C4Q4S4_SCHMA Loading...

Synembryn, putative

AlphaFold DB , UniProt , Accession C4Q4S4, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 528 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
1M37.4Very low72.5Confident236 Ų23689.5 Ų89.5100%1.16348%0.476SS*.  013.40-80.1-169.212900113
2S45.1Very low74.1Confident100 Ų10083.8 Ų83.870%0.69945%0.447SS*.  trans-105.7-15.7-177.150.20000115.7
3D55.9Low75.4Confident121 Ų12188.9 Ų88.965%0.64747%0.473SS*.SBendtrans-89.3-33.5-172.4-77.1-10.4000114.4N5 S6D3-N5 VanDerWaalsContact C-N 3.26Å; D3-N5 PolarHBondContact O-N 3.19Å; D3-S6 VanDerWaalsContact O-CB 3.31Å; D3-S6 WeakPolarHBondContact O-CB 3.43Å; D3-S6 PolarHBondContact O-N 2.8Å
4D57.8Low76.4Confident94 Ų9491.4 Ų91.450%0.50348%0.48SS..Hα-helixtrans-60.6-33.4-173.2-56.3-10.2000113.2
5N66.4Low77.4Confident34 Ų3485.9 Ų85.918%0.18245%0.451CS..Hα-helixtrans-73.8-28.9179.2-130.847.6000112.4D3 I7 L8 E9 G47D3-N5 VanDerWaalsContact C-N 3.26Å; D3-N5 PolarHBondContact O-N 3.19Å; N5-I7 PolarHBondContact O-N 3.37Å; N5-L8 PolarHBondContact O-N 2.69Å; N5-E9 PolarHBondContact ND2-OE1 3.14Å; N5-E9 WeakPolarHBondContact O-CB 3.48Å; N5-E9 VanDerWaalsContact O-CG 3.22Å; N5-E9 WeakPolarHBondContact O-CG 3.4Å; N5-E9 PolarHBondContact O-N 3.35Å; N5-G47 WeakPolarHBondContact OD1-CA 3.13Å
6S82Confident78Confident73 Ų7384.4 Ų84.451%0.5144%0.444SS..Hα-helixtrans-64.5-40.4-176-177.40000111.9D3 K10D3-S6 VanDerWaalsContact O-CB 3.31Å; D3-S6 WeakPolarHBondContact O-CB 3.43Å; D3-S6 PolarHBondContact O-N 2.8Å; S6-K10 WeakPolarHBondContact O-CB 3.5Å; S6-K10 PolarHBondContact O-N 3.08Å
7I88.8Confident78.3Confident99 Ų9985.9 Ų85.951%0.50846%0.461SS..Hα-helixtrans-67.8-45.5179.3-60.5176.4000110.8N5 K10 F11 I32N5-I7 PolarHBondContact O-N 3.37Å; I7-K10 PolarHBondContact O-N 3.16Å; I7-F11 PolarHBondContact O-N 3.47Å; I7-I32 HydrophobicContact CG2-CD1 3.66Å
8L90.5Very high78.5Confident3 Ų383.1 Ų83.12%0.01645%0.446CS..Hα-helixtrans-64.8-42.9178.4-60.7-177.4000111.7N5 K10 F11 V12 I32 E35 T50 C51N5-L8 PolarHBondContact O-N 2.69Å; L8-K10 PolarHBondContact O-N 3Å; L8-F11 PolarHBondContact O-N 3.28Å; L8-V12 WeakPolarHBondContact O-CG2 3.32Å; L8-V12 PolarHBondContact O-N 3.1Å; L8-I32 HydrophobicContact CD2-CD1 4.02Å; L8-I32 HydrophobicContact CD2-CG2 3.94Å; L8-E35 HydrophobicContact CD2-CB 4.1Å; L8-T50 HydrophobicContact CB-CG2 3.75Å; L8-C51 HydrophobicContact CD1-CB 4.5Å
9E90.9Very high78.5Confident90 Ų9087.7 Ų87.742%0.42146%0.462SS..Hα-helixtrans-61.6-44.7177.8-75.7172.4-165.800111.6N5 F11 V12 L13 T50N5-E9 PolarHBondContact ND2-OE1 3.14Å; N5-E9 WeakPolarHBondContact O-CB 3.48Å; N5-E9 VanDerWaalsContact O-CG 3.22Å; N5-E9 WeakPolarHBondContact O-CG 3.4Å; N5-E9 PolarHBondContact O-N 3.35Å; E9-F11 VanDerWaalsContact C-N 3.35Å; E9-F11 PolarHBondContact O-N 3.1Å; E9-V12 PolarHBondContact O-N 3.26Å; E9-L13 WeakPolarHBondContact O-CG 3.4Å; E9-L13 PolarHBondContact O-N 3.31Å; E9-T50 HydrophobicContact CB-CG2 4.38Å; E9-T50 HydrophobicContact CG-CG2 3.75Å
10K91.1Very high78.4Confident126 Ų12685.6 Ų85.655%0.54846%0.458SS..Hα-helixtrans-59.2-45.9175.4-176.4179.7175.1-175.20111.6S6 I7 L8 V12 L13 E14S6-K10 WeakPolarHBondContact O-CB 3.5Å; S6-K10 PolarHBondContact O-N 3.08Å; I7-K10 PolarHBondContact O-N 3.16Å; L8-K10 PolarHBondContact O-N 3Å; K10-V12 VanDerWaalsContact C-N 3.34Å; K10-V12 PolarHBondContact O-N 3.06Å; K10-L13 PolarHBondContact O-N 3.15Å; K10-E14 WeakPolarHBondContact CE-OE1 3.21Å; K10-E14 IonicContact NZ-OE1 2.68Å; K10-E14 WeakPolarHBondContact O-CG 3.36Å; K10-E14 PolarHBondContact O-N 3.43Å
11F91.9Very high78.6Confident8 Ų881.5 Ų81.54%0.03544%0.436CS..Hα-helixtrans-59.4-44178.9177.6-101.3000112.4I7 L8 E9 E14 N15 V24 I32 C54 I57 L58I7-F11 PolarHBondContact O-N 3.47Å; L8-F11 PolarHBondContact O-N 3.28Å; E9-F11 VanDerWaalsContact C-N 3.35Å; E9-F11 PolarHBondContact O-N 3.1Å; F11-E14 PolarHBondContact O-N 3.39Å; F11-N15 HydrophobicContact CE2-CB 4.45Å; F11-N15 HydrophobicContact CZ-CB 4.47Å; F11-N15 WeakPolarHBondContact O-CB 3.43Å; F11-N15 PolarHBondContact O-N 3.44Å; F11-N15 PolarHBondContact O-ND2 3.21Å; F11-N15 VanDerWaalsContact O-ND2 3.11Å; F11-V24 HydrophobicContact CE2-CG1 4.21Å; F11-V24 HydrophobicContact CE2-CG2 4.41Å; F11-I32 HydrophobicContact CB-CD1 3.72Å; F11-I32 HydrophobicContact CB-CG1 4.3Å; F11-I32 HydrophobicContact CD1-CG2 3.95Å; F11-I32 HydrophobicContact CD2-CD1 4.31Å; F11-I32 HydrophobicContact CD2-CG1 3.98Å; F11-I32 HydrophobicContact CE1-CG2 4.14Å; F11-I32 HydrophobicContact CE2-CG1 4.45Å; F11-I32 HydrophobicContact CG-CD1 3.98Å; F11-I32 HydrophobicContact CG-CG1 4Å; F11-I32 HydrophobicContact CG-CG2 4.27Å; F11-C54 HydrophobicContact CD1-CB 4.19Å; F11-C54 HydrophobicContact CE1-CB 4.39Å; F11-I57 HydrophobicContact CE1-CB 3.97Å; F11-I57 HydrophobicContact CE1-CD1 4.31Å; F11-I57 HydrophobicContact CE1-CG2 3.69Å; F11-I57 HydrophobicContact CZ-CB 4.47Å; F11-I57 HydrophobicContact CZ-CG2 3.73Å; F11-L58 HydrophobicContact CE1-CD2 4.15Å; F11-L58 HydrophobicContact CE1-CG 4.35Å; F11-L58 HydrophobicContact CZ-CD2 3.73Å; F11-L58 HydrophobicContact CZ-CG 4.4Å
12V91.6Very high80.6Confident21 Ų2176.2 Ų76.213%0.12741%0.412CS..Hα-helixtrans-63.1-48.3177.1174.50000110.9L8 E9 K10 E14 N15 D16 T50 C53 C54 I57L8-V12 WeakPolarHBondContact O-CG2 3.32Å; L8-V12 PolarHBondContact O-N 3.1Å; E9-V12 PolarHBondContact O-N 3.26Å; K10-V12 VanDerWaalsContact C-N 3.34Å; K10-V12 PolarHBondContact O-N 3.06Å; V12-E14 VanDerWaalsContact C-N 3.27Å; V12-E14 PolarHBondContact O-N 3.26Å; V12-N15 PolarHBondContact O-N 3.32Å; V12-D16 HydrophobicContact CG1-CB 4.49Å; V12-D16 VanDerWaalsContact O-CB 3.29Å; V12-D16 WeakPolarHBondContact O-CB 3.33Å; V12-D16 PolarHBondContact O-N 2.78Å; V12-T50 HydrophobicContact CG2-CG2 4.07Å; V12-C53 HydrophobicContact CG1-CB 4.04Å; V12-C53 HydrophobicContact CG2-CB 3.63Å; V12-C54 VanDerWaalsContact CG2-SG 3.52Å; V12-I57 HydrophobicContact CB-CD1 4.41Å; V12-I57 HydrophobicContact CG1-CD1 4.41Å; V12-I57 HydrophobicContact CG2-CD1 4.25Å
13L90.7Very high82.4Confident151 Ų15178.7 Ų78.779%0.79142%0.418SS*.Hα-helixtrans-58.8-38.2-179.3-73.1171.1000112.7E9 K10E9-L13 WeakPolarHBondContact O-CG 3.4Å; E9-L13 PolarHBondContact O-N 3.31Å; K10-L13 PolarHBondContact O-N 3.15Å
14E89.8Confident83.8Confident123 Ų12373.9 Ų73.958%0.57539%0.393SS*.Hα-helixtrans-79.5-28.2-179-69.9175.4176.200113.2K10 F11 V12K10-E14 WeakPolarHBondContact CE-OE1 3.21Å; K10-E14 IonicContact NZ-OE1 2.68Å; K10-E14 WeakPolarHBondContact O-CG 3.36Å; K10-E14 PolarHBondContact O-N 3.43Å; F11-E14 PolarHBondContact O-N 3.39Å; V12-E14 VanDerWaalsContact C-N 3.27Å; V12-E14 PolarHBondContact O-N 3.26Å
15N90.6Very high85.3Confident9 Ų973.7 Ų73.75%0.04839%0.392CS..Hα-helixtrans-1230.1-166.4-63.8-76.5000115.8F11 V12 C17 N18 I21 V24 I57 R60F11-N15 HydrophobicContact CE2-CB 4.45Å; F11-N15 HydrophobicContact CZ-CB 4.47Å; F11-N15 WeakPolarHBondContact O-CB 3.43Å; F11-N15 PolarHBondContact O-N 3.44Å; F11-N15 PolarHBondContact O-ND2 3.21Å; F11-N15 VanDerWaalsContact O-ND2 3.11Å; V12-N15 PolarHBondContact O-N 3.32Å; N15-C17 VanDerWaalsContact C-N 3.28Å; N15-C17 PolarHBondContact O-N 2.89Å; N15-N18 HydrophobicContact CB-CB 4.13Å; N15-N18 WeakPolarHBondContact O-CB 3.39Å; N15-N18 PolarHBondContact O-N 3.49Å; N15-N18 PolarHBondContact OD1-ND2 3.38Å; N15-I21 HydrophobicContact CB-CG2 4.27Å; N15-V24 VanDerWaalsContact OD1-CG2 3.23Å; N15-V24 WeakPolarHBondContact OD1-CG2 3.47Å; N15-I57 HydrophobicContact CB-CD1 4.47Å; N15-I57 HydrophobicContact CB-CG2 3.95Å; N15-R60 PolarHBondContact O-NH1 3Å
