CD1-CB 3.96Å; L1138-L1199 HydrophobicContact CD2-CD1 4.09Å; L1138-L1199 HydrophobicContact CG-CD1 4.47Å
1139E75.4Confident79.2Confident117 Ų11748 Ų4855%0.54723%0.228SC..Hα-helixtrans-111.3-26.3-168-58.5167.9-161.900112.5A1135 E1141 R1172 R1192A1135-E1139 WeakPolarHBondContact O-CA 3.47Å; A1135-E1139 VanDerWaalsContact O-CB 3.23Å; A1135-E1139 WeakPolarHBondContact O-CB 3.35Å; A1135-E1139 PolarHBondContact O-N 3.21Å; E1139-E1141 PolarHBondContact O-N 3.41Å; E1139-R1172 IonicContact OE1-CZ 3.51Å; E1139-R1172 IonicContact OE1-NH1 2.72Å; E1139-R1172 PolarHBondContact OE1-NH1 2.92Å; E1139-R1172 IonicContact OE1-NH2 3.23Å; E1139-R1192 PolarHBondContact O-NH2 2.96Å
1140C78.9Confident78.6Confident29 Ų2948.3 Ų48.320%0.19623%0.23CC..  trans-70.3131.4-176-168.90000112.4D1136 F1145 V1146 R1192D1136-C1140 WeakPolarHBondContact O-CB 3.48Å; D1136-C1140 PolarHBondContact O-N 3.39Å; C1140-F1145 HydrophobicContact CB-CD1 4.47Å; C1140-V1146 HydrophobicContact CB-CG2 4.29Å; C1140-V1146 WeakPolarHBondContact O-CG2 3.37Å; C1140-R1192 PolarHBondContact O-NE 2.91Å; C1140-R1192 PolarHBondContact O-NH2 3.42Å
1141E74.4Confident78.3Confident172 Ų17251.9 Ų51.980%0.80425%0.245SC*.  trans-83.1-19179.9-64.7-176.1167.600113.5E1139 E1143E1139-E1141 PolarHBondContact O-N 3.41Å; E1141-E1143 PolarHBondContact O-N 3.05Å
1142D79Confident78.3Confident79 Ų7946.1 Ų46.142%0.42222%0.224SC..  trans-75.6110179.5177.5-4.4000111.6N1144 F1145 V1146D1142-N1144 VanDerWaalsContact C-N 3.3Å; D1142-N1144 PolarHBondContact O-N 3.48Å; D1142-N1144 WeakPolarHBondContact OD1-CB 3.4Å; D1142-N1144 PolarHBondContact OD1-N 3.01Å; D1142-F1145 HydrophobicContact CB-CB 3.75Å; D1142-F1145 VanDerWaalsContact O-CB 3.28Å; D1142-F1145 WeakPolarHBondContact O-CB 3.09Å; D1142-F1145 PolarHBondContact O-N 2.76Å; D1142-F1145 VanDerWaalsContact O-N 3.1Å; D1142-F1145 PolarHBondContact OD1-N 3.46Å; D1142-V1146 WeakPolarHBondContact O-CG2 3.16Å; D1142-V1146 PolarHBondContact O-N 3.09Å
1143E70.1Confident77.9Confident104 Ų10446.1 Ų46.149%0.48622%0.222SC..Hα-helixtrans-57.5-36.6179.2-70.7-159.5154.900114.4E1141 F1145 R1147 P1191E1141-E1143 PolarHBondContact O-N 3.05Å; E1143-F1145 VanDerWaalsContact C-N 3.32Å; E1143-R1147 VanDerWaalsContact O-CB 3.25Å; E1143-R1147 WeakPolarHBondContact O-CB 3Å; E1143-R1147 PolarHBondContact O-N 2.89Å; E1143-P1191 HydrophobicContact CB-CG 4.25Å; E1143-P1191 HydrophobicContact CG-CG 4.34Å
1144N73.7Confident77.1Confident97 Ų9747.6 Ų47.652%0.51923%0.23SC..Hα-helixtrans-68.7-38.3178.4-97.5-34.8000110.8D1142 R1147 K1148D1142-N1144 VanDerWaalsContact C-N 3.3Å; D1142-N1144 PolarHBondContact O-N 3.48Å; D1142-N1144 WeakPolarHBondContact OD1-CB 3.4Å; D1142-N1144 PolarHBondContact OD1-N 3.01Å; N1144-R1147 PolarHBondContact O-N 3.02Å; N1144-K1148 WeakPolarHBondContact O-CG 3.45Å; N1144-K1148 PolarHBondContact O-N 3.4Å; N1144-K1148 VanDerWaalsContact O-N 3.16Å
1145F82.8Confident76.8Confident12 Ų1248.9 Ų48.95%0.05324%0.242CC..Hα-helixtrans-61.9-52.8175.8-157.2-74.5000110.7P1104 R1107 L1108 Y1111 D1136 C1140 D1142 E1143 R1147 K1148 A1149P1104-F1145 HydrophobicContact CB-CE2 4.3Å; P1104-F1145 VanDerWaalsContact O-CE2 3.26Å; P1104-F1145 WeakPolarHBondContact O-CE2 3.27Å; P1104-F1145 WeakPolarHBondContact O-CZ 3.46Å; R1107-F1145 HydrophobicContact CB-CZ 4.16Å; L1108-F1145 HydrophobicContact CB-CD2 4.08Å; L1108-F1145 HydrophobicContact CB-CE2 3.76Å; L1108-F1145 HydrophobicContact CB-CZ 4.35Å; L1108-F1145 HydrophobicContact CD1-CD2 4.08Å; L1108-F1145 HydrophobicContact CD1-CE2 4.49Å; L1108-F1145 HydrophobicContact CD1-CG 4.25Å; L1108-F1145 HydrophobicContact CD2-CD2 4.15Å; L1108-F1145 HydrophobicContact CG-CD2 4.32Å; L1108-F1145 HydrophobicContact CG-CE2 4.49Å; Y1111-F1145 HydrophobicContact CD2-CE1 4.26Å; Y1111-F1145 AromaticContact CE2-CE1 3.74Å; Y1111-F1145 HydrophobicContact CE2-CE1 3.74Å; Y1111-F1145 HydrophobicContact CE2-CZ 4.22Å; D1136-F1145 HydrophobicContact CB-CD1 4.18Å; D1136-F1145 HydrophobicContact CB-CE1 3.65Å; D1136-F1145 VanDerWaalsContact CG-CE1 3.48Å; D1136-F1145 WeakPolarHBondContact OD2-CE1 3.31Å; C1140-F1145 HydrophobicContact CB-CD1 4.47Å; D1142-F1145 HydrophobicContact CB-CB 3.75Å; D1142-F1145 VanDerWaalsContact O-CB 3.28Å; D1142-F1145 WeakPolarHBondContact O-CB 3.09Å; D1142-F1145 PolarHBondContact O-N 2.76Å; D1142-F1145 VanDerWaalsContact O-N 3.1Å; D1142-F1145 PolarHBondContact OD1-N 3.46Å; E1143-F1145 VanDerWaalsContact C-N 3.32Å; F1145-R1147 VanDerWaalsContact C-N 3.32Å; F1145-R1147 PolarHBondContact O-N 3.5Å; F1145-K1148 PolarHBondContact O-N 2.89Å; F1145-A1149 WeakPolarHBondContact O-CB 3.18Å; F1145-A1149 PolarHBondContact O-N 3.2Å
1146V77.7Confident76.5Confident2 Ų248.9 Ų48.91%0.01224%0.239CC..Hα-helixtrans-55.5-47.8176.2175.10000110.3C1140 D1142 K1148 A1149 V1150 P1191 R1192 A1195C1140-V1146 HydrophobicContact CB-CG2 4.29Å; C1140-V1146 WeakPolarHBondContact O-CG2 3.37Å; D1142-V1146 WeakPolarHBondContact O-CG2 3.16Å; D1142-V1146 PolarHBondContact O-N 3.09Å; V1146-K1148 VanDerWaalsContact C-N 3.32Å; V1146-K1148 PolarHBondContact O-N 3.47Å; V1146-A1149 PolarHBondContact O-N 3.41Å; V1146-V1150 HydrophobicContact CG1-CG2 4.16Å; V1146-V1150 WeakPolarHBondContact O-CB 3.33Å; V1146-V1150 WeakPolarHBondContact O-CG2 3.45Å; V1146-V1150 PolarHBondContact O-N 3.21Å; V1146-P1191 HydrophobicContact CG1-CB 4.13Å; V1146-R1192 HydrophobicContact CG1-CG 4.18Å; V1146-R1192 HydrophobicContact CG2-CG 4.26Å; V1146-A1195 HydrophobicContact CG1-CB 4.42Å
1147R74.4Confident75.7Confident99 Ų9950.1 Ų50.137%0.37425%0.248SC..Hα-helixtrans-59.3-38.2-179-172.1-174.5-66.7-176.4-3.9113.1E1143 N1144 F1145 K1151E1143-R1147 VanDerWaalsContact O-CB 3.25Å; E1143-R1147 WeakPolarHBondContact O-CB 3Å; E1143-R1147 PolarHBondContact O-N 2.89Å; N1144-R1147 PolarHBondContact O-N 3.02Å; F1145-R1147 VanDerWaalsContact C-N 3.32Å; F1145-R1147 PolarHBondContact O-N 3.5Å; R1147-K1151 WeakPolarHBondContact O-CG 3.37Å; R1147-K1151 PolarHBondContact O-N 2.91Å
1148K83.2Confident75.3Confident66 Ų6653.5 Ų53.529%0.28728%0.277SS..Hα-helixtrans-77-41.8178-65.9-61.6-179.5179.70111.9L1108 K1112 N1144 F1145 V1146 V1150 K1151 A1152L1108-K1148 HydrophobicContact CD1-CB 3.68Å; L1108-K1148 HydrophobicContact CD1-CG 3.86Å; K1112-K1148 HydrophobicContact CG-CD 4.05Å; K1112-K1148 HydrophobicContact CG-CG 4.25Å; N1144-K1148 WeakPolarHBondContact O-CG 3.45Å; N1144-K1148 PolarHBondContact O-N 3.4Å; N1144-K1148 VanDerWaalsContact O-N 3.16Å; F1145-K1148 PolarHBondContact O-N 2.89Å; V1146-K1148 VanDerWaalsContact C-N 3.32Å; V1146-K1148 PolarHBondContact O-N 3.47Å; K1148-V1150 VanDerWaalsContact C-N 3.34Å; K1148-V1150 PolarHBondContact O-N 2.85Å; K1148-K1151 PolarHBondContact O-N 2.81Å; K1148-A1152 PolarHBondContact O-N 3.39Å
1149A83Confident75.3Confident0 Ų052.6 Ų52.60%027%0.273CS..Hα-helixtrans-57-46.7175.400000111.5Y1111 L1133 V1137 F1145 V1146 K1151 A1152 Y1153Y1111-A1149 HydrophobicContact CD2-CB 3.7Å; Y1111-A1149 HydrophobicContact CE2-CB 3.8Å; Y1111-A1149 HydrophobicContact CG-CB 4.43Å; L1133-A1149 HydrophobicContact CD1-CB 3.72Å; V1137-A1149 HydrophobicContact CG2-CB 3.74Å; F1145-A1149 WeakPolarHBondContact O-CB 3.18Å; F1145-A1149 PolarHBondContact O-N 3.2Å; V1146-A1149 PolarHBondContact O-N 3.41Å; A1149-K1151 PolarHBondContact O-N 2.75Å; A1149-A1152 PolarHBondContact O-N 2.99Å; A1149-Y1153 PolarHBondContact O-N 3.01Å
1150V75.2Confident75.2Confident11 Ų1147.2 Ų47.27%0.06725%0.248CC..Hα-helixtrans-60-45.6176.2172.80000111.9V1137 V1146 K1148 A1152 Y1153 I1154 A1195 V1233V1137-V1150 HydrophobicContact CG1-CG2 4.32Å; V1137-V1150 HydrophobicContact CG2-CG2 4.34Å; V1146-V1150 HydrophobicContact CG1-CG2 4.16Å; V1146-V1150 WeakPolarHBondContact O-CB 3.33Å; V1146-V1150 WeakPolarHBondContact O-CG2 3.45Å; V1146-V1150 PolarHBondContact O-N 3.21Å; K1148-V1150 VanDerWaalsContact C-N 3.34Å; K1148-V1150 PolarHBondContact O-N 2.85Å; V1150-A1152 VanDerWaalsContact C-N 3.32Å; V1150-A1152 PolarHBondContact O-N 2.99Å; V1150-Y1153 PolarHBondContact O-N 3.43Å; V1150-I1154 HydrophobicContact CG1-CD1 3.69Å; V1150-I1154 HydrophobicContact CG1-CG1 4.4Å; V1150-I1154 VanDerWaalsContact O-CG1 3.27Å; V1150-I1154 WeakPolarHBondContact O-CG1 3.26Å; V1150-I1154 PolarHBondContact O-N 2.98Å; V1150-A1195 HydrophobicContact CG2-CB 3.24Å; V1150-V1233 HydrophobicContact CG1-CG1 4.37Å
1151K75.2Confident74.4Confident88 Ų8852.7 Ų52.738%0.38327%0.268SS..Hα-helixtrans-62.9-39.1178.1-75-179.8178.6-171.10112.3A1115 R1147 K1148 A1149 A1155A1115-K1151 HydrophobicContact CB-CB 3.74Å; R1147-K1151 WeakPolarHBondContact O-CG 3.37Å; R1147-K1151 PolarHBondContact O-N 2.91Å; K1148-K1151 PolarHBondContact O-N 2.81Å; A1149-K1151 PolarHBondContact O-N 2.75Å; K1151-A1155 WeakPolarHBondContact O-CB 3.43Å; K1151-A1155 PolarHBondContact O-N 2.9Å
1152A80.4Confident74.1Confident0 Ų045.3 Ų45.30%024%0.236CC..Hα-helixtrans-66-45.4175.500000111.8Y1111 L1114 K1148 A1149 V1150 I1154 A1155 H1156Y1111-A1152 HydrophobicContact CD1-CB 4.08Å; Y1111-A1152 HydrophobicContact CG-CB 4.26Å; L1114-A1152 HydrophobicContact CB-CB 3.8Å; L1114-A1152 HydrophobicContact CD1-CB 4.29Å; K1148-A1152 PolarHBondContact O-N 3.39Å; A1149-A1152 PolarHBondContact O-N 2.99Å; V1150-A1152 VanDerWaalsContact C-N 3.32Å; V1150-A1152 PolarHBondContact O-N 2.99Å; A1152-I1154 PolarHBondContact O-N 3.38Å; A1152-A1155 PolarHBondContact O-N 3.48Å; A1152-H1156 PolarHBondContact O-N 3.49Å
1153Y75.7Confident73.4Confident22 Ų2250 Ų509%0.08626%0.255CS..Hα-helixtrans-58.9-47176.6-173-86.9000111.5L1133 A1149 V1150 H1156 S1157 M1160 L1199 A1202 H1203L1133-Y1153 HydrophobicContact CD2-CD2 3.77Å; L1133-Y1153 HydrophobicContact CD2-CG 4.44Å; L1133-Y1153 HydrophobicContact CG-CD2 4.35Å; A1149-Y1153 PolarHBondContact O-N 3.01Å; V1150-Y1153 PolarHBondContact O-N 3.43Å; Y1153-H1156 CarbonylContact O-C 3.37Å; Y1153-H1156 PolarHBondContact O-N 2.97Å; Y1153-S1157 WeakPolarHBondContact O-CA 3.4Å; Y1153-S1157 WeakPolarHBondContact O-CB 3.42Å; Y1153-S1157 PolarHBondContact O-N 3.3Å; Y1153-M1160 HydrophobicContact CD2-CB 4.39Å; Y1153-M1160 HydrophobicContact CD2-CG 4.08Å; Y1153-M1160 HydrophobicContact CE2-CB 3.76Å; Y1153-M1160 HydrophobicContact CE2-CG 3.97Å; Y1153-L1199 HydrophobicContact CD1-CD2 4.06Å; Y1153-L1199 HydrophobicContact CD2-CD2 4.17Å; Y1153-L1199 HydrophobicContact CE1-CD2 3.62Å; Y1153-L1199 HydrophobicContact CE2-CD2 3.74Å; Y1153-L1199 HydrophobicContact CG-CD2 4.33Å; Y1153-L1199 VanDerWaalsContact CZ-CD2 3.47Å; Y1153-A1202 HydrophobicContact CE1-CB 4.47Å; Y1153-H1203 PolarHBondContact OH-CE1 3.41Å; Y1153-H1203 VanDerWaalsContact OH-CE1 3.25Å
1154I68.6Low73.1Confident32 Ų3250.2 Ų50.216%0.16426%0.259CS..Hα-helixtrans-62.7-49179.5-68.3167.5000111.1V1150 A1152 H1156 S1157 T1198 V1233 K1236V1150-I1154 HydrophobicContact CG1-CD1 3.69Å; V1150-I1154 HydrophobicContact CG1-CG1 4.4Å; V1150-I1154 VanDerWaalsContact O-CG1 3.27Å; V1150-I1154 WeakPolarHBondContact O-CG1 3.26Å; V1150-I1154 PolarHBondContact O-N 2.98Å; A1152-I1154 PolarHBondContact O-N 3.38Å; I1154-H1156 PolarHBondContact O-N 3.35Å; I1154-H1156 VanDerWaalsContact O-N 3.17Å; I1154-S1157 PolarHBondContact O-N 3.33Å; I1154-T1198 HydrophobicContact CD1-CG2 3.94Å; I1154-T1198 HydrophobicContact CG1-CG2 3.58Å; I1154-V1233 HydrophobicContact CD1-CG1 4.1Å; I1154-K1236 HydrophobicContact CG2-CD 4.26Å
1155A70.2Confident72.6Confident36 Ų3645.9 Ų45.930%0.29824%0.237SC..Hα-helixtrans-59.9-27.6-17700000113.1L1118 K1151 A1152L1118-A1155 HydrophobicContact CD2-CB 4.28Å; K1151-A1155 WeakPolarHBondContact O-CB 3.43Å; K1151-A1155 PolarHBondContact O-N 2.9Å; A1152-A1155 PolarHBondContact O-N 3.48Å
1156H75.7Confident71.6Confident19 Ų1950.9 Ų50.99%0.08826%0.256CS..THydrogen-bonded Turntrans-125.525.5-174.5-63.4-75.3000113.2L1114 N1117 F1125 A1152 Y1153 I1154 A1158 G1159 M1160L1114-H1156 PolarHBondContact O-CD2 2.94Å; L1114-H1156 PolarHBondContact O-NE2 2.93Å; N1117-H1156 PolarHBondContact O-CE1 3.43Å; N1117-H1156 PolarHBondContact O-NE2 2.86Å; F1125-H1156 HydrophobicContact CE2-CB 3.83Å; F1125-H1156 HydrophobicContact CZ-CB 4.13Å; A1152-H1156 PolarHBondContact O-N 3.49Å; Y1153-H1156 CarbonylContact O-C 3.37Å; Y1153-H1156 PolarHBondContact O-N 2.97Å; I1154-H1156 PolarHBondContact O-N 3.35Å; I1154-H1156 VanDerWaalsContact O-N 3.17Å; H1156-A1158 PolarHBondContact O-N 2.73Å; H1156-A1158 VanDerWaalsContact O-N 3.12Å; H1156-G1159 PolarHBondContact O-N 3.04Å; H1156-M1160 HydrophobicContact CB-CE 4.3Å; H1156-M1160 WeakPolarHBondContact O-CG 3.41Å
1157S70.1Confident71Confident37 Ų3753.8 Ų53.826%0.25928%0.28SS..G310 helixtrans-58.1-30-171.861.10000114.2Y1153 I1154 G1159 M1160Y1153-S1157 WeakPolarHBondContact O-CA 3.4Å; Y1153-S1157 WeakPolarHBondContact O-CB 3.42Å; Y1153-S1157 PolarHBondContact O-N 3.3Å; I1154-S1157 PolarHBondContact O-N 3.33Å; S1157-G1159 VanDerWaalsContact C-N 3.34Å; S1157-G1159 PolarHBondContact O-N 3.39Å; S1157-M1160 PolarHBondContact O-N 2.75Å
1158A66.7Low70.5Confident76 Ų7652 Ų5263%0.62828%0.276SS*.G310 helixtrans-60.4-40.5176.500000112.6H1156 M1160H1156-A1158 PolarHBondContact O-N 2.73Å; H1156-A1158 VanDerWaalsContact O-N 3.12Å; A1158-M1160 VanDerWaalsContact C-N 3.35Å; A1158-M1160 PolarHBondContact O-N 3.06Å
1159G71.6Confident69.4Low6 Ų649.4 Ų49.46%0.06227%0.265CS..G310 helixtrans-83-4.4-178.700000115.1D1123 F1125 H1156 S1157D1123-G1159 WeakPolarHBondContact O-CA 3.47Å; F1125-G1159 PolarHBondContact N-O 3.45Å; H1156-G1159 PolarHBondContact O-N 3.04Å; S1157-G1159 VanDerWaalsContact C-N 3.34Å; S1157-G1159 PolarHBondContact O-N 3.39Å
1160M71.9Confident68.6Low5 Ų552 Ų523%0.02528%0.279CS..G310 helixtrans-92.910.6-176.8-61.8-7017900113.7F1125 F1129 Q1130 L1133 Y1153 H1156 S1157 A1158 S1162F1125-M1160 HydrophobicContact CB-SD 4.06Å; F1125-M1160 HydrophobicContact CD1-CE 4.13Å; F1125-M1160 HydrophobicContact CD2-CE 3.81Å; F1125-M1160 HydrophobicContact CD2-SD 3.98Å; F1125-M1160 HydrophobicContact CE1-CE 4.23Å; F1125-M1160 HydrophobicContact CE2-CE 3.94Å; F1125-M1160 HydrophobicContact CG-CE 3.92Å; F1125-M1160 HydrophobicContact CG-SD 3.95Å; F1125-M1160 HydrophobicContact CZ-CE 4.14Å; F1129-M1160 HydrophobicContact CE1-CE 3.97Å; Q1130-M1160 HydrophobicContact CG-SD 4.11Å; Q1130-M1160 PolarHBondContact OE1-O 3.47Å; L1133-M1160 HydrophobicContact CD2-CE 3.64Å; L1133-M1160 HydrophobicContact CD2-SD 3.97Å; Y1153-M1160 HydrophobicContact CD2-CB 4.39Å; Y1153-M1160 HydrophobicContact CD2-CG 4.08Å; Y1153-M1160 HydrophobicContact CE2-CB 3.76Å; Y1153-M1160 HydrophobicContact CE2-CG 3.97Å; H1156-M1160 HydrophobicContact CB-CE 4.3Å; H1156-M1160 WeakPolarHBondContact O-CG 3.41Å; S1157-M1160 PolarHBondContact O-N 2.75Å; A1158-M1160 VanDerWaalsContact C-N 3.35Å; A1158-M1160 PolarHBondContact O-N 3.06Å; M1160-S1162 PolarHBondContact O-N 3.46Å
1161K63.3Low68.3Low143 Ų14356.8 Ų56.862%0.62230%0.3SS*.  trans-97.446.5-169.6-61.5178.6-178.6173.60113.9
1162S67.2Low67.7Low18 Ų1856.6 Ų56.613%0.12630%0.297CS..  trans-65.7143.5170.371.50000110.2Q1130 M1160 I1164 G1165 R1166Q1130-S1162 VanDerWaalsContact OE1-CB 3.27Å; Q1130-S1162 PolarHBondContact OE1-OG 2.95Å; M1160-S1162 PolarHBondContact O-N 3.46Å; S1162-I1164 VanDerWaalsContact C-N 3.31Å; S1162-I1164 PolarHBondContact O-N 3.37Å; S1162-G1165 PolarHBondContact O-N 3.05Å; S1162-G1165 WeakPolarHBondContact OG-CA 3.42Å; S1162-G1165 PolarHBondContact OG-N 2.93Å; S1162-R1166 WeakPolarHBondContact O-CB 3.37Å; S1162-R1166 PolarHBondContact O-N 3.31Å
1163E65.8Low67Low176 Ų17656.7 Ų56.782%0.82230%0.298SS*.Hα-helixtrans-61-41-177.2-159172.2-160.800111.9R1166 A1167E1163-R1166 PolarHBondContact O-N 2.94Å; E1163-A1167 PolarHBondContact O-N 3.28Å
1164I62.6Low66.5Low110 Ų11059.2 Ų59.256%0.56431%0.31SS*.Hα-helixtrans-64.2-47.3173.9-61.4169.2000110.9S1162 R1166 A1167 E1168S1162-I1164 VanDerWaalsContact C-N 3.31Å; S1162-I1164 PolarHBondContact O-N 3.37Å; I1164-R1166 VanDerWaalsContact C-N 3.28Å; I1164-R1166 PolarHBondContact O-N 3.38Å; I1164-A1167 PolarHBondContact O-N 3.36Å; I1164-E1168 PolarHBondContact O-N 2.88Å; I1164-E1168 VanDerWaalsContact O-N 3.12Å
1165G62.6Low66.4Low6 Ų665.6 Ų65.66%0.06233%0.332CS..Hα-helixtrans-62.6-35.7178.400000112.3S1162 T1169S1162-G1165 PolarHBondContact O-N 3.05Å; S1162-G1165 WeakPolarHBondContact OG-CA 3.42Å; S1162-G1165 PolarHBondContact OG-N 2.93Å; G1165-T1169 WeakPolarHBondContact O-CB 3.35Å; G1165-T1169 PolarHBondContact O-N 3.44Å; G1165-T1169 PolarHBondContact O-OG1 3.42Å
1166R62.5Low65.9Low117 Ų11765.4 Ų65.444%0.44233%0.328SS..Hα-helixtrans-63.7-47.2176.1-167.2-171.6178.9169.6-1.2111.7S1162 E1163 I1164 T1169 L1170S1162-R1166 WeakPolarHBondContact O-CB 3.37Å; S1162-R1166 PolarHBondContact O-N 3.31Å; E1163-R1166 PolarHBondContact O-N 2.94Å; I1164-R1166 VanDerWaalsContact C-N 3.28Å; I1164-R1166 PolarHBondContact O-N 3.38Å; R1166-T1169 PolarHBondContact O-N 3.26Å; R1166-L1170 HydrophobicContact CG-CD1 4.32Å; R1166-L1170 WeakPolarHBondContact O-CB 3.49Å; R1166-L1170 WeakPolarHBondContact O-CG 3.49Å; R1166-L1170 PolarHBondContact O-N 3.33Å
1167A66.2Low65.1Low63 Ų6366.4 Ų66.452%0.52133%0.333SS..Hα-helixtrans-64.6-46.7-179.400000112.3E1163 I1164 L1170 Q1171E1163-A1167 PolarHBondContact O-N 3.28Å; I1164-A1167 PolarHBondContact O-N 3.36Å; A1167-L1170 PolarHBondContact O-N 2.93Å; A1167-Q1171 PolarHBondContact O-N 3.41Å
1168E62.9Low64.8Low62 Ų6270.2 Ų70.229%0.2935%0.35SS..Hα-helixtrans-64.4-40.7175.4-89.7-177149.900112.4R1131 I1164 Q1171 R1172R1131-E1168 WeakPolarHBondContact CD-OE2 3.3Å; R1131-E1168 WeakPolarHBondContact CG-OE2 3.34Å; I1164-E1168 PolarHBondContact O-N 2.88Å; I1164-E1168 VanDerWaalsContact O-N 3.12Å; E1168-Q1171 PolarHBondContact O-N 3Å; E1168-R1172 WeakPolarHBondContact O-CG 3.38Å; E1168-R1172 PolarHBondContact O-N 3.33Å
1169T61.4Low64.5Low10 Ų1069.5 Ų69.56%0.06135%0.35CS..Hα-helixtrans-60.5-47.2176.8-59.10000110.6L1134 G1165 R1166 Q1171 R1172 L1173 H1203L1134-T1169 HydrophobicContact CD1-CG2 3.73Å; L1134-T1169 HydrophobicContact CD2-CG2 4.3Å; L1134-T1169 VanDerWaalsContact CD2-OG1 3.29Å; L1134-T1169 WeakPolarHBondContact CD2-OG1 3.35Å; G1165-T1169 WeakPolarHBondContact O-CB 3.35Å; G1165-T1169 PolarHBondContact O-N 3.44Å; G1165-T1169 PolarHBondContact O-OG1 3.42Å; R1166-T1169 PolarHBondContact O-N 3.26Å; T1169-Q1171 PolarHBondContact O-N 3.41Å; T1169-R1172 PolarHBondContact O-N 3.29Å; T1169-L1173 HydrophobicContact CG2-CD1 3.62Å; T1169-L1173 HydrophobicContact CG2-CG 4.15Å; T1169-L1173 VanDerWaalsContact O-CB 3.28Å; T1169-L1173 WeakPolarHBondContact O-CB 3.18Å; T1169-L1173 WeakPolarHBondContact O-CD1 3.48Å; T1169-L1173 WeakPolarHBondContact O-CG 3.21Å; T1169-L1173 PolarHBondContact O-N 3.31Å; T1169-H1203 VanDerWaalsContact CG2-CE1 3.42Å; T1169-H1203 WeakPolarHBondContact CG2-CE1 3.15Å
1170L65.8Low63.9Low56 Ų5674.3 Ų74.329%0.29337%0.366SS..Hα-helixtrans-59.1-45175-78.2168.1000111.9R1166 A1167 R1172 L1173 Q1174 H1203R1166-L1170 HydrophobicContact CG-CD1 4.32Å; R1166-L1170 WeakPolarHBondContact O-CB 3.49Å; R1166-L1170 WeakPolarHBondContact O-CG 3.49Å; R1166-L1170 PolarHBondContact O-N 3.33Å; A1167-L1170 PolarHBondContact O-N 2.93Å; L1170-R1172 PolarHBondContact O-N 3.18Å; L1170-L1173 PolarHBondContact O-N 3.42Å; L1170-Q1174 WeakPolarHBondContact O-CB 3.32Å; L1170-Q1174 PolarHBondContact O-N 3.34Å; L1170-H1203 HydrophobicContact CD2-CB 3.61Å; L1170-H1203 HydrophobicContact CG-CB 3.96Å
1171Q67.8Low62.9Low110 Ų11076.9 Ų76.951%0.51438%0.384SS..Hα-helixtrans-64.1-41.6179.8-163.6-177.626.200112.5A1167 E1168 T1169 R1175A1167-Q1171 PolarHBondContact O-N 3.41Å; E1168-Q1171 PolarHBondContact O-N 3Å; T1169-Q1171 PolarHBondContact O-N 3.41Å; Q1171-R1175 WeakPolarHBondContact O-CG 3.27Å; Q1171-R1175 PolarHBondContact O-N 3.29Å; Q1171-R1175 VanDerWaalsContact O-N 3.13Å
1172R64Low62.3Low85 Ų8577.6 Ų77.632%0.32139%0.389SS..Hα-helixtrans-69-42.4176.5-72.8-178.5177.3-143.2-5.6112L1138 E1139 E1168 T1169 L1170 Q1174 R1175 C1176L1138-R1172 HydrophobicContact CD1-CB 3.96Å; E1139-R1172 IonicContact OE1-CZ 3.51Å; E1139-R1172 IonicContact OE1-NH1 2.72Å; E1139-R1172 PolarHBondContact OE1-NH1 2.92Å; E1139-R1172 IonicContact OE1-NH2 3.23Å; E1168-R1172 WeakPolarHBondContact O-CG 3.38Å; E1168-R1172 PolarHBondContact O-N 3.33Å; T1169-R1172 PolarHBondContact O-N 3.29Å; L1170-R1172 PolarHBondContact O-N 3.18Å; R1172-Q1174 VanDerWaalsContact C-N 3.33Å; R1172-Q1174 PolarHBondContact O-N 2.79Å; R1172-R1175 PolarHBondContact O-N 2.95Å; R1172-C1176 PolarHBondContact O-N 2.79Å
1173L64.2Low61.4Low1 Ų182.3 Ų82.31%0.00541%0.409CS..Hα-helixtrans-60.5-43174.8-74.1168.6000111.2T1169 L1170 C1176 K1177 Y1196 L1199 F1200 H1203T1169-L1173 HydrophobicContact CG2-CD1 3.62Å; T1169-L1173 HydrophobicContact CG2-CG 4.15Å; T1169-L1173 VanDerWaalsContact O-CB 3.28Å; T1169-L1173 WeakPolarHBondContact O-CB 3.18Å; T1169-L1173 WeakPolarHBondContact O-CD1 3.48Å; T1169-L1173 WeakPolarHBondContact O-CG 3.21Å; T1169-L1173 PolarHBondContact O-N 3.31Å; L1170-L1173 PolarHBondContact O-N 3.42Å; L1173-C1176 PolarHBondContact O-N 3.46Å; L1173-K1177 PolarHBondContact O-N 3.48Å; L1173-Y1196 HydrophobicContact CB-CE2 4.46Å; L1173-Y1196 HydrophobicContact CD2-CD2 3.55Å; L1173-Y1196 HydrophobicContact CD2-CE2 3.5Å; L1173-Y1196 VanDerWaalsContact CD2-CE2 3.5Å; L1173-Y1196 HydrophobicContact CD2-CG 4.44Å; L1173-Y1196 PolarHBondContact O-OH 3.03Å; L1173-L1199 HydrophobicContact CD1-CB 4.3Å; L1173-L1199 HydrophobicContact CD2-CB 4.05Å; L1173-F1200 HydrophobicContact CB-CD2 4.37Å; L1173-F1200 HydrophobicContact CD1-CB 4.49Å; L1173-F1200 HydrophobicContact CD1-CD2 4.49Å; L1173-F1200 HydrophobicContact CD2-CB 4.32Å; L1173-H1203 HydrophobicContact CD1-CB 4.32Å