16D86.9Confident86.2Confident63 Ų6375.1 Ų75.134%0.33740%0.404SS..THydrogen-bonded Turntrans-57.2-43.3-178.7-170.318.5000112.2V12 R56 I57 R60V12-D16 HydrophobicContact CG1-CB 4.49Å; V12-D16 VanDerWaalsContact O-CB 3.29Å; V12-D16 WeakPolarHBondContact O-CB 3.33Å; V12-D16 PolarHBondContact O-N 2.78Å; D16-R56 IonicContact OD1-CZ 3.76Å; D16-R56 VanDerWaalsContact OD1-CZ 3.27Å; D16-R56 IonicContact OD1-NH1 3.95Å; D16-R56 PolarHBondContact OD1-NH1 3.33Å; D16-R56 IonicContact OD1-NH2 3.89Å; D16-R56 PolarHBondContact OD1-NH2 3.33Å; D16-I57 HydrophobicContact CB-CD1 4.44Å; D16-R60 PolarHBondContact O-NH1 3.44Å; D16-R60 PolarHBondContact O-NH2 3.31Å
17C84.1Confident86.6Confident109 Ų10978.3 Ų78.374%0.73641%0.408SS*.THydrogen-bonded Turntrans-88.93175.7-61.30000114.2N15 F19N15-C17 VanDerWaalsContact C-N 3.28Å; N15-C17 PolarHBondContact O-N 2.89Å; C17-F19 WeakPolarHBondContact O-CD2 3.31Å; C17-F19 PolarHBondContact O-N 3.06Å
18N82.4Confident86.7Confident35 Ų3576.2 Ų76.219%0.18740%0.4CS..  trans-87.899.4-179.5-173.5-6.8000110.6N15 A20 I21 R60N15-N18 HydrophobicContact CB-CB 4.13Å; N15-N18 WeakPolarHBondContact O-CB 3.39Å; N15-N18 PolarHBondContact O-N 3.49Å; N15-N18 PolarHBondContact OD1-ND2 3.38Å; N18-A20 PolarHBondContact O-N 3.2Å; N18-A20 PolarHBondContact OD1-N 3.28Å; N18-I21 HydrophobicContact CB-CG2 4.11Å; N18-I21 WeakPolarHBondContact O-CG2 3.42Å; N18-I21 PolarHBondContact OD1-N 3.19Å; N18-R60 WeakPolarHBondContact O-CD 3.27Å; N18-R60 PolarHBondContact O-NH1 3.15Å
19F77.6Confident86.7Confident172 Ų17276.6 Ų76.675%0.75440%0.402SS*.SBendtrans-73.8-23.6-172.4-67.5-77.4000115C17C17-F19 WeakPolarHBondContact O-CD2 3.31Å; C17-F19 PolarHBondContact O-N 3.06Å
20A76.8Confident86.8Confident44 Ų4476.9 Ų76.936%0.36440%0.403SS..SBendtrans-102.5-27.7-178.800000112.7N18 D22N18-A20 PolarHBondContact O-N 3.2Å; N18-A20 PolarHBondContact OD1-N 3.28Å; A20-D22 HydrophobicContact CB-CB 4.44Å; A20-D22 WeakPolarHBondContact CB-OD2 3.41Å; A20-D22 PolarHBondContact O-N 2.71Å
21I82.6Confident86.9Confident0 Ų075.1 Ų75.10%040%0.399CS..  trans49.523-172.860.3172.2000114.4N15 N18 N23 V24 K29 I57 R60 D61N15-I21 HydrophobicContact CB-CG2 4.27Å; N18-I21 HydrophobicContact CB-CG2 4.11Å; N18-I21 WeakPolarHBondContact O-CG2 3.42Å; N18-I21 PolarHBondContact OD1-N 3.19Å; I21-N23 VanDerWaalsContact C-N 3.26Å; I21-N23 PolarHBondContact O-N 2.82Å; I21-V24 PolarHBondContact O-N 2.94Å; I21-K29 WeakPolarHBondContact O-CE 3.39Å; I21-K29 PolarHBondContact O-NZ 3.42Å; I21-I57 WeakPolarHBondContact CD1-O 3.49Å; I21-I57 HydrophobicContact CG2-CG2 3.75Å; I21-R60 HydrophobicContact CD1-CB 4.05Å; I21-R60 HydrophobicContact CG1-CB 4.1Å; I21-D61 HydrophobicContact CD1-CB 3.68Å; I21-D61 HydrophobicContact CG1-CB 4.31Å
22D79.8Confident86.9Confident126 Ų12674.9 Ų74.967%0.67440%0.398SS*.THydrogen-bonded Turntrans-67.8-27.4-179.9-67.3-26000112.6A20 V24A20-D22 HydrophobicContact CB-CB 4.44Å; A20-D22 WeakPolarHBondContact CB-OD2 3.41Å; A20-D22 PolarHBondContact O-N 2.71Å; D22-V24 PolarHBondContact O-N 3.33Å
23N82.5Confident87Confident151 Ų15173.9 Ų73.981%0.80739%0.393SS*.THydrogen-bonded Turntrans-75.5-11.2-179.5-61.8-17.3000113.4I21I21-N23 VanDerWaalsContact C-N 3.26Å; I21-N23 PolarHBondContact O-N 2.82Å
24V85.6Confident87.2Confident21 Ų2170.3 Ų70.313%0.12737%0.372CS..SBendtrans-93.9126.1178-173.10000108.4F11 N15 I21 D22 T28 K29F11-V24 HydrophobicContact CE2-CG1 4.21Å; F11-V24 HydrophobicContact CE2-CG2 4.41Å; N15-V24 VanDerWaalsContact OD1-CG2 3.23Å; N15-V24 WeakPolarHBondContact OD1-CG2 3.47Å; I21-V24 PolarHBondContact O-N 2.94Å; D22-V24 PolarHBondContact O-N 3.33Å; V24-T28 HydrophobicContact CG1-CG2 3.78Å; V24-K29 HydrophobicContact CB-CG 4.13Å; V24-K29 HydrophobicContact CG1-CG 3.73Å; V24-K29 WeakPolarHBondContact O-CE 3.35Å; V24-K29 PolarHBondContact O-NZ 3.36Å
25D88.3Confident87.3Confident89 Ų8966.5 Ų66.548%0.47635%0.354SS..  trans-65.3151.9179.670-86.6000111.9K27 T28 K29D25-K27 VanDerWaalsContact C-N 3.25Å; D25-K27 PolarHBondContact O-N 3Å; D25-K27 WeakPolarHBondContact OD2-CB 3.37Å; D25-K27 PolarHBondContact OD2-N 3.25Å; D25-T28 VanDerWaalsContact CG-OG1 3.24Å; D25-T28 PolarHBondContact O-N 3.31Å; D25-T28 WeakPolarHBondContact OD1-CB 3.46Å; D25-T28 PolarHBondContact OD1-OG1 3.16Å; D25-T28 PolarHBondContact OD2-N 2.9Å; D25-T28 PolarHBondContact OD2-OG1 3.4Å; D25-K29 WeakPolarHBondContact O-CG 3.41Å; D25-K29 PolarHBondContact O-N 2.93Å; D25-K29 VanDerWaalsContact O-N 3.16Å
26C86.8Confident87.4Confident64 Ų6466.1 Ų66.143%0.43235%0.352SS..Hα-helixtrans-57.4-39.2-175.4-163.20000112.4K29 E30C26-K29 PolarHBondContact O-N 3.21Å; C26-E30 WeakPolarHBondContact O-CG 3.36Å; C26-E30 PolarHBondContact O-N 3.1Å; C26-E30 PolarHBondContact SG-OE1 3.16Å; C26-E30 VanDerWaalsContact SG-OE1 3.33Å
27K89.4Confident87.7Confident141 Ų14165.5 Ų65.561%0.61335%0.345SS*.Hα-helixtrans-67.1-45-177.1-173.8179.1-179.9-178.20111.3D25 K29 E30 D31D25-K27 VanDerWaalsContact C-N 3.25Å; D25-K27 PolarHBondContact O-N 3Å; D25-K27 WeakPolarHBondContact OD2-CB 3.37Å; D25-K27 PolarHBondContact OD2-N 3.25Å; K27-K29 VanDerWaalsContact C-N 3.29Å; K27-K29 PolarHBondContact O-N 2.72Å; K27-E30 PolarHBondContact O-N 3.28Å; K27-D31 WeakPolarHBondContact O-CB 3.41Å; K27-D31 VanDerWaalsContact O-CG 3.25Å; K27-D31 PolarHBondContact O-N 2.74Å
28T90Very high88.1Confident54 Ų5464.6 Ų64.633%0.33133%0.329SS..Hα-helixtrans-58-43.6173.6-63.90000110.9V24 D25 E30 D31 I32V24-T28 HydrophobicContact CG1-CG2 3.78Å; D25-T28 VanDerWaalsContact CG-OG1 3.24Å; D25-T28 PolarHBondContact O-N 3.31Å; D25-T28 WeakPolarHBondContact OD1-CB 3.46Å; D25-T28 PolarHBondContact OD1-OG1 3.16Å; D25-T28 PolarHBondContact OD2-N 2.9Å; D25-T28 PolarHBondContact OD2-OG1 3.4Å; T28-E30 PolarHBondContact O-N 2.8Å; T28-D31 PolarHBondContact O-N 3.37Å; T28-I32 HydrophobicContact CG2-CG1 4.46Å; T28-I32 WeakPolarHBondContact O-CG1 3.39Å; T28-I32 PolarHBondContact O-N 3.23Å
29K91.9Very high88.4Confident11 Ų1164.7 Ų64.75%0.04833%0.327CS..Hα-helixtrans-63.6-41.6178.5-61.8174.1174.4168.70112.3I21 V24 D25 C26 K27 I32 L33 L58 D61 L64I21-K29 WeakPolarHBondContact O-CE 3.39Å; I21-K29 PolarHBondContact O-NZ 3.42Å; V24-K29 HydrophobicContact CB-CG 4.13Å; V24-K29 HydrophobicContact CG1-CG 3.73Å; V24-K29 WeakPolarHBondContact O-CE 3.35Å; V24-K29 PolarHBondContact O-NZ 3.36Å; D25-K29 WeakPolarHBondContact O-CG 3.41Å; D25-K29 PolarHBondContact O-N 2.93Å; D25-K29 VanDerWaalsContact O-N 3.16Å; C26-K29 PolarHBondContact O-N 3.21Å; K27-K29 VanDerWaalsContact C-N 3.29Å; K27-K29 PolarHBondContact O-N 2.72Å; K29-I32 PolarHBondContact O-N 2.83Å; K29-L33 PolarHBondContact O-N 2.79Å; K29-L58 HydrophobicContact CB-CD2 4.17Å; K29-L58 HydrophobicContact CG-CD2 4.48Å; K29-D61 IonicContact NZ-OD2 3Å; K29-D61 PolarHBondContact NZ-OD2 3.4Å; K29-L64 HydrophobicContact CB-CD1 3.44Å; K29-L64 VanDerWaalsContact CB-CD1 3.44Å; K29-L64 HydrophobicContact CD-CD1 4.46Å; K29-L64 HydrophobicContact CG-CD1 4.47Å
30E92.2Very high89Confident96 Ų9656.5 Ų56.545%0.44929%0.291SS..Hα-helixtrans-63.8-43.9175.2-73.9169.8-167.700111.9C26 K27 T28 I32 L33 E34 L64C26-E30 WeakPolarHBondContact O-CG 3.36Å; C26-E30 PolarHBondContact O-N 3.1Å; C26-E30 PolarHBondContact SG-OE1 3.16Å; C26-E30 VanDerWaalsContact SG-OE1 3.33Å; K27-E30 PolarHBondContact O-N 3.28Å; T28-E30 PolarHBondContact O-N 2.8Å; E30-I32 VanDerWaalsContact C-N 3.34Å; E30-I32 PolarHBondContact O-N 2.78Å; E30-L33 WeakPolarHBondContact O-CB 3.31Å; E30-L33 PolarHBondContact O-N 2.82Å; E30-L33 VanDerWaalsContact O-N 3.15Å; E30-E34 PolarHBondContact O-N 3.27Å; E30-L64 HydrophobicContact CG-CD2 4.23Å
31D92.6Very high89.6Confident89 Ų8959.9 Ų59.948%0.47630%0.298SS..Hα-helixtrans-60.5-44.4176.9-71.5-23.7000110.7K27 T28 L33 E34 E35K27-D31 WeakPolarHBondContact O-CB 3.41Å; K27-D31 VanDerWaalsContact O-CG 3.25Å; K27-D31 PolarHBondContact O-N 2.74Å; T28-D31 PolarHBondContact O-N 3.37Å; D31-L33 VanDerWaalsContact C-N 3.33Å; D31-L33 PolarHBondContact O-N 3.21Å; D31-E34 PolarHBondContact O-N 3.36Å; D31-E35 WeakPolarHBondContact O-CG 3.31Å; D31-E35 PolarHBondContact O-N 3.07Å
32I93.6Very high89.7Confident3 Ų365.4 Ų65.42%0.01533%0.327CS..Hα-helixtrans-61.3-42174.9-64.7-68000111.2I7 L8 F11 T28 K29 E30 E35 C36 C54 L58I7-I32 HydrophobicContact CG2-CD1 3.66Å; L8-I32 HydrophobicContact CD2-CD1 4.02Å; L8-I32 HydrophobicContact CD2-CG2 3.94Å; F11-I32 HydrophobicContact CB-CD1 3.72Å; F11-I32 HydrophobicContact CB-CG1 4.3Å; F11-I32 HydrophobicContact CD1-CG2 3.95Å; F11-I32 HydrophobicContact CD2-CD1 4.31Å; F11-I32 HydrophobicContact CD2-CG1 3.98Å; F11-I32 HydrophobicContact CE1-CG2 4.14Å; F11-I32 HydrophobicContact CE2-CG1 4.45Å; F11-I32 HydrophobicContact CG-CD1 3.98Å; F11-I32 HydrophobicContact CG-CG1 4Å; F11-I32 HydrophobicContact CG-CG2 4.27Å; T28-I32 HydrophobicContact CG2-CG1 4.46Å; T28-I32 WeakPolarHBondContact O-CG1 3.39Å; T28-I32 PolarHBondContact O-N 3.23Å; K29-I32 PolarHBondContact O-N 2.83Å; E30-I32 VanDerWaalsContact C-N 3.34Å; E30-I32 PolarHBondContact O-N 2.78Å; I32-E35 PolarHBondContact O-N 3.39Å; I32-C36 WeakPolarHBondContact O-CB 3.49Å; I32-C36 PolarHBondContact O-N 2.99Å; I32-C36 PolarHBondContact O-SG 3.45Å; I32-C54 HydrophobicContact CG2-CB 3.91Å; I32-L58 HydrophobicContact CG2-CD1 4.03Å
33L94Very high89.3Confident1 Ų164.2 Ų64.21%0.00532%0.318CS..Hα-helixtrans-65-41.6179.6-176.559.6000111.9K29 E30 D31 C36 R37 L55 L58 L64 E67 L68 F73K29-L33 PolarHBondContact O-N 2.79Å; E30-L33 WeakPolarHBondContact O-CB 3.31Å; E30-L33 PolarHBondContact O-N 2.82Å; E30-L33 VanDerWaalsContact O-N 3.15Å; D31-L33 VanDerWaalsContact C-N 3.33Å; D31-L33 PolarHBondContact O-N 3.21Å; L33-C36 WeakPolarHBondContact O-CB 3.44Å; L33-C36 PolarHBondContact O-N 3.29Å; L33-R37 PolarHBondContact O-N 3.38Å; L33-L55 HydrophobicContact CD1-CD2 4.05Å; L33-L58 HydrophobicContact CB-CD1 4.04Å; L33-L58 HydrophobicContact CD1-CD1 4.06Å; L33-L64 HydrophobicContact CD2-CD2 3.94Å; L33-E67 HydrophobicContact CD2-CB 4.1Å; L33-E67 HydrophobicContact CD2-CG 4Å; L33-E67 WeakPolarHBondContact CD2-OE1 3.23Å; L33-E67 VanDerWaalsContact CD2-OE2 3.31Å; L33-E67 WeakPolarHBondContact CD2-OE2 3.41Å; L33-L68 HydrophobicContact CD1-CD2 3.59Å; L33-L68 HydrophobicContact CD1-CG 4.41Å; L33-F73 HydrophobicContact CD1-CE1 3.91Å; L33-F73 HydrophobicContact CD1-CE2 3.88Å; L33-F73 HydrophobicContact CD1-CZ 3.44Å; L33-F73 VanDerWaalsContact CD1-CZ 3.44Å; L33-F73 HydrophobicContact CD2-CE2 4.42Å; L33-F73 HydrophobicContact CG-CE2 4.2Å; L33-F73 HydrophobicContact CG-CZ 3.88Å
34E93Very high88.9Confident75 Ų7559.3 Ų59.335%0.3529%0.293SS..Hα-helixtrans-69-38.3178.1-174.553.8-149.300111.9E30 D31 C36 R37 K38E30-E34 PolarHBondContact O-N 3.27Å; D31-E34 PolarHBondContact O-N 3.36Å; E34-C36 VanDerWaalsContact C-N 3.33Å; E34-C36 PolarHBondContact O-N 3.47Å; E34-R37 WeakPolarHBondContact O-CB 3.29Å; E34-R37 PolarHBondContact O-N 3.01Å; E34-R37 VanDerWaalsContact O-N 3.16Å; E34-R37 VanDerWaalsContact OE2-CD 3.32Å; E34-R37 WeakPolarHBondContact OE2-CD 3.42Å; E34-R37 IonicContact OE2-NE 3.7Å; E34-R37 PolarHBondContact OE2-NE 3Å; E34-K38 WeakPolarHBondContact O-CG 3.45Å; E34-K38 PolarHBondContact O-N 3.24Å
35E91.9Very high88.2Confident44 Ų4461.2 Ų61.221%0.20630%0.304CS..Hα-helixtrans-62.4-41.1171.3-72.2-50.5125.500111.8L8 D31 I32 R37 K38 K39L8-E35 HydrophobicContact CD2-CB 4.1Å; D31-E35 WeakPolarHBondContact O-CG 3.31Å; D31-E35 PolarHBondContact O-N 3.07Å; I32-E35 PolarHBondContact O-N 3.39Å; E35-R37 VanDerWaalsContact C-N 3.33Å; E35-R37 PolarHBondContact O-N 3.46Å; E35-K38 PolarHBondContact O-N 3Å; E35-K38 IonicContact OE1-NZ 3.9Å; E35-K38 PolarHBondContact OE1-NZ 2.88Å; E35-K39 WeakPolarHBondContact O-CB 3.36Å; E35-K39 PolarHBondContact O-N 3.26Å
36C93.6Very high87.8Confident0 Ų061 Ų610%031%0.31CS..Hα-helixtrans-61-42.3172-68.20000111.5I32 L33 E34 K38 K39 L40 C51 L55I32-C36 WeakPolarHBondContact O-CB 3.49Å; I32-C36 PolarHBondContact O-N 2.99Å; I32-C36 PolarHBondContact O-SG 3.45Å; L33-C36 WeakPolarHBondContact O-CB 3.44Å; L33-C36 PolarHBondContact O-N 3.29Å; E34-C36 VanDerWaalsContact C-N 3.33Å; E34-C36 PolarHBondContact O-N 3.47Å; C36-K38 PolarHBondContact O-N 2.9Å; C36-K39 PolarHBondContact O-N 2.89Å; C36-L40 VanDerWaalsContact O-CG 3.27Å; C36-L40 WeakPolarHBondContact O-CG 3.43Å; C36-L40 PolarHBondContact O-N 3.44Å; C36-C51 VanDerWaalsContact CB-SG 3.6Å; C36-L55 HydrophobicContact CB-CD2 3.75Å; C36-L55 HydrophobicContact CB-CG 4.46Å
37R93.6Very high87.7Confident50 Ų5058.3 Ų58.319%0.18929%0.293CS..Hα-helixtrans-59-47.1177-169.7-173.2-73-99.77.3111.6L33 E34 E35 K39 L40 K41 E67 F72 F73L33-R37 PolarHBondContact O-N 3.38Å; E34-R37 WeakPolarHBondContact O-CB 3.29Å; E34-R37 PolarHBondContact O-N 3.01Å; E34-R37 VanDerWaalsContact O-N 3.16Å; E34-R37 VanDerWaalsContact OE2-CD 3.32Å; E34-R37 WeakPolarHBondContact OE2-CD 3.42Å; E34-R37 IonicContact OE2-NE 3.7Å; E34-R37 PolarHBondContact OE2-NE 3Å; E35-R37 VanDerWaalsContact C-N 3.33Å; E35-R37 PolarHBondContact O-N 3.46Å; R37-K39 VanDerWaalsContact C-N 3.35Å; R37-L40 PolarHBondContact O-N 2.93Å; R37-K41 WeakPolarHBondContact O-CG 3.47Å; R37-K41 PolarHBondContact O-N 3.49Å; R37-K41 VanDerWaalsContact O-N 3.09Å; R37-E67 IonicContact CZ-OE1 3.96Å; R37-E67 IonicContact NH2-OE1 3.92Å; R37-E67 PolarHBondContact NH2-OE1 3.26Å; R37-F72 HydrophobicContact CB-CE1 4.41Å; R37-F72 HydrophobicContact CG-CD1 4.22Å; R37-F72 HydrophobicContact CG-CE1 3.63Å; R37-F72 HydrophobicContact CG-CZ 4.15Å; R37-F73 HydrophobicContact CB-CE1 4.18Å; R37-F73 HydrophobicContact CB-CZ 3.86Å; R37-F73 HydrophobicContact CG-CZ 4.14Å; R37-F73 VanDerWaalsContact NH2-CE2 3.35Å
38K91.6Very high87.6Confident91 Ų9151.8 Ų51.840%0.39627%0.265SS..Hα-helixtrans-60.7-44.8176.3-69.4171.4-171164.50111.3E34 E35 C36 L40 K41 N42E34-K38 WeakPolarHBondContact O-CG 3.45Å; E34-K38 PolarHBondContact O-N 3.24Å; E35-K38 PolarHBondContact O-N 3Å; E35-K38 IonicContact OE1-NZ 3.9Å; E35-K38 PolarHBondContact OE1-NZ 2.88Å; C36-K38 PolarHBondContact O-N 2.9Å; K38-L40 PolarHBondContact O-N 3.46Å; K38-K41 PolarHBondContact O-N 2.89Å; K38-N42 VanDerWaalsContact O-CG 3.3Å; K38-N42 PolarHBondContact O-N 3.3Å; K38-N42 VanDerWaalsContact O-N 3.12Å; K38-N42 PolarHBondContact O-ND2 2.91Å
39K89.5Confident87.6Confident36 Ų3652 Ų5216%0.15726%0.262CS..Hα-helixtrans-61.1-45.8179.8-162.472.8172.2-178.10112.3E35 C36 R37 N42 H43 T44 S46 C51E35-K39 WeakPolarHBondContact O-CB 3.36Å; E35-K39 PolarHBondContact O-N 3.26Å; C36-K39 PolarHBondContact O-N 2.89Å; R37-K39 VanDerWaalsContact C-N 3.35Å; K39-N42 PolarHBondContact O-N 3.02Å; K39-H43 PolarHBondContact O-N 3Å; K39-T44 WeakPolarHBondContact CE-OG1 3.46Å; K39-S46 WeakPolarHBondContact CE-O 3.29Å; K39-S46 PolarHBondContact NZ-O 3.01Å; K39-C51 HydrophobicContact CG-CB 4.24Å
40L90Very high87.6Confident0 Ų052.5 Ų52.50%027%0.266CS..Hα-helixtrans-64.8-40.3178.2-68170.2000112.1C36 R37 K38 N42 H43 L48 L55 F72 F73 Q76 Y80C36-L40 VanDerWaalsContact O-CG 3.27Å; C36-L40 WeakPolarHBondContact O-CG 3.43Å; C36-L40 PolarHBondContact O-N 3.44Å; R37-L40 PolarHBondContact O-N 2.93Å; K38-L40 PolarHBondContact O-N 3.46Å; L40-N42 VanDerWaalsContact C-N 3.3Å; L40-N42 PolarHBondContact O-N 3.42Å; L40-H43 PolarHBondContact O-CE1 2.94Å; L40-H43 PolarHBondContact O-N 3.35Å; L40-H43 PolarHBondContact O-ND1 3.49Å; L40-L48 HydrophobicContact CD2-CD1 3.99Å; L40-L55 HydrophobicContact CD1-CD1 4.03Å; L40-F72 HydrophobicContact CB-CE1 4.49Å; L40-F72 HydrophobicContact CB-CZ 4.06Å; L40-F72 HydrophobicContact CD1-CE1 4.33Å; L40-F73 HydrophobicContact CD1-CD1 3.97Å; L40-F73 HydrophobicContact CD1-CE1 4.04Å; L40-Q76 HydrophobicContact CB-CG 4.27Å; L40-Q76 HydrophobicContact CD1-CB 4.12Å; L40-Q76 HydrophobicContact CD1-CG 4.32Å; L40-Q76 HydrophobicContact CD2-CB 4.35Å; L40-Y80 HydrophobicContact CD2-CD2 4.2Å; L40-Y80 HydrophobicContact CD2-CE2 3.66Å