1174Q66.5Low60.5Low75 Ų7574.9 Ų74.935%0.3538%0.375SS..Hα-helixtrans-61.5-46.2177.4-161.873.45.800111.5L1170 R1172 C1176 K1177 D1178L1170-Q1174 WeakPolarHBondContact O-CB 3.32Å; L1170-Q1174 PolarHBondContact O-N 3.34Å; R1172-Q1174 VanDerWaalsContact C-N 3.33Å; R1172-Q1174 PolarHBondContact O-N 2.79Å; Q1174-C1176 VanDerWaalsContact C-N 3.3Å; Q1174-C1176 PolarHBondContact O-N 2.91Å; Q1174-K1177 WeakPolarHBondContact O-CB 3.17Å; Q1174-K1177 PolarHBondContact O-N 2.76Å; Q1174-K1177 VanDerWaalsContact O-N 3.14Å; Q1174-D1178 WeakPolarHBondContact O-CB 3.44Å; Q1174-D1178 PolarHBondContact O-N 3.01Å
1175R65.4Low59.7Low166 Ų16676.9 Ų76.963%0.62638%0.38SS*.Hα-helixtrans-59.8-38.8174.7-71.5-177.4-164.9172.86.2112.7Q1171 R1172 G1179Q1171-R1175 WeakPolarHBondContact O-CG 3.27Å; Q1171-R1175 PolarHBondContact O-N 3.29Å; Q1171-R1175 VanDerWaalsContact O-N 3.13Å; R1172-R1175 PolarHBondContact O-N 2.95Å; R1175-G1179 PolarHBondContact O-N 3.2Å
1176C60.4Low58.8Low32 Ų3283 Ų8322%0.21641%0.41CS..Hα-helixtrans-68.2-39175.1-77.40000112.4R1172 L1173 Q1174 R1180 Y1196R1172-C1176 PolarHBondContact O-N 2.79Å; L1173-C1176 PolarHBondContact O-N 3.46Å; Q1174-C1176 VanDerWaalsContact C-N 3.3Å; Q1174-C1176 PolarHBondContact O-N 2.91Å; C1176-R1180 WeakPolarHBondContact O-CB 3.31Å; C1176-R1180 PolarHBondContact O-N 2.97Å; C1176-Y1196 HydrophobicContact CB-CD2 4.26Å; C1176-Y1196 HydrophobicContact CB-CE2 3.63Å
1177K58.4Low57.8Low41 Ų4185.7 Ų85.718%0.17842%0.422CS..Hα-helixtrans-58.6-54.4172.8-172.8178.5169.5179.30110.4L1173 Q1174 G1179 R1180 C1181 Y1196 F1200 S1211L1173-K1177 PolarHBondContact O-N 3.48Å; Q1174-K1177 WeakPolarHBondContact O-CB 3.17Å; Q1174-K1177 PolarHBondContact O-N 2.76Å; Q1174-K1177 VanDerWaalsContact O-N 3.14Å; K1177-G1179 VanDerWaalsContact C-N 3.3Å; K1177-G1179 PolarHBondContact O-N 3.45Å; K1177-R1180 PolarHBondContact O-N 3.34Å; K1177-C1181 PolarHBondContact O-N 2.93Å; K1177-Y1196 WeakPolarHBondContact CA-OH 3.48Å; K1177-Y1196 WeakPolarHBondContact CB-OH 3.22Å; K1177-Y1196 PolarHBondContact N-OH 3.45Å; K1177-F1200 HydrophobicContact CD-CE2 4.29Å; K1177-F1200 HydrophobicContact CD-CZ 4.27Å; K1177-S1211 PolarHBondContact NZ-OG 2.9Å
1178D64.4Low56.9Low117 Ų11784 Ų8463%0.62641%0.406SS*.Hα-helixtrans-64.3-34.9-176.3-61.6-19.4000111.7Q1174Q1174-D1178 WeakPolarHBondContact O-CB 3.44Å; Q1174-D1178 PolarHBondContact O-N 3.01Å
1179G61Low56.4Low60 Ų6085.9 Ų85.962%0.61942%0.422SS*.Hα-helixtrans-88.3-19.4-17800000116.6R1175 K1177R1175-G1179 PolarHBondContact O-N 3.2Å; K1177-G1179 VanDerWaalsContact C-N 3.3Å; K1177-G1179 PolarHBondContact O-N 3.45Å
1180R57.1Low56.2Low107 Ų10787 Ų8740%0.40443%0.431SS..Hα-helixtrans-128.613.4-170.4-63.9-171-178.3163.92.8115.7C1176 K1177 E1182 Q1183 L1184C1176-R1180 WeakPolarHBondContact O-CB 3.31Å; C1176-R1180 PolarHBondContact O-N 2.97Å; K1177-R1180 PolarHBondContact O-N 3.34Å; R1180-E1182 PolarHBondContact O-N 3.39Å; R1180-Q1183 PolarHBondContact O-N 2.84Å; R1180-Q1183 VanDerWaalsContact O-N 3.17Å; R1180-L1184 HydrophobicContact CB-CD1 3.93Å; R1180-L1184 HydrophobicContact CB-CG 4.15Å; R1180-L1184 WeakPolarHBondContact O-CB 3.41Å; R1180-L1184 PolarHBondContact O-N 2.79Å
1181C51Low55.7Low59 Ų5985.6 Ų85.640%0.39943%0.426SS..THydrogen-bonded Turntrans-51.9-32-178.7-109.40000114.2K1177K1177-C1181 PolarHBondContact O-N 2.93Å
1182E50.9Low55.4Low158 Ų15884.1 Ų84.174%0.73842%0.416SS*.THydrogen-bonded Turntrans-89.5-41.1174.1-70.7-140.9146.900114.3R1180 L1184 K1185 L1186R1180-E1182 PolarHBondContact O-N 3.39Å; E1182-L1184 VanDerWaalsContact C-N 3.26Å; E1182-L1184 PolarHBondContact O-N 3.21Å; E1182-K1185 PolarHBondContact O-N 3.43Å; E1182-K1185 VanDerWaalsContact O-N 3.13Å; E1182-L1186 PolarHBondContact O-N 2.98Å
1183Q48.8Very low55.2Low117 Ų11780.5 Ų80.555%0.54740%0.403SS..Hα-helixtrans-64.5-31.4-179-74.9-176.4-10.500112.9R1180 K1185 L1186 Y1187R1180-Q1183 PolarHBondContact O-N 2.84Å; R1180-Q1183 VanDerWaalsContact O-N 3.17Å; Q1183-K1185 VanDerWaalsContact C-N 3.31Å; Q1183-K1185 PolarHBondContact O-N 3.2Å; Q1183-L1186 PolarHBondContact O-N 3.29Å; Q1183-Y1187 PolarHBondContact O-N 3.34Å
1184L46Very low54.9Low20 Ų2080.9 Ų80.911%0.10541%0.405CS..Hα-helixtrans-66.2-32176.3-79.1159.6000112.1R1180 E1182 C1188 T1193 Y1196 W1214R1180-L1184 HydrophobicContact CB-CD1 3.93Å; R1180-L1184 HydrophobicContact CB-CG 4.15Å; R1180-L1184 WeakPolarHBondContact O-CB 3.41Å; R1180-L1184 PolarHBondContact O-N 2.79Å; E1182-L1184 VanDerWaalsContact C-N 3.26Å; E1182-L1184 PolarHBondContact O-N 3.21Å; L1184-C1188 PolarHBondContact O-N 3.36Å; L1184-C1188 PolarHBondContact O-SG 2.91Å; L1184-T1193 HydrophobicContact CD2-CG2 3.98Å; L1184-Y1196 HydrophobicContact CD1-CE1 4.49Å; L1184-W1214 HydrophobicContact CB-CZ2 4.26Å; L1184-W1214 HydrophobicContact CD1-CH2 3.95Å; L1184-W1214 HydrophobicContact CD1-CZ2 4.06Å
1185K45.9Very low54.6Low152 Ų15277.4 Ų77.466%0.66139%0.389SS*.Hα-helixtrans-68-38.8173.4-73.2-176.1174.3-176.60112.2E1182 Q1183E1182-K1185 PolarHBondContact O-N 3.43Å; E1182-K1185 VanDerWaalsContact O-N 3.13Å; Q1183-K1185 VanDerWaalsContact C-N 3.31Å; Q1183-K1185 PolarHBondContact O-N 3.2Å
1186L44.6Very low54.5Low134 Ų13470.1 Ų70.170%0.70236%0.362SS*.Hα-helixtrans-82-33.2-177.2-91.5131.9000114E1182 Q1183E1182-L1186 PolarHBondContact O-N 2.98Å; Q1183-L1186 PolarHBondContact O-N 3.29Å
1187Y41.6Very low54.7Low175 Ų17568.7 Ų68.769%0.68635%0.352SS*.  trans-118.741.4-175.9-68.3-82.2000112.9Q1183 V1189Q1183-Y1187 PolarHBondContact O-N 3.34Å; Y1187-V1189 PolarHBondContact O-N 3.41Å
1188C47.1Very low54.8Low28 Ų2866.9 Ų66.919%0.18934%0.344CS..THydrogen-bonded Turntrans-61.513.1178.4-110.70000115.6L1184 I1222L1184-C1188 PolarHBondContact O-N 3.36Å; L1184-C1188 PolarHBondContact O-SG 2.91Å; C1188-I1222 HydrophobicContact CB-CG1 4.1Å
1189V52.5Low54.8Low101 Ų10161.5 Ų61.561%0.61232%0.316SS*.THydrogen-bonded Turntrans-98-5.9-162.4-173.20000114.1Y1187Y1187-V1189 PolarHBondContact O-N 3.41Å
1190A57Low55Low32 Ų3259 Ų5926%0.26429%0.288SS..SBendtrans-106149.2-17000000115.6R1192 T1193A1190-R1192 PolarHBondContact O-N 3.22Å; A1190-T1193 WeakPolarHBondContact O-CB 3.42Å; A1190-T1193 PolarHBondContact O-N 2.95Å
1191P55.9Low55.4Low28 Ų2854 Ų5418%0.18227%0.269CS..Hα-helixtrans-49.8-26.9170.5-27.233.8000114.8E1143 V1146 A1195E1143-P1191 HydrophobicContact CB-CG 4.25Å; E1143-P1191 HydrophobicContact CG-CG 4.34Å; V1146-P1191 HydrophobicContact CG1-CB 4.13Å; P1191-A1195 WeakPolarHBondContact O-CB 3.46Å; P1191-A1195 PolarHBondContact O-N 3.45Å
1192R60.2Low55.9Low79 Ų7952.1 Ų52.130%0.29826%0.258SS..Hα-helixtrans-62-40.3174.1-81.5178.9172.1179.4-12112.9E1139 C1140 V1146 A1190 A1195 Y1196E1139-R1192 PolarHBondContact O-NH2 2.96Å; C1140-R1192 PolarHBondContact O-NE 2.91Å; C1140-R1192 PolarHBondContact O-NH2 3.42Å; V1146-R1192 HydrophobicContact CG1-CG 4.18Å; V1146-R1192 HydrophobicContact CG2-CG 4.26Å; A1190-R1192 PolarHBondContact O-N 3.22Å; R1192-A1195 WeakPolarHBondContact O-CB 3.47Å; R1192-A1195 PolarHBondContact O-N 3.38Å; R1192-Y1196 WeakPolarHBondContact O-CB 3.31Å; R1192-Y1196 PolarHBondContact O-N 3.14Å
1193T60.8Low56.5Low8 Ų845 Ų455%0.04922%0.224CC..Hα-helixtrans-64.6-44.2-178.2-58.50000110.8L1184 A1190 Y1196 F1197 I1222L1184-T1193 HydrophobicContact CD2-CG2 3.98Å; A1190-T1193 WeakPolarHBondContact O-CB 3.42Å; A1190-T1193 PolarHBondContact O-N 2.95Å; T1193-Y1196 WeakPolarHBondContact O-CB 3.37Å; T1193-Y1196 PolarHBondContact O-N 2.9Å; T1193-F1197 HydrophobicContact CG2-CD2 3.98Å; T1193-F1197 HydrophobicContact CG2-CE2 3.38Å; T1193-F1197 HydrophobicContact CG2-CZ 4.05Å; T1193-F1197 WeakPolarHBondContact O-CD2 3.33Å; T1193-F1197 WeakPolarHBondContact O-CG 3.35Å; T1193-F1197 PolarHBondContact O-N 3Å; T1193-I1222 HydrophobicContact CG2-CD1 3.83Å
1194V58.2Low57.1Low10 Ų1040.2 Ų40.26%0.06120%0.203CC..Hα-helixtrans-64.5-41174.6172.90000112F1197 T1198 T1230 V1233V1194-F1197 PolarHBondContact O-N 2.95Å; V1194-T1198 PolarHBondContact O-N 2.96Å; V1194-T1198 PolarHBondContact O-OG1 3.03Å; V1194-T1230 HydrophobicContact CG2-CG2 4.19Å; V1194-V1233 HydrophobicContact CB-CG1 4.46Å; V1194-V1233 HydrophobicContact CG1-CB 3.32Å; V1194-V1233 HydrophobicContact CG1-CG1 3Å; V1194-V1233 HydrophobicContact CG1-CG2 4.3Å
1195A59.7Low57.7Low2 Ų244.6 Ų44.62%0.01722%0.223CC..Hα-helixtrans-61.1-45174.800000112.3V1137 V1146 V1150 P1191 R1192 T1198 L1199V1137-A1195 HydrophobicContact CG1-CB 3.51Å; V1146-A1195 HydrophobicContact CG1-CB 4.42Å; V1150-A1195 HydrophobicContact CG2-CB 3.24Å; P1191-A1195 WeakPolarHBondContact O-CB 3.46Å; P1191-A1195 PolarHBondContact O-N 3.45Å; R1192-A1195 WeakPolarHBondContact O-CB 3.47Å; R1192-A1195 PolarHBondContact O-N 3.38Å; A1195-T1198 WeakPolarHBondContact O-CB 3.5Å; A1195-T1198 PolarHBondContact O-N 3.47Å; A1195-L1199 WeakPolarHBondContact O-CB 3.48Å; A1195-L1199 WeakPolarHBondContact O-CG 3.35Å; A1195-L1199 PolarHBondContact O-N 3.34Å
1196Y63.1Low58Low12 Ų1240.5 Ų40.55%0.04722%0.217CC..Hα-helixtrans-59-48.6175.2176.7-93.6000110.5L1173 C1176 K1177 L1184 R1192 T1193 T1198 L1199 F1200 W1214L1173-Y1196 HydrophobicContact CB-CE2 4.46Å; L1173-Y1196 HydrophobicContact CD2-CD2 3.55Å; L1173-Y1196 HydrophobicContact CD2-CE2 3.5Å; L1173-Y1196 VanDerWaalsContact CD2-CE2 3.5Å; L1173-Y1196 HydrophobicContact CD2-CG 4.44Å; L1173-Y1196 PolarHBondContact O-OH 3.03Å; C1176-Y1196 HydrophobicContact CB-CD2 4.26Å; C1176-Y1196 HydrophobicContact CB-CE2 3.63Å; K1177-Y1196 WeakPolarHBondContact CA-OH 3.48Å; K1177-Y1196 WeakPolarHBondContact CB-OH 3.22Å; K1177-Y1196 PolarHBondContact N-OH 3.45Å; L1184-Y1196 HydrophobicContact CD1-CE1 4.49Å; R1192-Y1196 WeakPolarHBondContact O-CB 3.31Å; R1192-Y1196 PolarHBondContact O-N 3.14Å; T1193-Y1196 WeakPolarHBondContact O-CB 3.37Å; T1193-Y1196 PolarHBondContact O-N 2.9Å; Y1196-T1198 VanDerWaalsContact C-N 3.35Å; Y1196-T1198 PolarHBondContact O-N 3.35Å; Y1196-L1199 PolarHBondContact O-N 2.98Å; Y1196-F1200 HydrophobicContact CE1-CB 4.48Å; Y1196-F1200 WeakPolarHBondContact O-CB 3.49Å; Y1196-F1200 PolarHBondContact O-N 3.44Å; Y1196-W1214 HydrophobicContact CD1-CH2 4.43Å; Y1196-W1214 AromaticContact CE1-CH2 3.74Å; Y1196-W1214 HydrophobicContact CE1-CH2 3.74Å; Y1196-W1214 AromaticContact CE1-CZ3 3.84Å; Y1196-W1214 HydrophobicContact CE1-CZ3 3.84Å
1197F64.5Low58.3Low2 Ų239.2 Ų39.21%0.00922%0.215CC..Hα-helixtrans-59.8-43.2175.1-69.7-49.1000112.8T1193 V1194 L1199 F1200 V1201 W1214 V1215 S1218 I1222 V1237T1193-F1197 HydrophobicContact CG2-CD2 3.98Å; T1193-F1197 HydrophobicContact CG2-CE2 3.38Å; T1193-F1197 HydrophobicContact CG2-CZ 4.05Å; T1193-F1197 WeakPolarHBondContact O-CD2 3.33Å; T1193-F1197 WeakPolarHBondContact O-CG 3.35Å; T1193-F1197 PolarHBondContact O-N 3Å; V1194-F1197 PolarHBondContact O-N 2.95Å; F1197-L1199 PolarHBondContact O-N 3.21Å; F1197-F1200 PolarHBondContact O-N 3.27Å; F1197-V1201 VanDerWaalsContact O-CB 3.32Å; F1197-V1201 WeakPolarHBondContact O-CB 3.38Å; F1197-V1201 VanDerWaalsContact O-CG2 3.24Å; F1197-V1201 WeakPolarHBondContact O-CG2 3.4Å; F1197-V1201 PolarHBondContact O-N 3.13Å; F1197-W1214 HydrophobicContact CD1-CZ3 4.25Å; F1197-W1214 HydrophobicContact CE1-CE3 4.12Å; F1197-W1214 AromaticContact CE1-CH2 3.63Å; F1197-W1214 HydrophobicContact CE1-CH2 3.63Å; F1197-W1214 HydrophobicContact CE1-CZ2 4.37Å; F1197-W1214 AromaticContact CE1-CZ3 3.49Å; F1197-W1214 HydrophobicContact CE1-CZ3 3.49Å; F1197-W1214 VanDerWaalsContact CE1-CZ3 3.49Å; F1197-W1214 HydrophobicContact CZ-CH2 4.15Å; F1197-W1214 HydrophobicContact CZ-CZ3 4.41Å; F1197-V1215 HydrophobicContact CD1-CB 4.31Å; F1197-V1215 HydrophobicContact CD1-CG1 3.96Å; F1197-V1215 HydrophobicContact CD1-CG2 3.92Å; F1197-V1215 HydrophobicContact CE1-CG2 4.19Å; F1197-V1215 HydrophobicContact CG-CG1 4.48Å; F1197-S1218 WeakPolarHBondContact CZ-OG 3.41Å; F1197-I1222 HydrophobicContact CD2-CD1 4.25Å; F1197-I1222 HydrophobicContact CE2-CD1 3.66Å; F1197-V1237 HydrophobicContact CB-CG1 4.11Å; F1197-V1237 HydrophobicContact CB-CG2 4.33Å
1198T61.3Low59.1Low3 Ų333.7 Ų33.72%0.01820%0.195CC..Hα-helixtrans-59.6-48.5176.9-51.30000111.7I1154 V1194 A1195 Y1196 A1202 V1237 L1240I1154-T1198 HydrophobicContact CD1-CG2 3.94Å; I1154-T1198 HydrophobicContact CG1-CG2 3.58Å; V1194-T1198 PolarHBondContact O-N 2.96Å; V1194-T1198 PolarHBondContact O-OG1 3.03Å; A1195-T1198 WeakPolarHBondContact O-CB 3.5Å; A1195-T1198 PolarHBondContact O-N 3.47Å; Y1196-T1198 VanDerWaalsContact C-N 3.35Å; Y1196-T1198 PolarHBondContact O-N 3.35Å; T1198-A1202 VanDerWaalsContact O-CB 3.27Å; T1198-A1202 WeakPolarHBondContact O-CB 3.29Å; T1198-A1202 PolarHBondContact O-N 3.35Å; T1198-V1237 WeakPolarHBondContact OG1-CG2 3.3Å; T1198-L1240 HydrophobicContact CG2-CD1 4.06Å
1199L64.2Low59.5Low4 Ų435.9 Ų35.92%0.02120%0.202CC..Hα-helixtrans-67.4-42.1179.7-74.7170.3000111.9L1134 V1137 L1138 Y1153 L1173 A1195 Y1196 F1197 A1202 H1203L1134-L1199 HydrophobicContact CD1-CD1 3.69Å; L1134-L1199 HydrophobicContact CD1-CD2 3.98Å; L1134-L1199 HydrophobicContact CD1-CG 4.46Å; V1137-L1199 HydrophobicContact CB-CD1 4.26Å; V1137-L1199 HydrophobicContact CG1-CD1 3.5Å; V1137-L1199 VanDerWaalsContact CG1-CD1 3.5Å; L1138-L1199 HydrophobicContact CD2-CD1 4.09Å; L1138-L1199 HydrophobicContact CG-CD1 4.47Å; Y1153-L1199 HydrophobicContact CD1-CD2 4.06Å; Y1153-L1199 HydrophobicContact CD2-CD2 4.17Å; Y1153-L1199 HydrophobicContact CE1-CD2 3.62Å; Y1153-L1199 HydrophobicContact CE2-CD2 3.74Å; Y1153-L1199 HydrophobicContact CG-CD2 4.33Å; Y1153-L1199 VanDerWaalsContact CZ-CD2 3.47Å; L1173-L1199 HydrophobicContact CD1-CB 4.3Å; L1173-L1199 HydrophobicContact CD2-CB 4.05Å; A1195-L1199 WeakPolarHBondContact O-CB 3.48Å; A1195-L1199 WeakPolarHBondContact O-CG 3.35Å; A1195-L1199 PolarHBondContact O-N 3.34Å; Y1196-L1199 PolarHBondContact O-N 2.98Å; F1197-L1199 PolarHBondContact O-N 3.21Å; L1199-A1202 PolarHBondContact O-N 2.99Å; L1199-H1203 PolarHBondContact O-N 2.93Å; L1199-H1203 VanDerWaalsContact O-N 3.13Å; L1199-H1203 PolarHBondContact O-ND1 3.03Å
1200F65.8Low59.8Low9 Ų935.6 Ų35.64%0.03921%0.205CC..Hα-helixtrans-61.8-49178-171-111000111.1L1173 K1177 Y1196 F1197 A1202 H1203 L1204 V1215L1173-F1200 HydrophobicContact CB-CD2 4.37Å; L1173-F1200 HydrophobicContact CD1-CB 4.49Å; L1173-F1200 HydrophobicContact CD1-CD2 4.49Å; L1173-F1200 HydrophobicContact CD2-CB 4.32Å; K1177-F1200 HydrophobicContact CD-CE2 4.29Å; K1177-F1200 HydrophobicContact CD-CZ 4.27Å; Y1196-F1200 HydrophobicContact CE1-CB 4.48Å; Y1196-F1200 WeakPolarHBondContact O-CB 3.49Å; Y1196-F1200 PolarHBondContact O-N 3.44Å; F1197-F1200 PolarHBondContact O-N 3.27Å; F1200-A1202 PolarHBondContact O-N 3.31Å; F1200-H1203 PolarHBondContact O-N 2.93Å; F1200-H1203 VanDerWaalsContact O-N 3.17Å; F1200-L1204 HydrophobicContact CD1-CD1 3.31Å; F1200-L1204 HydrophobicContact CD2-CD1 4.35Å; F1200-L1204 HydrophobicContact CE1-CD1 3.13Å; F1200-L1204 HydrophobicContact CE2-CD1 4.19Å; F1200-L1204 HydrophobicContact CG-CD1 3.94Å; F1200-L1204 HydrophobicContact CZ-CD1 3.6Å; F1200-L1204 WeakPolarHBondContact O-CB 3.39Å; F1200-L1204 PolarHBondContact O-N 3.38Å; F1200-V1215 HydrophobicContact CD1-CG2 3.62Å; F1200-V1215 HydrophobicContact CE1-CG2 3.77Å
1201V63.8Low59.9Low1 Ų134.1 Ų34.11%0.00619%0.193CC..Hα-helixtrans-62.9-40.9174.6170.60000111.9F1197 H1203 V1215 V1237 L1240 L1241 R1244F1197-V1201 VanDerWaalsContact O-CB 3.32Å; F1197-V1201 WeakPolarHBondContact O-CB 3.38Å; F1197-V1201 VanDerWaalsContact O-CG2 3.24Å; F1197-V1201 WeakPolarHBondContact O-CG2 3.4Å; F1197-V1201 PolarHBondContact O-N 3.13Å; V1201-H1203 PolarHBondContact O-N 3.46Å; V1201-V1215 HydrophobicContact CG2-CG1 3.99Å; V1201-V1237 HydrophobicContact CB-CG1 4.17Å; V1201-V1237 HydrophobicContact CG2-CG1 3.63Å; V1201-L1240 HydrophobicContact CG1-CB 3.64Å; V1201-L1241 HydrophobicContact CB-CD2 4.41Å; V1201-L1241 HydrophobicContact CB-CG 4.49Å; V1201-L1241 HydrophobicContact CG1-CD2 3.78Å; V1201-L1241 HydrophobicContact CG1-CG 3.73Å; V1201-L1241 HydrophobicContact CG2-CD1 4.25Å; V1201-L1241 HydrophobicContact CG2-CD2 3.76Å; V1201-L1241 HydrophobicContact CG2-CG 3.86Å; V1201-R1244 PolarHBondContact O-NH1 2.93Å; V1201-R1244 VanDerWaalsContact O-NH1 3.08Å
1202A62.3Low60.2Low19 Ų1933.2 Ų33.216%0.15719%0.186CC..Hα-helixtrans-62.2-25.1177.200000113.1Y1153 T1198 L1199 F1200 R1244Y1153-A1202 HydrophobicContact CE1-CB 4.47Å; T1198-A1202 VanDerWaalsContact O-CB 3.27Å; T1198-A1202 WeakPolarHBondContact O-CB 3.29Å; T1198-A1202 PolarHBondContact O-N 3.35Å; L1199-A1202 PolarHBondContact O-N 2.99Å; F1200-A1202 PolarHBondContact O-N 3.31Å; A1202-R1244 PolarHBondContact O-NH1 3.19Å; A1202-R1244 PolarHBondContact O-NH2 3.35Å
1203H63.5Low60.3Low8 Ų832.1 Ų32.14%0.03719%0.19CC..Hα-helixtrans-109.2-13.3-176.7-68.376.4000114.8Y1153 T1169 L1170 L1173 L1199 F1200 V1201 Q1205Y1153-H1203 PolarHBondContact OH-CE1 3.41Å; Y1153-H1203 VanDerWaalsContact OH-CE1 3.25Å; T1169-H1203 VanDerWaalsContact CG2-CE1 3.42Å; T1169-H1203 WeakPolarHBondContact CG2-CE1 3.15Å; L1170-H1203 HydrophobicContact CD2-CB 3.61Å; L1170-H1203 HydrophobicContact CG-CB 3.96Å; L1173-H1203 HydrophobicContact CD1-CB 4.32Å; L1199-H1203 PolarHBondContact O-N 2.93Å; L1199-H1203 VanDerWaalsContact O-N 3.13Å; L1199-H1203 PolarHBondContact O-ND1 3.03Å; F1200-H1203 PolarHBondContact O-N 2.93Å; F1200-H1203 VanDerWaalsContact O-N 3.17Å; V1201-H1203 PolarHBondContact O-N 3.46Å; H1203-Q1205 PolarHBondContact O-N 3.18Å
1204L62.2Low60.2Low18 Ų1833.8 Ų33.89%0.09420%0.195CC..  trans-52.8133.6-178.7-134.1109.6000112.5F1200 E1208 I1212 R1244F1200-L1204 HydrophobicContact CD1-CD1 3.31Å; F1200-L1204 HydrophobicContact CD2-CD1 4.35Å; F1200-L1204 HydrophobicContact CE1-CD1 3.13Å; F1200-L1204 HydrophobicContact CE2-CD1 4.19Å; F1200-L1204 HydrophobicContact CG-CD1 3.94Å; F1200-L1204 HydrophobicContact CZ-CD1 3.6Å; F1200-L1204 WeakPolarHBondContact O-CB 3.39Å; F1200-L1204 PolarHBondContact O-N 3.38Å; L1204-E1208 HydrophobicContact CD2-CB 4.1Å; L1204-I1212 HydrophobicContact CD2-CD1 3.96Å; L1204-I1212 HydrophobicContact CD2-CG1 3.54Å; L1204-R1244 PolarHBondContact O-NH1 3.31Å
1205Q57.6Low60.4Low112 Ų11233.3 Ų33.352%0.52319%0.193SC..  trans-80.7145.5166.1-64.1-170.1-3.700109.5H1203 T1207 E1208H1203-Q1205 PolarHBondContact O-N 3.18Å; Q1205-T1207 PolarHBondContact O-N 3.18Å; Q1205-E1208 PolarHBondContact O-N 3.45Å
1206A52.5Low60.7Low66 Ų6633.5 Ų33.555%0.54519%0.193SC..THydrogen-bonded Turntrans-60.8-10.8-172.200000115
1207T49.6Very low60.6Low106 Ų10636.6 Ų36.665%0.6521%0.211SC*.THydrogen-bonded Turntrans-92.9-6.4-174.2480000114.9Q1205 H1209Q1205-T1207 PolarHBondContact O-N 3.18Å; T1207-H1209 PolarHBondContact O-N 3.41Å
1208E59.1Low60.3Low59 Ų5937 Ų3728%0.27621%0.213SC..  trans-89.769.4-176.9-66.6-168.8-167.700114L1204 Q1205 S1210 S1211 I1212L1204-E1208 HydrophobicContact CD2-CB 4.1Å; Q1205-E1208 PolarHBondContact O-N 3.45Å; E1208-S1210 PolarHBondContact O-N 3.46Å; E1208-S1211 WeakPolarHBondContact O-CB 3.44Å; E1208-S1211 PolarHBondContact O-N 3.01Å; E1208-S1211 WeakPolarHBondContact OE2-CB 3.4Å; E1208-S1211 PolarHBondContact OE2-OG 2.73Å; E1208-I1212 WeakPolarHBondContact O-CG1 3.3Å; E1208-I1212 PolarHBondContact O-N 2.9Å
1209H55.6Low60.4Low74 Ų7436.9 Ų36.934%0.34321%0.213SC..Hα-helixtrans-59.1-38.7-178.3-68.4-63.5000114.7T1207 I1212 C1213T1207-H1209 PolarHBondContact O-N 3.41Å; H1209-I1212 WeakPolarHBondContact O-CB 3.31Å; H1209-I1212 PolarHBondContact O-N 3.45Å; H1209-C1213 PolarHBondContact O-N 3.13Å; H1209-C1213 VanDerWaalsContact O-N 3.1Å; H1209-C1213 PolarHBondContact O-SG 3.25Å; H1209-C1213 VanDerWaalsContact O-SG 3.42Å
1210S58.8Low60.2Low95 Ų9537.8 Ų37.866%0.66422%0.218SC*.Hα-helixtrans-66.3-40.517954.20000112.5E1208 I1212 C1213 W1214E1208-S1210 PolarHBondContact O-N 3.46Å; S1210-I1212 VanDerWaalsContact C-N 3.31Å; S1210-I1212 PolarHBondContact O-N 3.32Å; S1210-C1213 PolarHBondContact O-N 3.13Å; S1210-W1214 PolarHBondContact O-N 3.1Å; S1210-W1214 VanDerWaalsContact O-N 3.13Å
1211S59.6Low59.8Low2 Ų242.8 Ų42.81%0.01424%0.241CC..Hα-helixtrans-60.5-41.5174.4-66.50000111.3K1177 E1208 W1214 V1215K1177-S1211 PolarHBondContact NZ-OG 2.9Å; E1208-S1211 WeakPolarHBondContact O-CB 3.44Å; E1208-S1211 PolarHBondContact O-N 3.01Å; E1208-S1211 WeakPolarHBondContact OE2-CB 3.4Å; E1208-S1211 PolarHBondContact OE2-OG 2.73Å; S1211-W1214 PolarHBondContact O-N 3.19Å; S1211-V1215 VanDerWaalsContact O-CG2 3.24Å; S1211-V1215 WeakPolarHBondContact O-CG2 3.45Å; S1211-V1215 PolarHBondContact O-N 3.48Å