41K89.5Confident87.6Confident115 Ų11548 Ų4850%0.525%0.245SC..Hα-helixtrans-62.1-36.3175.6-75.9175.8179.3174.50112.9R37 K38 H43 F72R37-K41 WeakPolarHBondContact O-CG 3.47Å; R37-K41 PolarHBondContact O-N 3.49Å; R37-K41 VanDerWaalsContact O-N 3.09Å; K38-K41 PolarHBondContact O-N 2.89Å; K41-H43 PolarHBondContact O-N 2.74Å; K41-F72 HydrophobicContact CG-CE2 3.86Å; K41-F72 HydrophobicContact CG-CZ 3.76Å
42N84.3Confident87.6Confident116 Ų11643.8 Ų43.862%0.6222%0.222SC*.THydrogen-bonded Turntrans-78-8.3-178.2-68.3-18.3000113.3K38 K39 L40 T44K38-N42 VanDerWaalsContact O-CG 3.3Å; K38-N42 PolarHBondContact O-N 3.3Å; K38-N42 VanDerWaalsContact O-N 3.12Å; K38-N42 PolarHBondContact O-ND2 2.91Å; K39-N42 PolarHBondContact O-N 3.02Å; L40-N42 VanDerWaalsContact C-N 3.3Å; L40-N42 PolarHBondContact O-N 3.42Å; N42-T44 HydrophobicContact CB-CG2 4.08Å; N42-T44 PolarHBondContact O-N 3Å
43H72.5Confident87.6Confident102 Ų10243.9 Ų43.947%0.47222%0.224SC..THydrogen-bonded Turntrans48.427.6-178.3-63.3-54.2000114.7K39 L40 K41 V45K39-H43 PolarHBondContact O-N 3Å; L40-H43 PolarHBondContact O-CE1 2.94Å; L40-H43 PolarHBondContact O-N 3.35Å; L40-H43 PolarHBondContact O-ND1 3.49Å; K41-H43 PolarHBondContact O-N 2.74Å; H43-V45 PolarHBondContact O-N 3.48Å
44T72.7Confident87.6Confident48 Ų4843.9 Ų43.929%0.29422%0.223SC..  trans-75.2125.6178.654.50000110.1K39 N42 S46K39-T44 WeakPolarHBondContact CE-OG1 3.46Å; N42-T44 HydrophobicContact CB-CG2 4.08Å; N42-T44 PolarHBondContact O-N 3Å; T44-S46 VanDerWaalsContact C-N 3.32Å; T44-S46 PolarHBondContact O-N 2.97Å
45V71.8Confident87.7Confident60 Ų6040.3 Ų40.336%0.36421%0.207SC..SBendtrans-62.7-40.6176.3-177.40000111.2H43 G47 L48 Y90H43-V45 PolarHBondContact O-N 3.48Å; V45-G47 PolarHBondContact O-N 3.01Å; V45-L48 VanDerWaalsContact O-CB 3.26Å; V45-L48 WeakPolarHBondContact O-CB 3.38Å; V45-L48 PolarHBondContact O-N 2.91Å; V45-L48 VanDerWaalsContact O-N 3.12Å; V45-Y90 HydrophobicContact CG1-CE2 4.21Å
46S79.8Confident87.9Confident84 Ų8439.6 Ų39.659%0.58720%0.202SC*.THydrogen-bonded Turntrans-61.3121.1-179.4177.60000111.5K39 T44 L48K39-S46 WeakPolarHBondContact CE-O 3.29Å; K39-S46 PolarHBondContact NZ-O 3.01Å; T44-S46 VanDerWaalsContact C-N 3.32Å; T44-S46 PolarHBondContact O-N 2.97Å; S46-L48 VanDerWaalsContact C-N 3.3Å; S46-L48 PolarHBondContact O-N 3.47Å
47G84.2Confident87.9Confident8 Ų839.6 Ų39.68%0.08220%0.202CC..THydrogen-bonded Turntrans80.82.9179.100000114.9N5 V45 H49 T50 C51N5-G47 WeakPolarHBondContact OD1-CA 3.13Å; V45-G47 PolarHBondContact O-N 3.01Å; G47-H49 VanDerWaalsContact C-N 3.3Å; G47-H49 PolarHBondContact O-N 3.5Å; G47-T50 PolarHBondContact O-N 2.84Å; G47-C51 PolarHBondContact O-N 2.84Å
48L88.4Confident87.9Confident5 Ų537.2 Ų37.23%0.02619%0.193CC..Hα-helixtrans-61.6-38.9178.8179.763.2000112.1L40 V45 S46 C51 L52 Y80 T93L40-L48 HydrophobicContact CD2-CD1 3.99Å; V45-L48 VanDerWaalsContact O-CB 3.26Å; V45-L48 WeakPolarHBondContact O-CB 3.38Å; V45-L48 PolarHBondContact O-N 2.91Å; V45-L48 VanDerWaalsContact O-N 3.12Å; S46-L48 VanDerWaalsContact C-N 3.3Å; S46-L48 PolarHBondContact O-N 3.47Å; L48-C51 WeakPolarHBondContact O-CB 3.35Å; L48-C51 PolarHBondContact O-N 3.49Å; L48-L52 HydrophobicContact CD1-CD1 4.38Å; L48-L52 HydrophobicContact CD1-CG 4.36Å; L48-L52 HydrophobicContact CG-CD1 4.2Å; L48-L52 WeakPolarHBondContact O-CG 3.38Å; L48-L52 PolarHBondContact O-N 2.95Å; L48-Y80 HydrophobicContact CD1-CD2 4.42Å; L48-Y80 HydrophobicContact CD1-CE1 4.33Å; L48-Y80 HydrophobicContact CD1-CE2 4.02Å; L48-Y80 HydrophobicContact CD2-CD1 3.78Å; L48-Y80 HydrophobicContact CD2-CE1 3.45Å; L48-Y80 VanDerWaalsContact CD2-CE1 3.45Å; L48-Y80 HydrophobicContact CD2-CG 4.47Å; L48-Y80 HydrophobicContact CG-CE1 4.5Å; L48-T93 HydrophobicContact CB-CG2 4.31Å; L48-T93 HydrophobicContact CD2-CG2 4.1Å; L48-T93 HydrophobicContact CG-CG2 4.03Å
49H89.2Confident88Confident59 Ų5933.1 Ų33.127%0.27318%0.176SC..Hα-helixtrans-57.3-50.9174.7174.9-93.1000111.8G47 C51 L52 C53 T93G47-H49 VanDerWaalsContact C-N 3.3Å; G47-H49 PolarHBondContact O-N 3.5Å; H49-C51 VanDerWaalsContact C-N 3.3Å; H49-C51 PolarHBondContact O-N 3.36Å; H49-L52 PolarHBondContact O-N 3.08Å; H49-C53 VanDerWaalsContact CE1-SG 3.52Å; H49-C53 PolarHBondContact O-N 3.44Å; H49-C53 PolarHBondContact O-SG 2.86Å; H49-T93 HydrophobicContact CB-CG2 3.96Å
50T91.1Very high88.1Confident21 Ų2133.7 Ų33.713%0.12918%0.177CC..Hα-helixtrans-59.7-42.8177.2-49.30000111.1L8 E9 V12 G47 L52 C53 C54L8-T50 HydrophobicContact CB-CG2 3.75Å; E9-T50 HydrophobicContact CB-CG2 4.38Å; E9-T50 HydrophobicContact CG-CG2 3.75Å; V12-T50 HydrophobicContact CG2-CG2 4.07Å; G47-T50 PolarHBondContact O-N 2.84Å; T50-L52 PolarHBondContact O-N 3.35Å; T50-C53 WeakPolarHBondContact O-CB 3.47Å; T50-C53 PolarHBondContact O-N 3.22Å; T50-C54 PolarHBondContact O-N 2.65Å; T50-C54 PolarHBondContact O-SG 3.16Å
51C92.2Very high88.1Confident0 Ų034.7 Ų34.70%018%0.182CC..Hα-helixtrans-57-47.7175.2178.40000112L8 C36 K39 G47 L48 H49 C53 C54 L55L8-C51 HydrophobicContact CD1-CB 4.5Å; C36-C51 VanDerWaalsContact CB-SG 3.6Å; K39-C51 HydrophobicContact CG-CB 4.24Å; G47-C51 PolarHBondContact O-N 2.84Å; L48-C51 WeakPolarHBondContact O-CB 3.35Å; L48-C51 PolarHBondContact O-N 3.49Å; H49-C51 VanDerWaalsContact C-N 3.3Å; H49-C51 PolarHBondContact O-N 3.36Å; C51-C53 PolarHBondContact O-N 2.97Å; C51-C54 WeakPolarHBondContact O-CB 3.34Å; C51-C54 PolarHBondContact O-N 3.46Å; C51-L55 WeakPolarHBondContact O-CG 3.25Å; C51-L55 PolarHBondContact O-N 3.49Å
52L93.4Very high88.1Confident1 Ų134.3 Ų34.31%0.00519%0.186CC..Hα-helixtrans-68.6-33.8178.4-67.6170.9000112.8L48 H49 T50 C54 L55 R56 Y80 T93 E96 A97L48-L52 HydrophobicContact CD1-CD1 4.38Å; L48-L52 HydrophobicContact CD1-CG 4.36Å; L48-L52 HydrophobicContact CG-CD1 4.2Å; L48-L52 WeakPolarHBondContact O-CG 3.38Å; L48-L52 PolarHBondContact O-N 2.95Å; H49-L52 PolarHBondContact O-N 3.08Å; T50-L52 PolarHBondContact O-N 3.35Å; L52-C54 VanDerWaalsContact C-N 3.34Å; L52-L55 HydrophobicContact CD2-CD1 3.96Å; L52-L55 PolarHBondContact O-N 2.93Å; L52-R56 PolarHBondContact O-N 3.05Å; L52-Y80 HydrophobicContact CD1-CG 4.49Å; L52-Y80 HydrophobicContact CD2-CD2 4.49Å; L52-T93 HydrophobicContact CD1-CG2 4.24Å; L52-T93 VanDerWaalsContact CD1-O 3.31Å; L52-T93 WeakPolarHBondContact CD1-O 3.49Å; L52-E96 HydrophobicContact CB-CB 3.76Å; L52-A97 HydrophobicContact CD1-CB 4.36Å; L52-A97 HydrophobicContact CD2-CB 4.48Å
53C93.7Very high88.3Confident6 Ų634.3 Ų34.34%0.04118%0.184CC..Hα-helixtrans-59.5-45169.5-73.60000111.3V12 H49 T50 C51 R56 I57V12-C53 HydrophobicContact CG1-CB 4.04Å; V12-C53 HydrophobicContact CG2-CB 3.63Å; H49-C53 VanDerWaalsContact CE1-SG 3.52Å; H49-C53 PolarHBondContact O-N 3.44Å; H49-C53 PolarHBondContact O-SG 2.86Å; T50-C53 WeakPolarHBondContact O-CB 3.47Å; T50-C53 PolarHBondContact O-N 3.22Å; C51-C53 PolarHBondContact O-N 2.97Å; C53-R56 PolarHBondContact O-N 3.46Å; C53-I57 WeakPolarHBondContact O-CG1 3.4Å; C53-I57 PolarHBondContact O-N 2.78Å
54C94.4Very high89.2Confident0 Ų029.6 Ų29.60%016%0.163CC..Hα-helixtrans-58.4-50.3174.8-65.60000110.5F11 V12 I32 T50 C51 L52 R56 I57 L58F11-C54 HydrophobicContact CD1-CB 4.19Å; F11-C54 HydrophobicContact CE1-CB 4.39Å; V12-C54 VanDerWaalsContact CG2-SG 3.52Å; I32-C54 HydrophobicContact CG2-CB 3.91Å; T50-C54 PolarHBondContact O-N 2.65Å; T50-C54 PolarHBondContact O-SG 3.16Å; C51-C54 WeakPolarHBondContact O-CB 3.34Å; C51-C54 PolarHBondContact O-N 3.46Å; L52-C54 VanDerWaalsContact C-N 3.34Å; C54-R56 VanDerWaalsContact C-N 3.33Å; C54-R56 PolarHBondContact O-N 2.96Å; C54-I57 PolarHBondContact O-N 2.91Å; C54-I57 VanDerWaalsContact O-N 3.09Å; C54-L58 VanDerWaalsContact O-CG 3.26Å; C54-L58 WeakPolarHBondContact O-CG 3.34Å; C54-L58 PolarHBondContact O-N 3.26Å