1212I61.9Low59.4Low9 Ų943.2 Ų43.25%0.04624%0.243CC..Hα-helixtrans-63-49.1178.1-74.4167.9000111.6L1204 E1208 H1209 S1210 W1214 V1215 L1216 L1250L1204-I1212 HydrophobicContact CD2-CD1 3.96Å; L1204-I1212 HydrophobicContact CD2-CG1 3.54Å; E1208-I1212 WeakPolarHBondContact O-CG1 3.3Å; E1208-I1212 PolarHBondContact O-N 2.9Å; H1209-I1212 WeakPolarHBondContact O-CB 3.31Å; H1209-I1212 PolarHBondContact O-N 3.45Å; S1210-I1212 VanDerWaalsContact C-N 3.31Å; S1210-I1212 PolarHBondContact O-N 3.32Å; I1212-W1214 VanDerWaalsContact C-N 3.29Å; I1212-W1214 PolarHBondContact O-N 3.01Å; I1212-V1215 PolarHBondContact O-N 2.62Å; I1212-L1216 HydrophobicContact CG2-CD1 4.01Å; I1212-L1216 WeakPolarHBondContact O-CG 3.37Å; I1212-L1216 PolarHBondContact O-N 3.39Å; I1212-L1250 HydrophobicContact CD1-CD1 4.41Å; I1212-L1250 HydrophobicContact CD1-CD2 4.26Å; I1212-L1250 HydrophobicContact CG2-CD1 3.25Å; I1212-L1250 HydrophobicContact CG2-CG 4.38Å
1213C61.2Low59.2Low55 Ų5542.4 Ų42.437%0.37224%0.236SC..Hα-helixtrans-61.1-41.1179.8-67.40000111.2H1209 S1210 V1215 L1216 D1217H1209-C1213 PolarHBondContact O-N 3.13Å; H1209-C1213 VanDerWaalsContact O-N 3.1Å; H1209-C1213 PolarHBondContact O-SG 3.25Å; H1209-C1213 VanDerWaalsContact O-SG 3.42Å; S1210-C1213 PolarHBondContact O-N 3.13Å; C1213-V1215 PolarHBondContact O-N 3.18Å; C1213-L1216 PolarHBondContact O-N 2.96Å; C1213-D1217 WeakPolarHBondContact O-CB 3.38Å; C1213-D1217 PolarHBondContact O-N 3.29Å
1214W59.4Low58.8Low43 Ų4343.1 Ų43.116%0.16324%0.24CC..Hα-helixtrans-63-39.7175.6177.276000113.2L1184 Y1196 F1197 S1210 S1211 I1212 S1218L1184-W1214 HydrophobicContact CB-CZ2 4.26Å; L1184-W1214 HydrophobicContact CD1-CH2 3.95Å; L1184-W1214 HydrophobicContact CD1-CZ2 4.06Å; Y1196-W1214 HydrophobicContact CD1-CH2 4.43Å; Y1196-W1214 AromaticContact CE1-CH2 3.74Å; Y1196-W1214 HydrophobicContact CE1-CH2 3.74Å; Y1196-W1214 AromaticContact CE1-CZ3 3.84Å; Y1196-W1214 HydrophobicContact CE1-CZ3 3.84Å; F1197-W1214 HydrophobicContact CD1-CZ3 4.25Å; F1197-W1214 HydrophobicContact CE1-CE3 4.12Å; F1197-W1214 AromaticContact CE1-CH2 3.63Å; F1197-W1214 HydrophobicContact CE1-CH2 3.63Å; F1197-W1214 HydrophobicContact CE1-CZ2 4.37Å; F1197-W1214 AromaticContact CE1-CZ3 3.49Å; F1197-W1214 HydrophobicContact CE1-CZ3 3.49Å; F1197-W1214 VanDerWaalsContact CE1-CZ3 3.49Å; F1197-W1214 HydrophobicContact CZ-CH2 4.15Å; F1197-W1214 HydrophobicContact CZ-CZ3 4.41Å; S1210-W1214 PolarHBondContact O-N 3.1Å; S1210-W1214 VanDerWaalsContact O-N 3.13Å; S1211-W1214 PolarHBondContact O-N 3.19Å; I1212-W1214 VanDerWaalsContact C-N 3.29Å; I1212-W1214 PolarHBondContact O-N 3.01Å; W1214-S1218 WeakPolarHBondContact O-CB 3.23Å; W1214-S1218 PolarHBondContact O-N 3.31Å; W1214-S1218 PolarHBondContact O-OG 2.82Å
1215V63.2Low58.3Low1 Ų145.5 Ų45.51%0.00626%0.263CS..Hα-helixtrans-64.7-44.1174.6172.60000111F1197 F1200 V1201 S1211 I1212 C1213 S1218 I1219 L1241F1197-V1215 HydrophobicContact CD1-CB 4.31Å; F1197-V1215 HydrophobicContact CD1-CG1 3.96Å; F1197-V1215 HydrophobicContact CD1-CG2 3.92Å; F1197-V1215 HydrophobicContact CE1-CG2 4.19Å; F1197-V1215 HydrophobicContact CG-CG1 4.48Å; F1200-V1215 HydrophobicContact CD1-CG2 3.62Å; F1200-V1215 HydrophobicContact CE1-CG2 3.77Å; V1201-V1215 HydrophobicContact CG2-CG1 3.99Å; S1211-V1215 VanDerWaalsContact O-CG2 3.24Å; S1211-V1215 WeakPolarHBondContact O-CG2 3.45Å; S1211-V1215 PolarHBondContact O-N 3.48Å; I1212-V1215 PolarHBondContact O-N 2.62Å; C1213-V1215 PolarHBondContact O-N 3.18Å; V1215-S1218 PolarHBondContact O-N 2.85Å; V1215-I1219 HydrophobicContact CG1-CD1 3.64Å; V1215-I1219 HydrophobicContact CG1-CG1 4.28Å; V1215-I1219 WeakPolarHBondContact O-CB 3.36Å; V1215-I1219 VanDerWaalsContact O-CG1 3.24Å; V1215-I1219 WeakPolarHBondContact O-CG1 3.29Å; V1215-I1219 PolarHBondContact O-N 2.81Å; V1215-L1241 HydrophobicContact CG1-CD1 4.14Å
1216L64.7Low57.9Low5 Ų544.9 Ų44.93%0.02626%0.26CS..Hα-helixtrans-66.9-41.7-179.5-73.2176.6000112.4I1212 C1213 I1219 L1220 L1241 L1250 C1253 L1254 V1257I1212-L1216 HydrophobicContact CG2-CD1 4.01Å; I1212-L1216 WeakPolarHBondContact O-CG 3.37Å; I1212-L1216 PolarHBondContact O-N 3.39Å; C1213-L1216 PolarHBondContact O-N 2.96Å; L1216-I1219 PolarHBondContact O-N 3.04Å; L1216-L1220 WeakPolarHBondContact O-CB 3.38Å; L1216-L1220 PolarHBondContact O-N 2.8Å; L1216-L1241 HydrophobicContact CD2-CD1 3.8Å; L1216-L1241 HydrophobicContact CG-CD1 4.43Å; L1216-L1250 HydrophobicContact CD1-CD1 4.22Å; L1216-C1253 HydrophobicContact CD1-CB 3.34Å; L1216-L1254 HydrophobicContact CD1-CG 4.45Å; L1216-L1254 HydrophobicContact CD2-CD2 3.67Å; L1216-L1254 HydrophobicContact CD2-CG 4.2Å; L1216-V1257 HydrophobicContact CB-CG2 4.11Å; L1216-V1257 HydrophobicContact CD2-CG2 4.23Å
1217D61.2Low58Low78 Ų7845.3 Ų45.342%0.41725%0.253SS..Hα-helixtrans-60.8-46.5173.4-177.949.3000110.9C1213 I1219 L1220 Q1221C1213-D1217 WeakPolarHBondContact O-CB 3.38Å; C1213-D1217 PolarHBondContact O-N 3.29Å; D1217-I1219 PolarHBondContact O-N 3.03Å; D1217-L1220 WeakPolarHBondContact O-CB 3.43Å; D1217-L1220 PolarHBondContact O-N 3.17Å; D1217-Q1221 WeakPolarHBondContact O-CG 3.33Å; D1217-Q1221 PolarHBondContact O-N 3.43Å
1218S59.3Low58.4Low9 Ų943.2 Ų43.26%0.06324%0.243CC..Hα-helixtrans-64.5-40.6177.3-56.40000113F1197 W1214 V1215 L1220 Q1221 I1222F1197-S1218 WeakPolarHBondContact CZ-OG 3.41Å; W1214-S1218 WeakPolarHBondContact O-CB 3.23Å; W1214-S1218 PolarHBondContact O-N 3.31Å; W1214-S1218 PolarHBondContact O-OG 2.82Å; V1215-S1218 PolarHBondContact O-N 2.85Å; S1218-L1220 VanDerWaalsContact C-N 3.31Å; S1218-Q1221 PolarHBondContact O-N 3.43Å; S1218-I1222 WeakPolarHBondContact O-CB 3.32Å; S1218-I1222 WeakPolarHBondContact O-CG1 3.38Å; S1218-I1222 PolarHBondContact O-N 2.92Å
1219I62.9Low58.2Low1 Ų142.8 Ų42.81%0.00524%0.244CC..Hα-helixtrans-61.5-42.7174.2-77.3170000110.2V1215 L1216 D1217 I1222 S1223 C1234 V1237 M1238 L1241 V1257V1215-I1219 HydrophobicContact CG1-CD1 3.64Å; V1215-I1219 HydrophobicContact CG1-CG1 4.28Å; V1215-I1219 WeakPolarHBondContact O-CB 3.36Å; V1215-I1219 VanDerWaalsContact O-CG1 3.24Å; V1215-I1219 WeakPolarHBondContact O-CG1 3.29Å; V1215-I1219 PolarHBondContact O-N 2.81Å; L1216-I1219 PolarHBondContact O-N 3.04Å; D1217-I1219 PolarHBondContact O-N 3.03Å; I1219-I1222 PolarHBondContact O-N 3.28Å; I1219-S1223 WeakPolarHBondContact O-CA 3.42Å; I1219-S1223 WeakPolarHBondContact O-CB 3.47Å; I1219-S1223 PolarHBondContact O-N 2.96Å; I1219-S1223 PolarHBondContact O-OG 3.23Å; I1219-C1234 HydrophobicContact CG2-CB 4.14Å; I1219-V1237 HydrophobicContact CD1-CB 4.21Å; I1219-V1237 HydrophobicContact CD1-CG1 3.79Å; I1219-M1238 HydrophobicContact CD1-CG 4.05Å; I1219-M1238 HydrophobicContact CG2-CG 3.95Å; I1219-M1238 HydrophobicContact CG2-SD 3.74Å; I1219-L1241 HydrophobicContact CD1-CD1 4.2Å; I1219-V1257 HydrophobicContact CG2-CG1 4.14Å
1220L58.9Low58.3Low24 Ų2441.1 Ų41.113%0.12624%0.239CC..Hα-helixtrans-59.5-54.6176.6-177.665.6000109.6L1216 D1217 S1218 I1222 S1223 L1224 V1257 M1260L1216-L1220 WeakPolarHBondContact O-CB 3.38Å; L1216-L1220 PolarHBondContact O-N 2.8Å; D1217-L1220 WeakPolarHBondContact O-CB 3.43Å; D1217-L1220 PolarHBondContact O-N 3.17Å; S1218-L1220 VanDerWaalsContact C-N 3.31Å; L1220-I1222 PolarHBondContact O-N 3.45Å; L1220-S1223 PolarHBondContact O-N 3.36Å; L1220-S1223 PolarHBondContact O-OG 2.85Å; L1220-L1224 HydrophobicContact CD1-CD1 3.85Å; L1220-L1224 HydrophobicContact CD1-CG 4.21Å; L1220-L1224 HydrophobicContact CG-CD1 3.97Å; L1220-L1224 WeakPolarHBondContact O-CG 3.44Å; L1220-L1224 PolarHBondContact O-N 3.19Å; L1220-V1257 HydrophobicContact CB-CG1 4.48Å; L1220-V1257 HydrophobicContact CD1-CG1 4.4Å; L1220-M1260 HydrophobicContact CD1-CB 3.62Å; L1220-M1260 HydrophobicContact CD1-CE 3.87Å; L1220-M1260 HydrophobicContact CD1-CG 4.26Å; L1220-M1260 HydrophobicContact CD1-SD 3.71Å; L1220-M1260 HydrophobicContact CD2-CE 3.96Å; L1220-M1260 HydrophobicContact CD2-SD 3.58Å; L1220-M1260 VanDerWaalsContact CD2-SD 3.58Å; L1220-M1260 HydrophobicContact CG-CE 4.33Å; L1220-M1260 HydrophobicContact CG-SD 4.26Å
1221Q58.4Low58.4Low113 Ų11336.7 Ų36.753%0.52821%0.209SC..Hα-helixtrans-55.4-46.2178.7-64.2-61.8-21.600112.8D1217 S1218 A1225D1217-Q1221 WeakPolarHBondContact O-CG 3.33Å; D1217-Q1221 PolarHBondContact O-N 3.43Å; S1218-Q1221 PolarHBondContact O-N 3.43Å; Q1221-A1225 WeakPolarHBondContact O-CB 3.15Å; Q1221-A1225 PolarHBondContact O-N 2.7Å
1222I56.2Low58.4Low10 Ų1037.9 Ų37.95%0.05122%0.215CC..Hα-helixtrans-68.2-46.3179.7-67.1167.8000111.5C1188 T1193 F1197 S1218 I1219 L1220 L1224 A1225 T1230 C1234C1188-I1222 HydrophobicContact CB-CG1 4.1Å; T1193-I1222 HydrophobicContact CG2-CD1 3.83Å; F1197-I1222 HydrophobicContact CD2-CD1 4.25Å; F1197-I1222 HydrophobicContact CE2-CD1 3.66Å; S1218-I1222 WeakPolarHBondContact O-CB 3.32Å; S1218-I1222 WeakPolarHBondContact O-CG1 3.38Å; S1218-I1222 PolarHBondContact O-N 2.92Å; I1219-I1222 PolarHBondContact O-N 3.28Å; L1220-I1222 PolarHBondContact O-N 3.45Å; I1222-L1224 PolarHBondContact O-N 3.12Å; I1222-A1225 PolarHBondContact O-N 3.22Å; I1222-T1230 HydrophobicContact CG2-CG2 3.57Å; I1222-C1234 VanDerWaalsContact CG2-SG 3.53Å
1223S58.2Low58.4Low2 Ų238.8 Ų38.81%0.01422%0.22CC..Hα-helixtrans-57.4-43.2-178.869.60000109I1219 L1220 I1261 K1265I1219-S1223 WeakPolarHBondContact O-CA 3.42Å; I1219-S1223 WeakPolarHBondContact O-CB 3.47Å; I1219-S1223 PolarHBondContact O-N 2.96Å; I1219-S1223 PolarHBondContact O-OG 3.23Å; L1220-S1223 PolarHBondContact O-N 3.36Å; L1220-S1223 PolarHBondContact O-OG 2.85Å; S1223-I1261 WeakPolarHBondContact OG-CG1 3.03Å; S1223-K1265 WeakPolarHBondContact O-CE 3.33Å; S1223-K1265 PolarHBondContact O-NZ 3.43Å
1224L54.1Low58.7Low23 Ų2336.2 Ų36.212%0.1220%0.203CC..Hα-helixtrans-71.3-34.7-178.5-62.4178.1000113.9L1220 I1222 M1260 Q1264 K1265 F1341L1220-L1224 HydrophobicContact CD1-CD1 3.85Å; L1220-L1224 HydrophobicContact CD1-CG 4.21Å; L1220-L1224 HydrophobicContact CG-CD1 3.97Å; L1220-L1224 WeakPolarHBondContact O-CG 3.44Å; L1220-L1224 PolarHBondContact O-N 3.19Å; I1222-L1224 PolarHBondContact O-N 3.12Å; L1224-M1260 HydrophobicContact CD1-CE 4.23Å; L1224-Q1264 HydrophobicContact CD2-CB 3.61Å; L1224-Q1264 HydrophobicContact CD2-CG 4.31Å; L1224-K1265 PolarHBondContact O-NZ 3.5Å; L1224-K1265 VanDerWaalsContact O-NZ 3.08Å; L1224-F1341 HydrophobicContact CB-CE2 4.15Å; L1224-F1341 HydrophobicContact CD2-CE2 4.37Å
1225A51.8Low59.2Low68 Ų6834.4 Ų34.456%0.56220%0.197SC*.Hα-helixtrans-73.3-32.9-171.400000116.5Q1221 I1222Q1221-A1225 WeakPolarHBondContact O-CB 3.15Å; Q1221-A1225 PolarHBondContact O-N 2.7Å; I1222-A1225 PolarHBondContact O-N 3.22Å
1226Q49.3Very low59.4Low99 Ų9939.2 Ų39.246%0.46322%0.218SC..SBendtrans-143.5-165.5-163.1-69.6-158-1.800117.6K1265Q1226-K1265 PolarHBondContact O-NZ 3.22Å
1227D55.5Low59.5Low75 Ų7539 Ų3940%0.40122%0.217SC..  trans-56.5162-165.890.3-23.1000115.8T1229 T1230 A1231D1227-T1229 PolarHBondContact O-N 3.39Å; D1227-T1229 WeakPolarHBondContact OD1-CB 3.4Å; D1227-T1229 PolarHBondContact OD1-N 3.01Å; D1227-T1229 VanDerWaalsContact OD1-N 3.16Å; D1227-T1229 WeakPolarHBondContact OD2-CB 3.39Å; D1227-T1229 PolarHBondContact OD2-OG1 3.04Å; D1227-T1230 PolarHBondContact O-N 3.38Å; D1227-T1230 VanDerWaalsContact OD1-CB 3.31Å; D1227-T1230 WeakPolarHBondContact OD1-CB 3.43Å; D1227-T1230 PolarHBondContact OD1-N 3.09Å; D1227-T1230 PolarHBondContact OD1-OG1 3.27Å; D1227-A1231 PolarHBondContact O-N 3.18Å
1228S57.9Low60.1Low63 Ų6335.3 Ų35.344%0.44120%0.197SC..Hα-helixtrans-60.7-26.9178.558.90000112.6N1232S1228-N1232 PolarHBondContact O-N 3.26Å; S1228-N1232 PolarHBondContact O-ND2 3.17Å; S1228-N1232 PolarHBondContact O-OD1 3.07Å
1229T54.7Low60.7Low49 Ų4937.4 Ų37.430%0.30121%0.207SC..Hα-helixtrans-67.7-45.1-179-35.90000112D1227 N1232D1227-T1229 PolarHBondContact O-N 3.39Å; D1227-T1229 WeakPolarHBondContact OD1-CB 3.4Å; D1227-T1229 PolarHBondContact OD1-N 3.01Å; D1227-T1229 VanDerWaalsContact OD1-N 3.16Å; D1227-T1229 WeakPolarHBondContact OD2-CB 3.39Å; D1227-T1229 PolarHBondContact OD2-OG1 3.04Å; T1229-N1232 PolarHBondContact O-N 3.04Å; T1229-N1232 PolarHBondContact O-ND2 3.07Å
1230T56.4Low60.9Low39 Ų3939.1 Ų39.124%0.23922%0.216CC..Hα-helixtrans-72.9-39.8-176.5-52.50000111.1V1194 I1222 D1227 N1232 V1233 C1234V1194-T1230 HydrophobicContact CG2-CG2 4.19Å; I1222-T1230 HydrophobicContact CG2-CG2 3.57Å; D1227-T1230 PolarHBondContact O-N 3.38Å; D1227-T1230 VanDerWaalsContact OD1-CB 3.31Å; D1227-T1230 WeakPolarHBondContact OD1-CB 3.43Å; D1227-T1230 PolarHBondContact OD1-N 3.09Å; D1227-T1230 PolarHBondContact OD1-OG1 3.27Å; T1230-N1232 PolarHBondContact O-N 3.19Å; T1230-V1233 PolarHBondContact O-N 3.35Å; T1230-C1234 PolarHBondContact O-N 3.23Å; T1230-C1234 VanDerWaalsContact O-N 3.11Å; T1230-C1234 PolarHBondContact O-SG 3.17Å; T1230-C1234 VanDerWaalsContact O-SG 3.33Å
1231A61.8Low61.5Low3 Ų338.3 Ų38.33%0.02521%0.212CC..Hα-helixtrans-53.5-41.3172.100000111.8D1227 V1233 C1234 L1235 V1270D1227-A1231 PolarHBondContact O-N 3.18Å; A1231-V1233 VanDerWaalsContact C-N 3.33Å; A1231-V1233 PolarHBondContact O-N 3.49Å; A1231-C1234 WeakPolarHBondContact O-CB 3.48Å; A1231-C1234 PolarHBondContact O-N 3.41Å; A1231-L1235 WeakPolarHBondContact O-CB 3.25Å; A1231-L1235 WeakPolarHBondContact O-CD1 3.15Å; A1231-L1235 VanDerWaalsContact O-CG 3.23Å; A1231-L1235 WeakPolarHBondContact O-CG 3.27Å; A1231-L1235 PolarHBondContact O-N 3.02Å; A1231-V1270 HydrophobicContact CB-CG1 3.93Å; A1231-V1270 HydrophobicContact CB-CG2 3.89Å
1232N60.5Low62.2Low27 Ų2733.3 Ų33.314%0.14419%0.189CC..Hα-helixtrans-66.7-36-178.5-51.4-29.7000114S1228 T1229 T1230 K1236 W1269S1228-N1232 PolarHBondContact O-N 3.26Å; S1228-N1232 PolarHBondContact O-ND2 3.17Å; S1228-N1232 PolarHBondContact O-OD1 3.07Å; T1229-N1232 PolarHBondContact O-N 3.04Å; T1229-N1232 PolarHBondContact O-ND2 3.07Å; T1230-N1232 PolarHBondContact O-N 3.19Å; N1232-K1236 PolarHBondContact O-N 3.1Å; N1232-W1269 HydrophobicContact CB-CH2 3.92Å; N1232-W1269 HydrophobicContact CB-CZ3 4.23Å; N1232-W1269 WeakPolarHBondContact ND2-CH2 3.39Å; N1232-W1269 WeakPolarHBondContact ND2-CZ3 3.38Å; N1232-W1269 WeakPolarHBondContact OD1-CH2 3.37Å; N1232-W1269 WeakPolarHBondContact OD1-CZ3 3.33Å
1233V60.8Low62.7Low27 Ų2736.6 Ų36.616%0.16421%0.213CC..Hα-helixtrans-74.3-38.6-179-161.50000108.5V1150 I1154 V1194 T1230 A1231 L1235 K1236 V1237V1150-V1233 HydrophobicContact CG1-CG1 4.37Å; I1154-V1233 HydrophobicContact CD1-CG1 4.1Å; V1194-V1233 HydrophobicContact CB-CG1 4.46Å; V1194-V1233 HydrophobicContact CG1-CB 3.32Å; V1194-V1233 HydrophobicContact CG1-CG1 3Å; V1194-V1233 HydrophobicContact CG1-CG2 4.3Å; T1230-V1233 PolarHBondContact O-N 3.35Å; A1231-V1233 VanDerWaalsContact C-N 3.33Å; A1231-V1233 PolarHBondContact O-N 3.49Å; V1233-L1235 VanDerWaalsContact C-N 3.35Å; V1233-L1235 PolarHBondContact O-N 3.37Å; V1233-K1236 WeakPolarHBondContact O-CB 3.43Å; V1233-K1236 PolarHBondContact O-N 3.19Å; V1233-V1237 WeakPolarHBondContact O-CG2 3.03Å; V1233-V1237 PolarHBondContact O-N 3.25Å
1234C67.5Low62.9Low2 Ų240.1 Ų40.11%0.01423%0.226CC..Hα-helixtrans-58.3-44.9169.7-62.20000112.1I1219 I1222 T1230 A1231 K1236 V1237 M1238I1219-C1234 HydrophobicContact CG2-CB 4.14Å; I1222-C1234 VanDerWaalsContact CG2-SG 3.53Å; T1230-C1234 PolarHBondContact O-N 3.23Å; T1230-C1234 VanDerWaalsContact O-N 3.11Å; T1230-C1234 PolarHBondContact O-SG 3.17Å; T1230-C1234 VanDerWaalsContact O-SG 3.33Å; A1231-C1234 WeakPolarHBondContact O-CB 3.48Å; A1231-C1234 PolarHBondContact O-N 3.41Å; C1234-K1236 VanDerWaalsContact C-N 3.31Å; C1234-K1236 PolarHBondContact O-N 3.38Å; C1234-V1237 WeakPolarHBondContact O-CA 3.33Å; C1234-V1237 WeakPolarHBondContact O-CB 3.48Å; C1234-V1237 PolarHBondContact O-N 3.04Å; C1234-M1238 WeakPolarHBondContact O-CG 3.31Å; C1234-M1238 PolarHBondContact O-N 2.91Å
1235L70.6Confident63.3Low5 Ų540 Ų403%0.02623%0.227CC..Hα-helixtrans-62-36.3175.6-72.1163.2000112.4A1231 V1233 M1238 D1239 I1261 V1270 Q1273 A1274 L1277A1231-L1235 WeakPolarHBondContact O-CB 3.25Å; A1231-L1235 WeakPolarHBondContact O-CD1 3.15Å; A1231-L1235 VanDerWaalsContact O-CG 3.23Å; A1231-L1235 WeakPolarHBondContact O-CG 3.27Å; A1231-L1235 PolarHBondContact O-N 3.02Å; V1233-L1235 VanDerWaalsContact C-N 3.35Å; V1233-L1235 PolarHBondContact O-N 3.37Å; L1235-M1238 HydrophobicContact CD2-SD 4.25Å; L1235-M1238 CarbonylContact O-C 3.45Å; L1235-M1238 WeakPolarHBondContact O-CB 3.24Å; L1235-M1238 PolarHBondContact O-N 3.31Å; L1235-D1239 PolarHBondContact O-N 3.33Å; L1235-I1261 HydrophobicContact CD2-CD1 4.16Å; L1235-I1261 HydrophobicContact CD2-CG2 4.46Å; L1235-V1270 HydrophobicContact CD1-CB 4.4Å; L1235-V1270 HydrophobicContact CD1-CG1 3.74Å; L1235-Q1273 HydrophobicContact CB-CB 4.44Å; L1235-Q1273 HydrophobicContact CD1-CB 3.59Å; L1235-Q1273 HydrophobicContact CG-CB 4.43Å; L1235-A1274 HydrophobicContact CD2-CB 3.9Å; L1235-L1277 HydrophobicContact CB-CD1 4.22Å; L1235-L1277 HydrophobicContact CD2-CD1 3.48Å; L1235-L1277 VanDerWaalsContact CD2-CD1 3.48Å; L1235-L1277 HydrophobicContact CG-CD1 4.48Å
1236K66.6Low63.8Low101 Ų10143.6 Ų43.644%0.43923%0.232SC..Hα-helixtrans-69.3-30.9171.3-88.8170.1167.5-175.80113.9I1154 N1232 V1233 C1234 D1239 L1240I1154-K1236 HydrophobicContact CG2-CD 4.26Å; N1232-K1236 PolarHBondContact O-N 3.1Å; V1233-K1236 WeakPolarHBondContact O-CB 3.43Å; V1233-K1236 PolarHBondContact O-N 3.19Å; C1234-K1236 VanDerWaalsContact C-N 3.31Å; C1234-K1236 PolarHBondContact O-N 3.38Å; K1236-D1239 WeakPolarHBondContact O-CB 3.43Å; K1236-D1239 PolarHBondContact O-N 2.94Å; K1236-L1240 PolarHBondContact O-N 3.5Å
1237V67.8Low64.6Low1 Ų141 Ų411%0.00622%0.222CC..Hα-helixtrans-68.1-41.4170.4177.40000110F1197 T1198 V1201 I1219 V1233 C1234 D1239 L1240 L1241F1197-V1237 HydrophobicContact CB-CG1 4.11Å; F1197-V1237 HydrophobicContact CB-CG2 4.33Å; T1198-V1237 WeakPolarHBondContact OG1-CG2 3.3Å; V1201-V1237 HydrophobicContact CB-CG1 4.17Å; V1201-V1237 HydrophobicContact CG2-CG1 3.63Å; I1219-V1237 HydrophobicContact CD1-CB 4.21Å; I1219-V1237 HydrophobicContact CD1-CG1 3.79Å; V1233-V1237 WeakPolarHBondContact O-CG2 3.03Å; V1233-V1237 PolarHBondContact O-N 3.25Å; C1234-V1237 WeakPolarHBondContact O-CA 3.33Å; C1234-V1237 WeakPolarHBondContact O-CB 3.48Å; C1234-V1237 PolarHBondContact O-N 3.04Å; V1237-D1239 VanDerWaalsContact C-N 3.31Å; V1237-D1239 PolarHBondContact O-N 3.26Å; V1237-L1240 WeakPolarHBondContact O-CB 3.42Å; V1237-L1240 PolarHBondContact O-N 3.4Å; V1237-L1241 PolarHBondContact O-N 2.99Å
1238M73.2Confident65Low0 Ų042.5 Ų42.50%023%0.227CC..Hα-helixtrans-62.3-37.9173.4-66.117571.700111.8I1219 C1234 L1235 L1240 L1241 V1242 L1254 V1257 I1258 I1261 L1277I1219-M1238 HydrophobicContact CD1-CG 4.05Å; I1219-M1238 HydrophobicContact CG2-CG 3.95Å; I1219-M1238 HydrophobicContact CG2-SD 3.74Å; C1234-M1238 WeakPolarHBondContact O-CG 3.31Å; C1234-M1238 PolarHBondContact O-N 2.91Å; L1235-M1238 HydrophobicContact CD2-SD 4.25Å; L1235-M1238 CarbonylContact O-C 3.45Å; L1235-M1238 WeakPolarHBondContact O-CB 3.24Å; L1235-M1238 PolarHBondContact O-N 3.31Å; M1238-L1240 VanDerWaalsContact C-N 3.32Å; M1238-L1240 PolarHBondContact O-N 3.33Å; M1238-L1241 CarbonylContact O-C 3.55Å; M1238-L1241 WeakPolarHBondContact O-CA 3.3Å; M1238-L1241 WeakPolarHBondContact O-CB 3.49Å; M1238-L1241 PolarHBondContact O-N 3.3Å; M1238-V1242 WeakPolarHBondContact O-CB 3.34Å; M1238-V1242 VanDerWaalsContact O-CG2 3.27Å; M1238-V1242 WeakPolarHBondContact O-CG2 3.27Å; M1238-V1242 PolarHBondContact O-N 3.45Å; M1238-L1254 HydrophobicContact CB-CD2 4.45Å; M1238-L1254 HydrophobicContact CE-CD2 4.21Å; M1238-V1257 HydrophobicContact CE-CB 4.01Å; M1238-V1257 HydrophobicContact CE-CG1 3.59Å; M1238-V1257 HydrophobicContact SD-CG1 3.98Å; M1238-I1258 HydrophobicContact CE-CB 4.42Å; M1238-I1258 HydrophobicContact CE-CD1 4.33Å; M1238-I1258 HydrophobicContact CE-CG1 3.37Å; M1238-I1261 HydrophobicContact CE-CD1 4.13Å; M1238-I1261 HydrophobicContact SD-CD1 3.56Å; M1238-I1261 VanDerWaalsContact SD-CD1 3.56Å; M1238-L1277 HydrophobicContact CB-CD1 3.53Å; M1238-L1277 HydrophobicContact CB-CD2 4.33Å; M1238-L1277 HydrophobicContact CE-CD1 4.18Å; M1238-L1277 HydrophobicContact CG-CD1 4.45Å; M1238-L1277 HydrophobicContact SD-CD1 4.14Å
1239D71.7Confident65.2Low54 Ų5444.1 Ų44.129%0.28923%0.23SC..Hα-helixtrans-54.6-47.9173.4-173.226.7000111.7L1235 K1236 V1237 L1241 V1242 S1243 L1277 M1280L1235-D1239 PolarHBondContact O-N 3.33Å; K1236-D1239 WeakPolarHBondContact O-CB 3.43Å; K1236-D1239 PolarHBondContact O-N 2.94Å; V1237-D1239 VanDerWaalsContact C-N 3.31Å; V1237-D1239 PolarHBondContact O-N 3.26Å; D1239-L1241 VanDerWaalsContact C-N 3.35Å; D1239-L1241 PolarHBondContact O-N 2.55Å; D1239-V1242 PolarHBondContact O-N 2.93Å; D1239-S1243 PolarHBondContact O-N 3.29Å; D1239-L1277 HydrophobicContact CB-CD2 3.54Å; D1239-M1280 WeakPolarHBondContact OD1-CE 3.43Å
1240L67.2Low65.7Low37 Ų3742.2 Ų42.219%0.19422%0.218CC..Hα-helixtrans-62.9-38.4174.5-68.9167.3000112.5T1198 V1201 K1236 V1237 M1238 S1243 R1244T1198-L1240 HydrophobicContact CG2-CD1 4.06Å; V1201-L1240 HydrophobicContact CG1-CB 3.64Å; K1236-L1240 PolarHBondContact O-N 3.5Å; V1237-L1240 WeakPolarHBondContact O-CB 3.42Å; V1237-L1240 PolarHBondContact O-N 3.4Å; M1238-L1240 VanDerWaalsContact C-N 3.32Å; M1238-L1240 PolarHBondContact O-N 3.33Å; L1240-S1243 PolarHBondContact O-N 3.46Å; L1240-S1243 PolarHBondContact O-OG 3.44Å; L1240-R1244 PolarHBondContact O-N 2.75Å
1241L71.8Confident66.3Low6 Ų643 Ų433%0.03122%0.218CC..Hα-helixtrans-66.1-42.6175.3-75.6169.4000112.1V1201 V1215 L1216 I1219 V1237 M1238 D1239 S1243 R1244 C1245 L1254V1201-L1241 HydrophobicContact CB-CD2 4.41Å; V1201-L1241 HydrophobicContact CB-CG 4.49Å; V1201-L1241 HydrophobicContact CG1-CD2 3.78Å; V1201-L1241 HydrophobicContact CG1-CG 3.73Å; V1201-L1241 HydrophobicContact CG2-CD1 4.25Å; V1201-L1241 HydrophobicContact CG2-CD2 3.76Å; V1201-L1241 HydrophobicContact CG2-CG 3.86Å; V1215-L1241 HydrophobicContact CG1-CD1 4.14Å; L1216-L1241 HydrophobicContact CD2-CD1 3.8Å; L1216-L1241 HydrophobicContact CG-CD1 4.43Å; I1219-L1241 HydrophobicContact CD1-CD1 4.2Å; V1237-L1241 PolarHBondContact O-N 2.99Å; M1238-L1241 CarbonylContact O-C 3.55Å; M1238-L1241 WeakPolarHBondContact O-CA 3.3Å; M1238-L1241 WeakPolarHBondContact O-CB 3.49Å; M1238-L1241 PolarHBondContact O-N 3.3Å; D1239-L1241 VanDerWaalsContact C-N 3.35Å; D1239-L1241 PolarHBondContact O-N 2.55Å; L1241-S1243 VanDerWaalsContact C-N 3.32Å; L1241-S1243 PolarHBondContact O-N 2.95Å; L1241-R1244 CarbonylContact O-C 3.13Å; L1241-R1244 PolarHBondContact O-N 2.69Å; L1241-C1245 PolarHBondContact O-N 2.96Å; L1241-L1254 HydrophobicContact CB-CD1 4.24Å; L1241-L1254 HydrophobicContact CB-CD2 4.06Å; L1241-L1254 HydrophobicContact CD1-CD2 4.38Å
1242V72.6Confident66.6Low9 Ų945.9 Ų45.96%0.05523%0.231CC..Hα-helixtrans-60.3-43.5176.6167.20000110.2M1238 D1239 R1244 C1245 L1254 L1277 M1280 M1281M1238-V1242 WeakPolarHBondContact O-CB 3.34Å; M1238-V1242 VanDerWaalsContact O-CG2 3.27Å; M1238-V1242 WeakPolarHBondContact O-CG2 3.27Å; M1238-V1242 PolarHBondContact O-N 3.45Å; D1239-V1242 PolarHBondContact O-N 2.93Å; V1242-R1244 PolarHBondContact O-N 3.23Å; V1242-R1244 VanDerWaalsContact O-N 3.08Å; V1242-C1245 WeakPolarHBondContact O-CB 3.29Å; V1242-C1245 PolarHBondContact O-N 3.32Å; V1242-C1245 VanDerWaalsContact O-N 3.11Å; V1242-L1254 HydrophobicContact CG2-CD1 4Å; V1242-L1254 HydrophobicContact CG2-CD2 4.23Å; V1242-L1277 HydrophobicContact CG2-CB 4.45Å; V1242-L1277 HydrophobicContact CG2-CD2 4.39Å; V1242-M1280 HydrophobicContact CG1-CB 3.6Å; V1242-M1281 HydrophobicContact CB-CG 3.99Å; V1242-M1281 HydrophobicContact CG1-CB 4.24Å; V1242-M1281 HydrophobicContact CG1-CG 3.39Å; V1242-M1281 HydrophobicContact CG2-CG 3.49Å; V1242-M1281 VanDerWaalsContact CG2-CG 3.49Å; V1242-M1281 HydrophobicContact CG2-SD 3.84Å
1243S67.2Low66.9Low78 Ų7846 Ų4655%0.54523%0.234SC..THydrogen-bonded Turntrans-61.2-18.7176.178.70000114.2D1239 L1240 L1241D1239-S1243 PolarHBondContact O-N 3.29Å; L1240-S1243 PolarHBondContact O-N 3.46Å; L1240-S1243 PolarHBondContact O-OG 3.44Å; L1241-S1243 VanDerWaalsContact C-N 3.32Å; L1241-S1243 PolarHBondContact O-N 2.95Å
1244R62.1Low67.5Low77 Ų7744.7 Ų44.729%0.29123%0.226SC..THydrogen-bonded Turntrans-109.713.6180-65.5-171.4177.5-167.83.9113.5V1201 A1202 L1204 L1240 L1241 V1242 H1246V1201-R1244 PolarHBondContact O-NH1 2.93Å; V1201-R1244 VanDerWaalsContact O-NH1 3.08Å; A1202-R1244 PolarHBondContact O-NH1 3.19Å; A1202-R1244 PolarHBondContact O-NH2 3.35Å; L1204-R1244 PolarHBondContact O-NH1 3.31Å; L1240-R1244 PolarHBondContact O-N 2.75Å; L1241-R1244 CarbonylContact O-C 3.13Å; L1241-R1244 PolarHBondContact O-N 2.69Å; V1242-R1244 PolarHBondContact O-N 3.23Å; V1242-R1244 VanDerWaalsContact O-N 3.08Å; R1244-H1246 VanDerWaalsContact C-N 3.32Å; R1244-H1246 PolarHBondContact O-CD2 3.24Å; R1244-H1246 VanDerWaalsContact O-CD2 3.29Å; R1244-H1246 PolarHBondContact O-N 3.48Å
1245C63.1Low67.9Low19 Ų1944.6 Ų44.613%0.12823%0.225CC..  trans-7479-172.6-1460000112.4L1241 V1242 L1250 K1251 L1254L1241-C1245 PolarHBondContact O-N 2.96Å; V1242-C1245 WeakPolarHBondContact O-CB 3.29Å; V1242-C1245 PolarHBondContact O-N 3.32Å; V1242-C1245 VanDerWaalsContact O-N 3.11Å; C1245-L1250 HydrophobicContact CB-CD2 4.36Å; C1245-L1250 VanDerWaalsContact SG-CG 3.58Å; C1245-K1251 HydrophobicContact CB-CG 4.29Å; C1245-K1251 WeakPolarHBondContact SG-CA 2.98Å; C1245-K1251 WeakPolarHBondContact SG-CG 3.28Å; C1245-K1251 PolarHBondContact SG-N 3.25Å; C1245-L1254 HydrophobicContact CB-CD1 4.48Å
1246H62.2Low67.7Low145 Ų14546.1 Ų46.167%0.67123%0.233SC*.  trans-94.6-17.7-178.6-59.7-53.3000114.3R1244R1244-H1246 VanDerWaalsContact C-N 3.32Å; R1244-H1246 PolarHBondContact O-CD2 3.24Å; R1244-H1246 VanDerWaalsContact O-CD2 3.29Å; R1244-H1246 PolarHBondContact O-N 3.48Å
1247T65.1Low68Low43 Ų4341.8 Ų41.826%0.26422%0.215SC..SBendtrans-110.5142.2-178.362.90000110.8L1249 L1250 K1251T1247-L1249 VanDerWaalsContact C-N 3.26Å; T1247-L1249 PolarHBondContact O-N 2.87Å; T1247-L1250 PolarHBondContact O-N 3.09Å; T1247-L1250 WeakPolarHBondContact OG1-CB 3.33Å; T1247-L1250 PolarHBondContact OG1-N 3.14Å; T1247-K1251 PolarHBondContact O-N 3.45Å
1248E63.9Low68.4Low107 Ų10741.7 Ų41.750%0.522%0.215SC..Hα-helixtrans-56.6-43.7175.6-71.7-56.8128.100110.3L1250 K1251 H1252E1248-L1250 VanDerWaalsContact C-N 3.33Å; E1248-L1250 PolarHBondContact O-N 2.95Å; E1248-K1251 WeakPolarHBondContact O-CA 3.5Å; E1248-K1251 WeakPolarHBondContact O-CB 3.26Å; E1248-K1251 PolarHBondContact O-N 3.3Å; E1248-K1251 IonicContact OE1-NZ 3.16Å; E1248-K1251 PolarHBondContact OE1-NZ 3.23Å; E1248-H1252 VanDerWaalsContact C-ND1 3.29Å; E1248-H1252 PolarHBondContact O-N 3.5Å; E1248-H1252 PolarHBondContact O-ND1 3.06Å; E1248-H1252 IonicContact OE2-CE1 2.79Å
1249L61.5Low68.2Low98 Ų9841.8 Ų41.851%0.51322%0.216SC..Hα-helixtrans-53.6-45.6178-175.666.4000113.3T1247 H1252 C1253T1247-L1249 VanDerWaalsContact C-N 3.26Å; T1247-L1249 PolarHBondContact O-N 2.87Å; L1249-H1252 PolarHBondContact O-N 3.47Å; L1249-C1253 PolarHBondContact O-N 2.88Å; L1249-C1253 PolarHBondContact O-SG 2.8Å
1250L65.4Low67.9Low8 Ų840.7 Ų40.74%0.04221%0.209CC..Hα-helixtrans-67-38178.3172.263.5000111.7I1212 L1216 C1245 T1247 E1248 H1252 C1253 L1254I1212-L1250 HydrophobicContact CD1-CD1 4.41Å; I1212-L1250 HydrophobicContact CD1-CD2 4.26Å; I1212-L1250 HydrophobicContact CG2-CD1 3.25Å; I1212-L1250 HydrophobicContact CG2-CG 4.38Å; L1216-L1250 HydrophobicContact CD1-CD1 4.22Å; C1245-L1250 HydrophobicContact CB-CD2 4.36Å; C1245-L1250 VanDerWaalsContact SG-CG 3.58Å; T1247-L1250 PolarHBondContact O-N 3.09Å; T1247-L1250 WeakPolarHBondContact OG1-CB 3.33Å; T1247-L1250 PolarHBondContact OG1-N 3.14Å; E1248-L1250 VanDerWaalsContact C-N 3.33Å; E1248-L1250 PolarHBondContact O-N 2.95Å; L1250-H1252 VanDerWaalsContact C-N 3.32Å; L1250-C1253 PolarHBondContact O-N 2.96Å; L1250-L1254 HydrophobicContact CD1-CD1 3.82Å; L1250-L1254 HydrophobicContact CD1-CG 4.09Å; L1250-L1254 HydrophobicContact CG-CD1 3.95Å; L1250-L1254 WeakPolarHBondContact O-CB 3.3Å; L1250-L1254 WeakPolarHBondContact O-CG 3.36Å; L1250-L1254 PolarHBondContact O-N 2.74Å
1251K70.6Confident68Low57 Ų5739 Ų3925%0.24820%0.2CC..Hα-helixtrans-58.5-49171.8-69.4179.7-173.2164.80109.9C1245 T1247 E1248 C1253 L1254 T1255 M1281C1245-K1251 HydrophobicContact CB-CG 4.29Å; C1245-K1251 WeakPolarHBondContact SG-CA 2.98Å; C1245-K1251 WeakPolarHBondContact SG-CG 3.28Å; C1245-K1251 PolarHBondContact SG-N 3.25Å; T1247-K1251 PolarHBondContact O-N 3.45Å; E1248-K1251 WeakPolarHBondContact O-CA 3.5Å; E1248-K1251 WeakPolarHBondContact O-CB 3.26Å; E1248-K1251 PolarHBondContact O-N 3.3Å; E1248-K1251 IonicContact OE1-NZ 3.16Å; E1248-K1251 PolarHBondContact OE1-NZ 3.23Å; K1251-C1253 VanDerWaalsContact C-N 3.35Å; K1251-C1253 PolarHBondContact O-N 3.01Å; K1251-L1254 PolarHBondContact O-N 2.69Å; K1251-T1255 WeakPolarHBondContact O-CB 3.24Å; K1251-T1255 PolarHBondContact O-N 3.18Å; K1251-T1255 PolarHBondContact O-OG1 2.96Å; K1251-M1281 HydrophobicContact CB-CE 3.98Å; K1251-M1281 HydrophobicContact CG-CE 4.34Å; K1251-M1281 VanDerWaalsContact O-CE 3.3Å; K1251-M1281 WeakPolarHBondContact O-CE 3.37Å
1252H66.8Low67.9Low62 Ų6238.8 Ų38.829%0.28720%0.199SC..Hα-helixtrans-60.4-41.9-179.2-71.476000112.4E1248 L1249 L1250 N1256 Q1308E1248-H1252 VanDerWaalsContact C-ND1 3.29Å; E1248-H1252 PolarHBondContact O-N 3.5Å; E1248-H1252 PolarHBondContact O-ND1 3.06Å; E1248-H1252 IonicContact OE2-CE1 2.79Å; L1249-H1252 PolarHBondContact O-N 3.47Å; L1250-H1252 VanDerWaalsContact C-N 3.32Å; H1252-N1256 PolarHBondContact O-N 3.12Å; H1252-Q1308 PolarHBondContact CD2-NE2 2.87Å; H1252-Q1308 PolarHBondContact O-NE2 3.21Å
1253C66.9Low67.3Low30 Ų3038.9 Ų38.920%0.20320%0.199CC..Hα-helixtrans-68.4-41.9176.6-640000112.4L1216 L1249 L1250 K1251 N1256 V1257L1216-C1253 HydrophobicContact CD1-CB 3.34Å; L1249-C1253 PolarHBondContact O-N 2.88Å; L1249-C1253 PolarHBondContact O-SG 2.8Å; L1250-C1253 PolarHBondContact O-N 2.96Å; K1251-C1253 VanDerWaalsContact C-N 3.35Å; K1251-C1253 PolarHBondContact O-N 3.01Å; C1253-N1256 PolarHBondContact O-N 3.46Å; C1253-V1257 WeakPolarHBondContact O-CG2 3.22Å; C1253-V1257 PolarHBondContact O-N 3.19Å; C1253-V1257 VanDerWaalsContact O-N 3.15Å
1254L74.4Confident67Low0 Ų036.3 Ų36.30%018%0.178CC..Hα-helixtrans-63.8-43.6176.4-82.2162.7000111.8L1216 M1238 L1241 V1242 C1245 L1250 K1251 N1256 V1257 I1258 M1281L1216-L1254 HydrophobicContact CD1-CG 4.45Å; L1216-L1254 HydrophobicContact CD2-CD2 3.67Å; L1216-L1254 HydrophobicContact CD2-CG 4.2Å; M1238-L1254 HydrophobicContact CB-CD2 4.45Å; M1238-L1254 HydrophobicContact CE-CD2 4.21Å; L1241-L1254 HydrophobicContact CB-CD1 4.24Å; L1241-L1254 HydrophobicContact CB-CD2 4.06Å; L1241-L1254 HydrophobicContact CD1-CD2 4.38Å; V1242-L1254 HydrophobicContact CG2-CD1 4Å; V1242-L1254 HydrophobicContact CG2-CD2 4.23Å; C1245-L1254 HydrophobicContact CB-CD1 4.48Å; L1250-L1254 HydrophobicContact CD1-CD1 3.82Å; L1250-L1254 HydrophobicContact CD1-CG 4.09Å; L1250-L1254 HydrophobicContact CG-CD1 3.95Å; L1250-L1254 WeakPolarHBondContact O-CB 3.3Å; L1250-L1254 WeakPolarHBondContact O-CG 3.36Å; L1250-L1254 PolarHBondContact O-N 2.74Å; K1251-L1254 PolarHBondContact O-N 2.69Å; L1254-N1256 VanDerWaalsContact C-N 3.28Å; L1254-N1256 PolarHBondContact O-N 2.97Å; L1254-V1257 PolarHBondContact O-N 3.4Å; L1254-V1257 VanDerWaalsContact O-N 3.17Å; L1254-I1258 WeakPolarHBondContact O-CB 3.5Å; L1254-I1258 VanDerWaalsContact O-CG1 3.27Å; L1254-I1258 WeakPolarHBondContact O-CG1 3.4Å; L1254-I1258 PolarHBondContact O-N 2.93Å; L1254-M1281 HydrophobicContact CB-CE 3.78Å; L1254-M1281 HydrophobicContact CB-SD 3.61Å; L1254-M1281 HydrophobicContact CD1-SD 4.29Å
1255T74.3Confident66.9Low0 Ų033.7 Ų33.70%017%0.169CC..Hα-helixtrans-54.3-45175.2-62.20000111.2K1251 C1259 W1278 M1281 I1302K1251-T1255 WeakPolarHBondContact O-CB 3.24Å; K1251-T1255 PolarHBondContact O-N 3.18Å; K1251-T1255 PolarHBondContact O-OG1 2.96Å; T1255-C1259 WeakPolarHBondContact O-CB 3.36Å; T1255-C1259 PolarHBondContact O-N 3.42Å; T1255-W1278 HydrophobicContact CG2-CH2 4.05Å; T1255-W1278 HydrophobicContact CG2-CZ3 3.54Å; T1255-M1281 WeakPolarHBondContact OG1-CE 3.47Å; T1255-I1302 HydrophobicContact CG2-CD1 4.41Å; T1255-I1302 HydrophobicContact CG2-CG1 3.98Å
1256N68.2Low66.4Low36 Ų3636.6 Ų36.619%0.19319%0.187CC..Hα-helixtrans-62.7-47.4177.2-73.3-11.3000112H1252 C1253 L1254 C1259 M1260 Q1308H1252-N1256 PolarHBondContact O-N 3.12Å; C1253-N1256 PolarHBondContact O-N 3.46Å; L1254-N1256 VanDerWaalsContact C-N 3.28Å; L1254-N1256 PolarHBondContact O-N 2.97Å; N1256-C1259 PolarHBondContact O-N 2.92Å; N1256-M1260 WeakPolarHBondContact O-CB 3.27Å; N1256-M1260 WeakPolarHBondContact O-CG 3.28Å; N1256-M1260 PolarHBondContact O-N 3.35Å; N1256-Q1308 PolarHBondContact OD1-NE2 2.79Å
1257V72.4Confident66.4Low10 Ų1031.6 Ų31.66%0.06117%0.168CC..Hα-helixtrans-65.7-43.2179.9178.20000111.5L1216 I1219 L1220 M1238 C1253 L1254 C1259 M1260 I1261L1216-V1257 HydrophobicContact CB-CG2 4.11Å; L1216-V1257 HydrophobicContact CD2-CG2 4.23Å; I1219-V1257 HydrophobicContact CG2-CG1 4.14Å; L1220-V1257 HydrophobicContact CB-CG1 4.48Å; L1220-V1257 HydrophobicContact CD1-CG1 4.4Å; M1238-V1257 HydrophobicContact CE-CB 4.01Å; M1238-V1257 HydrophobicContact CE-CG1 3.59Å; M1238-V1257 HydrophobicContact SD-CG1 3.98Å; C1253-V1257 WeakPolarHBondContact O-CG2 3.22Å; C1253-V1257 PolarHBondContact O-N 3.19Å; C1253-V1257 VanDerWaalsContact O-N 3.15Å; L1254-V1257 PolarHBondContact O-N 3.4Å; L1254-V1257 VanDerWaalsContact O-N 3.17Å; V1257-C1259 PolarHBondContact O-N 2.91Å; V1257-M1260 PolarHBondContact O-N 3.01Å; V1257-I1261 HydrophobicContact CG1-CD1 3.92Å; V1257-I1261 HydrophobicContact CG1-CG1 4.43Å; V1257-I1261 WeakPolarHBondContact O-CG1 3.46Å; V1257-I1261 PolarHBondContact O-N 3.19Å
1258I76.4Confident66.3Low0 Ų033 Ų330%018%0.18CC..Hα-helixtrans-59.6-47.5176-70.2169.5000110.3M1238 L1254 M1260 I1261 M1262 A1274 L1277 W1278 M1281M1238-I1258 HydrophobicContact CE-CB 4.42Å; M1238-I1258 HydrophobicContact CE-CD1 4.33Å; M1238-I1258 HydrophobicContact CE-CG1 3.37Å; L1254-I1258 WeakPolarHBondContact O-CB 3.5Å; L1254-I1258 VanDerWaalsContact O-CG1 3.27Å; L1254-I1258 WeakPolarHBondContact O-CG1 3.4Å; L1254-I1258 PolarHBondContact O-N 2.93Å; I1258-M1260 PolarHBondContact O-N 2.94Å; I1258-I1261 PolarHBondContact O-N 2.94Å; I1258-M1262 HydrophobicContact CG2-CE 3.68Å; I1258-M1262 HydrophobicContact CG2-SD 4.36Å; I1258-M1262 WeakPolarHBondContact O-CG 3.38Å; I1258-M1262 PolarHBondContact O-N 3.31Å; I1258-A1274 HydrophobicContact CG2-CB 4.39Å; I1258-A1274 WeakPolarHBondContact CG2-O 3.43Å; I1258-L1277 HydrophobicContact CD1-CB 3.83Å; I1258-L1277 HydrophobicContact CG1-CB 4.31Å; I1258-W1278 HydrophobicContact CG2-CB 4.19Å; I1258-M1281 HydrophobicContact CD1-SD 3.44Å; I1258-M1281 WeakPolarHBondContact CD1-SD 3.46Å
1259C69Low66.4Low2 Ų233.2 Ų33.21%0.01418%0.176CC..Hα-helixtrans-59.6-45.6176.4-168.60000111.4T1255 N1256 V1257 M1262 L1263 C1298 I1302T1255-C1259 WeakPolarHBondContact O-CB 3.36Å; T1255-C1259 PolarHBondContact O-N 3.42Å; N1256-C1259 PolarHBondContact O-N 2.92Å; V1257-C1259 PolarHBondContact O-N 2.91Å; C1259-M1262 PolarHBondContact O-N 3.4Å; C1259-L1263 WeakPolarHBondContact O-CB 3.48Å; C1259-L1263 WeakPolarHBondContact O-CD1 3.44Å; C1259-L1263 WeakPolarHBondContact O-CG 3.36Å; C1259-L1263 PolarHBondContact O-N 3.27Å; C1259-L1263 VanDerWaalsContact SG-CD1 3.53Å; C1259-C1298 HydrophobicContact CB-CB 3.95Å; C1259-I1302 HydrophobicContact CB-CD1 3.56Å; C1259-I1302 WeakPolarHBondContact SG-CD1 3.16Å
1260M65.3Low66.7Low30 Ų3028.7 Ų28.715%0.14815%0.152CC..Hα-helixtrans-63.1-43178.2-76.2-166.269.900112.8L1220 L1224 N1256 V1257 I1258 M1262 L1263 Q1264L1220-M1260 HydrophobicContact CD1-CB 3.62Å; L1220-M1260 HydrophobicContact CD1-CE 3.87Å; L1220-M1260 HydrophobicContact CD1-CG 4.26Å; L1220-M1260 HydrophobicContact CD1-SD 3.71Å; L1220-M1260 HydrophobicContact CD2-CE 3.96Å; L1220-M1260 HydrophobicContact CD2-SD 3.58Å; L1220-M1260 VanDerWaalsContact CD2-SD 3.58Å; L1220-M1260 HydrophobicContact CG-CE 4.33Å; L1220-M1260 HydrophobicContact CG-SD 4.26Å; L1224-M1260 HydrophobicContact CD1-CE 4.23Å; N1256-M1260 WeakPolarHBondContact O-CB 3.27Å; N1256-M1260 WeakPolarHBondContact O-CG 3.28Å; N1256-M1260 PolarHBondContact O-N 3.35Å; V1257-M1260 PolarHBondContact O-N 3.01Å; I1258-M1260 PolarHBondContact O-N 2.94Å; M1260-M1262 VanDerWaalsContact C-N 3.34Å; M1260-M1262 PolarHBondContact O-N 3.04Å; M1260-L1263 PolarHBondContact O-N 3.49Å; M1260-Q1264 WeakPolarHBondContact O-CB 3.47Å; M1260-Q1264 WeakPolarHBondContact O-CG 3.49Å; M1260-Q1264 PolarHBondContact O-N 3.05Å
1261I69.2Low67Low2 Ų229.8 Ų29.81%0.0116%0.156CC..Hα-helixtrans-60.9-44.3175.1-68.6169.3000110.6S1223 L1235 M1238 V1257 I1258 L1263 K1265 V1270 A1274S1223-I1261 WeakPolarHBondContact OG-CG1 3.03Å; L1235-I1261 HydrophobicContact CD2-CD1 4.16Å; L1235-I1261 HydrophobicContact CD2-CG2 4.46Å; M1238-I1261 HydrophobicContact CE-CD1 4.13Å; M1238-I1261 HydrophobicContact SD-CD1 3.56Å; M1238-I1261 VanDerWaalsContact SD-CD1 3.56Å; V1257-I1261 HydrophobicContact CG1-CD1 3.92Å; V1257-I1261 HydrophobicContact CG1-CG1 4.43Å; V1257-I1261 WeakPolarHBondContact O-CG1 3.46Å; V1257-I1261 PolarHBondContact O-N 3.19Å; I1258-I1261 PolarHBondContact O-N 2.94Å; I1261-L1263 VanDerWaalsContact C-N 3.33Å; I1261-L1263 PolarHBondContact O-N 3.19Å; I1261-K1265 WeakPolarHBondContact O-CB 3.35Å; I1261-K1265 PolarHBondContact O-N 3.21Å; I1261-V1270 HydrophobicContact CG2-CG1 3.94Å; I1261-A1274 HydrophobicContact CB-CB 4.49Å; I1261-A1274 HydrophobicContact CG2-CB 4Å
1262M68.6Low67.3Low1 Ų133.8 Ų33.81%0.00517%0.169CC..Hα-helixtrans-67.9-30.8179-72.3-170.3-57.900113.5I1258 C1259 M1260 R1271 A1274 A1275 C1294 L1295 C1298I1258-M1262 HydrophobicContact CG2-CE 3.68Å; I1258-M1262 HydrophobicContact CG2-SD 4.36Å; I1258-M1262 WeakPolarHBondContact O-CG 3.38Å; I1258-M1262 PolarHBondContact O-N 3.31Å; C1259-M1262 PolarHBondContact O-N 3.4Å; M1260-M1262 VanDerWaalsContact C-N 3.34Å; M1260-M1262 PolarHBondContact O-N 3.04Å; M1262-R1271 PolarHBondContact O-NE 3.38Å; M1262-R1271 PolarHBondContact O-NH2 2.92Å; M1262-A1274 HydrophobicContact CG-CB 3.61Å; M1262-A1274 HydrophobicContact SD-CB 4.35Å; M1262-A1275 HydrophobicContact SD-CB 4.24Å; M1262-C1294 HydrophobicContact CE-CB 4.32Å; M1262-C1294 HydrophobicContact SD-CB 4.01Å; M1262-L1295 HydrophobicContact CB-CB 4.47Å; M1262-L1295 HydrophobicContact CB-CD1 4.13Å; M1262-L1295 HydrophobicContact CE-CB 4.02Å; M1262-L1295 HydrophobicContact CE-CD1 4.24Å; M1262-L1295 HydrophobicContact SD-CB 4.34Å; M1262-C1298 HydrophobicContact CE-CB 4.13Å; M1262-C1298 WeakPolarHBondContact CE-SG 3.32Å
1263L60.2Low67.6Low12 Ų1232.9 Ų32.96%0.06317%0.165CC..Hα-helixtrans-78.5-36.5177.5-75.4164.3000113.1C1259 M1260 I1261 L1295 N1355C1259-L1263 WeakPolarHBondContact O-CB 3.48Å; C1259-L1263 WeakPolarHBondContact O-CD1 3.44Å; C1259-L1263 WeakPolarHBondContact O-CG 3.36Å; C1259-L1263 PolarHBondContact O-N 3.27Å; C1259-L1263 VanDerWaalsContact SG-CD1 3.53Å; M1260-L1263 PolarHBondContact O-N 3.49Å; I1261-L1263 VanDerWaalsContact C-N 3.33Å; I1261-L1263 PolarHBondContact O-N 3.19Å; L1263-L1295 HydrophobicContact CD1-CD1 4.34Å; L1263-L1295 HydrophobicContact CD2-CD1 3.81Å; L1263-L1295 HydrophobicContact CD2-CD2 3.95Å; L1263-L1295 HydrophobicContact CD2-CG 4.43Å; L1263-L1295 HydrophobicContact CG-CD1 3.66Å; L1263-L1295 HydrophobicContact CG-CD2 4.47Å; L1263-N1355 HydrophobicContact CD2-CB 4.41Å; L1263-N1355 WeakPolarHBondContact CD2-ND2 3.47Å
1264Q60.3Low68.1Low23 Ų2331.4 Ų31.411%0.10716%0.155CC..Hα-helixtrans-104.6-7.7-167.3-64.6-176.4-22.100114.5L1224 M1260 F1341 N1345L1224-Q1264 HydrophobicContact CD2-CB 3.61Å; L1224-Q1264 HydrophobicContact CD2-CG 4.31Å; M1260-Q1264 WeakPolarHBondContact O-CB 3.47Å; M1260-Q1264 WeakPolarHBondContact O-CG 3.49Å; M1260-Q1264 PolarHBondContact O-N 3.05Å; Q1264-F1341 HydrophobicContact CB-CE2 4.48Å; Q1264-F1341 HydrophobicContact CB-CZ 4.28Å; Q1264-F1341 HydrophobicContact CG-CZ 4.22Å; Q1264-N1345 PolarHBondContact O-OD1 2.64Å; Q1264-N1345 VanDerWaalsContact O-OD1 3.13Å
1265K61.5Low68.4Low22 Ų2231.5 Ų31.510%0.09616%0.156CC..  trans-107.5131.7178.1-73.7-66.1-175-176.10113.7S1223 L1224 Q1226 I1261 V1270 R1271S1223-K1265 WeakPolarHBondContact O-CE 3.33Å; S1223-K1265 PolarHBondContact O-NZ 3.43Å; L1224-K1265 PolarHBondContact O-NZ 3.5Å; L1224-K1265 VanDerWaalsContact O-NZ 3.08Å; Q1226-K1265 PolarHBondContact O-NZ 3.22Å; I1261-K1265 WeakPolarHBondContact O-CB 3.35Å; I1261-K1265 PolarHBondContact O-N 3.21Å; K1265-V1270 HydrophobicContact CB-CG1 4.38Å; K1265-V1270 HydrophobicContact CG-CG1 4.31Å; K1265-R1271 WeakPolarHBondContact O-CD 3.34Å; K1265-R1271 WeakPolarHBondContact O-CG 3.46Å
1266T51.9Low68.6Low81 Ų8134.1 Ų34.150%0.49717%0.172SC..  trans-78.9-20174.8550000114.2S1268 C1348T1266-S1268 PolarHBondContact O-N 3.45Å; T1266-C1348 VanDerWaalsContact CG2-SG 3.59Å
1267S62.5Low69.2Low39 Ų3932.7 Ų32.727%0.27317%0.165SC..  trans-69.2107.8-178.4-178.70000111.2W1269 V1270 R1271S1267-W1269 PolarHBondContact O-N 3.04Å; S1267-W1269 VanDerWaalsContact O-N 3.08Å; S1267-V1270 PolarHBondContact O-N 3.41Å; S1267-R1271 WeakPolarHBondContact O-CG 3.47Å; S1267-R1271 PolarHBondContact O-N 3.39Å
1268S63.3Low69.5Low74 Ų7432.2 Ų32.252%0.51716%0.162SC..Hα-helixtrans-52.2-34.7178.964.30000113.4T1266 R1272T1266-S1268 PolarHBondContact O-N 3.45Å; S1268-R1272 WeakPolarHBondContact O-CG 3.3Å; S1268-R1272 PolarHBondContact O-N 3.03Å
1269W66.6Low69.6Low111 Ų11132.5 Ų32.542%0.4216%0.163SC..Hα-helixtrans-77.7-36.1179.7-18082.7000113.3N1232 S1267 R1271 R1272 Q1273N1232-W1269 HydrophobicContact CB-CH2 3.92Å; N1232-W1269 HydrophobicContact CB-CZ3 4.23Å; N1232-W1269 WeakPolarHBondContact ND2-CH2 3.39Å; N1232-W1269 WeakPolarHBondContact ND2-CZ3 3.38Å; N1232-W1269 WeakPolarHBondContact OD1-CH2 3.37Å; N1232-W1269 WeakPolarHBondContact OD1-CZ3 3.33Å; S1267-W1269 PolarHBondContact O-N 3.04Å; S1267-W1269 VanDerWaalsContact O-N 3.08Å; W1269-R1271 VanDerWaalsContact C-N 3.34Å; W1269-R1272 PolarHBondContact O-N 3.23Å; W1269-Q1273 HydrophobicContact CD2-CG 4.49Å; W1269-Q1273 VanDerWaalsContact CZ2-CD 3.49Å; W1269-Q1273 HydrophobicContact CZ2-CG 4.14Å; W1269-Q1273 PolarHBondContact O-N 3.36Å
1270V67.7Low69.9Low2 Ų236.2 Ų36.21%0.01218%0.182CC..Hα-helixtrans-63.2-43.3170.5174.70000110.1A1231 L1235 I1261 K1265 S1267 R1272 Q1273 A1274A1231-V1270 HydrophobicContact CB-CG1 3.93Å; A1231-V1270 HydrophobicContact CB-CG2 3.89Å; L1235-V1270 HydrophobicContact CD1-CB 4.4Å; L1235-V1270 HydrophobicContact CD1-CG1 3.74Å; I1261-V1270 HydrophobicContact CG2-CG1 3.94Å; K1265-V1270 HydrophobicContact CB-CG1 4.38Å; K1265-V1270 HydrophobicContact CG-CG1 4.31Å; S1267-V1270 PolarHBondContact O-N 3.41Å; V1270-R1272 PolarHBondContact O-N 3.02Å; V1270-Q1273 PolarHBondContact O-N 3.2Å; V1270-A1274 PolarHBondContact O-N 3.41Å