55L95Very high90.1Very high1 Ų128.1 Ų28.11%0.00515%0.152CC..Hα-helixtrans-55.8-47177.6-61.9-177.6000111.6L33 C36 L40 C51 L52 I57 L58 T59 L68 F73 V77L33-L55 HydrophobicContact CD1-CD2 4.05Å; C36-L55 HydrophobicContact CB-CD2 3.75Å; C36-L55 HydrophobicContact CB-CG 4.46Å; L40-L55 HydrophobicContact CD1-CD1 4.03Å; C51-L55 WeakPolarHBondContact O-CG 3.25Å; C51-L55 PolarHBondContact O-N 3.49Å; L52-L55 HydrophobicContact CD2-CD1 3.96Å; L52-L55 PolarHBondContact O-N 2.93Å; L55-I57 VanDerWaalsContact C-N 3.3Å; L55-I57 PolarHBondContact O-N 2.88Å; L55-L58 PolarHBondContact O-N 3.13Å; L55-L58 VanDerWaalsContact O-N 3.13Å; L55-T59 WeakPolarHBondContact O-CG2 3.46Å; L55-T59 PolarHBondContact O-N 3.38Å; L55-L68 HydrophobicContact CD2-CD2 3.78Å; L55-F73 HydrophobicContact CD2-CD1 4.47Å; L55-F73 HydrophobicContact CD2-CE1 4.32Å; L55-V77 HydrophobicContact CD1-CG2 3.94Å
56R94.6Very high91Very high29 Ų2931.9 Ų31.911%0.10916%0.163CC..Hα-helixtrans-55.3-45.5176.4-179.1-17752.894.110.6111.4D16 L52 C53 C54 T59 E96 K99 S100D16-R56 IonicContact OD1-CZ 3.76Å; D16-R56 VanDerWaalsContact OD1-CZ 3.27Å; D16-R56 IonicContact OD1-NH1 3.95Å; D16-R56 PolarHBondContact OD1-NH1 3.33Å; D16-R56 IonicContact OD1-NH2 3.89Å; D16-R56 PolarHBondContact OD1-NH2 3.33Å; L52-R56 PolarHBondContact O-N 3.05Å; C53-R56 PolarHBondContact O-N 3.46Å; C54-R56 VanDerWaalsContact C-N 3.33Å; C54-R56 PolarHBondContact O-N 2.96Å; R56-T59 PolarHBondContact O-N 3.13Å; R56-T59 PolarHBondContact O-OG1 3.25Å; R56-E96 WeakPolarHBondContact CD-OE2 3.44Å; R56-E96 IonicContact CZ-OE2 3.82Å; R56-E96 IonicContact NE-OE2 3.39Å; R56-E96 PolarHBondContact NE-OE2 3.45Å; R56-E96 IonicContact NH2-OE2 2.71Å; R56-K99 HydrophobicContact CG-CB 4.23Å; R56-S100 VanDerWaalsContact CA-OG 3.3Å; R56-S100 WeakPolarHBondContact CA-OG 3.48Å; R56-S100 WeakPolarHBondContact CB-OG 3.35Å; R56-S100 PolarHBondContact N-OG 2.97Å
57I94.2Very high91.6Very high0 Ų031.1 Ų31.10%015%0.151CC..Hα-helixtrans-64.7-45.3178.6-66.7165.6000110F11 V12 N15 D16 I21 C53 C54 L55 T59 R60F11-I57 HydrophobicContact CE1-CB 3.97Å; F11-I57 HydrophobicContact CE1-CD1 4.31Å; F11-I57 HydrophobicContact CE1-CG2 3.69Å; F11-I57 HydrophobicContact CZ-CB 4.47Å; F11-I57 HydrophobicContact CZ-CG2 3.73Å; V12-I57 HydrophobicContact CB-CD1 4.41Å; V12-I57 HydrophobicContact CG1-CD1 4.41Å; V12-I57 HydrophobicContact CG2-CD1 4.25Å; N15-I57 HydrophobicContact CB-CD1 4.47Å; N15-I57 HydrophobicContact CB-CG2 3.95Å; D16-I57 HydrophobicContact CB-CD1 4.44Å; I21-I57 WeakPolarHBondContact CD1-O 3.49Å; I21-I57 HydrophobicContact CG2-CG2 3.75Å; C53-I57 WeakPolarHBondContact O-CG1 3.4Å; C53-I57 PolarHBondContact O-N 2.78Å; C54-I57 PolarHBondContact O-N 2.91Å; C54-I57 VanDerWaalsContact O-N 3.09Å; L55-I57 VanDerWaalsContact C-N 3.3Å; L55-I57 PolarHBondContact O-N 2.88Å; I57-T59 PolarHBondContact O-N 3.47Å; I57-R60 VanDerWaalsContact O-CB 3.23Å; I57-R60 WeakPolarHBondContact O-CB 3.34Å; I57-R60 WeakPolarHBondContact O-CD 3.33Å; I57-R60 VanDerWaalsContact O-CG 3.26Å; I57-R60 WeakPolarHBondContact O-CG 3.3Å; I57-R60 PolarHBondContact O-N 3.43Å
58L94.5Very high92.1Very high0 Ų030.9 Ų30.90%015%0.147CC..Hα-helixtrans-63.5-25.1-179.8-64.1174.3000113.3F11 K29 I32 L33 C54 L55 R60 D61 L64 L68F11-L58 HydrophobicContact CE1-CD2 4.15Å; F11-L58 HydrophobicContact CE1-CG 4.35Å; F11-L58 HydrophobicContact CZ-CD2 3.73Å; F11-L58 HydrophobicContact CZ-CG 4.4Å; K29-L58 HydrophobicContact CB-CD2 4.17Å; K29-L58 HydrophobicContact CG-CD2 4.48Å; I32-L58 HydrophobicContact CG2-CD1 4.03Å; L33-L58 HydrophobicContact CB-CD1 4.04Å; L33-L58 HydrophobicContact CD1-CD1 4.06Å; C54-L58 VanDerWaalsContact O-CG 3.26Å; C54-L58 WeakPolarHBondContact O-CG 3.34Å; C54-L58 PolarHBondContact O-N 3.26Å; L55-L58 PolarHBondContact O-N 3.13Å; L55-L58 VanDerWaalsContact O-N 3.13Å; L58-R60 PolarHBondContact O-N 3.46Å; L58-D61 PolarHBondContact O-N 3.35Å; L58-L64 HydrophobicContact CD2-CD1 3.78Å; L58-L68 HydrophobicContact CB-CD1 4.13Å
59T93.3Very high92.3Very high4 Ų432.3 Ų32.33%0.02516%0.156CC..THydrogen-bonded Turntrans-59.1-18.7172.366.50000113.8L55 R56 I57 D61 R65 L68 N103 I104L55-T59 WeakPolarHBondContact O-CG2 3.46Å; L55-T59 PolarHBondContact O-N 3.38Å; R56-T59 PolarHBondContact O-N 3.13Å; R56-T59 PolarHBondContact O-OG1 3.25Å; I57-T59 PolarHBondContact O-N 3.47Å; T59-D61 VanDerWaalsContact C-N 3.31Å; T59-R65 WeakPolarHBondContact O-CD 3.47Å; T59-R65 PolarHBondContact O-NH1 2.88Å; T59-L68 HydrophobicContact CG2-CD1 3.83Å; T59-N103 HydrophobicContact CG2-CB 4.25Å; T59-N103 VanDerWaalsContact OG1-CB 3.24Å; T59-N103 WeakPolarHBondContact OG1-CB 3.27Å; T59-N103 PolarHBondContact OG1-ND2 3.09Å; T59-I104 HydrophobicContact CG2-CD1 4.1Å; T59-I104 HydrophobicContact CG2-CG1 3.61Å
60R91.1Very high92.6Very high48 Ų4831.3 Ų31.318%0.18116%0.156CC..THydrogen-bonded Turntrans-71.9-26.6177.5-59.9169.3-177166.11.9111.9N15 D16 N18 I21 I57 L58N15-R60 PolarHBondContact O-NH1 3Å; D16-R60 PolarHBondContact O-NH1 3.44Å; D16-R60 PolarHBondContact O-NH2 3.31Å; N18-R60 WeakPolarHBondContact O-CD 3.27Å; N18-R60 PolarHBondContact O-NH1 3.15Å; I21-R60 HydrophobicContact CD1-CB 4.05Å; I21-R60 HydrophobicContact CG1-CB 4.1Å; I57-R60 VanDerWaalsContact O-CB 3.23Å; I57-R60 WeakPolarHBondContact O-CB 3.34Å; I57-R60 WeakPolarHBondContact O-CD 3.33Å; I57-R60 VanDerWaalsContact O-CG 3.26Å; I57-R60 WeakPolarHBondContact O-CG 3.3Å; I57-R60 PolarHBondContact O-N 3.43Å; L58-R60 PolarHBondContact O-N 3.46Å
61D91.3Very high92.7Very high22 Ų2237.9 Ų37.912%0.11819%0.185CC..SBendtrans-79.9135.8178.6-172.4-83.8000111.3I21 K29 L58 T59 I63 L64 R65I21-D61 HydrophobicContact CD1-CB 3.68Å; I21-D61 HydrophobicContact CG1-CB 4.31Å; K29-D61 IonicContact NZ-OD2 3Å; K29-D61 PolarHBondContact NZ-OD2 3.4Å; L58-D61 PolarHBondContact O-N 3.35Å; T59-D61 VanDerWaalsContact C-N 3.31Å; D61-I63 WeakPolarHBondContact OD1-CA 3.38Å; D61-I63 WeakPolarHBondContact OD1-CB 3.35Å; D61-I63 PolarHBondContact OD1-N 2.87Å; D61-L64 HydrophobicContact CB-CB 4.28Å; D61-L64 PolarHBondContact OD1-N 3.41Å; D61-R65 WeakPolarHBondContact O-CB 3.43Å; D61-R65 PolarHBondContact O-N 3.46Å; D61-R65 VanDerWaalsContact O-N 3.09Å; D61-R65 PolarHBondContact O-NH1 3.22Å
62N88.1Confident92.9Very high107 Ų10740.4 Ų40.457%0.57220%0.196SC*.Hα-helixtrans-71.9-31.4-176.4-68.5-30.2000114.1R65N62-R65 PolarHBondContact OD1-NH1 3.46Å; N62-R65 PolarHBondContact OD1-NH2 2.9Å
63I89Confident93Very high115 Ų11540.3 Ų40.359%0.5920%0.196SC*.Hα-helixtrans-80.9-53.4-177.5-61.9173.3000108.5D61 R65 K66D61-I63 WeakPolarHBondContact OD1-CA 3.38Å; D61-I63 WeakPolarHBondContact OD1-CB 3.35Å; D61-I63 PolarHBondContact OD1-N 2.87Å; I63-R65 VanDerWaalsContact C-N 3.32Å; I63-R65 PolarHBondContact O-N 2.88Å; I63-K66 WeakPolarHBondContact O-CB 3.47Å; I63-K66 PolarHBondContact O-N 3.26Å; I63-K66 VanDerWaalsContact O-N 3.14Å
64L91.1Very high93.1Very high4 Ų440.2 Ų40.22%0.02120%0.195CC..Hα-helixtrans-69.2-30.1-176.9-64.4-168.9000113.3K29 E30 L33 L58 D61 K66 E67 L68K29-L64 HydrophobicContact CB-CD1 3.44Å; K29-L64 VanDerWaalsContact CB-CD1 3.44Å; K29-L64 HydrophobicContact CD-CD1 4.46Å; K29-L64 HydrophobicContact CG-CD1 4.47Å; E30-L64 HydrophobicContact CG-CD2 4.23Å; L33-L64 HydrophobicContact CD2-CD2 3.94Å; L58-L64 HydrophobicContact CD2-CD1 3.78Å; D61-L64 HydrophobicContact CB-CB 4.28Å; D61-L64 PolarHBondContact OD1-N 3.41Å; L64-K66 PolarHBondContact O-N 3.19Å; L64-E67 WeakPolarHBondContact O-CA 3.45Å; L64-E67 WeakPolarHBondContact O-CB 3.28Å; L64-E67 PolarHBondContact O-N 3.34Å; L64-L68 WeakPolarHBondContact O-CG 3.34Å; L64-L68 PolarHBondContact O-N 2.96Å
65R92Very high93.1Very high16 Ų1642 Ų426%0.0621%0.208CC..Hα-helixtrans-56.9-35.5173.1-178.5176.756.2-107.9-0.2112T59 D61 N62 I63 E67 L68 T69 E108T59-R65 WeakPolarHBondContact O-CD 3.47Å; T59-R65 PolarHBondContact O-NH1 2.88Å; D61-R65 WeakPolarHBondContact O-CB 3.43Å; D61-R65 PolarHBondContact O-N 3.46Å; D61-R65 VanDerWaalsContact O-N 3.09Å; D61-R65 PolarHBondContact O-NH1 3.22Å; N62-R65 PolarHBondContact OD1-NH1 3.46Å; N62-R65 PolarHBondContact OD1-NH2 2.9Å; I63-R65 VanDerWaalsContact C-N 3.32Å; I63-R65 PolarHBondContact O-N 2.88Å; R65-E67 VanDerWaalsContact C-N 3.32Å; R65-E67 PolarHBondContact O-N 3.45Å; R65-L68 WeakPolarHBondContact O-CB 3.38Å; R65-L68 PolarHBondContact O-N 3.39Å; R65-T69 WeakPolarHBondContact O-CG2 3.46Å; R65-T69 PolarHBondContact O-N 2.79Å; R65-E108 HydrophobicContact CG-CG 3.93Å; R65-E108 IonicContact CZ-OE1 2.68Å; R65-E108 IonicContact NE-OE1 3.58Å; R65-E108 PolarHBondContact NE-OE1 3.29Å; R65-E108 IonicContact NH2-OE1 3.27Å; R65-E108 PolarHBondContact NH2-OE1 2.86Å