1271R71.9Confident70.3Confident31 Ų3135.6 Ų35.612%0.11718%0.178CC..Hα-helixtrans-60.5-42.2174.5-62.6-179.487.5-157.9-8.3111.7M1262 K1265 S1267 W1269 A1274 A1275 P1291 E1292M1262-R1271 PolarHBondContact O-NE 3.38Å; M1262-R1271 PolarHBondContact O-NH2 2.92Å; K1265-R1271 WeakPolarHBondContact O-CD 3.34Å; K1265-R1271 WeakPolarHBondContact O-CG 3.46Å; S1267-R1271 WeakPolarHBondContact O-CG 3.47Å; S1267-R1271 PolarHBondContact O-N 3.39Å; W1269-R1271 VanDerWaalsContact C-N 3.34Å; R1271-A1274 PolarHBondContact O-N 3.21Å; R1271-A1275 WeakPolarHBondContact O-CB 3.45Å; R1271-A1275 PolarHBondContact O-N 3.36Å; R1271-P1291 HydrophobicContact CB-CB 3.89Å; R1271-P1291 HydrophobicContact CB-CG 4.25Å; R1271-E1292 IonicContact CZ-OE1 3.36Å; R1271-E1292 IonicContact NH1-OE1 2.96Å; R1271-E1292 PolarHBondContact NH1-OE1 3.09Å; R1271-E1292 VanDerWaalsContact NH2-CD 3.27Å; R1271-E1292 IonicContact NH2-OE1 3.3Å; R1271-E1292 PolarHBondContact NH2-OE1 3.48Å; R1271-E1292 IonicContact NH2-OE2 3.38Å; R1271-E1292 PolarHBondContact NH2-OE2 3.46Å
1272R75.1Confident70.5Confident141 Ų14137.4 Ų37.453%0.53219%0.187SC..Hα-helixtrans-60.9-43.2173.4-78.2-179.8-158163.95.1113S1268 W1269 V1270 A1275 T1276 P1291S1268-R1272 WeakPolarHBondContact O-CG 3.3Å; S1268-R1272 PolarHBondContact O-N 3.03Å; W1269-R1272 PolarHBondContact O-N 3.23Å; V1270-R1272 PolarHBondContact O-N 3.02Å; R1272-A1275 WeakPolarHBondContact O-CB 3.39Å; R1272-A1275 PolarHBondContact O-N 3.18Å; R1272-T1276 PolarHBondContact O-N 3.5Å; R1272-T1276 PolarHBondContact O-OG1 2.86Å; R1272-P1291 HydrophobicContact CB-CG 4.3Å; R1272-P1291 HydrophobicContact CG-CG 3.56Å
1273Q74.9Confident69.9Low43 Ų4342.2 Ų42.220%0.20122%0.218CC..Hα-helixtrans-65.2-41176.5-74.9-157.4-31.500112.3L1235 W1269 V1270 A1275 T1276 L1277L1235-Q1273 HydrophobicContact CB-CB 4.44Å; L1235-Q1273 HydrophobicContact CD1-CB 3.59Å; L1235-Q1273 HydrophobicContact CG-CB 4.43Å; W1269-Q1273 HydrophobicContact CD2-CG 4.49Å; W1269-Q1273 VanDerWaalsContact CZ2-CD 3.49Å; W1269-Q1273 HydrophobicContact CZ2-CG 4.14Å; W1269-Q1273 PolarHBondContact O-N 3.36Å; V1270-Q1273 PolarHBondContact O-N 3.2Å; Q1273-A1275 VanDerWaalsContact C-N 3.28Å; Q1273-A1275 PolarHBondContact O-N 3.07Å; Q1273-T1276 WeakPolarHBondContact O-CB 3.35Å; Q1273-T1276 PolarHBondContact O-N 3.45Å; Q1273-T1276 VanDerWaalsContact O-N 3.17Å; Q1273-L1277 WeakPolarHBondContact O-CG 3.47Å; Q1273-L1277 PolarHBondContact O-N 3.24Å
1274A77.2Confident69.8Low0 Ų048.9 Ų48.90%025%0.254CS..Hα-helixtrans-61-38.4172.900000112L1235 I1258 I1261 M1262 V1270 R1271 L1277 W1278L1235-A1274 HydrophobicContact CD2-CB 3.9Å; I1258-A1274 HydrophobicContact CG2-CB 4.39Å; I1258-A1274 WeakPolarHBondContact CG2-O 3.43Å; I1261-A1274 HydrophobicContact CB-CB 4.49Å; I1261-A1274 HydrophobicContact CG2-CB 4Å; M1262-A1274 HydrophobicContact CG-CB 3.61Å; M1262-A1274 HydrophobicContact SD-CB 4.35Å; V1270-A1274 PolarHBondContact O-N 3.41Å; R1271-A1274 PolarHBondContact O-N 3.21Å; A1274-L1277 WeakPolarHBondContact O-CB 3.28Å; A1274-L1277 PolarHBondContact O-N 3.49Å; A1274-W1278 PolarHBondContact O-N 3.33Å
1275A78.9Confident69.3Low1 Ų151.6 Ų51.61%0.00827%0.265CS..Hα-helixtrans-65.4-36.2173.500000112.9M1262 R1271 R1272 Q1273 W1278 C1279 P1291 C1294M1262-A1275 HydrophobicContact SD-CB 4.24Å; R1271-A1275 WeakPolarHBondContact O-CB 3.45Å; R1271-A1275 PolarHBondContact O-N 3.36Å; R1272-A1275 WeakPolarHBondContact O-CB 3.39Å; R1272-A1275 PolarHBondContact O-N 3.18Å; Q1273-A1275 VanDerWaalsContact C-N 3.28Å; Q1273-A1275 PolarHBondContact O-N 3.07Å; A1275-W1278 WeakPolarHBondContact O-CB 3.24Å; A1275-W1278 PolarHBondContact O-N 3.46Å; A1275-C1279 PolarHBondContact O-N 3.11Å; A1275-C1279 VanDerWaalsContact O-N 3.12Å; A1275-P1291 HydrophobicContact CB-CB 4.2Å; A1275-P1291 HydrophobicContact CB-CG 4.36Å; A1275-C1294 HydrophobicContact CB-CB 3.77Å
1276T80Confident68.6Low56 Ų5651.6 Ų51.634%0.34427%0.271SS..Hα-helixtrans-63.3-43.9171.8-52.50000111.1R1272 Q1273 W1278 C1279 M1280R1272-T1276 PolarHBondContact O-N 3.5Å; R1272-T1276 PolarHBondContact O-OG1 2.86Å; Q1273-T1276 WeakPolarHBondContact O-CB 3.35Å; Q1273-T1276 PolarHBondContact O-N 3.45Å; Q1273-T1276 VanDerWaalsContact O-N 3.17Å; T1276-W1278 VanDerWaalsContact C-N 3.3Å; T1276-W1278 PolarHBondContact O-N 3.43Å; T1276-C1279 PolarHBondContact O-N 3.19Å; T1276-C1279 VanDerWaalsContact O-N 3.12Å; T1276-M1280 HydrophobicContact CG2-SD 4.27Å; T1276-M1280 WeakPolarHBondContact O-CG 3.18Å; T1276-M1280 PolarHBondContact O-N 2.93Å
1277L79.8Confident68.4Low6 Ų655.4 Ų55.43%0.03128%0.283CS..Hα-helixtrans-59.3-41.6176-66.1173.6000112.3L1235 M1238 D1239 V1242 I1258 Q1273 A1274 C1279 M1280 M1281L1235-L1277 HydrophobicContact CB-CD1 4.22Å; L1235-L1277 HydrophobicContact CD2-CD1 3.48Å; L1235-L1277 VanDerWaalsContact CD2-CD1 3.48Å; L1235-L1277 HydrophobicContact CG-CD1 4.48Å; M1238-L1277 HydrophobicContact CB-CD1 3.53Å; M1238-L1277 HydrophobicContact CB-CD2 4.33Å; M1238-L1277 HydrophobicContact CE-CD1 4.18Å; M1238-L1277 HydrophobicContact CG-CD1 4.45Å; M1238-L1277 HydrophobicContact SD-CD1 4.14Å; D1239-L1277 HydrophobicContact CB-CD2 3.54Å; V1242-L1277 HydrophobicContact CG2-CB 4.45Å; V1242-L1277 HydrophobicContact CG2-CD2 4.39Å; I1258-L1277 HydrophobicContact CD1-CB 3.83Å; I1258-L1277 HydrophobicContact CG1-CB 4.31Å; Q1273-L1277 WeakPolarHBondContact O-CG 3.47Å; Q1273-L1277 PolarHBondContact O-N 3.24Å; A1274-L1277 WeakPolarHBondContact O-CB 3.28Å; A1274-L1277 PolarHBondContact O-N 3.49Å; L1277-C1279 VanDerWaalsContact C-N 3.34Å; L1277-C1279 PolarHBondContact O-N 2.85Å; L1277-M1280 PolarHBondContact O-N 3.49Å; L1277-M1281 PolarHBondContact O-N 3.04Å
1278W79.5Confident67.9Low0 Ų060.9 Ų60.90%031%0.309CS..Hα-helixtrans-55.9-49.1172.9175.7-105.7000111.5T1255 I1258 A1274 A1275 T1276 M1280 M1281 H1282 C1294 E1297 C1298 E1301T1255-W1278 HydrophobicContact CG2-CH2 4.05Å; T1255-W1278 HydrophobicContact CG2-CZ3 3.54Å; I1258-W1278 HydrophobicContact CG2-CB 4.19Å; A1274-W1278 PolarHBondContact O-N 3.33Å; A1275-W1278 WeakPolarHBondContact O-CB 3.24Å; A1275-W1278 PolarHBondContact O-N 3.46Å; T1276-W1278 VanDerWaalsContact C-N 3.3Å; T1276-W1278 PolarHBondContact O-N 3.43Å; W1278-M1280 VanDerWaalsContact C-N 3.28Å; W1278-M1280 PolarHBondContact O-N 3.13Å; W1278-M1281 WeakPolarHBondContact O-CB 3.47Å; W1278-M1281 PolarHBondContact O-N 3.14Å; W1278-M1281 VanDerWaalsContact O-N 3.15Å; W1278-H1282 AromaticContact CD2-CD2 3.95Å; W1278-H1282 AromaticContact CE2-CD2 3.87Å; W1278-H1282 AromaticContact CE3-CD2 3.99Å; W1278-H1282 AromaticContact CE3-NE2 3.99Å; W1278-H1282 AromaticContact CH2-CD2 3.99Å; W1278-H1282 AromaticContact CH2-NE2 3.5Å; W1278-H1282 AromaticContact CZ2-CD2 3.92Å; W1278-H1282 AromaticContact CZ2-NE2 3.86Å; W1278-H1282 AromaticContact CZ3-NE2 3.55Å; W1278-H1282 PolarHBondContact O-CD2 2.9Å; W1278-H1282 PolarHBondContact O-N 3.29Å; W1278-C1294 HydrophobicContact CB-CB 4.15Å; W1278-C1294 VanDerWaalsContact CD1-SG 3.54Å; W1278-C1294 HydrophobicContact CG-CB 3.97Å; W1278-E1297 HydrophobicContact CZ2-CB 3.79Å; W1278-E1297 PolarHBondContact NE1-OE2 3.05Å; W1278-C1298 HydrophobicContact CH2-CB 4.4Å; W1278-C1298 HydrophobicContact CZ3-CB 4.41Å; W1278-C1298 WeakPolarHBondContact CZ3-SG 3.49Å; W1278-E1301 HydrophobicContact CH2-CB 3.79Å; W1278-E1301 HydrophobicContact CH2-CG 4.17Å; W1278-E1301 WeakPolarHBondContact CH2-OE2 3.42Å; W1278-E1301 HydrophobicContact CZ2-CB 4.42Å
1279C78Confident67.5Low5 Ų558.6 Ų58.63%0.03429%0.293CS..Hα-helixtrans-64.6-33.1178.3-71.40000113.3A1275 T1276 L1277 M1281 H1282 T1289A1275-C1279 PolarHBondContact O-N 3.11Å; A1275-C1279 VanDerWaalsContact O-N 3.12Å; T1276-C1279 PolarHBondContact O-N 3.19Å; T1276-C1279 VanDerWaalsContact O-N 3.12Å; L1277-C1279 VanDerWaalsContact C-N 3.34Å; L1277-C1279 PolarHBondContact O-N 2.85Å; C1279-M1281 VanDerWaalsContact C-N 3.34Å; C1279-H1282 CarbonylContact O-C 3.47Å; C1279-H1282 PolarHBondContact O-N 3.17Å; C1279-H1282 VanDerWaalsContact O-O 3.07Å; C1279-T1289 PolarHBondContact SG-OG1 3.05Å
1280M76.2Confident67.5Low81 Ų8158.6 Ų58.640%0.39930%0.297SS..Hα-helixtrans-68.3-32.8175.1-68.2179.177.100112.6D1239 V1242 T1276 L1277 W1278 H1282D1239-M1280 WeakPolarHBondContact OD1-CE 3.43Å; V1242-M1280 HydrophobicContact CG1-CB 3.6Å; T1276-M1280 HydrophobicContact CG2-SD 4.27Å; T1276-M1280 WeakPolarHBondContact O-CG 3.18Å; T1276-M1280 PolarHBondContact O-N 2.93Å; L1277-M1280 PolarHBondContact O-N 3.49Å; W1278-M1280 VanDerWaalsContact C-N 3.28Å; W1278-M1280 PolarHBondContact O-N 3.13Å; M1280-H1282 VanDerWaalsContact C-N 3.26Å; M1280-H1282 PolarHBondContact O-N 3.41Å
1281M74.1Confident67.3Low16 Ų1659 Ų598%0.07930%0.299CS..Hα-helixtrans-68.1-27.5171.8-69.8177.856.800112.7V1242 K1251 L1254 T1255 I1258 L1277 W1278 C1279 P1283V1242-M1281 HydrophobicContact CB-CG 3.99Å; V1242-M1281 HydrophobicContact CG1-CB 4.24Å; V1242-M1281 HydrophobicContact CG1-CG 3.39Å; V1242-M1281 HydrophobicContact CG2-CG 3.49Å; V1242-M1281 VanDerWaalsContact CG2-CG 3.49Å; V1242-M1281 HydrophobicContact CG2-SD 3.84Å; K1251-M1281 HydrophobicContact CB-CE 3.98Å; K1251-M1281 HydrophobicContact CG-CE 4.34Å; K1251-M1281 VanDerWaalsContact O-CE 3.3Å; K1251-M1281 WeakPolarHBondContact O-CE 3.37Å; L1254-M1281 HydrophobicContact CB-CE 3.78Å; L1254-M1281 HydrophobicContact CB-SD 3.61Å; L1254-M1281 HydrophobicContact CD1-SD 4.29Å; T1255-M1281 WeakPolarHBondContact OG1-CE 3.47Å; I1258-M1281 HydrophobicContact CD1-SD 3.44Å; I1258-M1281 WeakPolarHBondContact CD1-SD 3.46Å; L1277-M1281 PolarHBondContact O-N 3.04Å; W1278-M1281 WeakPolarHBondContact O-CB 3.47Å; W1278-M1281 PolarHBondContact O-N 3.14Å; W1278-M1281 VanDerWaalsContact O-N 3.15Å; C1279-M1281 VanDerWaalsContact C-N 3.34Å; M1281-P1283 VanDerWaalsContact C-CD 3.46Å; M1281-P1283 WeakPolarHBondContact O-CD 3.32Å
1282H72.4Confident66.9Low41 Ų4159.5 Ų59.519%0.1930%0.303CS..SBendtrans-120.969.4179.9-59.6-80.4000110.9W1278 C1279 M1280 N1284 K1285 E1301W1278-H1282 AromaticContact CD2-CD2 3.95Å; W1278-H1282 AromaticContact CE2-CD2 3.87Å; W1278-H1282 AromaticContact CE3-CD2 3.99Å; W1278-H1282 AromaticContact CE3-NE2 3.99Å; W1278-H1282 AromaticContact CH2-CD2 3.99Å; W1278-H1282 AromaticContact CH2-NE2 3.5Å; W1278-H1282 AromaticContact CZ2-CD2 3.92Å; W1278-H1282 AromaticContact CZ2-NE2 3.86Å; W1278-H1282 AromaticContact CZ3-NE2 3.55Å; W1278-H1282 PolarHBondContact O-CD2 2.9Å; W1278-H1282 PolarHBondContact O-N 3.29Å; C1279-H1282 CarbonylContact O-C 3.47Å; C1279-H1282 PolarHBondContact O-N 3.17Å; C1279-H1282 VanDerWaalsContact O-O 3.07Å; M1280-H1282 VanDerWaalsContact C-N 3.26Å; M1280-H1282 PolarHBondContact O-N 3.41Å; H1282-N1284 PolarHBondContact O-N 2.82Å; H1282-K1285 HydrophobicContact CB-CD 4.2Å; H1282-K1285 WeakPolarHBondContact O-CB 3.39Å; H1282-K1285 PolarHBondContact O-N 3.45Å; H1282-E1301 IonicContact CE1-OE1 2.72Å; H1282-E1301 PolarHBondContact CE1-OE1 2.92Å; H1282-E1301 VanDerWaalsContact CE1-OE1 3.23Å; H1282-E1301 IonicContact CE1-OE2 3.14Å; H1282-E1301 PolarHBondContact CE1-OE2 3.05Å; H1282-E1301 IonicContact NE2-OE1 2.76Å; H1282-E1301 IonicContact NE2-OE2 3.44Å; H1282-E1301 PolarHBondContact NE2-OE2 2.89Å
1283P56.8Low66.3Low101 Ų10155.6 Ų55.666%0.65629%0.291SS*.THydrogen-bonded Turntrans-60.1-13.6-169.122-33.2000114.8M1281 K1285M1281-P1283 VanDerWaalsContact C-CD 3.46Å; M1281-P1283 WeakPolarHBondContact O-CD 3.32Å; P1283-K1285 PolarHBondContact O-N 3.29Å; P1283-K1285 VanDerWaalsContact O-N 3.16Å
1284N56.4Low66.1Low153 Ų15353.5 Ų53.582%0.81828%0.281SS*.THydrogen-bonded Turntrans-66.8-4.5169.1-69.4-15.4000113.4R264 H1282R264-N1284 PolarHBondContact NH2-O 2.83Å; H1282-N1284 PolarHBondContact O-N 2.82Å
1285K50Low65.5Low80 Ų8053.6 Ų53.635%0.34828%0.282SS..SBendtrans-117.4139-179.2-59.7-179.8177.8177.80110.9R264 H1282 P1283 E1297R264-K1285 VanDerWaalsContact NH2-N 3.2Å; R264-K1285 PolarHBondContact NH2-O 3.33Å; H1282-K1285 HydrophobicContact CB-CD 4.2Å; H1282-K1285 WeakPolarHBondContact O-CB 3.39Å; H1282-K1285 PolarHBondContact O-N 3.45Å; P1283-K1285 PolarHBondContact O-N 3.29Å; P1283-K1285 VanDerWaalsContact O-N 3.16Å; K1285-E1297 WeakPolarHBondContact CD-OE2 3.39Å; K1285-E1297 IonicContact NZ-OE2 3.85Å; K1285-E1297 PolarHBondContact NZ-OE2 3.31Å
1286G47.2Very low64.6Low21 Ų2156.9 Ų56.922%0.21630%0.299CS..  trans-75.2160.6-168.300000113.2R264 D1288R264-G1286 VanDerWaalsContact CZ-N 3.31Å; G1286-D1288 PolarHBondContact O-N 3.46Å
1287E48.2Very low63.9Low162 Ų16255.7 Ų55.776%0.75729%0.29SS*.THydrogen-bonded Turntrans-66.4-13.9-176.5-68.4-177.1164.100114.9
1288D52.1Low63.2Low153 Ų15355.4 Ų55.482%0.81829%0.288SS*.THydrogen-bonded Turntrans-98.520.3-170.9-80.4-30.9000115.5G1286G1286-D1288 PolarHBondContact O-N 3.46Å
1289T55Low62.2Low27 Ų2756.3 Ų56.317%0.16629%0.293CS..  trans-73.1137.8179.345.50000112.8C1279 C1294C1279-T1289 PolarHBondContact SG-OG1 3.05Å; T1289-C1294 VanDerWaalsContact CB-SG 3.59Å; T1289-C1294 PolarHBondContact OG1-SG 3.45Å
1290H66.1Low61.3Low111 Ų11162.3 Ų62.351%0.51432%0.324SS..  trans-65.8143.1177.9-166.4-98.6000110.9E1292 Q1293 C1294H1290-E1292 PolarHBondContact ND1-N 3.02Å; H1290-E1292 PolarHBondContact O-N 3.29Å; H1290-E1292 VanDerWaalsContact O-N 3.17Å; H1290-Q1293 HydrophobicContact CB-CB 4.42Å; H1290-Q1293 WeakPolarHBondContact O-CA 3.49Å; H1290-Q1293 WeakPolarHBondContact O-CB 3.49Å; H1290-Q1293 PolarHBondContact O-N 3.34Å; H1290-C1294 PolarHBondContact O-N 3.44Å
1291P64.1Low60.6Low9 Ų961 Ų616%0.05832%0.317CS..Hα-helixtrans-55.8-35.9-179.2-24.431.9000114.6R1271 R1272 A1275 Q1293 C1294 L1295R1271-P1291 HydrophobicContact CB-CB 3.89Å; R1271-P1291 HydrophobicContact CB-CG 4.25Å; R1272-P1291 HydrophobicContact CB-CG 4.3Å; R1272-P1291 HydrophobicContact CG-CG 3.56Å; A1275-P1291 HydrophobicContact CB-CB 4.2Å; A1275-P1291 HydrophobicContact CB-CG 4.36Å; P1291-Q1293 VanDerWaalsContact C-N 3.31Å; P1291-Q1293 PolarHBondContact O-N 3Å; P1291-C1294 PolarHBondContact O-N 2.85Å; P1291-L1295 VanDerWaalsContact O-CB 3.24Å; P1291-L1295 WeakPolarHBondContact O-CB 3.18Å; P1291-L1295 PolarHBondContact O-N 3.25Å
1292E62.7Low60Low42 Ų4260.4 Ų60.420%0.19631%0.314CS..Hα-helixtrans-67.7-31.7176.5-61.7-61.916200112.7R1271 H1290 N1296R1271-E1292 IonicContact CZ-OE1 3.36Å; R1271-E1292 IonicContact NH1-OE1 2.96Å; R1271-E1292 PolarHBondContact NH1-OE1 3.09Å; R1271-E1292 VanDerWaalsContact NH2-CD 3.27Å; R1271-E1292 IonicContact NH2-OE1 3.3Å; R1271-E1292 PolarHBondContact NH2-OE1 3.48Å; R1271-E1292 IonicContact NH2-OE2 3.38Å; R1271-E1292 PolarHBondContact NH2-OE2 3.46Å; H1290-E1292 PolarHBondContact ND1-N 3.02Å; H1290-E1292 PolarHBondContact O-N 3.29Å; H1290-E1292 VanDerWaalsContact O-N 3.17Å; E1292-N1296 WeakPolarHBondContact O-CB 3.32Å; E1292-N1296 PolarHBondContact O-N 2.88Å; E1292-N1296 PolarHBondContact O-ND2 2.72Å
1293Q63.3Low58.9Low59 Ų5959.2 Ų59.228%0.27631%0.313SS..Hα-helixtrans-70.7-49174.7-174.6-175.1-9.600110H1290 P1291 L1295 N1296 E1297H1290-Q1293 HydrophobicContact CB-CB 4.42Å; H1290-Q1293 WeakPolarHBondContact O-CA 3.49Å; H1290-Q1293 WeakPolarHBondContact O-CB 3.49Å; H1290-Q1293 PolarHBondContact O-N 3.34Å; P1291-Q1293 VanDerWaalsContact C-N 3.31Å; P1291-Q1293 PolarHBondContact O-N 3Å; Q1293-L1295 PolarHBondContact O-N 2.95Å; Q1293-N1296 PolarHBondContact O-N 3.19Å; Q1293-E1297 PolarHBondContact NE2-OE1 3.27Å; Q1293-E1297 VanDerWaalsContact NE2-OE1 3.14Å; Q1293-E1297 WeakPolarHBondContact O-CB 3.25Å; Q1293-E1297 VanDerWaalsContact O-CG 3.29Å; Q1293-E1297 WeakPolarHBondContact O-CG 3.47Å; Q1293-E1297 PolarHBondContact O-N 3.37Å
1294C70Confident58.9Low0 Ų058.7 Ų58.70%031%0.312CS..Hα-helixtrans-59.3-35.6174.1-65.30000111.7M1262 A1275 W1278 T1289 H1290 P1291 C1298M1262-C1294 HydrophobicContact CE-CB 4.32Å; M1262-C1294 HydrophobicContact SD-CB 4.01Å; A1275-C1294 HydrophobicContact CB-CB 3.77Å; W1278-C1294 HydrophobicContact CB-CB 4.15Å; W1278-C1294 VanDerWaalsContact CD1-SG 3.54Å; W1278-C1294 HydrophobicContact CG-CB 3.97Å; T1289-C1294 VanDerWaalsContact CB-SG 3.59Å; T1289-C1294 PolarHBondContact OG1-SG 3.45Å; H1290-C1294 PolarHBondContact O-N 3.44Å; P1291-C1294 PolarHBondContact O-N 2.85Å; C1294-C1298 VanDerWaalsContact O-CB 3.27Å; C1294-C1298 WeakPolarHBondContact O-CB 3.35Å; C1294-C1298 PolarHBondContact O-N 3.26Å; C1294-C1298 PolarHBondContact O-SG 2.88Å
1295L65Low58.7Low1 Ų152.7 Ų52.71%0.00528%0.282CS..Hα-helixtrans-66.6-48.7174.5176.759.7000112M1262 L1263 P1291 Q1293 E1297 C1298 L1299M1262-L1295 HydrophobicContact CB-CB 4.47Å; M1262-L1295 HydrophobicContact CB-CD1 4.13Å; M1262-L1295 HydrophobicContact CE-CB 4.02Å; M1262-L1295 HydrophobicContact CE-CD1 4.24Å; M1262-L1295 HydrophobicContact SD-CB 4.34Å; L1263-L1295 HydrophobicContact CD1-CD1 4.34Å; L1263-L1295 HydrophobicContact CD2-CD1 3.81Å; L1263-L1295 HydrophobicContact CD2-CD2 3.95Å; L1263-L1295 HydrophobicContact CD2-CG 4.43Å; L1263-L1295 HydrophobicContact CG-CD1 3.66Å; L1263-L1295 HydrophobicContact CG-CD2 4.47Å; P1291-L1295 VanDerWaalsContact O-CB 3.24Å; P1291-L1295 WeakPolarHBondContact O-CB 3.18Å; P1291-L1295 PolarHBondContact O-N 3.25Å; Q1293-L1295 PolarHBondContact O-N 2.95Å; L1295-E1297 VanDerWaalsContact C-N 3.27Å; L1295-E1297 PolarHBondContact O-N 3.21Å; L1295-C1298 WeakPolarHBondContact O-CB 3.34Å; L1295-C1298 PolarHBondContact O-N 2.6Å; L1295-L1299 HydrophobicContact CD1-CD1 4.18Å; L1295-L1299 HydrophobicContact CD1-CG 4.13Å; L1295-L1299 HydrophobicContact CG-CD1 4.08Å; L1295-L1299 HydrophobicContact CG-CG 4.47Å; L1295-L1299 WeakPolarHBondContact O-CB 3.49Å; L1295-L1299 VanDerWaalsContact O-CG 3.22Å; L1295-L1299 WeakPolarHBondContact O-CG 3.45Å; L1295-L1299 PolarHBondContact O-N 3.37Å
1296N58.8Low58.8Low70 Ų7055.2 Ų55.237%0.37429%0.289SS..Hα-helixtrans-60.1-39.7175.4-79.3-31.4000111.6E1292 Q1293 L1299 L1300E1292-N1296 WeakPolarHBondContact O-CB 3.32Å; E1292-N1296 PolarHBondContact O-N 2.88Å; E1292-N1296 PolarHBondContact O-ND2 2.72Å; Q1293-N1296 PolarHBondContact O-N 3.19Å; N1296-L1299 PolarHBondContact O-N 3.24Å; N1296-L1300 WeakPolarHBondContact O-CB 3.31Å; N1296-L1300 VanDerWaalsContact O-CG 3.24Å; N1296-L1300 WeakPolarHBondContact O-CG 3.44Å; N1296-L1300 PolarHBondContact O-N 3.37Å
1297E65.3Low58.9Low31 Ų3157.4 Ų57.415%0.14530%0.298CS..Hα-helixtrans-67.1-43.8175.2-70.5179.3-166.600112.3W1278 K1285 Q1293 L1295 L1299 L1300 E1301W1278-E1297 HydrophobicContact CZ2-CB 3.79Å; W1278-E1297 PolarHBondContact NE1-OE2 3.05Å; K1285-E1297 WeakPolarHBondContact CD-OE2 3.39Å; K1285-E1297 IonicContact NZ-OE2 3.85Å; K1285-E1297 PolarHBondContact NZ-OE2 3.31Å; Q1293-E1297 PolarHBondContact NE2-OE1 3.27Å; Q1293-E1297 VanDerWaalsContact NE2-OE1 3.14Å; Q1293-E1297 WeakPolarHBondContact O-CB 3.25Å; Q1293-E1297 VanDerWaalsContact O-CG 3.29Å; Q1293-E1297 WeakPolarHBondContact O-CG 3.47Å; Q1293-E1297 PolarHBondContact O-N 3.37Å; L1295-E1297 VanDerWaalsContact C-N 3.27Å; L1295-E1297 PolarHBondContact O-N 3.21Å; E1297-L1299 VanDerWaalsContact C-N 3.28Å; E1297-L1299 PolarHBondContact O-N 3.31Å; E1297-L1300 PolarHBondContact O-N 3.44Å; E1297-E1301 WeakPolarHBondContact O-CB 3.26Å; E1297-E1301 PolarHBondContact O-N 2.91Å
1298C66Low59Low0 Ų050 Ų500%026%0.263CS..Hα-helixtrans-54.9-47.2170.8-78.40000110.3C1259 M1262 W1278 C1294 L1295 L1300 E1301 I1302C1259-C1298 HydrophobicContact CB-CB 3.95Å; M1262-C1298 HydrophobicContact CE-CB 4.13Å; M1262-C1298 WeakPolarHBondContact CE-SG 3.32Å; W1278-C1298 HydrophobicContact CH2-CB 4.4Å; W1278-C1298 HydrophobicContact CZ3-CB 4.41Å; W1278-C1298 WeakPolarHBondContact CZ3-SG 3.49Å; C1294-C1298 VanDerWaalsContact O-CB 3.27Å; C1294-C1298 WeakPolarHBondContact O-CB 3.35Å; C1294-C1298 PolarHBondContact O-N 3.26Å; C1294-C1298 PolarHBondContact O-SG 2.88Å; L1295-C1298 WeakPolarHBondContact O-CB 3.34Å; L1295-C1298 PolarHBondContact O-N 2.6Å; C1298-L1300 PolarHBondContact O-N 3.18Å; C1298-E1301 PolarHBondContact O-N 3.49Å; C1298-I1302 WeakPolarHBondContact O-CB 3.49Å; C1298-I1302 WeakPolarHBondContact O-CD1 3Å; C1298-I1302 WeakPolarHBondContact O-CG1 3.4Å; C1298-I1302 PolarHBondContact O-N 3.25Å
1299L58.9Low59.1Low19 Ų1945.7 Ų45.710%0.09924%0.236CC..Hα-helixtrans-64.3-37.6178.5-71.2171.2000112.1L1295 N1296 E1297 G1303 L1359L1295-L1299 HydrophobicContact CD1-CD1 4.18Å; L1295-L1299 HydrophobicContact CD1-CG 4.13Å; L1295-L1299 HydrophobicContact CG-CD1 4.08Å; L1295-L1299 HydrophobicContact CG-CG 4.47Å; L1295-L1299 WeakPolarHBondContact O-CB 3.49Å; L1295-L1299 VanDerWaalsContact O-CG 3.22Å; L1295-L1299 WeakPolarHBondContact O-CG 3.45Å; L1295-L1299 PolarHBondContact O-N 3.37Å; N1296-L1299 PolarHBondContact O-N 3.24Å; E1297-L1299 VanDerWaalsContact C-N 3.28Å; E1297-L1299 PolarHBondContact O-N 3.31Å; L1299-G1303 WeakPolarHBondContact O-CA 3.2Å; L1299-G1303 PolarHBondContact O-N 2.82Å; L1299-L1359 HydrophobicContact CD2-CD2 3.97Å; L1299-L1359 HydrophobicContact CD2-CG 4.41Å
1300L59.2Low58.9Low131 Ų13146.4 Ų46.469%0.68624%0.238SC*.Hα-helixtrans-68.7-40.6174.7-75168.4000112.1N1296 E1297 C1298 G1303 S1304N1296-L1300 WeakPolarHBondContact O-CB 3.31Å; N1296-L1300 VanDerWaalsContact O-CG 3.24Å; N1296-L1300 WeakPolarHBondContact O-CG 3.44Å; N1296-L1300 PolarHBondContact O-N 3.37Å; E1297-L1300 PolarHBondContact O-N 3.44Å; C1298-L1300 PolarHBondContact O-N 3.18Å; L1300-G1303 CarbonylContact O-C 3.35Å; L1300-G1303 VanDerWaalsContact O-CA 3.22Å; L1300-G1303 WeakPolarHBondContact O-CA 3.48Å; L1300-G1303 PolarHBondContact O-N 2.98Å; L1300-G1303 VanDerWaalsContact O-N 3.11Å; L1300-S1304 PolarHBondContact O-N 3.03Å
1301E62.1Low58.2Low55 Ų5543.4 Ų43.426%0.25723%0.227SC..Hα-helixtrans-70.5-43.2177.8-169.3159.2150.200111.4W1278 H1282 E1297 C1298 G1303 S1304W1278-E1301 HydrophobicContact CH2-CB 3.79Å; W1278-E1301 HydrophobicContact CH2-CG 4.17Å; W1278-E1301 WeakPolarHBondContact CH2-OE2 3.42Å; W1278-E1301 HydrophobicContact CZ2-CB 4.42Å; H1282-E1301 IonicContact CE1-OE1 2.72Å; H1282-E1301 PolarHBondContact CE1-OE1 2.92Å; H1282-E1301 VanDerWaalsContact CE1-OE1 3.23Å; H1282-E1301 IonicContact CE1-OE2 3.14Å; H1282-E1301 PolarHBondContact CE1-OE2 3.05Å; H1282-E1301 IonicContact NE2-OE1 2.76Å; H1282-E1301 IonicContact NE2-OE2 3.44Å; H1282-E1301 PolarHBondContact NE2-OE2 2.89Å; E1297-E1301 WeakPolarHBondContact O-CB 3.26Å; E1297-E1301 PolarHBondContact O-N 2.91Å; C1298-E1301 PolarHBondContact O-N 3.49Å; E1301-G1303 PolarHBondContact O-N 2.84Å; E1301-S1304 VanDerWaalsContact O-CB 3.32Å; E1301-S1304 WeakPolarHBondContact O-CB 3.34Å; E1301-S1304 PolarHBondContact O-N 3.13Å; E1301-S1304 PolarHBondContact O-OG 3.37Å
1302I60.2Low57.8Low3 Ų343.6 Ų43.62%0.01523%0.23CC..Hα-helixtrans-53.9-39.7164.7-73.6169.4000109.9T1255 C1259 C1298 S1304 S1305 Q1308 R1309 A1312T1255-I1302 HydrophobicContact CG2-CD1 4.41Å; T1255-I1302 HydrophobicContact CG2-CG1 3.98Å; C1259-I1302 HydrophobicContact CB-CD1 3.56Å; C1259-I1302 WeakPolarHBondContact SG-CD1 3.16Å; C1298-I1302 WeakPolarHBondContact O-CB 3.49Å; C1298-I1302 WeakPolarHBondContact O-CD1 3Å; C1298-I1302 WeakPolarHBondContact O-CG1 3.4Å; C1298-I1302 PolarHBondContact O-N 3.25Å; I1302-S1304 VanDerWaalsContact C-N 3.26Å; I1302-S1304 PolarHBondContact O-N 2.98Å; I1302-S1305 PolarHBondContact O-N 2.93Å; I1302-Q1308 HydrophobicContact CB-CB 4.13Å; I1302-Q1308 HydrophobicContact CG1-CB 4.23Å; I1302-Q1308 HydrophobicContact CG2-CB 3.82Å; I1302-Q1308 WeakPolarHBondContact CG2-O 3.46Å; I1302-R1309 PolarHBondContact O-N 3.27Å; I1302-A1312 HydrophobicContact CG2-CB 3.77Å
1303G49.5Very low57.5Low16 Ų1641.6 Ų41.617%0.16522%0.22CC..Hα-helixtrans-58-31.2173.100000114.2L1299 L1300 E1301 S1305 R1309L1299-G1303 WeakPolarHBondContact O-CA 3.2Å; L1299-G1303 PolarHBondContact O-N 2.82Å; L1300-G1303 CarbonylContact O-C 3.35Å; L1300-G1303 VanDerWaalsContact O-CA 3.22Å; L1300-G1303 WeakPolarHBondContact O-CA 3.48Å; L1300-G1303 PolarHBondContact O-N 2.98Å; L1300-G1303 VanDerWaalsContact O-N 3.11Å; E1301-G1303 PolarHBondContact O-N 2.84Å; G1303-S1305 VanDerWaalsContact C-N 3.34Å; G1303-S1305 PolarHBondContact O-N 2.7Å; G1303-R1309 PolarHBondContact O-NE 3.25Å; G1303-R1309 PolarHBondContact O-NH2 3.45Å
1304S56.1Low57.2Low90 Ų9042.5 Ų42.563%0.62922%0.224SC*.Hα-helixtrans-71.6-28.2179.777.70000112.8L1300 E1301 I1302L1300-S1304 PolarHBondContact O-N 3.03Å; E1301-S1304 VanDerWaalsContact O-CB 3.32Å; E1301-S1304 WeakPolarHBondContact O-CB 3.34Å; E1301-S1304 PolarHBondContact O-N 3.13Å; E1301-S1304 PolarHBondContact O-OG 3.37Å; I1302-S1304 VanDerWaalsContact C-N 3.26Å; I1302-S1304 PolarHBondContact O-N 2.98Å
1305S53.3Low56.6Low27 Ų2743.7 Ų43.719%0.18923%0.233CC..  trans-103125.4179.71770000111.9I1302 G1303 V1307 Q1308 R1309I1302-S1305 PolarHBondContact O-N 2.93Å; G1303-S1305 VanDerWaalsContact C-N 3.34Å; G1303-S1305 PolarHBondContact O-N 2.7Å; S1305-V1307 VanDerWaalsContact C-N 3.26Å; S1305-V1307 PolarHBondContact O-N 2.69Å; S1305-Q1308 VanDerWaalsContact CB-OE1 3.23Å; S1305-Q1308 PolarHBondContact O-N 2.99Å; S1305-R1309 PolarHBondContact O-N 3.24Å; S1305-R1309 VanDerWaalsContact O-N 3.12Å
1306R51.3Low56.4Low133 Ų13344 Ų4450%0.50223%0.234SC..Hα-helixtrans-60.1-35.9177.6-171177.3-178.1177.91.7112.2I1310R1306-I1310 HydrophobicContact CG-CD1 4.45Å; R1306-I1310 WeakPolarHBondContact O-CD1 3.43Å; R1306-I1310 VanDerWaalsContact O-CG1 3.31Å; R1306-I1310 WeakPolarHBondContact O-CG1 3.46Å; R1306-I1310 PolarHBondContact O-N 3.46Å
1307V49.9Very low56.7Low67 Ų6740.9 Ų40.941%0.40622%0.217SC..Hα-helixtrans-69.7-43.7-179.8178.90000110.9S1305 I1310 V1311 A1417S1305-V1307 VanDerWaalsContact C-N 3.26Å; S1305-V1307 PolarHBondContact O-N 2.69Å; V1307-I1310 PolarHBondContact O-N 3.37Å; V1307-V1311 PolarHBondContact O-N 3.14Å; V1307-V1311 VanDerWaalsContact O-N 3.14Å; V1307-A1417 HydrophobicContact CG1-CB 4.25Å
1308Q51Low56.6Low6 Ų643.1 Ų43.13%0.02823%0.23CC..Hα-helixtrans-68.4-39.1-179.1-68178.3-47.200112.2H1252 N1256 I1302 S1305 I1310 V1311 A1312H1252-Q1308 PolarHBondContact CD2-NE2 2.87Å; H1252-Q1308 PolarHBondContact O-NE2 3.21Å; N1256-Q1308 PolarHBondContact OD1-NE2 2.79Å; I1302-Q1308 HydrophobicContact CB-CB 4.13Å; I1302-Q1308 HydrophobicContact CG1-CB 4.23Å; I1302-Q1308 HydrophobicContact CG2-CB 3.82Å; I1302-Q1308 WeakPolarHBondContact CG2-O 3.46Å; S1305-Q1308 VanDerWaalsContact CB-OE1 3.23Å; S1305-Q1308 PolarHBondContact O-N 2.99Å; Q1308-I1310 VanDerWaalsContact C-N 3.27Å; Q1308-I1310 PolarHBondContact O-N 3.47Å; Q1308-V1311 PolarHBondContact O-N 3.48Å; Q1308-A1312 WeakPolarHBondContact O-CB 3.35Å; Q1308-A1312 PolarHBondContact O-N 2.9Å
1309R52.6Low56.4Low63 Ų6343.5 Ų43.524%0.23823%0.233CC..Hα-helixtrans-53.8-43.5170.5-86.9-176.7-81.1-177.8-11.4112.3I1302 G1303 S1305 C1313 S1362 A1363I1302-R1309 PolarHBondContact O-N 3.27Å; G1303-R1309 PolarHBondContact O-NE 3.25Å; G1303-R1309 PolarHBondContact O-NH2 3.45Å; S1305-R1309 PolarHBondContact O-N 3.24Å; S1305-R1309 VanDerWaalsContact O-N 3.12Å; R1309-C1313 VanDerWaalsContact O-CB 3.25Å; R1309-C1313 WeakPolarHBondContact O-CB 3.43Å; R1309-C1313 PolarHBondContact O-N 3.38Å; R1309-C1313 PolarHBondContact O-SG 2.94Å; R1309-S1362 PolarHBondContact NH1-O 3.17Å; R1309-A1363 HydrophobicContact CB-CB 4.4Å
1310I51.6Low56.7Low41 Ų4142.7 Ų42.721%0.2123%0.229CC..Hα-helixtrans-66.7-44.4-179.9-63.2164.4000110.9R1306 V1307 Q1308 C1313 H1314 F1414R1306-I1310 HydrophobicContact CG-CD1 4.45Å; R1306-I1310 WeakPolarHBondContact O-CD1 3.43Å; R1306-I1310 VanDerWaalsContact O-CG1 3.31Å; R1306-I1310 WeakPolarHBondContact O-CG1 3.46Å; R1306-I1310 PolarHBondContact O-N 3.46Å; V1307-I1310 PolarHBondContact O-N 3.37Å; Q1308-I1310 VanDerWaalsContact C-N 3.27Å; Q1308-I1310 PolarHBondContact O-N 3.47Å; I1310-C1313 PolarHBondContact O-N 2.97Å; I1310-H1314 WeakPolarHBondContact O-CB 3.45Å; I1310-H1314 PolarHBondContact O-N 3.43Å; I1310-F1414 HydrophobicContact CB-CE2 4.03Å; I1310-F1414 HydrophobicContact CD1-CD2 3.79Å; I1310-F1414 HydrophobicContact CD1-CE2 3.71Å; I1310-F1414 HydrophobicContact CG1-CE2 4.44Å; I1310-F1414 HydrophobicContact CG2-CD2 4.33Å; I1310-F1414 HydrophobicContact CG2-CE2 3.41Å; I1310-F1414 VanDerWaalsContact CG2-CE2 3.41Å; I1310-F1414 HydrophobicContact CG2-CZ 3.69Å
1311V52.4Low57Low48 Ų4838.3 Ų38.329%0.29121%0.205SC..Hα-helixtrans-62.2-48.7177.8175.90000111.2V1307 Q1308 C1313 H1314 S1315V1307-V1311 PolarHBondContact O-N 3.14Å; V1307-V1311 VanDerWaalsContact O-N 3.14Å; Q1308-V1311 PolarHBondContact O-N 3.48Å; V1311-C1313 PolarHBondContact O-N 3.04Å; V1311-H1314 PolarHBondContact O-N 3.38Å; V1311-H1314 VanDerWaalsContact O-N 3.16Å; V1311-S1315 PolarHBondContact O-N 3.36Å; V1311-S1315 PolarHBondContact O-OG 3.37Å
1312A54.8Low57.1Low13 Ų1338 Ų3811%0.10721%0.205CC..Hα-helixtrans-62.2-43.8178.100000112.1I1302 Q1308 H1314 S1315 Q1316 L1359I1302-A1312 HydrophobicContact CG2-CB 3.77Å; Q1308-A1312 WeakPolarHBondContact O-CB 3.35Å; Q1308-A1312 PolarHBondContact O-N 2.9Å; A1312-H1314 VanDerWaalsContact C-N 3.33Å; A1312-H1314 PolarHBondContact O-N 3.3Å; A1312-S1315 PolarHBondContact O-N 3.31Å; A1312-Q1316 WeakPolarHBondContact O-CG 3.37Å; A1312-Q1316 PolarHBondContact O-N 3.38Å; A1312-L1359 HydrophobicContact CB-CD1 3.94Å; A1312-L1359 HydrophobicContact CB-CD2 3.85Å
1313C57.4Low57.2Low1 Ų138.2 Ų38.21%0.00721%0.207CC..Hα-helixtrans-58.4-44.9172.2-800000111.4R1309 I1310 V1311 S1315 Q1316 L1317 L1365R1309-C1313 VanDerWaalsContact O-CB 3.25Å; R1309-C1313 WeakPolarHBondContact O-CB 3.43Å; R1309-C1313 PolarHBondContact O-N 3.38Å; R1309-C1313 PolarHBondContact O-SG 2.94Å; I1310-C1313 PolarHBondContact O-N 2.97Å; V1311-C1313 PolarHBondContact O-N 3.04Å; C1313-S1315 PolarHBondContact O-N 3.49Å; C1313-Q1316 PolarHBondContact O-N 2.85Å; C1313-L1317 VanDerWaalsContact O-CB 3.29Å; C1313-L1317 WeakPolarHBondContact O-CB 3.43Å; C1313-L1317 VanDerWaalsContact O-CG 3.25Å; C1313-L1317 WeakPolarHBondContact O-CG 3.34Å; C1313-L1317 PolarHBondContact O-N 3.31Å; C1313-L1365 HydrophobicContact CB-CD2 4.12Å
1314H56.2Low58Low77 Ų7737.4 Ų37.436%0.35620%0.199SC..Hα-helixtrans-65.3-39.7-178.5-163.292.8000112.4I1310 V1311 A1312 L1317 L1318 K1372I1310-H1314 WeakPolarHBondContact O-CB 3.45Å; I1310-H1314 PolarHBondContact O-N 3.43Å; V1311-H1314 PolarHBondContact O-N 3.38Å; V1311-H1314 VanDerWaalsContact O-N 3.16Å; A1312-H1314 VanDerWaalsContact C-N 3.33Å; A1312-H1314 PolarHBondContact O-N 3.3Å; H1314-L1317 PolarHBondContact O-N 3.41Å; H1314-L1318 WeakPolarHBondContact O-CB 3.05Å; H1314-L1318 PolarHBondContact O-N 3.3Å; H1314-K1372 VanDerWaalsContact CE1-CE 3.42Å; H1314-K1372 WeakPolarHBondContact CE1-CE 3.44Å; H1314-K1372 PolarHBondContact CE1-NZ 3.31Å; H1314-K1372 PolarHBondContact NE2-NZ 2.88Å
1315S56.7Low58.4Low25 Ų2537.7 Ų37.718%0.17519%0.19CC..Hα-helixtrans-65.1-40.5174.3-59.50000112.4V1311 A1312 C1313 L1318 A1319V1311-S1315 PolarHBondContact O-N 3.36Å; V1311-S1315 PolarHBondContact O-OG 3.37Å; A1312-S1315 PolarHBondContact O-N 3.31Å; C1313-S1315 PolarHBondContact O-N 3.49Å; S1315-L1318 PolarHBondContact O-N 3.31Å; S1315-A1319 PolarHBondContact O-N 2.96Å
1316Q62.1Low58.7Low9 Ų939.3 Ų39.34%0.04220%0.195CC..Hα-helixtrans-69.2-39.3175-68-57.3-33.200112A1312 C1313 L1318 A1319 V1320 A1352 N1355 L1356 L1359A1312-Q1316 WeakPolarHBondContact O-CG 3.37Å; A1312-Q1316 PolarHBondContact O-N 3.38Å; C1313-Q1316 PolarHBondContact O-N 2.85Å; Q1316-L1318 VanDerWaalsContact C-N 3.34Å; Q1316-L1318 PolarHBondContact O-N 3.3Å; Q1316-A1319 PolarHBondContact O-N 3.44Å; Q1316-V1320 VanDerWaalsContact O-CG2 3.31Å; Q1316-V1320 WeakPolarHBondContact O-CG2 3.43Å; Q1316-V1320 PolarHBondContact O-N 3.48Å; Q1316-A1352 VanDerWaalsContact OE1-CA 3.23Å; Q1316-A1352 VanDerWaalsContact OE1-CB 3.31Å; Q1316-A1352 PolarHBondContact OE1-O 2.87Å; Q1316-N1355 HydrophobicContact CG-CB 4.17Å; Q1316-L1356 HydrophobicContact CB-CB 4.06Å; Q1316-L1356 HydrophobicContact CB-CD1 4.08Å; Q1316-L1359 HydrophobicContact CB-CD1 4.43Å; Q1316-L1359 HydrophobicContact CG-CD1 3.7Å
1317L65.1Low59.1Low3 Ų333 Ų332%0.01617%0.171CC..Hα-helixtrans-58.3-45.3171.9-79.6170.6000111C1313 H1314 A1319 V1320 E1321 L1356 V1373 M1376C1313-L1317 VanDerWaalsContact O-CB 3.29Å; C1313-L1317 WeakPolarHBondContact O-CB 3.43Å; C1313-L1317 VanDerWaalsContact O-CG 3.25Å; C1313-L1317 WeakPolarHBondContact O-CG 3.34Å; C1313-L1317 PolarHBondContact O-N 3.31Å; H1314-L1317 PolarHBondContact O-N 3.41Å; L1317-A1319 PolarHBondContact O-N 2.94Å; L1317-V1320 PolarHBondContact O-N 3.29Å; L1317-E1321 WeakPolarHBondContact O-CB 3.45Å; L1317-E1321 PolarHBondContact O-N 3.02Å; L1317-L1356 HydrophobicContact CD2-CD1 4.23Å; L1317-L1356 HydrophobicContact CD2-CD2 3.69Å; L1317-L1356 HydrophobicContact CG-CD1 4Å; L1317-L1356 HydrophobicContact CG-CD2 4.23Å; L1317-V1373 HydrophobicContact CD2-CG2 4.48Å; L1317-M1376 HydrophobicContact CB-CE 3.59Å; L1317-M1376 HydrophobicContact CD2-CE 3.42Å; L1317-M1376 VanDerWaalsContact CD2-CE 3.42Å; L1317-M1376 HydrophobicContact CD2-SD 3.85Å; L1317-M1376 HydrophobicContact CG-CE 4.07Å; L1317-M1376 WeakPolarHBondContact O-CE 3.26Å
1318L62.4Low59.7Low78 Ų7831 Ų3141%0.40816%0.158SC..Hα-helixtrans-63.9-39.2176-157.790000112.2H1314 S1315 Q1316 E1321 N1322 K1372H1314-L1318 WeakPolarHBondContact O-CB 3.05Å; H1314-L1318 PolarHBondContact O-N 3.3Å; S1315-L1318 PolarHBondContact O-N 3.31Å; Q1316-L1318 VanDerWaalsContact C-N 3.34Å; Q1316-L1318 PolarHBondContact O-N 3.3Å; L1318-E1321 WeakPolarHBondContact O-CB 3.32Å; L1318-E1321 PolarHBondContact O-N 2.73Å; L1318-N1322 VanDerWaalsContact O-CG 3.25Å; L1318-N1322 PolarHBondContact O-N 2.77Å; L1318-N1322 PolarHBondContact O-ND2 3.34Å; L1318-K1372 VanDerWaalsContact CD1-NZ 3.34Å
1319A61.2Low59.7Low9 Ų933.9 Ų33.97%0.07418%0.182CC..Hα-helixtrans-63.4-44.5175.300000111.5S1315 Q1316 L1317 N1322 V1323 L1349 A1352S1315-A1319 PolarHBondContact O-N 2.96Å; Q1316-A1319 PolarHBondContact O-N 3.44Å; L1317-A1319 PolarHBondContact O-N 2.94Å; A1319-N1322 PolarHBondContact O-N 3.49Å; A1319-V1323 VanDerWaalsContact O-CG2 3.26Å; A1319-V1323 WeakPolarHBondContact O-CG2 3.29Å; A1319-V1323 PolarHBondContact O-N 2.94Å; A1319-L1349 HydrophobicContact CB-CD2 4.04Å; A1319-A1352 HydrophobicContact CB-CB 3.95Å
1320V65.8Low59.2Low2 Ų233.8 Ų33.81%0.01220%0.201CC..Hα-helixtrans-63.3-41175.1171.70000111.4Q1316 L1317 V1323 L1324 A1352 P1353 L1356 M1376 V1396Q1316-V1320 VanDerWaalsContact O-CG2 3.31Å; Q1316-V1320 WeakPolarHBondContact O-CG2 3.43Å; Q1316-V1320 PolarHBondContact O-N 3.48Å; L1317-V1320 PolarHBondContact O-N 3.29Å; V1320-V1323 WeakPolarHBondContact O-CB 3.48Å; V1320-V1323 PolarHBondContact O-N 3.39Å; V1320-L1324 HydrophobicContact CG1-CD1 4.28Å; V1320-L1324 HydrophobicContact CG1-CG 4.42Å; V1320-L1324 WeakPolarHBondContact O-CG 3.35Å; V1320-L1324 PolarHBondContact O-N 2.88Å; V1320-A1352 HydrophobicContact CG2-CB 3.99Å; V1320-P1353 HydrophobicContact CG2-CG 4.25Å; V1320-L1356 HydrophobicContact CG2-CD2 4.21Å; V1320-M1376 HydrophobicContact CB-SD 4.36Å; V1320-M1376 HydrophobicContact CG1-SD 3.91Å; V1320-V1396 HydrophobicContact CG1-CB 4.34Å; V1320-V1396 HydrophobicContact CG1-CG1 3.53Å; V1320-V1396 HydrophobicContact CG1-CG2 3.76Å
1321E65.3Low58.7Low39 Ų3937 Ų3718%0.18223%0.227CC..Hα-helixtrans-58.8-48.9175.3-171.1179.8174.100111.6L1317 L1318 V1323 L1324 Q1325 M1376 L1379L1317-E1321 WeakPolarHBondContact O-CB 3.45Å; L1317-E1321 PolarHBondContact O-N 3.02Å; L1318-E1321 WeakPolarHBondContact O-CB 3.32Å; L1318-E1321 PolarHBondContact O-N 2.73Å; E1321-V1323 VanDerWaalsContact C-N 3.3Å; E1321-V1323 PolarHBondContact O-N 3.5Å; E1321-L1324 PolarHBondContact O-N 2.93Å; E1321-Q1325 WeakPolarHBondContact O-CG 3.27Å; E1321-Q1325 PolarHBondContact O-N 3.02Å; E1321-M1376 HydrophobicContact CB-CE 4.2Å; E1321-L1379 HydrophobicContact CG-CD1 4.01Å
1322N63.6Low57.7Low48 Ų4840 Ų4026%0.25725%0.251SS..Hα-helixtrans-61.5-38.4177.8-69.4-23000112L1318 A1319 Q1325 E1326L1318-N1322 VanDerWaalsContact O-CG 3.25Å; L1318-N1322 PolarHBondContact O-N 2.77Å; L1318-N1322 PolarHBondContact O-ND2 3.34Å; A1319-N1322 PolarHBondContact O-N 3.49Å; N1322-Q1325 PolarHBondContact O-N 3.18Å; N1322-E1326 PolarHBondContact O-N 3.47Å; N1322-E1326 VanDerWaalsContact O-N 3.16Å
1323V63.5Low56.8Low7 Ų745.4 Ų45.44%0.04229%0.287CS..Hα-helixtrans-65.2-45174.9172.10000111.5A1319 V1320 E1321 Q1325 E1326 C1327 L1349 I1392A1319-V1323 VanDerWaalsContact O-CG2 3.26Å; A1319-V1323 WeakPolarHBondContact O-CG2 3.29Å; A1319-V1323 PolarHBondContact O-N 2.94Å; V1320-V1323 WeakPolarHBondContact O-CB 3.48Å; V1320-V1323 PolarHBondContact O-N 3.39Å; E1321-V1323 VanDerWaalsContact C-N 3.3Å; E1321-V1323 PolarHBondContact O-N 3.5Å; V1323-Q1325 VanDerWaalsContact C-N 3.33Å; V1323-E1326 PolarHBondContact O-N 2.95Å; V1323-C1327 WeakPolarHBondContact O-CB 2.94Å; V1323-C1327 PolarHBondContact O-N 3.25Å; V1323-C1327 PolarHBondContact O-SG 3.24Å; V1323-L1349 HydrophobicContact CG2-CB 3.4Å; V1323-L1349 VanDerWaalsContact CG2-CB 3.4Å; V1323-L1349 HydrophobicContact CG2-CD1 3.75Å; V1323-L1349 HydrophobicContact CG2-CD2 3.37Å; V1323-L1349 HydrophobicContact CG2-CG 3.63Å; V1323-I1392 HydrophobicContact CG1-CG2 3.5Å; V1323-I1392 VanDerWaalsContact CG1-CG2 3.5Å
1324L66.9Low55.5Low0 Ų049.3 Ų49.30%031%0.314CS..Hα-helixtrans-60.5-45.3176.6-76.1176.7000110.5V1320 E1321 E1326 C1327 I1328 M1376 L1379 V1393 V1396V1320-L1324 HydrophobicContact CG1-CD1 4.28Å; V1320-L1324 HydrophobicContact CG1-CG 4.42Å; V1320-L1324 WeakPolarHBondContact O-CG 3.35Å; V1320-L1324 PolarHBondContact O-N 2.88Å; E1321-L1324 PolarHBondContact O-N 2.93Å; L1324-E1326 VanDerWaalsContact C-N 3.3Å; L1324-E1326 PolarHBondContact O-N 3.06Å; L1324-C1327 WeakPolarHBondContact O-CB 3.24Å; L1324-C1327 PolarHBondContact O-N 2.9Å; L1324-C1327 VanDerWaalsContact O-N 3.09Å; L1324-I1328 HydrophobicContact CB-CD1 4.15Å; L1324-I1328 WeakPolarHBondContact O-CB 3.35Å; L1324-I1328 WeakPolarHBondContact O-CD1 3.47Å; L1324-I1328 WeakPolarHBondContact O-CG1 3.46Å; L1324-I1328 PolarHBondContact O-N 3.01Å; L1324-M1376 HydrophobicContact CD1-CB 3.91Å; L1324-M1376 HydrophobicContact CD1-CG 4.02Å; L1324-L1379 HydrophobicContact CB-CB 4.39Å; L1324-L1379 HydrophobicContact CB-CD1 4.36Å; L1324-L1379 HydrophobicContact CD1-CB 4.23Å; L1324-V1393 HydrophobicContact CD2-CG2 4Å; L1324-V1396 HydrophobicContact CD1-CG1 3.86Å; L1324-V1396 HydrophobicContact CD2-CB 4.2Å; L1324-V1396 HydrophobicContact CD2-CG1 4.16Å; L1324-V1396 HydrophobicContact CD2-CG2 4.36Å; L1324-V1396 HydrophobicContact CG-CG1 4.25Å
1325Q63.4Low54.4Low95 Ų9551.1 Ų51.144%0.44433%0.331SS..Hα-helixtrans-56-43.1176.9-73.8179.8-0.700112E1321 N1322 V1323 A1329 L1379E1321-Q1325 WeakPolarHBondContact O-CG 3.27Å; E1321-Q1325 PolarHBondContact O-N 3.02Å; N1322-Q1325 PolarHBondContact O-N 3.18Å; V1323-Q1325 VanDerWaalsContact C-N 3.33Å; Q1325-A1329 WeakPolarHBondContact O-CB 3.41Å; Q1325-A1329 PolarHBondContact O-N 3.34Å; Q1325-A1329 VanDerWaalsContact O-N 3.12Å; Q1325-L1379 HydrophobicContact CG-CD1 4.38Å
1326E59.5Low53.2Low62 Ų6256.9 Ų56.929%0.2936%0.359SS..Hα-helixtrans-69.9-38.1175.2-164.7-177.3-157.800112.5N1322 V1323 L1324 I1328 A1329 V1342N1322-E1326 PolarHBondContact O-N 3.47Å; N1322-E1326 VanDerWaalsContact O-N 3.16Å; V1323-E1326 PolarHBondContact O-N 2.95Å; L1324-E1326 VanDerWaalsContact C-N 3.3Å; L1324-E1326 PolarHBondContact O-N 3.06Å; E1326-I1328 VanDerWaalsContact C-N 3.27Å; E1326-I1328 PolarHBondContact O-N 2.98Å; E1326-A1329 PolarHBondContact O-N 2.89Å; E1326-V1342 VanDerWaalsContact CD-CG1 3.44Å; E1326-V1342 HydrophobicContact CG-CG1 4.49Å; E1326-V1342 WeakPolarHBondContact OE2-CG1 3.32Å
1327C60Low52Low1 Ų159.3 Ų59.31%0.00738%0.381CS..Hα-helixtrans-66.3-28.2178.4-74.10000113.2V1323 L1324 A1385 H1389 V1393V1323-C1327 WeakPolarHBondContact O-CB 2.94Å; V1323-C1327 PolarHBondContact O-N 3.25Å; V1323-C1327 PolarHBondContact O-SG 3.24Å; L1324-C1327 WeakPolarHBondContact O-CB 3.24Å; L1324-C1327 PolarHBondContact O-N 2.9Å; L1324-C1327 VanDerWaalsContact O-N 3.09Å; C1327-A1385 VanDerWaalsContact O-CB 3.31Å; C1327-A1385 WeakPolarHBondContact O-CB 3.44Å; C1327-A1385 PolarHBondContact O-N 2.7Å; C1327-H1389 HydrophobicContact CB-CB 3.83Å; C1327-H1389 PolarHBondContact O-ND1 3.06Å; C1327-V1393 HydrophobicContact CB-CG2 4.11Å
1328I61.9Low50.5Low25 Ų2567.1 Ų67.113%0.12842%0.418CS..Hα-helixtrans-93-25-177.5-64157000111.7L1324 E1326 G1330 L1379 L1382L1324-I1328 HydrophobicContact CB-CD1 4.15Å; L1324-I1328 WeakPolarHBondContact O-CB 3.35Å; L1324-I1328 WeakPolarHBondContact O-CD1 3.47Å; L1324-I1328 WeakPolarHBondContact O-CG1 3.46Å; L1324-I1328 PolarHBondContact O-N 3.01Å; E1326-I1328 VanDerWaalsContact C-N 3.27Å; E1326-I1328 PolarHBondContact O-N 2.98Å; I1328-G1330 VanDerWaalsContact C-N 3.31Å; I1328-G1330 PolarHBondContact O-N 3.48Å; I1328-L1379 HydrophobicContact CD1-CB 3.58Å; I1328-L1379 HydrophobicContact CD1-CD2 3.96Å; I1328-L1379 HydrophobicContact CD1-CG 4.34Å; I1328-L1379 WeakPolarHBondContact CD1-O 3.39Å; I1328-L1382 HydrophobicContact CG2-CB 3.64Å; I1328-L1382 HydrophobicContact CG2-CD1 3.95Å; I1328-L1382 HydrophobicContact CG2-CG 4.45Å
1329A51.8Low49.3Very low66 Ų6665.9 Ų65.955%0.54542%0.415SS..  trans-60.188-172.800000113.1Q1325 E1326Q1325-A1329 WeakPolarHBondContact O-CB 3.41Å; Q1325-A1329 PolarHBondContact O-N 3.34Å; Q1325-A1329 VanDerWaalsContact O-N 3.12Å; E1326-A1329 PolarHBondContact O-N 2.89Å
1330G41.5Very low48.1Very low61 Ų6169.7 Ų69.763%0.62944%0.44SS*.  trans-151.636.5176.400000110.7I1328I1328-G1330 VanDerWaalsContact C-N 3.31Å; I1328-G1330 PolarHBondContact O-N 3.48Å
1331S41.8Very low46.7Very low107 Ų10771.7 Ų71.775%0.74845%0.448SS*.SBendtrans-174.3122.5159.953.20000109.7
1332S30.3Very low45.5Very low113 Ų11370.5 Ų70.579%0.7944%0.443SS*.SBendtrans89124.6179.781.40000117S1334S1332-S1334 VanDerWaalsContact C-N 3.26Å; S1332-S1334 PolarHBondContact O-N 3.41Å
1333S37.2Very low44.3Very low126 Ų12676.8 Ų76.888%0.88147%0.469SS*.  trans-68.359.4-177.4510000113.9
1334S29.1Very low43.1Very low82 Ų8281.9 Ų81.957%0.57350%0.495SS*.  trans-88123.5169.971.20000110.7S1332 D1336S1332-S1334 VanDerWaalsContact C-N 3.26Å; S1332-S1334 PolarHBondContact O-N 3.41Å; S1334-D1336 PolarHBondContact O-N 3.33Å