66K91Very high93Very high139 Ų13943.1 Ų43.160%0.60421%0.213SC*.Hα-helixtrans-68.3-29.7174.5-66.4-179.1177.9-179.50112.9I63 L64 T69I63-K66 WeakPolarHBondContact O-CB 3.47Å; I63-K66 PolarHBondContact O-N 3.26Å; I63-K66 VanDerWaalsContact O-N 3.14Å; L64-K66 PolarHBondContact O-N 3.19Å; K66-T69 PolarHBondContact O-OG1 3.4Å
67E92.4Very high93Very high69 Ų6941.8 Ų41.832%0.32221%0.208SC..Hα-helixtrans-72.9-36.6172.5-167.2178.4154.700111.3L33 R37 L64 R65 T69 S70 F73L33-E67 HydrophobicContact CD2-CB 4.1Å; L33-E67 HydrophobicContact CD2-CG 4Å; L33-E67 WeakPolarHBondContact CD2-OE1 3.23Å; L33-E67 VanDerWaalsContact CD2-OE2 3.31Å; L33-E67 WeakPolarHBondContact CD2-OE2 3.41Å; R37-E67 IonicContact CZ-OE1 3.96Å; R37-E67 IonicContact NH2-OE1 3.92Å; R37-E67 PolarHBondContact NH2-OE1 3.26Å; L64-E67 WeakPolarHBondContact O-CA 3.45Å; L64-E67 WeakPolarHBondContact O-CB 3.28Å; L64-E67 PolarHBondContact O-N 3.34Å; R65-E67 VanDerWaalsContact C-N 3.32Å; R65-E67 PolarHBondContact O-N 3.45Å; E67-T69 PolarHBondContact O-N 3.25Å; E67-S70 WeakPolarHBondContact O-CB 3.48Å; E67-S70 PolarHBondContact O-N 2.83Å; E67-S70 PolarHBondContact O-OG 3.14Å; E67-F73 HydrophobicContact CG-CE2 4.26Å; E67-F73 WeakPolarHBondContact O-CD2 3.03Å
68L94Very high93Very high2 Ų242.8 Ų42.81%0.0121%0.212CC..Hα-helixtrans-65.6-16.2175.2-66173.6000113.5L33 L55 L58 T59 L64 R65 S70 F73 I104L33-L68 HydrophobicContact CD1-CD2 3.59Å; L33-L68 HydrophobicContact CD1-CG 4.41Å; L55-L68 HydrophobicContact CD2-CD2 3.78Å; L58-L68 HydrophobicContact CB-CD1 4.13Å; T59-L68 HydrophobicContact CG2-CD1 3.83Å; L64-L68 WeakPolarHBondContact O-CG 3.34Å; L64-L68 PolarHBondContact O-N 2.96Å; R65-L68 WeakPolarHBondContact O-CB 3.38Å; R65-L68 PolarHBondContact O-N 3.39Å; L68-S70 VanDerWaalsContact C-N 3.27Å; L68-F73 HydrophobicContact CD2-CB 4.24Å; L68-F73 HydrophobicContact CD2-CD1 4.09Å; L68-F73 HydrophobicContact CD2-CD2 4.16Å; L68-F73 HydrophobicContact CD2-CE1 4.47Å; L68-F73 HydrophobicContact CD2-CG 3.93Å; L68-F73 WeakPolarHBondContact O-CB 3.26Å; L68-I104 HydrophobicContact CB-CD1 4.18Å
69T94Very high92.9Very high35 Ų3546.5 Ų46.522%0.21523%0.228CC..THydrogen-bonded Turntrans-82.1-1.7170.369.70000113.7R65 K66 E67 L74 I104 E108 V111R65-T69 WeakPolarHBondContact O-CG2 3.46Å; R65-T69 PolarHBondContact O-N 2.79Å; K66-T69 PolarHBondContact O-OG1 3.4Å; E67-T69 PolarHBondContact O-N 3.25Å; T69-L74 WeakPolarHBondContact O-CD1 3.37Å; T69-I104 HydrophobicContact CG2-CG2 3.83Å; T69-E108 HydrophobicContact CG2-CB 4.01Å; T69-E108 HydrophobicContact CG2-CG 3.96Å; T69-V111 HydrophobicContact CG2-CG1 3.48Å; T69-V111 VanDerWaalsContact CG2-CG1 3.48Å
70S94.3Very high92.8Very high39 Ų3947 Ų4727%0.27323%0.23SC..SBendtrans-61.1149.817363.60000111.5E67 L68 F72 F73 L74E67-S70 WeakPolarHBondContact O-CB 3.48Å; E67-S70 PolarHBondContact O-N 2.83Å; E67-S70 PolarHBondContact O-OG 3.14Å; L68-S70 VanDerWaalsContact C-N 3.27Å; S70-F72 PolarHBondContact O-N 3.4Å; S70-F72 VanDerWaalsContact O-N 3.14Å; S70-F73 PolarHBondContact O-N 2.97Å; S70-F73 VanDerWaalsContact O-N 3.1Å; S70-F73 WeakPolarHBondContact OG-CD2 3.48Å; S70-L74 WeakPolarHBondContact O-CB 3.32Å; S70-L74 PolarHBondContact O-N 3.23Å
71E94.1Very high92.9Very high158 Ų15844.8 Ų44.874%0.73822%0.221SC*.Hα-helixtrans-52.4-39.1179.8-174.2-176.8173.900112.5S75E71-S75 WeakPolarHBondContact O-CB 3.43Å; E71-S75 PolarHBondContact O-N 2.89Å; E71-S75 PolarHBondContact O-OG 3.47Å
72F95.1Very high92.8Very high53 Ų5344.8 Ų44.823%0.23222%0.22CC..Hα-helixtrans-59.3-58175.2175.2-97.3000111.8R37 L40 K41 S70 S75 Q76R37-F72 HydrophobicContact CB-CE1 4.41Å; R37-F72 HydrophobicContact CG-CD1 4.22Å; R37-F72 HydrophobicContact CG-CE1 3.63Å; R37-F72 HydrophobicContact CG-CZ 4.15Å; L40-F72 HydrophobicContact CB-CE1 4.49Å; L40-F72 HydrophobicContact CB-CZ 4.06Å; L40-F72 HydrophobicContact CD1-CE1 4.33Å; K41-F72 HydrophobicContact CG-CE2 3.86Å; K41-F72 HydrophobicContact CG-CZ 3.76Å; S70-F72 PolarHBondContact O-N 3.4Å; S70-F72 VanDerWaalsContact O-N 3.14Å; F72-S75 PolarHBondContact O-N 3.05Å; F72-S75 PolarHBondContact O-OG 3.44Å; F72-Q76 HydrophobicContact CD2-CG 4.49Å; F72-Q76 HydrophobicContact CE1-CG 4.33Å; F72-Q76 HydrophobicContact CE2-CG 4.07Å; F72-Q76 HydrophobicContact CZ-CG 3.98Å; F72-Q76 VanDerWaalsContact O-CG 3.3Å; F72-Q76 WeakPolarHBondContact O-CG 3.36Å; F72-Q76 PolarHBondContact O-N 2.95Å; F72-Q76 VanDerWaalsContact O-N 3.15Å
73F95.5Very high92.5Very high0 Ų043.6 Ų43.60%021%0.212CC..Hα-helixtrans-68.4-41.6-176-75.2-64.5000111.9L33 R37 L40 L55 E67 L68 S70 S75 Q76 V77L33-F73 HydrophobicContact CD1-CE1 3.91Å; L33-F73 HydrophobicContact CD1-CE2 3.88Å; L33-F73 HydrophobicContact CD1-CZ 3.44Å; L33-F73 VanDerWaalsContact CD1-CZ 3.44Å; L33-F73 HydrophobicContact CD2-CE2 4.42Å; L33-F73 HydrophobicContact CG-CE2 4.2Å; L33-F73 HydrophobicContact CG-CZ 3.88Å; R37-F73 HydrophobicContact CB-CE1 4.18Å; R37-F73 HydrophobicContact CB-CZ 3.86Å; R37-F73 HydrophobicContact CG-CZ 4.14Å; R37-F73 VanDerWaalsContact NH2-CE2 3.35Å; L40-F73 HydrophobicContact CD1-CD1 3.97Å; L40-F73 HydrophobicContact CD1-CE1 4.04Å; L55-F73 HydrophobicContact CD2-CD1 4.47Å; L55-F73 HydrophobicContact CD2-CE1 4.32Å; E67-F73 HydrophobicContact CG-CE2 4.26Å; E67-F73 WeakPolarHBondContact O-CD2 3.03Å; L68-F73 HydrophobicContact CD2-CB 4.24Å; L68-F73 HydrophobicContact CD2-CD1 4.09Å; L68-F73 HydrophobicContact CD2-CD2 4.16Å; L68-F73 HydrophobicContact CD2-CE1 4.47Å; L68-F73 HydrophobicContact CD2-CG 3.93Å; L68-F73 WeakPolarHBondContact O-CB 3.26Å; S70-F73 PolarHBondContact O-N 2.97Å; S70-F73 VanDerWaalsContact O-N 3.1Å; S70-F73 WeakPolarHBondContact OG-CD2 3.48Å; F73-S75 PolarHBondContact O-N 3.24Å; F73-Q76 PolarHBondContact O-N 3.38Å; F73-V77 VanDerWaalsContact O-CG2 3.3Å; F73-V77 WeakPolarHBondContact O-CG2 3.19Å; F73-V77 PolarHBondContact O-N 2.99Å
74L95.6Very high91Very high3 Ų343.4 Ų43.42%0.01620%0.204CC..Hα-helixtrans-58.5-46.6176.6-74-177.7000112T69 S70 Q76 V77 F78 I104 V111 P114 M118T69-L74 WeakPolarHBondContact O-CD1 3.37Å; S70-L74 WeakPolarHBondContact O-CB 3.32Å; S70-L74 PolarHBondContact O-N 3.23Å; L74-Q76 VanDerWaalsContact C-N 3.35Å; L74-Q76 PolarHBondContact O-N 2.66Å; L74-V77 PolarHBondContact O-N 3.5Å; L74-F78 WeakPolarHBondContact O-CB 3.44Å; L74-F78 PolarHBondContact O-N 3.08Å; L74-I104 HydrophobicContact CD2-CD1 4.41Å; L74-I104 HydrophobicContact CD2-CG2 4.34Å; L74-V111 HydrophobicContact CD1-CB 4.16Å; L74-V111 HydrophobicContact CD1-CG1 4.12Å; L74-V111 HydrophobicContact CD2-CG1 4.44Å; L74-P114 HydrophobicContact CD1-CB 4.39Å; L74-M118 HydrophobicContact CB-CE 4.33Å
75S94.5Very high89.5Confident38 Ų3846.8 Ų46.827%0.26622%0.222SC..Hα-helixtrans-63.4-39.9179.762.70000112.3E71 F72 F73 K79E71-S75 WeakPolarHBondContact O-CB 3.43Å; E71-S75 PolarHBondContact O-N 2.89Å; E71-S75 PolarHBondContact O-OG 3.47Å; F72-S75 PolarHBondContact O-N 3.05Å; F72-S75 PolarHBondContact O-OG 3.44Å; F73-S75 PolarHBondContact O-N 3.24Å; S75-K79 VanDerWaalsContact O-CB 3.26Å; S75-K79 WeakPolarHBondContact O-CB 3.3Å; S75-K79 PolarHBondContact O-N 3Å
76Q93.4Very high87.6Confident24 Ų2451.5 Ų51.511%0.11226%0.257CS..Hα-helixtrans-66.4-50.2176.7-64.3-54.4-6600111.9L40 F72 F73 L74 F78 K79 Y80L40-Q76 HydrophobicContact CB-CG 4.27Å; L40-Q76 HydrophobicContact CD1-CB 4.12Å; L40-Q76 HydrophobicContact CD1-CG 4.32Å; L40-Q76 HydrophobicContact CD2-CB 4.35Å; F72-Q76 HydrophobicContact CD2-CG 4.49Å; F72-Q76 HydrophobicContact CE1-CG 4.33Å; F72-Q76 HydrophobicContact CE2-CG 4.07Å; F72-Q76 HydrophobicContact CZ-CG 3.98Å; F72-Q76 VanDerWaalsContact O-CG 3.3Å; F72-Q76 WeakPolarHBondContact O-CG 3.36Å; F72-Q76 PolarHBondContact O-N 2.95Å; F72-Q76 VanDerWaalsContact O-N 3.15Å; F73-Q76 PolarHBondContact O-N 3.38Å; L74-Q76 VanDerWaalsContact C-N 3.35Å; L74-Q76 PolarHBondContact O-N 2.66Å; Q76-F78 VanDerWaalsContact C-N 3.31Å; Q76-F78 PolarHBondContact O-N 3.34Å; Q76-K79 PolarHBondContact O-N 3.14Å; Q76-Y80 WeakPolarHBondContact O-CD2 3.31Å; Q76-Y80 PolarHBondContact O-N 3.32Å
77V94.3Very high86.2Confident1 Ų150.1 Ų50.11%0.00626%0.256CS..Hα-helixtrans-63.8-40.9-180-177.10000110.2L55 F73 L74 Y80 A81 A97 L101L55-V77 HydrophobicContact CD1-CG2 3.94Å; F73-V77 VanDerWaalsContact O-CG2 3.3Å; F73-V77 WeakPolarHBondContact O-CG2 3.19Å; F73-V77 PolarHBondContact O-N 2.99Å; L74-V77 PolarHBondContact O-N 3.5Å; V77-Y80 PolarHBondContact O-N 3.35Å; V77-A81 WeakPolarHBondContact O-CB 3.18Å; V77-A81 PolarHBondContact O-N 3.38Å; V77-A97 HydrophobicContact CG1-CB 4.13Å; V77-A97 WeakPolarHBondContact CG1-O 3.4Å; V77-L101 HydrophobicContact CB-CD2 4.17Å; V77-L101 HydrophobicContact CG1-CD2 3.74Å; V77-L101 HydrophobicContact CG1-CG 3.65Å
78F94.8Very high84.7Confident22 Ų2253.8 Ų53.810%0.09628%0.277CS..Hα-helixtrans-58.5-48.5174.6-176-94.6000112.3L74 Q76 Y80 A81 F82 L115 M118 L120L74-F78 WeakPolarHBondContact O-CB 3.44Å; L74-F78 PolarHBondContact O-N 3.08Å; Q76-F78 VanDerWaalsContact C-N 3.31Å; Q76-F78 PolarHBondContact O-N 3.34Å; F78-Y80 PolarHBondContact O-N 3.47Å; F78-A81 PolarHBondContact O-N 2.75Å; F78-F82 HydrophobicContact CD1-CD2 4.41Å; F78-F82 AromaticContact CD2-CD2 3.79Å; F78-F82 HydrophobicContact CD2-CD2 3.79Å; F78-F82 AromaticContact CD2-CE2 3.69Å; F78-F82 HydrophobicContact CD2-CE2 3.69Å; F78-F82 HydrophobicContact CE1-CD2 4.23Å; F78-F82 AromaticContact CE2-CD2 3.6Å; F78-F82 HydrophobicContact CE2-CD2 3.6Å; F78-F82 AromaticContact CE2-CE2 3.52Å; F78-F82 HydrophobicContact CE2-CE2 3.52Å; F78-F82 HydrophobicContact CG-CD2 4.21Å; F78-F82 HydrophobicContact CG-CE2 4.5Å; F78-F82 AromaticContact CZ-CD2 3.84Å; F78-F82 HydrophobicContact CZ-CD2 3.84Å; F78-F82 HydrophobicContact CZ-CE2 4.2Å; F78-F82 WeakPolarHBondContact O-CD2 3.41Å; F78-F82 PolarHBondContact O-N 2.97Å; F78-L115 HydrophobicContact CB-CD2 4.42Å; F78-L115 HydrophobicContact CD2-CD2 3.86Å; F78-L115 HydrophobicContact CG-CD2 4.5Å; F78-M118 HydrophobicContact CB-SD 4.13Å; F78-M118 HydrophobicContact CD1-CB 4.01Å; F78-M118 HydrophobicContact CD1-SD 4.4Å; F78-M118 HydrophobicContact CD2-CB 4.44Å; F78-M118 HydrophobicContact CE1-CB 3.82Å; F78-M118 VanDerWaalsContact CE1-O 3.26Å; F78-M118 WeakPolarHBondContact CE1-O 3.42Å; F78-M118 HydrophobicContact CE2-CB 4.24Å; F78-M118 HydrophobicContact CG-CB 4.31Å; F78-M118 HydrophobicContact CG-SD 4.14Å; F78-M118 HydrophobicContact CZ-CB 3.93Å; F78-M118 VanDerWaalsContact CZ-O 3.25Å; F78-M118 WeakPolarHBondContact CZ-O 3.48Å; F78-L120 HydrophobicContact CD2-CD1 4.44Å; F78-L120 HydrophobicContact CE2-CB 4Å; F78-L120 HydrophobicContact CE2-CD1 3.88Å
79K92Very high83.1Confident78 Ų7858.4 Ų58.434%0.33930%0.298SS..Hα-helixtrans-55.2-53.9176.3177179173.6177.30110.8S75 Q76 A81 F82 E83S75-K79 VanDerWaalsContact O-CB 3.26Å; S75-K79 WeakPolarHBondContact O-CB 3.3Å; S75-K79 PolarHBondContact O-N 3Å; Q76-K79 PolarHBondContact O-N 3.14Å; K79-A81 VanDerWaalsContact C-N 3.26Å; K79-A81 PolarHBondContact O-N 3.31Å; K79-F82 PolarHBondContact O-N 3.18Å; K79-E83 VanDerWaalsContact CE-CD 3.45Å; K79-E83 WeakPolarHBondContact CE-OE1 3.4Å; K79-E83 WeakPolarHBondContact CE-OE2 3.45Å; K79-E83 HydrophobicContact CG-CB 4.3Å; K79-E83 WeakPolarHBondContact CG-OE2 3.31Å; K79-E83 IonicContact NZ-OE2 2.71Å; K79-E83 WeakPolarHBondContact O-CB 3.3Å; K79-E83 PolarHBondContact O-N 2.86Å
80Y91.2Very high81.8Confident15 Ų1559.1 Ų59.16%0.05930%0.297CS..Hα-helixtrans-69.1-21.2-177.8-67.5-61.4000114.2L40 L48 L52 Q76 V77 F78 S94L40-Y80 HydrophobicContact CD2-CD2 4.2Å; L40-Y80 HydrophobicContact CD2-CE2 3.66Å; L48-Y80 HydrophobicContact CD1-CD2 4.42Å; L48-Y80 HydrophobicContact CD1-CE1 4.33Å; L48-Y80 HydrophobicContact CD1-CE2 4.02Å; L48-Y80 HydrophobicContact CD2-CD1 3.78Å; L48-Y80 HydrophobicContact CD2-CE1 3.45Å; L48-Y80 VanDerWaalsContact CD2-CE1 3.45Å; L48-Y80 HydrophobicContact CD2-CG 4.47Å; L48-Y80 HydrophobicContact CG-CE1 4.5Å; L52-Y80 HydrophobicContact CD1-CG 4.49Å; L52-Y80 HydrophobicContact CD2-CD2 4.49Å; Q76-Y80 WeakPolarHBondContact O-CD2 3.31Å; Q76-Y80 PolarHBondContact O-N 3.32Å; V77-Y80 PolarHBondContact O-N 3.35Å; F78-Y80 PolarHBondContact O-N 3.47Å; Y80-S94 WeakPolarHBondContact O-CA 3.02Å; Y80-S94 WeakPolarHBondContact O-CB 3.35Å
81A92.4Very high81.1Confident0 Ų059 Ų590%030%0.296CS..Hα-helixtrans-72-35.7174.300000113V77 F78 K79 A97 L98 L101 R139V77-A81 WeakPolarHBondContact O-CB 3.18Å; V77-A81 PolarHBondContact O-N 3.38Å; F78-A81 PolarHBondContact O-N 2.75Å; K79-A81 VanDerWaalsContact C-N 3.26Å; K79-A81 PolarHBondContact O-N 3.31Å; A81-A97 HydrophobicContact CB-CB 3.93Å; A81-L98 HydrophobicContact CB-CD2 3.92Å; A81-L98 HydrophobicContact CB-CG 4.03Å; A81-L101 HydrophobicContact CB-CD1 3.54Å; A81-R139 PolarHBondContact O-NH2 3.32Å
82F90.5Very high80.7Confident22 Ų2257.2 Ų57.210%0.09629%0.286CS..Hα-helixtrans-120.4-13.8-170.3-58.3-64.6000115.4F78 K79 Y84 L98 L101 L120 V124 L146F78-F82 HydrophobicContact CD1-CD2 4.41Å; F78-F82 AromaticContact CD2-CD2 3.79Å; F78-F82 HydrophobicContact CD2-CD2 3.79Å; F78-F82 AromaticContact CD2-CE2 3.69Å; F78-F82 HydrophobicContact CD2-CE2 3.69Å; F78-F82 HydrophobicContact CE1-CD2 4.23Å; F78-F82 AromaticContact CE2-CD2 3.6Å; F78-F82 HydrophobicContact CE2-CD2 3.6Å; F78-F82 AromaticContact CE2-CE2 3.52Å; F78-F82 HydrophobicContact CE2-CE2 3.52Å; F78-F82 HydrophobicContact CG-CD2 4.21Å; F78-F82 HydrophobicContact CG-CE2 4.5Å; F78-F82 AromaticContact CZ-CD2 3.84Å; F78-F82 HydrophobicContact CZ-CD2 3.84Å; F78-F82 HydrophobicContact CZ-CE2 4.2Å; F78-F82 WeakPolarHBondContact O-CD2 3.41Å; F78-F82 PolarHBondContact O-N 2.97Å; K79-F82 PolarHBondContact O-N 3.18Å; F82-Y84 PolarHBondContact O-N 3.28Å; F82-L98 HydrophobicContact CE1-CD2 3.94Å; F82-L98 HydrophobicContact CZ-CD2 3.97Å; F82-L101 HydrophobicContact CE2-CD1 4.01Å; F82-L101 HydrophobicContact CZ-CD1 4.49Å; F82-L120 HydrophobicContact CE2-CD1 3.84Å; F82-L120 HydrophobicContact CZ-CD1 3.91Å; F82-V124 HydrophobicContact CE1-CB 4.22Å; F82-V124 HydrophobicContact CE1-CG2 3.43Å; F82-V124 VanDerWaalsContact CE1-CG2 3.43Å; F82-V124 HydrophobicContact CE2-CG2 4.33Å; F82-V124 HydrophobicContact CZ-CG2 3.3Å; F82-L146 HydrophobicContact CZ-CD2 3.85Å
83E80.8Confident80.4Confident83 Ų8354.9 Ų54.939%0.38828%0.276SS..  trans-66.7102.7172.7-170.3173.1-148.200108.9K79 N85K79-E83 VanDerWaalsContact CE-CD 3.45Å; K79-E83 WeakPolarHBondContact CE-OE1 3.4Å; K79-E83 WeakPolarHBondContact CE-OE2 3.45Å; K79-E83 HydrophobicContact CG-CB 4.3Å; K79-E83 WeakPolarHBondContact CG-OE2 3.31Å; K79-E83 IonicContact NZ-OE2 2.71Å; K79-E83 WeakPolarHBondContact O-CB 3.3Å; K79-E83 PolarHBondContact O-N 2.86Å; E83-N85 PolarHBondContact O-N 2.79Å
84Y58.4Low80.2Confident111 Ų11155 Ų5544%0.43528%0.277SS..  trans-77.7116.5-177-172.5-91.4000110.3F82 I130F82-Y84 PolarHBondContact O-N 3.28Å; Y84-I130 HydrophobicContact CE2-CG2 3.99Å
85N60Low80Confident75 Ų7555.3 Ų55.340%0.40128%0.279SS..  trans-133131.1167.6-84.3-45.1000109.1E83 N87 Y90E83-N85 PolarHBondContact O-N 2.79Å; N85-N87 PolarHBondContact O-N 3.36Å; N85-Y90 HydrophobicContact CB-CD1 3.88Å; N85-Y90 HydrophobicContact CB-CD2 4.33Å; N85-Y90 HydrophobicContact CB-CE1 4.3Å; N85-Y90 HydrophobicContact CB-CG 3.88Å
86C52.1Low79.9Confident115 Ų11554.2 Ų54.278%0.77727%0.269SS*.  trans-68.37.6-173.4-49.90000115.3