1335V33.7Very low42Very low116 Ų11682.2 Ų82.270%0.70350%0.497SS*.G310 helixtrans-72.9-10.1-170.1172.30000113A1337V1335-A1337 VanDerWaalsContact C-N 3.29Å; V1335-A1337 PolarHBondContact O-N 3.28Å
1336D31.5Very low41.2Very low145 Ų14581 Ų8178%0.77549%0.491SS*.G310 helixtrans-75.8-9.9-174.2-68-34.7000114.9S1334 Q1338S1334-D1336 PolarHBondContact O-N 3.33Å; D1336-Q1338 PolarHBondContact O-N 2.91Å; D1336-Q1338 VanDerWaalsContact O-N 3.16Å
1337A36.6Very low40.6Very low61 Ų6182.9 Ų82.950%0.50450%0.503SS..G310 helixtrans-70.9-4.7176.100000114.2V1335 S1339V1335-A1337 VanDerWaalsContact C-N 3.29Å; V1335-A1337 PolarHBondContact O-N 3.28Å; A1337-S1339 PolarHBondContact O-N 3.5Å
1338Q33.2Very low40Very low167 Ų16783.8 Ų83.878%0.7851%0.509SS*.G310 helixtrans-9224.8-179.6-66-167.50.100114.5D1336 P1340D1336-Q1338 PolarHBondContact O-N 2.91Å; D1336-Q1338 VanDerWaalsContact O-N 3.16Å; Q1338-P1340 WeakPolarHBondContact O-CD 3.42Å; Q1338-P1340 VanDerWaalsContact O-N 3.16Å
1339S36.8Very low39.4Very low51 Ų5183 Ų8336%0.35751%0.505SS..  trans-60.9119.8172.5178.20000110.6A1337 F1341 V1342A1337-S1339 PolarHBondContact O-N 3.5Å; S1339-F1341 PolarHBondContact O-N 3.23Å; S1339-F1341 VanDerWaalsContact OG-CB 3.24Å; S1339-F1341 WeakPolarHBondContact OG-CB 3.42Å; S1339-F1341 PolarHBondContact OG-N 2.7Å; S1339-V1342 PolarHBondContact O-N 3.34Å
1340P35.7Very low39.4Very low90 Ų9080.6 Ų80.658%0.58448%0.483SS*.Hα-helixtrans-56.9-18.8174.6-22.132.5000113.1Q1338 V1342 N1344Q1338-P1340 WeakPolarHBondContact O-CD 3.42Å; Q1338-P1340 VanDerWaalsContact O-N 3.16Å; P1340-V1342 VanDerWaalsContact C-N 3.34Å; P1340-N1344 PolarHBondContact O-N 3.4Å; P1340-N1344 PolarHBondContact O-ND2 3.01Å
1341F37.8Very low40Very low44 Ų4479.2 Ų79.219%0.19346%0.46CS..Hα-helixtrans-63.4-37.3175.4-172.8-96.2000112.3L1224 Q1264 S1339 N1345L1224-F1341 HydrophobicContact CB-CE2 4.15Å; L1224-F1341 HydrophobicContact CD2-CE2 4.37Å; Q1264-F1341 HydrophobicContact CB-CE2 4.48Å; Q1264-F1341 HydrophobicContact CB-CZ 4.28Å; Q1264-F1341 HydrophobicContact CG-CZ 4.22Å; S1339-F1341 PolarHBondContact O-N 3.23Å; S1339-F1341 VanDerWaalsContact OG-CB 3.24Å; S1339-F1341 WeakPolarHBondContact OG-CB 3.42Å; S1339-F1341 PolarHBondContact OG-N 2.7Å; F1341-N1345 VanDerWaalsContact O-CB 3.28Å; F1341-N1345 WeakPolarHBondContact O-CB 3.44Å; F1341-N1345 PolarHBondContact O-N 2.91Å; F1341-N1345 PolarHBondContact O-ND2 3.44Å
1342V40Very low40.7Very low13 Ų1374.2 Ų74.28%0.07943%0.425CS..Hα-helixtrans-80.2-45.8-173.8179.30000110.9E1326 S1339 P1340 N1344 N1345 F1346 L1349E1326-V1342 VanDerWaalsContact CD-CG1 3.44Å; E1326-V1342 HydrophobicContact CG-CG1 4.49Å; E1326-V1342 WeakPolarHBondContact OE2-CG1 3.32Å; S1339-V1342 PolarHBondContact O-N 3.34Å; P1340-V1342 VanDerWaalsContact C-N 3.34Å; V1342-N1344 VanDerWaalsContact C-N 3.3Å; V1342-N1344 PolarHBondContact O-N 3.28Å; V1342-N1345 PolarHBondContact O-N 3.13Å; V1342-F1346 PolarHBondContact O-N 2.85Å; V1342-L1349 HydrophobicContact CB-CD1 4.33Å; V1342-L1349 HydrophobicContact CG1-CD1 3.81Å
1343K38.1Very low41.9Very low181 Ų18169 Ų6979%0.78739%0.388SS*.Hα-helixtrans-61.4-33.3179.4-165175.5-176.3175.70113.8
1344N39Very low42.6Very low113 Ų11364 Ų6460%0.60435%0.352SS*.Hα-helixtrans-88.3-16.1-178-71.8-37.8000114.1P1340 V1342P1340-N1344 PolarHBondContact O-N 3.4Å; P1340-N1344 PolarHBondContact O-ND2 3.01Å; V1342-N1344 VanDerWaalsContact C-N 3.3Å; V1342-N1344 PolarHBondContact O-N 3.28Å
1345N42.6Very low43.9Very low8 Ų860.4 Ų60.44%0.04333%0.326CS..  trans-123.519.2-170.7-62.6-45.2000113.5Q1264 F1341 V1342 D1347 C1348 L1349Q1264-N1345 PolarHBondContact O-OD1 2.64Å; Q1264-N1345 VanDerWaalsContact O-OD1 3.13Å; F1341-N1345 VanDerWaalsContact O-CB 3.28Å; F1341-N1345 WeakPolarHBondContact O-CB 3.44Å; F1341-N1345 PolarHBondContact O-N 2.91Å; F1341-N1345 PolarHBondContact O-ND2 3.44Å; V1342-N1345 PolarHBondContact O-N 3.13Å; N1345-D1347 PolarHBondContact O-N 2.94Å; N1345-D1347 VanDerWaalsContact O-N 3.1Å; N1345-C1348 HydrophobicContact CB-CB 4.23Å; N1345-C1348 WeakPolarHBondContact O-CA 3.48Å; N1345-C1348 WeakPolarHBondContact O-CB 3.39Å; N1345-C1348 PolarHBondContact O-N 3.33Å; N1345-L1349 WeakPolarHBondContact O-CB 3.17Å; N1345-L1349 WeakPolarHBondContact O-CG 3.42Å; N1345-L1349 PolarHBondContact O-N 3.33Å
1346F46.8Very low45.1Very low70 Ų7055 Ų5531%0.30729%0.293SS..Hα-helixtrans-49.5-38.5179.6-160.6-94.3000112.7V1342 L1349 L1350 I1392V1342-F1346 PolarHBondContact O-N 2.85Å; F1346-L1349 WeakPolarHBondContact O-CB 3.48Å; F1346-L1349 PolarHBondContact O-N 2.76Å; F1346-L1350 HydrophobicContact CD1-CD1 4.22Å; F1346-L1350 HydrophobicContact CD1-CG 4.45Å; F1346-L1350 HydrophobicContact CE1-CD1 4.26Å; F1346-L1350 HydrophobicContact CE1-CD2 4.46Å; F1346-L1350 HydrophobicContact CE1-CG 4.44Å; F1346-L1350 WeakPolarHBondContact O-CG 3.36Å; F1346-L1350 PolarHBondContact O-N 2.94Å; F1346-L1350 VanDerWaalsContact O-N 3.08Å; F1346-I1392 HydrophobicContact CZ-CD1 4.29Å
1347D46.5Very low46.2Very low100 Ų10050.2 Ų50.254%0.53527%0.266SS..Hα-helixtrans-67.6-41.7174.9-66.8-36.3000113.3N1345 L1349 L1350 E1351N1345-D1347 PolarHBondContact O-N 2.94Å; N1345-D1347 VanDerWaalsContact O-N 3.1Å; D1347-L1349 VanDerWaalsContact C-N 3.28Å; D1347-L1349 PolarHBondContact O-N 3.32Å; D1347-L1350 PolarHBondContact O-N 3.47Å; D1347-E1351 PolarHBondContact O-N 2.94Å
1348C47.5Very low47Very low21 Ų2152 Ų5214%0.14226%0.26CS..Hα-helixtrans-66.9-32.3174.9-65.40000111.8T1266 N1345 E1351 A1352T1266-C1348 VanDerWaalsContact CG2-SG 3.59Å; N1345-C1348 HydrophobicContact CB-CB 4.23Å; N1345-C1348 WeakPolarHBondContact O-CA 3.48Å; N1345-C1348 WeakPolarHBondContact O-CB 3.39Å; N1345-C1348 PolarHBondContact O-N 3.33Å; C1348-E1351 WeakPolarHBondContact O-CB 3.4Å; C1348-E1351 PolarHBondContact O-N 3.1Å; C1348-A1352 PolarHBondContact O-N 3.41Å
1349L50Low48Very low7 Ų744.3 Ų44.34%0.03722%0.224CC..Hα-helixtrans-68.8-32.5176.3-79.3176.9000112.2A1319 V1323 V1342 N1345 F1346 D1347 E1351 A1352 P1353A1319-L1349 HydrophobicContact CB-CD2 4.04Å; V1323-L1349 HydrophobicContact CG2-CB 3.4Å; V1323-L1349 VanDerWaalsContact CG2-CB 3.4Å; V1323-L1349 HydrophobicContact CG2-CD1 3.75Å; V1323-L1349 HydrophobicContact CG2-CD2 3.37Å; V1323-L1349 HydrophobicContact CG2-CG 3.63Å; V1342-L1349 HydrophobicContact CB-CD1 4.33Å; V1342-L1349 HydrophobicContact CG1-CD1 3.81Å; N1345-L1349 WeakPolarHBondContact O-CB 3.17Å; N1345-L1349 WeakPolarHBondContact O-CG 3.42Å; N1345-L1349 PolarHBondContact O-N 3.33Å; F1346-L1349 WeakPolarHBondContact O-CB 3.48Å; F1346-L1349 PolarHBondContact O-N 2.76Å; D1347-L1349 VanDerWaalsContact C-N 3.28Å; D1347-L1349 PolarHBondContact O-N 3.32Å; L1349-E1351 VanDerWaalsContact C-N 3.25Å; L1349-E1351 PolarHBondContact O-N 2.83Å; L1349-A1352 WeakPolarHBondContact O-CB 3.21Å; L1349-A1352 PolarHBondContact O-N 3.09Å; L1349-P1353 WeakPolarHBondContact O-CD 3.39Å
1350L52.3Low48.8Very low16 Ų1643.2 Ų43.28%0.08421%0.214CC..Hα-helixtrans-67.8-23170-67.2171000112.8L405 F1346 D1347 I1392L405-L1350 HydrophobicContact CB-CB 4.47Å; L405-L1350 HydrophobicContact CB-CD2 4.26Å; L405-L1350 HydrophobicContact CD1-CD2 3.97Å; L405-L1350 HydrophobicContact CD2-CD2 4.5Å; L405-L1350 HydrophobicContact CG-CD2 4.48Å; F1346-L1350 HydrophobicContact CD1-CD1 4.22Å; F1346-L1350 HydrophobicContact CD1-CG 4.45Å; F1346-L1350 HydrophobicContact CE1-CD1 4.26Å; F1346-L1350 HydrophobicContact CE1-CD2 4.46Å; F1346-L1350 HydrophobicContact CE1-CG 4.44Å; F1346-L1350 WeakPolarHBondContact O-CG 3.36Å; F1346-L1350 PolarHBondContact O-N 2.94Å; F1346-L1350 VanDerWaalsContact O-N 3.08Å; D1347-L1350 PolarHBondContact O-N 3.47Å; L1350-I1392 HydrophobicContact CD2-CD1 3.9Å; L1350-I1392 HydrophobicContact CD2-CG1 4.13Å
1351E53.8Low49.5Very low32 Ų3244.7 Ų44.715%0.1522%0.217CC..Hα-helixtrans-85.9-18.6174.6-64.6-173166.900113.4D1347 C1348 L1349 L1354 N1355D1347-E1351 PolarHBondContact O-N 2.94Å; C1348-E1351 WeakPolarHBondContact O-CB 3.4Å; C1348-E1351 PolarHBondContact O-N 3.1Å; L1349-E1351 VanDerWaalsContact C-N 3.25Å; L1349-E1351 PolarHBondContact O-N 2.83Å; E1351-L1354 WeakPolarHBondContact O-CB 3.29Å; E1351-L1354 PolarHBondContact O-N 3.3Å; E1351-N1355 PolarHBondContact O-N 3.12Å; E1351-N1355 PolarHBondContact O-ND2 3.14Å
1352A56.5Low49.9Very low2 Ų245.1 Ų45.12%0.01723%0.225CC..Hα-helixtrans-56.6-42.3-17700000113.7Q1316 A1319 V1320 C1348 L1349 L1354 N1355 L1356Q1316-A1352 VanDerWaalsContact OE1-CA 3.23Å; Q1316-A1352 VanDerWaalsContact OE1-CB 3.31Å; Q1316-A1352 PolarHBondContact OE1-O 2.87Å; A1319-A1352 HydrophobicContact CB-CB 3.95Å; V1320-A1352 HydrophobicContact CG2-CB 3.99Å; C1348-A1352 PolarHBondContact O-N 3.41Å; L1349-A1352 WeakPolarHBondContact O-CB 3.21Å; L1349-A1352 PolarHBondContact O-N 3.09Å; A1352-L1354 VanDerWaalsContact C-N 3.35Å; A1352-L1354 PolarHBondContact O-N 3.37Å; A1352-N1355 PolarHBondContact O-N 3.3Å; A1352-L1356 VanDerWaalsContact O-CB 3.23Å; A1352-L1356 WeakPolarHBondContact O-CB 3.47Å; A1352-L1356 PolarHBondContact O-N 3.29Å
1353P55.6Low50.3Low3 Ų345.6 Ų45.62%0.01923%0.231CC..Hα-helixtrans-60.6-38.2173.5-25.836.3000114V1320 L1349 L1356 Q1357 H1395 V1396 L1399V1320-P1353 HydrophobicContact CG2-CG 4.25Å; L1349-P1353 WeakPolarHBondContact O-CD 3.39Å; P1353-L1356 PolarHBondContact O-N 3.32Å; P1353-Q1357 PolarHBondContact O-N 3.21Å; P1353-H1395 WeakPolarHBondContact CB-CD2 3.35Å; P1353-H1395 WeakPolarHBondContact CB-NE2 3.42Å; P1353-V1396 HydrophobicContact CG-CG2 4.06Å; P1353-L1399 HydrophobicContact CB-CD2 4.04Å; P1353-L1399 WeakPolarHBondContact O-CD2 3.43Å
1354L52.2Low50.7Low23 Ų2343.5 Ų43.512%0.1222%0.224CC..Hα-helixtrans-70.8-42.4177.5-99.1147.5000111.8Q406 E1351 A1352 L1356 Q1357 R1358Q406-L1354 HydrophobicContact CG-CD1 4.22Å; E1351-L1354 WeakPolarHBondContact O-CB 3.29Å; E1351-L1354 PolarHBondContact O-N 3.3Å; A1352-L1354 VanDerWaalsContact C-N 3.35Å; A1352-L1354 PolarHBondContact O-N 3.37Å; L1354-L1356 VanDerWaalsContact C-N 3.32Å; L1354-Q1357 WeakPolarHBondContact O-CB 3.45Å; L1354-Q1357 PolarHBondContact O-N 3.12Å; L1354-R1358 WeakPolarHBondContact O-CG 3.4Å; L1354-R1358 PolarHBondContact O-N 3.3Å
1355N55.2Low51.1Low6 Ų639.3 Ų39.33%0.03220%0.202CC..Hα-helixtrans-63.5-41.2174.1-72.1-38.2000110.9L1263 Q1316 E1351 A1352 R1358 L1359L1263-N1355 HydrophobicContact CD2-CB 4.41Å; L1263-N1355 WeakPolarHBondContact CD2-ND2 3.47Å; Q1316-N1355 HydrophobicContact CG-CB 4.17Å; E1351-N1355 PolarHBondContact O-N 3.12Å; E1351-N1355 PolarHBondContact O-ND2 3.14Å; A1352-N1355 PolarHBondContact O-N 3.3Å; N1355-R1358 PolarHBondContact O-N 3.27Å; N1355-L1359 WeakPolarHBondContact O-CB 3.45Å; N1355-L1359 WeakPolarHBondContact O-CD1 3.32Å; N1355-L1359 VanDerWaalsContact O-CG 3.28Å; N1355-L1359 WeakPolarHBondContact O-CG 3.47Å; N1355-L1359 PolarHBondContact O-N 3.31Å
1356L58.9Low51.6Low1 Ų140.3 Ų40.31%0.00521%0.214CC..Hα-helixtrans-61.9-44.1172.7-174.359.5000110.9Q1316 L1317 V1320 A1352 P1353 L1354 R1358 L1359 L1360 L1399Q1316-L1356 HydrophobicContact CB-CB 4.06Å; Q1316-L1356 HydrophobicContact CB-CD1 4.08Å; L1317-L1356 HydrophobicContact CD2-CD1 4.23Å; L1317-L1356 HydrophobicContact CD2-CD2 3.69Å; L1317-L1356 HydrophobicContact CG-CD1 4Å; L1317-L1356 HydrophobicContact CG-CD2 4.23Å; V1320-L1356 HydrophobicContact CG2-CD2 4.21Å; A1352-L1356 VanDerWaalsContact O-CB 3.23Å; A1352-L1356 WeakPolarHBondContact O-CB 3.47Å; A1352-L1356 PolarHBondContact O-N 3.29Å; P1353-L1356 PolarHBondContact O-N 3.32Å; L1354-L1356 VanDerWaalsContact C-N 3.32Å; L1356-R1358 PolarHBondContact O-N 3.08Å; L1356-L1359 PolarHBondContact O-N 3.1Å; L1356-L1360 HydrophobicContact CD1-CD1 3.7Å; L1356-L1360 HydrophobicContact CD1-CD2 4.41Å; L1356-L1360 HydrophobicContact CD1-CG 3.91Å; L1356-L1360 HydrophobicContact CD2-CD1 4.38Å; L1356-L1360 HydrophobicContact CG-CD1 3.63Å; L1356-L1360 HydrophobicContact CG-CG 4.21Å; L1356-L1360 WeakPolarHBondContact O-CB 3.17Å; L1356-L1360 WeakPolarHBondContact O-CG 3.45Å; L1356-L1360 PolarHBondContact O-N 3.31Å; L1356-L1399 HydrophobicContact CB-CD2 4.04Å; L1356-L1399 HydrophobicContact CD2-CD2 3.65Å; L1356-L1399 HydrophobicContact CG-CD2 3.97Å
1357Q55.1Low51.6Low46 Ų4641.8 Ų41.822%0.21523%0.225CC..Hα-helixtrans-57.3-47.3173.8-163.7-176.1-0.400112.4P1353 L1354 L1359 L1360 N1361 L1399P1353-Q1357 PolarHBondContact O-N 3.21Å; L1354-Q1357 WeakPolarHBondContact O-CB 3.45Å; L1354-Q1357 PolarHBondContact O-N 3.12Å; Q1357-L1359 VanDerWaalsContact C-N 3.32Å; Q1357-L1359 PolarHBondContact O-N 3.41Å; Q1357-L1360 PolarHBondContact O-N 3.44Å; Q1357-N1361 WeakPolarHBondContact O-CB 3.47Å; Q1357-N1361 VanDerWaalsContact O-CG 3.26Å; Q1357-N1361 PolarHBondContact O-N 3.3Å; Q1357-N1361 PolarHBondContact O-OD1 3.11Å; Q1357-L1399 HydrophobicContact CB-CD1 3.5Å; Q1357-L1399 VanDerWaalsContact CB-CD1 3.5Å; Q1357-L1399 HydrophobicContact CG-CD1 3.83Å
1358R53.7Low51.7Low99 Ų9943.2 Ų43.237%0.37423%0.228SC..Hα-helixtrans-60.5-42.1178.2-72.6174.6179.9176.80.3111.7L1354 N1355 L1356L1354-R1358 WeakPolarHBondContact O-CG 3.4Å; L1354-R1358 PolarHBondContact O-N 3.3Å; N1355-R1358 PolarHBondContact O-N 3.27Å; L1356-R1358 PolarHBondContact O-N 3.08Å
1359L53.9Low51.9Low5 Ų542.6 Ų42.63%0.02623%0.225CC..Hα-helixtrans-68.3-40.5177.3-72.9165000111.8L1299 A1312 Q1316 N1355 L1356 Q1357 S1362 A1363L1299-L1359 HydrophobicContact CD2-CD2 3.97Å; L1299-L1359 HydrophobicContact CD2-CG 4.41Å; A1312-L1359 HydrophobicContact CB-CD1 3.94Å; A1312-L1359 HydrophobicContact CB-CD2 3.85Å; Q1316-L1359 HydrophobicContact CB-CD1 4.43Å; Q1316-L1359 HydrophobicContact CG-CD1 3.7Å; N1355-L1359 WeakPolarHBondContact O-CB 3.45Å; N1355-L1359 WeakPolarHBondContact O-CD1 3.32Å; N1355-L1359 VanDerWaalsContact O-CG 3.28Å; N1355-L1359 WeakPolarHBondContact O-CG 3.47Å; N1355-L1359 PolarHBondContact O-N 3.31Å; L1356-L1359 PolarHBondContact O-N 3.1Å; Q1357-L1359 VanDerWaalsContact C-N 3.32Å; Q1357-L1359 PolarHBondContact O-N 3.41Å; L1359-S1362 PolarHBondContact O-N 3.06Å; L1359-S1362 PolarHBondContact O-OG 3.38Å; L1359-A1363 WeakPolarHBondContact O-CB 3.4Å; L1359-A1363 PolarHBondContact O-N 3.43Å
1360L53.5Low52.1Low28 Ų2844.2 Ų44.215%0.14724%0.24CC..Hα-helixtrans-76.3-35.2-176.5-67.4177.5000113.8L1356 Q1357 S1362 A1363 L1365 C1403L1356-L1360 HydrophobicContact CD1-CD1 3.7Å; L1356-L1360 HydrophobicContact CD1-CD2 4.41Å; L1356-L1360 HydrophobicContact CD1-CG 3.91Å; L1356-L1360 HydrophobicContact CD2-CD1 4.38Å; L1356-L1360 HydrophobicContact CG-CD1 3.63Å; L1356-L1360 HydrophobicContact CG-CG 4.21Å; L1356-L1360 WeakPolarHBondContact O-CB 3.17Å; L1356-L1360 WeakPolarHBondContact O-CG 3.45Å; L1356-L1360 PolarHBondContact O-N 3.31Å; Q1357-L1360 PolarHBondContact O-N 3.44Å; L1360-S1362 PolarHBondContact O-N 3.35Å; L1360-A1363 PolarHBondContact O-N 2.85Å; L1360-L1365 HydrophobicContact CD2-CD1 3.44Å; L1360-L1365 VanDerWaalsContact CD2-CD1 3.44Å; L1360-L1365 HydrophobicContact CD2-CD2 4.15Å; L1360-L1365 HydrophobicContact CD2-CG 3.71Å; L1360-C1403 HydrophobicContact CD1-CB 4.46Å; L1360-C1403 WeakPolarHBondContact CD1-SG 3.12Å
1361N50.7Low52.4Low120 Ų12045.1 Ų45.164%0.64225%0.253SS*.THydrogen-bonded Turntrans-55.8-15.9167.7-73.2-5.1000112.5Q1357Q1357-N1361 WeakPolarHBondContact O-CB 3.47Å; Q1357-N1361 VanDerWaalsContact O-CG 3.26Å; Q1357-N1361 PolarHBondContact O-N 3.3Å; Q1357-N1361 PolarHBondContact O-OD1 3.11Å
1362S47.2Very low52.7Low53 Ų5345 Ų4537%0.37125%0.252SS..THydrogen-bonded Turntrans-108.9-4.517981.40000114.8R1309 L1359 L1360R1309-S1362 PolarHBondContact NH1-O 3.17Å; L1359-S1362 PolarHBondContact O-N 3.06Å; L1359-S1362 PolarHBondContact O-OG 3.38Å; L1360-S1362 PolarHBondContact O-N 3.35Å
1363A47.3Very low53Low24 Ų2445.6 Ų45.620%0.19826%0.255CS..  trans-138.4135.8-163.500000115.2R1309 L1359 L1360R1309-A1363 HydrophobicContact CB-CB 4.4Å; L1359-A1363 WeakPolarHBondContact O-CB 3.4Å; L1359-A1363 PolarHBondContact O-N 3.43Å; L1360-A1363 PolarHBondContact O-N 2.85Å
1364Q47.6Very low53.4Low137 Ų13748.8 Ų48.864%0.6428%0.278SS*.  trans-88109.4162.5-73-178.8-15.200109.6
1365L46.5Very low54.1Low25 Ų2552 Ų5213%0.13130%0.295CS..  trans-68.6150.3174.5-73.9168.5000111.3C1313 L1360 F1409C1313-L1365 HydrophobicContact CB-CD2 4.12Å; L1360-L1365 HydrophobicContact CD2-CD1 3.44Å; L1360-L1365 VanDerWaalsContact CD2-CD1 3.44Å; L1360-L1365 HydrophobicContact CD2-CD2 4.15Å; L1360-L1365 HydrophobicContact CD2-CG 3.71Å; L1365-F1409 HydrophobicContact CB-CE1 4Å; L1365-F1409 WeakPolarHBondContact O-CD1 3.49Å; L1365-F1409 VanDerWaalsContact O-CE1 3.25Å; L1365-F1409 WeakPolarHBondContact O-CE1 3.43Å
1366G53Low54.7Low29 Ų2951.7 Ų51.730%0.29929%0.293SS..  trans-94.3-177.5170.300000113.1E1368 G1369G1366-E1368 VanDerWaalsContact C-N 3.32Å; G1366-E1368 PolarHBondContact O-N 2.95Å; G1366-G1369 PolarHBondContact O-N 3.02Å
1367N47.7Very low55.3Low100 Ų10056.9 Ų56.954%0.53531%0.313SS..Hα-helixtrans-54.2-34.9-174.9-75.31.1000115.4G1369 A1370 G1371N1367-G1369 VanDerWaalsContact C-N 3.31Å; N1367-G1369 PolarHBondContact O-N 2.99Å; N1367-A1370 WeakPolarHBondContact O-CB 3.39Å; N1367-A1370 PolarHBondContact O-N 3.13Å; N1367-G1371 PolarHBondContact O-N 3.12Å
1368E47.7Very low56.1Low130 Ų13057.5 Ų57.561%0.60733%0.326SS*.Hα-helixtrans-66.8-31.4177.9-73.9-177.3-18000112.9G1366 A1370 K1372 F1414G1366-E1368 VanDerWaalsContact C-N 3.32Å; G1366-E1368 PolarHBondContact O-N 2.95Å; E1368-A1370 VanDerWaalsContact C-N 3.35Å; E1368-K1372 PolarHBondContact O-N 3.38Å; E1368-F1414 WeakPolarHBondContact OE2-CE1 2.85Å
1369G52.2Low56.7Low8 Ų854.4 Ų54.48%0.08232%0.316CS..Hα-helixtrans-68.3-34.7173.900000112.3G1366 N1367 K1372 V1373G1366-G1369 PolarHBondContact O-N 3.02Å; N1367-G1369 VanDerWaalsContact C-N 3.31Å; N1367-G1369 PolarHBondContact O-N 2.99Å; G1369-K1372 PolarHBondContact O-N 3.16Å; G1369-V1373 WeakPolarHBondContact O-CB 3.21Å; G1369-V1373 VanDerWaalsContact O-CG2 3.26Å; G1369-V1373 WeakPolarHBondContact O-CG2 3.3Å; G1369-V1373 PolarHBondContact O-N 3.2Å
1370A53.2Low57.3Low41 Ų4154.8 Ų54.834%0.33932%0.319SS..Hα-helixtrans-66.3-37.4177.500000112.4N1367 E1368 V1373 S1374 F1409N1367-A1370 WeakPolarHBondContact O-CB 3.39Å; N1367-A1370 PolarHBondContact O-N 3.13Å; E1368-A1370 VanDerWaalsContact C-N 3.35Å; A1370-V1373 PolarHBondContact O-N 3.41Å; A1370-S1374 PolarHBondContact O-N 3.13Å; A1370-F1409 HydrophobicContact CB-CE1 4.46Å; A1370-F1409 HydrophobicContact CB-CZ 4.45Å
1371G58.8Low58.1Low35 Ų3557.5 Ų57.536%0.36135%0.346SS..Hα-helixtrans-59.6-53.2172.900000111.9N1367 V1373 S1374 D1375N1367-G1371 PolarHBondContact O-N 3.12Å; G1371-V1373 VanDerWaalsContact C-N 3.34Å; G1371-V1373 PolarHBondContact O-N 3.4Å; G1371-S1374 WeakPolarHBondContact O-CA 3.16Å; G1371-S1374 VanDerWaalsContact O-CB 3.26Å; G1371-S1374 WeakPolarHBondContact O-CB 3.39Å; G1371-S1374 PolarHBondContact O-N 3.43Å; G1371-D1375 PolarHBondContact O-N 3.37Å
1372K61.2Low59.1Low30 Ų3057.6 Ų57.613%0.1335%0.346CS..Hα-helixtrans-60.4-38.2176.9-91.3-171.7166.7-164.50114H1314 L1318 E1368 G1369 S1374 D1375 M1376H1314-K1372 VanDerWaalsContact CE1-CE 3.42Å; H1314-K1372 WeakPolarHBondContact CE1-CE 3.44Å; H1314-K1372 PolarHBondContact CE1-NZ 3.31Å; H1314-K1372 PolarHBondContact NE2-NZ 2.88Å; L1318-K1372 VanDerWaalsContact CD1-NZ 3.34Å; E1368-K1372 PolarHBondContact O-N 3.38Å; G1369-K1372 PolarHBondContact O-N 3.16Å; K1372-S1374 VanDerWaalsContact C-N 3.3Å; K1372-D1375 PolarHBondContact O-N 2.86Å; K1372-M1376 HydrophobicContact CB-CE 4.3Å; K1372-M1376 WeakPolarHBondContact O-CG 3.38Å; K1372-M1376 PolarHBondContact O-N 3.26Å
1373V62.1Low59.6Low15 Ų1556.9 Ų56.99%0.09135%0.346CS..Hα-helixtrans-63.8-38.1173.9165.60000110.9L1317 G1369 A1370 G1371 R1377 L1400L1317-V1373 HydrophobicContact CD2-CG2 4.48Å; G1369-V1373 WeakPolarHBondContact O-CB 3.21Å; G1369-V1373 VanDerWaalsContact O-CG2 3.26Å; G1369-V1373 WeakPolarHBondContact O-CG2 3.3Å; G1369-V1373 PolarHBondContact O-N 3.2Å; A1370-V1373 PolarHBondContact O-N 3.41Å; G1371-V1373 VanDerWaalsContact C-N 3.34Å; G1371-V1373 PolarHBondContact O-N 3.4Å; V1373-R1377 WeakPolarHBondContact O-CG 3.45Å; V1373-R1377 PolarHBondContact O-N 3.28Å; V1373-L1400 HydrophobicContact CB-CD2 4.4Å; V1373-L1400 HydrophobicContact CG1-CB 4.48Å; V1373-L1400 HydrophobicContact CG1-CD2 4.07Å; V1373-L1400 HydrophobicContact CG2-CD2 4.05Å
1374S63.9Low60.2Low69 Ų6957.6 Ų57.648%0.48335%0.35SS..Hα-helixtrans-65.1-44.3173.4-172.60000112A1370 G1371 K1372 M1376 R1377 A1378A1370-S1374 PolarHBondContact O-N 3.13Å; G1371-S1374 WeakPolarHBondContact O-CA 3.16Å; G1371-S1374 VanDerWaalsContact O-CB 3.26Å; G1371-S1374 WeakPolarHBondContact O-CB 3.39Å; G1371-S1374 PolarHBondContact O-N 3.43Å; K1372-S1374 VanDerWaalsContact C-N 3.3Å; S1374-M1376 VanDerWaalsContact C-N 3.34Å; S1374-M1376 PolarHBondContact O-N 2.82Å; S1374-R1377 WeakPolarHBondContact O-CB 3.49Å; S1374-R1377 PolarHBondContact O-N 2.85Å; S1374-A1378 PolarHBondContact O-N 3.04Å
1375D67.7Low60.7Low90 Ų9053.1 Ų53.148%0.48134%0.336SS..Hα-helixtrans-62-42.7177.3-62.3-26.2000111.1G1371 K1372 A1378 L1379G1371-D1375 PolarHBondContact O-N 3.37Å; K1372-D1375 PolarHBondContact O-N 2.86Å; D1375-A1378 WeakPolarHBondContact O-CB 3.22Å; D1375-A1378 PolarHBondContact O-N 3.34Å; D1375-L1379 WeakPolarHBondContact O-CG 3.03Å; D1375-L1379 PolarHBondContact O-N 2.85Å
1376M67.7Low61Low1 Ų152.7 Ų52.71%0.00534%0.335CS..Hα-helixtrans-66.1-36.5174.2-70.8-179.8-146.600113L1317 V1320 E1321 L1324 K1372 S1374 A1378 L1379 C1380 L1400L1317-M1376 HydrophobicContact CB-CE 3.59Å; L1317-M1376 HydrophobicContact CD2-CE 3.42Å; L1317-M1376 VanDerWaalsContact CD2-CE 3.42Å; L1317-M1376 HydrophobicContact CD2-SD 3.85Å; L1317-M1376 HydrophobicContact CG-CE 4.07Å; L1317-M1376 WeakPolarHBondContact O-CE 3.26Å; V1320-M1376 HydrophobicContact CB-SD 4.36Å; V1320-M1376 HydrophobicContact CG1-SD 3.91Å; E1321-M1376 HydrophobicContact CB-CE 4.2Å; L1324-M1376 HydrophobicContact CD1-CB 3.91Å; L1324-M1376 HydrophobicContact CD1-CG 4.02Å; K1372-M1376 HydrophobicContact CB-CE 4.3Å; K1372-M1376 WeakPolarHBondContact O-CG 3.38Å; K1372-M1376 PolarHBondContact O-N 3.26Å; S1374-M1376 VanDerWaalsContact C-N 3.34Å; S1374-M1376 PolarHBondContact O-N 2.82Å; M1376-A1378 VanDerWaalsContact C-N 3.31Å; M1376-L1379 PolarHBondContact O-N 2.79Å; M1376-C1380 WeakPolarHBondContact O-CB 3.44Å; M1376-C1380 PolarHBondContact O-N 3.09Å; M1376-C1380 PolarHBondContact O-SG 3.25Å; M1376-L1400 HydrophobicContact CB-CD1 3.66Å; M1376-L1400 HydrophobicContact SD-CD2 4.37Å
1377R70.5Confident61Low110 Ų11052 Ų5242%0.41533%0.325SS..Hα-helixtrans-63-39.9171.9-78.3177.8-173.3155.76.2111.4V1373 S1374 C1380 A1381 L1400V1373-R1377 WeakPolarHBondContact O-CG 3.45Å; V1373-R1377 PolarHBondContact O-N 3.28Å; S1374-R1377 WeakPolarHBondContact O-CB 3.49Å; S1374-R1377 PolarHBondContact O-N 2.85Å; R1377-C1380 PolarHBondContact O-N 3.36Å; R1377-A1381 WeakPolarHBondContact O-CB 3.31Å; R1377-A1381 PolarHBondContact O-N 2.94Å; R1377-L1400 HydrophobicContact CG-CD1 3.97Å; R1377-L1400 PolarHBondContact NH2-O 3.09Å
1378A71.6Confident61.2Low58 Ų5848.4 Ų48.448%0.47931%0.308SS..Hα-helixtrans-63.7-43.5174.400000111.2S1374 D1375 M1376 A1381 L1382S1374-A1378 PolarHBondContact O-N 3.04Å; D1375-A1378 WeakPolarHBondContact O-CB 3.22Å; D1375-A1378 PolarHBondContact O-N 3.34Å; M1376-A1378 VanDerWaalsContact C-N 3.31Å; A1378-A1381 WeakPolarHBondContact O-CB 3.35Å; A1378-A1381 PolarHBondContact O-N 2.79Å; A1378-L1382 PolarHBondContact O-N 3.07Å
1379L66.5Low61.8Low34 Ų3443.7 Ų43.718%0.17829%0.287CS..Hα-helixtrans-58.9-51.1172.6-74.3173.7000111.3E1321 L1324 Q1325 I1328 D1375 M1376 A1381 L1382E1321-L1379 HydrophobicContact CG-CD1 4.01Å; L1324-L1379 HydrophobicContact CB-CB 4.39Å; L1324-L1379 HydrophobicContact CB-CD1 4.36Å; L1324-L1379 HydrophobicContact CD1-CB 4.23Å; Q1325-L1379 HydrophobicContact CG-CD1 4.38Å; I1328-L1379 HydrophobicContact CD1-CB 3.58Å; I1328-L1379 HydrophobicContact CD1-CD2 3.96Å; I1328-L1379 HydrophobicContact CD1-CG 4.34Å; I1328-L1379 WeakPolarHBondContact CD1-O 3.39Å; D1375-L1379 WeakPolarHBondContact O-CG 3.03Å; D1375-L1379 PolarHBondContact O-N 2.85Å; M1376-L1379 PolarHBondContact O-N 2.79Å; L1379-A1381 PolarHBondContact O-N 2.65Å; L1379-A1381 VanDerWaalsContact O-N 3.14Å; L1379-L1382 HydrophobicContact CD2-CD1 4.13Å; L1379-L1382 WeakPolarHBondContact O-CB 3.47Å; L1379-L1382 PolarHBondContact O-N 3.05Å
1380C67.2Low62.4Low14 Ų1446.8 Ų46.810%0.09530%0.299CS..Hα-helixtrans-57.4-29.5176.5-71.30000113.2M1376 R1377 L1382 V1393M1376-C1380 WeakPolarHBondContact O-CB 3.44Å; M1376-C1380 PolarHBondContact O-N 3.09Å; M1376-C1380 PolarHBondContact O-SG 3.25Å; R1377-C1380 PolarHBondContact O-N 3.36Å; C1380-L1382 VanDerWaalsContact C-N 3.3Å; C1380-L1382 PolarHBondContact O-N 3.01Å; C1380-V1393 HydrophobicContact CB-CG1 3.86Å
1381A70.3Confident62.7Low84 Ų8447.1 Ų47.169%0.69429%0.291SS*.Hα-helixtrans-74.6-15.8178.300000113.9R1377 A1378 L1379 G1383R1377-A1381 WeakPolarHBondContact O-CB 3.31Å; R1377-A1381 PolarHBondContact O-N 2.94Å; A1378-A1381 WeakPolarHBondContact O-CB 3.35Å; A1378-A1381 PolarHBondContact O-N 2.79Å; L1379-A1381 PolarHBondContact O-N 2.65Å; L1379-A1381 VanDerWaalsContact O-N 3.14Å; A1381-G1383 PolarHBondContact O-N 2.73Å
1382L70.7Confident62.9Low123 Ų12345.7 Ų45.764%0.64428%0.275SS*.THydrogen-bonded Turntrans-72.9-11.5178.6-65.1172.2000113.6I1328 A1378 L1379 C1380I1328-L1382 HydrophobicContact CG2-CB 3.64Å; I1328-L1382 HydrophobicContact CG2-CD1 3.95Å; I1328-L1382 HydrophobicContact CG2-CG 4.45Å; A1378-L1382 PolarHBondContact O-N 3.07Å; L1379-L1382 HydrophobicContact CD2-CD1 4.13Å; L1379-L1382 WeakPolarHBondContact O-CB 3.47Å; L1379-L1382 PolarHBondContact O-N 3.05Å; C1380-L1382 VanDerWaalsContact C-N 3.3Å; C1380-L1382 PolarHBondContact O-N 3.01Å
1383G57.4Low63.2Low37 Ų3744.8 Ų44.838%0.38127%0.272SS..  trans85.1166.6-177.300000113.6A1381A1381-G1383 PolarHBondContact O-N 2.73Å
1384S61.7Low63.4Low40 Ų4047.3 Ų47.328%0.2829%0.29SS..  trans-103.4139.8-17458.10000113.2S1386 E1390S1384-S1386 PolarHBondContact O-N 3.02Å; S1384-S1386 PolarHBondContact OG-O 2.78Å; S1384-E1390 VanDerWaalsContact CB-CA 3.42Å; S1384-E1390 VanDerWaalsContact CB-N 3.28Å; S1384-E1390 VanDerWaalsContact OG-CA 3.31Å; S1384-E1390 WeakPolarHBondContact OG-CA 3.39Å; S1384-E1390 VanDerWaalsContact OG-CB 3.26Å; S1384-E1390 WeakPolarHBondContact OG-CB 3.37Å; S1384-E1390 PolarHBondContact OG-N 3.33Å
1385A57.4Low63.4Low42 Ų4245 Ų4535%0.34727%0.271SS..SBendtrans-72.1-11.3178.900000114.5C1327C1327-A1385 VanDerWaalsContact O-CB 3.31Å; C1327-A1385 WeakPolarHBondContact O-CB 3.44Å; C1327-A1385 PolarHBondContact O-N 2.7Å
1386S53.5Low63.5Low16 Ų1640.8 Ų40.811%0.11225%0.249CC..SBendtrans-157.3163.3174.1730000111.4S1384 A1388 H1389 E1390S1384-S1386 PolarHBondContact O-N 3.02Å; S1384-S1386 PolarHBondContact OG-O 2.78Å; S1386-A1388 PolarHBondContact O-N 3.1Å; S1386-A1388 PolarHBondContact OG-N 3.37Å; S1386-H1389 CarbonylContact O-C 3.45Å; S1386-H1389 WeakPolarHBondContact O-CA 3.39Å; S1386-H1389 WeakPolarHBondContact O-CB 3.38Å; S1386-H1389 PolarHBondContact O-N 3.49Å; S1386-H1389 PolarHBondContact OG-N 2.99Å; S1386-H1389 VanDerWaalsContact OG-N 3.13Å; S1386-H1389 PolarHBondContact OG-ND1 3Å; S1386-H1389 VanDerWaalsContact OG-ND1 3.13Å; S1386-E1390 PolarHBondContact O-N 2.88Å
1387I52.8Low63.5Low16 Ų1645.8 Ų45.88%0.08227%0.271CS..Hα-helixtrans-58.6-34.8173.5-63.8-177.9000111.4A471 W504 H1389 E1390A471-I1387 HydrophobicContact CB-CG2 3.63Å; W504-I1387 HydrophobicContact CD2-CD1 3.67Å; W504-I1387 HydrophobicContact CE3-CD1 3.85Å; W504-I1387 HydrophobicContact CG-CD1 4.44Å; W504-I1387 HydrophobicContact CH2-CD1 3.61Å; W504-I1387 HydrophobicContact CZ2-CD1 3.36Å; W504-I1387 HydrophobicContact CZ2-CG1 4.05Å; W504-I1387 HydrophobicContact CZ3-CD1 3.83Å; I1387-H1389 VanDerWaalsContact C-N 3.33Å; I1387-E1390 WeakPolarHBondContact O-CB 3.42Å; I1387-E1390 PolarHBondContact O-N 3.19Å
1388A52.1Low63.2Low23 Ų2342.7 Ų42.719%0.1927%0.268CS..Hα-helixtrans-64.2-40.3174.900000111.4S1386S1386-A1388 PolarHBondContact O-N 3.1Å; S1386-A1388 PolarHBondContact OG-N 3.37Å
1389H59.8Low62.8Low32 Ų3240.3 Ų40.315%0.14825%0.248CC..Hα-helixtrans-72.1-32.1176.4-60.6155.8000112.7C1327 S1386 I1387 R1391 I1392 V1393C1327-H1389 HydrophobicContact CB-CB 3.83Å; C1327-H1389 PolarHBondContact O-ND1 3.06Å; S1386-H1389 CarbonylContact O-C 3.45Å; S1386-H1389 WeakPolarHBondContact O-CA 3.39Å; S1386-H1389 WeakPolarHBondContact O-CB 3.38Å; S1386-H1389 PolarHBondContact O-N 3.49Å; S1386-H1389 PolarHBondContact OG-N 2.99Å; S1386-H1389 VanDerWaalsContact OG-N 3.13Å; S1386-H1389 PolarHBondContact OG-ND1 3Å; S1386-H1389 VanDerWaalsContact OG-ND1 3.13Å; I1387-H1389 VanDerWaalsContact C-N 3.33Å; H1389-R1391 PolarHBondContact O-N 2.69Å; H1389-I1392 WeakPolarHBondContact O-CB 3.09Å; H1389-I1392 PolarHBondContact O-N 3.12Å; H1389-V1393 WeakPolarHBondContact O-CG2 3.12Å; H1389-V1393 PolarHBondContact O-N 3.41Å
1390E63.4Low62.7Low73 Ų7338.8 Ų38.834%0.34124%0.24SC..Hα-helixtrans-53.6-41176.6-163.8-177.8168.800111.1R501 S1384 S1386 I1387 V1393 C1394R501-E1390 IonicContact NH1-OE2 2.82Å; R501-E1390 IonicContact NH2-OE2 3.43Å; S1384-E1390 VanDerWaalsContact CB-CA 3.42Å; S1384-E1390 VanDerWaalsContact CB-N 3.28Å; S1384-E1390 VanDerWaalsContact OG-CA 3.31Å; S1384-E1390 WeakPolarHBondContact OG-CA 3.39Å; S1384-E1390 VanDerWaalsContact OG-CB 3.26Å; S1384-E1390 WeakPolarHBondContact OG-CB 3.37Å; S1384-E1390 PolarHBondContact OG-N 3.33Å; S1386-E1390 PolarHBondContact O-N 2.88Å; I1387-E1390 WeakPolarHBondContact O-CB 3.42Å; I1387-E1390 PolarHBondContact O-N 3.19Å; E1390-V1393 PolarHBondContact O-N 3.37Å; E1390-C1394 WeakPolarHBondContact O-CB 3.46Å; E1390-C1394 PolarHBondContact O-N 3.28Å; E1390-C1394 PolarHBondContact O-SG 2.8Å
1391R61.3Low62.5Low47 Ų4742.6 Ų42.618%0.17726%0.256CS..Hα-helixtrans-66.7-40.6177-69.8-175.7178.4160.311.3113.6L405 E468 H1389 V1393 C1394 H1395L405-R1391 HydrophobicContact CD2-CB 4.46Å; E468-R1391 PolarHBondContact O-NH2 2.89Å; H1389-R1391 PolarHBondContact O-N 2.69Å; R1391-V1393 VanDerWaalsContact C-N 3.33Å; R1391-C1394 PolarHBondContact O-N 3.36Å; R1391-H1395 VanDerWaalsContact O-CB 3.23Å; R1391-H1395 WeakPolarHBondContact O-CB 3.3Å; R1391-H1395 PolarHBondContact O-N 3.2Å
1392I62.8Low61.8Low5 Ų543.9 Ų43.93%0.02624%0.243CC..Hα-helixtrans-63.9-46.8177.5-61.6172.6000108.6L405 V1323 F1346 L1350 H1389 C1394 H1395 V1396L405-I1392 HydrophobicContact CD1-CG1 4.47Å; L405-I1392 HydrophobicContact CD2-CG1 4.23Å; V1323-I1392 HydrophobicContact CG1-CG2 3.5Å; V1323-I1392 VanDerWaalsContact CG1-CG2 3.5Å; F1346-I1392 HydrophobicContact CZ-CD1 4.29Å; L1350-I1392 HydrophobicContact CD2-CD1 3.9Å; L1350-I1392 HydrophobicContact CD2-CG1 4.13Å; H1389-I1392 WeakPolarHBondContact O-CB 3.09Å; H1389-I1392 PolarHBondContact O-N 3.12Å; I1392-C1394 PolarHBondContact O-N 3.4Å; I1392-H1395 PolarHBondContact O-N 3.06Å; I1392-V1396 HydrophobicContact CG2-CG2 4.49Å; I1392-V1396 WeakPolarHBondContact O-CB 3.11Å; I1392-V1396 VanDerWaalsContact O-CG2 3.24Å; I1392-V1396 WeakPolarHBondContact O-CG2 3.43Å; I1392-V1396 PolarHBondContact O-N 3.24Å
1393V67.8Low61.1Low11 Ų1139.2 Ų39.27%0.06722%0.221CC..Hα-helixtrans-60-45.9176174.30000111.5L1324 C1327 C1380 H1389 E1390 R1391 V1396 K1397L1324-V1393 HydrophobicContact CD2-CG2 4Å; C1327-V1393 HydrophobicContact CB-CG2 4.11Å; C1380-V1393 HydrophobicContact CB-CG1 3.86Å; H1389-V1393 WeakPolarHBondContact O-CG2 3.12Å; H1389-V1393 PolarHBondContact O-N 3.41Å; E1390-V1393 PolarHBondContact O-N 3.37Å; R1391-V1393 VanDerWaalsContact C-N 3.33Å; V1393-V1396 PolarHBondContact O-N 2.84Å; V1393-K1397 VanDerWaalsContact O-CB 3.31Å; V1393-K1397 WeakPolarHBondContact O-CB 3.03Å; V1393-K1397 PolarHBondContact O-N 2.76Å
1394C65.5Low60.9Low69 Ų6940.1 Ų40.147%0.46622%0.224SC..Hα-helixtrans-64.9-42.1177.2-76.10000112.9E1390 R1391 I1392 K1397 A1398E1390-C1394 WeakPolarHBondContact O-CB 3.46Å; E1390-C1394 PolarHBondContact O-N 3.28Å; E1390-C1394 PolarHBondContact O-SG 2.8Å; R1391-C1394 PolarHBondContact O-N 3.36Å; I1392-C1394 PolarHBondContact O-N 3.4Å; C1394-K1397 PolarHBondContact O-N 3.4Å; C1394-A1398 WeakPolarHBondContact O-CB 3.48Å; C1394-A1398 PolarHBondContact O-N 2.76Å
1395H64.4Low60.3Low20 Ų2046 Ų469%0.09325%0.247CC..Hα-helixtrans-64.6-44.4177.5-177.568000111.2Q403 L405 P1353 R1391 I1392 A1398 L1399Q403-H1395 PolarHBondContact O-CE1 2.95Å; Q403-H1395 PolarHBondContact O-ND1 2.54Å; L405-H1395 HydrophobicContact CD1-CB 4.37Å; P1353-H1395 WeakPolarHBondContact CB-CD2 3.35Å; P1353-H1395 WeakPolarHBondContact CB-NE2 3.42Å; R1391-H1395 VanDerWaalsContact O-CB 3.23Å; R1391-H1395 WeakPolarHBondContact O-CB 3.3Å; R1391-H1395 PolarHBondContact O-N 3.2Å; I1392-H1395 PolarHBondContact O-N 3.06Å; H1395-A1398 PolarHBondContact O-N 2.78Å; H1395-L1399 WeakPolarHBondContact O-CB 3.42Å; H1395-L1399 PolarHBondContact O-N 3.39Å
1396V68.2Low59.6Low1 Ų150.3 Ų50.31%0.00626%0.264CS..Hα-helixtrans-62.6-43.7173.7173.70000110.4V1320 L1324 P1353 I1392 V1393 A1398 L1399 L1400V1320-V1396 HydrophobicContact CG1-CB 4.34Å; V1320-V1396 HydrophobicContact CG1-CG1 3.53Å; V1320-V1396 HydrophobicContact CG1-CG2 3.76Å; L1324-V1396 HydrophobicContact CD1-CG1 3.86Å; L1324-V1396 HydrophobicContact CD2-CB 4.2Å; L1324-V1396 HydrophobicContact CD2-CG1 4.16Å; L1324-V1396 HydrophobicContact CD2-CG2 4.36Å; L1324-V1396 HydrophobicContact CG-CG1 4.25Å; P1353-V1396 HydrophobicContact CG-CG2 4.06Å; I1392-V1396 HydrophobicContact CG2-CG2 4.49Å; I1392-V1396 WeakPolarHBondContact O-CB 3.11Å; I1392-V1396 VanDerWaalsContact O-CG2 3.24Å; I1392-V1396 WeakPolarHBondContact O-CG2 3.43Å; I1392-V1396 PolarHBondContact O-N 3.24Å; V1393-V1396 PolarHBondContact O-N 2.84Å; V1396-A1398 PolarHBondContact O-N 3.15Å; V1396-L1399 WeakPolarHBondContact O-CB 3.48Å; V1396-L1399 PolarHBondContact O-N 3.05Å; V1396-L1400 HydrophobicContact CG1-CD1 4.04Å; V1396-L1400 HydrophobicContact CG1-CG 4.2Å; V1396-L1400 VanDerWaalsContact O-CG 3.25Å; V1396-L1400 WeakPolarHBondContact O-CG 3.14Å; V1396-L1400 PolarHBondContact O-N 2.83Å
1397K68.6Low58.9Low107 Ų10751.1 Ų51.147%0.46527%0.272SS..Hα-helixtrans-58.9-48.1176.1-172.6-179.2177.4-174.20112.3V1393 C1394 L1399 L1400 E1401V1393-K1397 VanDerWaalsContact O-CB 3.31Å; V1393-K1397 WeakPolarHBondContact O-CB 3.03Å; V1393-K1397 PolarHBondContact O-N 2.76Å; C1394-K1397 PolarHBondContact O-N 3.4Å; K1397-L1399 VanDerWaalsContact C-N 3.3Å; K1397-L1399 PolarHBondContact O-N 3.47Å; K1397-L1400 CarbonylContact O-C 3.58Å; K1397-L1400 PolarHBondContact O-N 2.91Å; K1397-L1400 VanDerWaalsContact O-N 3.14Å; K1397-E1401 VanDerWaalsContact CE-OE1 3.24Å; K1397-E1401 WeakPolarHBondContact CE-OE1 3.09Å; K1397-E1401 WeakPolarHBondContact O-CG 3.46Å; K1397-E1401 PolarHBondContact O-N 3.31Å
1398A64.2Low58Low44 Ų4458.8 Ų58.836%0.36431%0.307SS..Hα-helixtrans-62.3-37.317700000112.2C1394 H1395 V1396 E1401 R1402C1394-A1398 WeakPolarHBondContact O-CB 3.48Å; C1394-A1398 PolarHBondContact O-N 2.76Å; H1395-A1398 PolarHBondContact O-N 2.78Å; V1396-A1398 PolarHBondContact O-N 3.15Å; A1398-E1401 PolarHBondContact O-N 3.18Å; A1398-R1402 PolarHBondContact O-N 3.45Å
1399L63.1Low57.3Low8 Ų862 Ų624%0.04232%0.317CS..Hα-helixtrans-60.7-51.6171.2-174.278000110.4P1353 L1356 Q1357 H1395 V1396 K1397 E1401 R1402 C1403P1353-L1399 HydrophobicContact CB-CD2 4.04Å; P1353-L1399 WeakPolarHBondContact O-CD2 3.43Å; L1356-L1399 HydrophobicContact CB-CD2 4.04Å; L1356-L1399 HydrophobicContact CD2-CD2 3.65Å; L1356-L1399 HydrophobicContact CG-CD2 3.97Å; Q1357-L1399 HydrophobicContact CB-CD1 3.5Å; Q1357-L1399 VanDerWaalsContact CB-CD1 3.5Å; Q1357-L1399 HydrophobicContact CG-CD1 3.83Å; H1395-L1399 WeakPolarHBondContact O-CB 3.42Å; H1395-L1399 PolarHBondContact O-N 3.39Å; V1396-L1399 WeakPolarHBondContact O-CB 3.48Å; V1396-L1399 PolarHBondContact O-N 3.05Å; K1397-L1399 VanDerWaalsContact C-N 3.3Å; K1397-L1399 PolarHBondContact O-N 3.47Å; L1399-E1401 VanDerWaalsContact C-N 3.26Å; L1399-E1401 PolarHBondContact O-N 2.85Å; L1399-R1402 PolarHBondContact O-N 3.27Å; L1399-C1403 PolarHBondContact O-N 2.68Å; L1399-C1403 PolarHBondContact O-SG 3.22Å
1400L64.8Low55.9Low2 Ų267.5 Ų67.51%0.0135%0.347CS..Hα-helixtrans-64.2-25.7178.9-62.3176.9000113.5V1373 M1376 R1377 V1396 K1397 A1404V1373-L1400 HydrophobicContact CB-CD2 4.4Å; V1373-L1400 HydrophobicContact CG1-CB 4.48Å; V1373-L1400 HydrophobicContact CG1-CD2 4.07Å; V1373-L1400 HydrophobicContact CG2-CD2 4.05Å; M1376-L1400 HydrophobicContact CB-CD1 3.66Å; M1376-L1400 HydrophobicContact SD-CD2 4.37Å; R1377-L1400 HydrophobicContact CG-CD1 3.97Å; R1377-L1400 PolarHBondContact NH2-O 3.09Å; V1396-L1400 HydrophobicContact CG1-CD1 4.04Å; V1396-L1400 HydrophobicContact CG1-CG 4.2Å; V1396-L1400 VanDerWaalsContact O-CG 3.25Å; V1396-L1400 WeakPolarHBondContact O-CG 3.14Å; V1396-L1400 PolarHBondContact O-N 2.83Å; K1397-L1400 CarbonylContact O-C 3.58Å; K1397-L1400 PolarHBondContact O-N 2.91Å; K1397-L1400 VanDerWaalsContact O-N 3.14Å; L1400-A1404 PolarHBondContact O-N 3.4Å
1401E63.2Low54.3Low95 Ų9566.9 Ų66.944%0.44435%0.351SS..Hα-helixtrans-73.4-49.3173-77.5171.7-179.300111.2K1397 A1398 L1399 C1403 A1404 E1405K1397-E1401 VanDerWaalsContact CE-OE1 3.24Å; K1397-E1401 WeakPolarHBondContact CE-OE1 3.09Å; K1397-E1401 WeakPolarHBondContact O-CG 3.46Å; K1397-E1401 PolarHBondContact O-N 3.31Å; A1398-E1401 PolarHBondContact O-N 3.18Å; L1399-E1401 VanDerWaalsContact C-N 3.26Å; L1399-E1401 PolarHBondContact O-N 2.85Å; E1401-C1403 PolarHBondContact O-N 3.05Å; E1401-A1404 WeakPolarHBondContact O-CA 3.47Å; E1401-A1404 WeakPolarHBondContact O-CB 3.39Å; E1401-A1404 PolarHBondContact O-N 3.43Å; E1401-E1405 PolarHBondContact O-N 3.01Å
1402R55.9Low52.9Low110 Ų11073.7 Ų73.742%0.41538%0.384SS..Hα-helixtrans-55.9-37.5171.7-76-177-179.6163.45.4111.9A1398 L1399 A1404 E1405A1398-R1402 PolarHBondContact O-N 3.45Å; L1399-R1402 PolarHBondContact O-N 3.27Å; R1402-A1404 PolarHBondContact O-N 3.23Å; R1402-E1405 PolarHBondContact O-N 3.45Å
1403C54.1Low51.4Low26 Ų2678.9 Ų78.918%0.17642%0.417CS..Hα-helixtrans-65.1-26.4175.2-60.80000113.6L1360 L1399 E1401L1360-C1403 HydrophobicContact CD1-CB 4.46Å; L1360-C1403 WeakPolarHBondContact CD1-SG 3.12Å; L1399-C1403 PolarHBondContact O-N 2.68Å; L1399-C1403 PolarHBondContact O-SG 3.22Å; E1401-C1403 PolarHBondContact O-N 3.05Å
1404A54.3Low49.7Very low55 Ų5582 Ų8246%0.45543%0.429SS..Hα-helixtrans-76.8-35.4179.600000112L1400 E1401 R1402L1400-A1404 PolarHBondContact O-N 3.4Å; E1401-A1404 WeakPolarHBondContact O-CA 3.47Å; E1401-A1404 WeakPolarHBondContact O-CB 3.39Å; E1401-A1404 PolarHBondContact O-N 3.43Å; R1402-A1404 PolarHBondContact O-N 3.23Å
1405E48.8Very low47.8Very low163 Ų16389 Ų8976%0.76245%0.452SS*.Hα-helixtrans-72.6-35-176.5-67.7178.9168.600112.5E1401 R1402E1401-E1405 PolarHBondContact O-N 3.01Å; R1402-E1405 PolarHBondContact O-N 3.45Å
1406D42.3Very low46.2Very low133 Ų13394 Ų9471%0.71149%0.488SS*.SBendtrans-88.5-5-173.4-80.1-27.2000115.5
1407A39.3Very low44.4Very low33 Ų3397 Ų9727%0.27351%0.512SS..  trans-10794-164.100000115F1409A1407-F1409 HydrophobicContact CB-CD2 3.88Å; A1407-F1409 HydrophobicContact CB-CE1 4.3Å; A1407-F1409 HydrophobicContact CB-CE2 3.26Å; A1407-F1409 HydrophobicContact CB-CZ 3.5Å; A1407-F1409 VanDerWaalsContact CB-CZ 3.5Å; A1407-F1409 VanDerWaalsContact O-CD2 3.25Å; A1407-F1409 WeakPolarHBondContact O-CD2 3.46Å; A1407-F1409 PolarHBondContact O-N 3.47Å
1408H34.1Very low42.5Very low177 Ų17795.9 Ų95.982%0.81952%0.518SS*.  trans-81.4105.6155.5-84-63.8000109.8
1409F36.8Very low40.8Very low91 Ų9197.3 Ų97.340%0.39954%0.536SS..  trans-84.7132.1-173.8-71.7-86.7000113.2L1365 A1370 A1407L1365-F1409 HydrophobicContact CB-CE1 4Å; L1365-F1409 WeakPolarHBondContact O-CD1 3.49Å; L1365-F1409 VanDerWaalsContact O-CE1 3.25Å; L1365-F1409 WeakPolarHBondContact O-CE1 3.43Å; A1370-F1409 HydrophobicContact CB-CE1 4.46Å; A1370-F1409 HydrophobicContact CB-CZ 4.45Å; A1407-F1409 HydrophobicContact CB-CD2 3.88Å; A1407-F1409 HydrophobicContact CB-CE1 4.3Å; A1407-F1409 HydrophobicContact CB-CE2 3.26Å; A1407-F1409 HydrophobicContact CB-CZ 3.5Å; A1407-F1409 VanDerWaalsContact CB-CZ 3.5Å; A1407-F1409 VanDerWaalsContact O-CD2 3.25Å; A1407-F1409 WeakPolarHBondContact O-CD2 3.46Å; A1407-F1409 PolarHBondContact O-N 3.47Å
1410N31.8Very low39.4Very low147 Ų147108 Ų10879%0.78659%0.594SS**  trans-141.3124.5164.7-132-17.3000111.7
1411C29.7Very low38.1Very low61 Ų61113.3 Ų113.341%0.41262%0.623SS.*  trans-116.8121.9-164.3179.30000111
1412Q31.5Very low36.8Very low189 Ų189114.3 Ų114.388%0.88363%0.632SS**  trans-162.8-1.7151.8-113.9172.819.900117.3
1413T31Very low35.7Very low114 Ų114114.5 Ų114.570%0.69964%0.644SS**  trans-106.49.2-170.25.70000117.8
1414F31Very low34.6Very low76 Ų76119.7 Ų119.733%0.33367%0.672SS.*G310 helixtrans-85.6-12.9-174.1-152.8-109.8000116I1310 E1368 C1416I1310-F1414 HydrophobicContact CB-CE2 4.03Å; I1310-F1414 HydrophobicContact CD1-CD2 3.79Å; I1310-F1414 HydrophobicContact CD1-CE2 3.71Å; I1310-F1414 HydrophobicContact CG1-CE2 4.44Å; I1310-F1414 HydrophobicContact CG2-CD2 4.33Å; I1310-F1414 HydrophobicContact CG2-CE2 3.41Å; I1310-F1414 VanDerWaalsContact CG2-CE2 3.41Å; I1310-F1414 HydrophobicContact CG2-CZ 3.69Å; E1368-F1414 WeakPolarHBondContact OE2-CE1 2.85Å; F1414-C1416 VanDerWaalsContact C-N 3.27Å; F1414-C1416 PolarHBondContact O-N 2.9Å; F1414-C1416 VanDerWaalsContact O-N 3.11Å
1415K27.5Very low33.4Very low216 Ų216123.8 Ų123.894%0.93969%0.685SS**G310 helixtrans-74.41.5-173.5-88.9-169.8176.3-176.20116.9
1416C29.8Very low32.3Very low125 Ų125121.1 Ų121.185%0.84568%0.68SS**G310 helixtrans-117.7-5.1-170.1-149.70000117.3F1414F1414-C1416 VanDerWaalsContact C-N 3.27Å; F1414-C1416 PolarHBondContact O-N 2.9Å; F1414-C1416 VanDerWaalsContact O-N 3.11Å
1417A31.5Very low31.6Very low64 Ų64120.3 Ų120.353%0.52968%0.678SS.*SBendtrans-112.3-13.6-171.800000116.5V1307V1307-A1417 HydrophobicContact CG1-CB 4.25Å
1418C27.3Very low31.1Very low85 Ų85127 Ų12757%0.57471%0.709SS**  trans-122.769.2177.4-62.20000109.7N1420C1418-N1420 PolarHBondContact O-N 3.11Å
1419G30Very low30.8Very low73 Ų73122.8 Ų122.875%0.75370%0.7SS**  trans-84.691.316400000108.8
1420N31.7Very low30.3Very low233 Ų233125.7 Ų125.7100%1.24673%0.727SS**  trans102.60-175.3-60.7-33.2000115.4C1418C1418-N1420 PolarHBondContact O-N 3.11Å

Retrieved 1,420 of 1,420 residues in 1172.8 ms (Link to these results)

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