87N61.2Low80Confident109 Ų10953 Ų5358%0.58326%0.264SS*.  trans-81.6139-177.2-104.2-19.4000111.8N85 E89 Y90 S91N85-N87 PolarHBondContact O-N 3.36Å; N87-E89 VanDerWaalsContact C-N 3.29Å; N87-E89 PolarHBondContact O-N 2.82Å; N87-Y90 HydrophobicContact CB-CD2 3.55Å; N87-Y90 HydrophobicContact CB-CE2 4.42Å; N87-Y90 HydrophobicContact CB-CG 4.28Å; N87-Y90 WeakPolarHBondContact O-CA 3.33Å; N87-Y90 WeakPolarHBondContact O-CB 3.49Å; N87-Y90 PolarHBondContact O-N 3.24Å; N87-S91 PolarHBondContact O-N 2.94Å
88L60.8Low80Confident146 Ų14653 Ų5376%0.76426%0.264SS*.Hα-helixtrans-59.2-38.3-179.8-165.178.4000112.6Y90 S91 K92L88-Y90 VanDerWaalsContact C-N 3.34Å; L88-S91 WeakPolarHBondContact O-CB 3.08Å; L88-S91 PolarHBondContact O-N 3.1Å; L88-K92 PolarHBondContact O-N 2.74Å
89E60.8Low80Confident99 Ų9954.7 Ų54.746%0.46327%0.271SS..Hα-helixtrans-64.9-38.9175.6-166173.9-174.600111.4N87 S91 K92 T93N87-E89 VanDerWaalsContact C-N 3.29Å; N87-E89 PolarHBondContact O-N 2.82Å; E89-S91 VanDerWaalsContact C-N 3.3Å; E89-S91 PolarHBondContact O-N 3.24Å; E89-K92 PolarHBondContact O-N 3.24Å; E89-T93 WeakPolarHBondContact O-CG2 3.36Å; E89-T93 PolarHBondContact O-N 3.46Å; E89-T93 VanDerWaalsContact O-N 3.17Å
90Y67.1Low80.1Confident51 Ų5151 Ų5120%0.226%0.255CS..Hα-helixtrans-66.6-30.1175.1-83.9-95.1000112.9V45 N85 N87 L88 K92 T93 S94V45-Y90 HydrophobicContact CG1-CE2 4.21Å; N85-Y90 HydrophobicContact CB-CD1 3.88Å; N85-Y90 HydrophobicContact CB-CD2 4.33Å; N85-Y90 HydrophobicContact CB-CE1 4.3Å; N85-Y90 HydrophobicContact CB-CG 3.88Å; N87-Y90 HydrophobicContact CB-CD2 3.55Å; N87-Y90 HydrophobicContact CB-CE2 4.42Å; N87-Y90 HydrophobicContact CB-CG 4.28Å; N87-Y90 WeakPolarHBondContact O-CA 3.33Å; N87-Y90 WeakPolarHBondContact O-CB 3.49Å; N87-Y90 PolarHBondContact O-N 3.24Å; L88-Y90 VanDerWaalsContact C-N 3.34Å; Y90-K92 VanDerWaalsContact C-N 3.35Å; Y90-K92 PolarHBondContact O-N 2.62Å; Y90-T93 VanDerWaalsContact CA-OG1 3.28Å; Y90-T93 WeakPolarHBondContact CA-OG1 3.26Å; Y90-T93 PolarHBondContact O-N 3.34Å; Y90-T93 PolarHBondContact O-OG1 3.07Å; Y90-S94 WeakPolarHBondContact O-CB 3.44Å; Y90-S94 PolarHBondContact O-N 3.24Å
91S78.2Confident80.3Confident36 Ų3650.4 Ų50.425%0.25225%0.253SS..Hα-helixtrans-59.9-48.2174-172.10000110.6N87 L88 E89 S94 L95N87-S91 PolarHBondContact O-N 2.94Å; L88-S91 WeakPolarHBondContact O-CB 3.08Å; L88-S91 PolarHBondContact O-N 3.1Å; E89-S91 VanDerWaalsContact C-N 3.3Å; E89-S91 PolarHBondContact O-N 3.24Å; S91-S94 PolarHBondContact O-N 3.35Å; S91-S94 PolarHBondContact O-OG 2.87Å; S91-L95 WeakPolarHBondContact O-CG 3.36Å; S91-L95 PolarHBondContact O-N 3.14Å
92K86.8Confident80.5Confident120 Ų12051 Ų5152%0.52226%0.257SS..Hα-helixtrans-66-41.8179.9-63.9-175.5177-179.50112.3L88 E89 Y90 S94 L95 E96L88-K92 PolarHBondContact O-N 2.74Å; E89-K92 PolarHBondContact O-N 3.24Å; Y90-K92 VanDerWaalsContact C-N 3.35Å; Y90-K92 PolarHBondContact O-N 2.62Å; K92-S94 VanDerWaalsContact C-N 3.31Å; K92-S94 PolarHBondContact O-N 3.06Å; K92-L95 PolarHBondContact O-N 3.4Å; K92-E96 PolarHBondContact O-N 2.81Å
93T89.1Confident80.6Confident4 Ų452.8 Ų52.83%0.02527%0.268CS..Hα-helixtrans-60.7-41.7176.159.20000111.5L48 H49 L52 E89 Y90 L95 E96 A97L48-T93 HydrophobicContact CB-CG2 4.31Å; L48-T93 HydrophobicContact CD2-CG2 4.1Å; L48-T93 HydrophobicContact CG-CG2 4.03Å; H49-T93 HydrophobicContact CB-CG2 3.96Å; L52-T93 HydrophobicContact CD1-CG2 4.24Å; L52-T93 VanDerWaalsContact CD1-O 3.31Å; L52-T93 WeakPolarHBondContact CD1-O 3.49Å; E89-T93 WeakPolarHBondContact O-CG2 3.36Å; E89-T93 PolarHBondContact O-N 3.46Å; E89-T93 VanDerWaalsContact O-N 3.17Å; Y90-T93 VanDerWaalsContact CA-OG1 3.28Å; Y90-T93 WeakPolarHBondContact CA-OG1 3.26Å; Y90-T93 PolarHBondContact O-N 3.34Å; Y90-T93 PolarHBondContact O-OG1 3.07Å; T93-L95 VanDerWaalsContact C-N 3.31Å; T93-L95 PolarHBondContact O-N 3.22Å; T93-E96 PolarHBondContact O-N 3.29Å; T93-A97 WeakPolarHBondContact O-CB 3.41Å; T93-A97 PolarHBondContact O-N 2.95Å
94S89.7Confident81.3Confident2 Ų249 Ų491%0.01425%0.25CC..Hα-helixtrans-62.7-37.1177.883.30000112.9Y80 Y90 S91 K92 A97 L98Y80-S94 WeakPolarHBondContact O-CA 3.02Å; Y80-S94 WeakPolarHBondContact O-CB 3.35Å; Y90-S94 WeakPolarHBondContact O-CB 3.44Å; Y90-S94 PolarHBondContact O-N 3.24Å; S91-S94 PolarHBondContact O-N 3.35Å; S91-S94 PolarHBondContact O-OG 2.87Å; K92-S94 VanDerWaalsContact C-N 3.31Å; K92-S94 PolarHBondContact O-N 3.06Å; S94-A97 PolarHBondContact O-N 3.41Å; S94-L98 WeakPolarHBondContact O-CB 3.33Å; S94-L98 VanDerWaalsContact O-CG 3.32Å; S94-L98 WeakPolarHBondContact O-CG 3.37Å; S94-L98 PolarHBondContact O-N 3Å
95L91.9Very high83Confident11 Ų1143.7 Ų43.76%0.05823%0.229CC..Hα-helixtrans-64.2-44.8177.3-65.7173.4000110.9S91 K92 T93 A97 L98 K99 E138 R139 L142S91-L95 WeakPolarHBondContact O-CG 3.36Å; S91-L95 PolarHBondContact O-N 3.14Å; K92-L95 PolarHBondContact O-N 3.4Å; T93-L95 VanDerWaalsContact C-N 3.31Å; T93-L95 PolarHBondContact O-N 3.22Å; L95-A97 VanDerWaalsContact C-N 3.35Å; L95-L98 PolarHBondContact O-N 3.29Å; L95-K99 WeakPolarHBondContact O-CB 3.33Å; L95-K99 VanDerWaalsContact O-CG 3.22Å; L95-K99 WeakPolarHBondContact O-CG 3.32Å; L95-K99 PolarHBondContact O-N 2.85Å; L95-E138 HydrophobicContact CD1-CG 4.34Å; L95-E138 HydrophobicContact CD2-CG 4.16Å; L95-R139 HydrophobicContact CD2-CB 3.8Å; L95-R139 HydrophobicContact CD2-CG 4.16Å; L95-L142 HydrophobicContact CB-CD1 4.17Å; L95-L142 HydrophobicContact CD2-CD1 3.59Å; L95-L142 HydrophobicContact CG-CD1 4.49Å
96E93.1Very high84.6Confident14 Ų1446.1 Ų46.17%0.06524%0.236CC..Hα-helixtrans-66.8-36.3177.7-65-54.9125.400112.3L52 R56 K92 T93 K99 S100L52-E96 HydrophobicContact CB-CB 3.76Å; R56-E96 WeakPolarHBondContact CD-OE2 3.44Å; R56-E96 IonicContact CZ-OE2 3.82Å; R56-E96 IonicContact NE-OE2 3.39Å; R56-E96 PolarHBondContact NE-OE2 3.45Å; R56-E96 IonicContact NH2-OE2 2.71Å; K92-E96 PolarHBondContact O-N 2.81Å; T93-E96 PolarHBondContact O-N 3.29Å; E96-K99 IonicContact OE1-NZ 2.97Å; E96-K99 PolarHBondContact OE1-NZ 3.14Å; E96-S100 WeakPolarHBondContact O-CB 3.34Å; E96-S100 PolarHBondContact O-N 3.38Å; E96-S100 PolarHBondContact O-OG 3.08Å
97A94.2Very high86.4Confident0 Ų046.5 Ų46.50%023%0.225CC..Hα-helixtrans-64.9-45.917300000111.9L52 V77 A81 T93 S94 L95 K99 S100 L101L52-A97 HydrophobicContact CD1-CB 4.36Å; L52-A97 HydrophobicContact CD2-CB 4.48Å; V77-A97 HydrophobicContact CG1-CB 4.13Å; V77-A97 WeakPolarHBondContact CG1-O 3.4Å; A81-A97 HydrophobicContact CB-CB 3.93Å; T93-A97 WeakPolarHBondContact O-CB 3.41Å; T93-A97 PolarHBondContact O-N 2.95Å; S94-A97 PolarHBondContact O-N 3.41Å; L95-A97 VanDerWaalsContact C-N 3.35Å; A97-K99 PolarHBondContact O-N 3.15Å; A97-S100 WeakPolarHBondContact O-CB 3.41Å; A97-S100 PolarHBondContact O-N 2.9Å; A97-L101 WeakPolarHBondContact O-CG 3.31Å; A97-L101 PolarHBondContact O-N 3.2Å
98L94.9Very high88Confident0 Ų043 Ų430%021%0.205CC..Hα-helixtrans-62.8-41176.6-75.7167.7000112.5A81 F82 S94 L95 S100 L101 S102 R139 L142 L146A81-L98 HydrophobicContact CB-CD2 3.92Å; A81-L98 HydrophobicContact CB-CG 4.03Å; F82-L98 HydrophobicContact CE1-CD2 3.94Å; F82-L98 HydrophobicContact CZ-CD2 3.97Å; S94-L98 WeakPolarHBondContact O-CB 3.33Å; S94-L98 VanDerWaalsContact O-CG 3.32Å; S94-L98 WeakPolarHBondContact O-CG 3.37Å; S94-L98 PolarHBondContact O-N 3Å; L95-L98 PolarHBondContact O-N 3.29Å; L98-S100 VanDerWaalsContact C-N 3.35Å; L98-L101 PolarHBondContact O-N 3.39Å; L98-S102 WeakPolarHBondContact O-CB 3.18Å; L98-S102 PolarHBondContact O-N 3.12Å; L98-S102 PolarHBondContact O-OG 3.39Å; L98-R139 HydrophobicContact CD1-CG 3.72Å; L98-L142 HydrophobicContact CB-CB 4.08Å; L98-L142 HydrophobicContact CB-CD1 4.08Å; L98-L142 HydrophobicContact CD1-CB 4.16Å; L98-L142 HydrophobicContact CD1-CD1 4.49Å; L98-L146 HydrophobicContact CD2-CD2 4.24Å
99K95Very high89.5Confident58 Ų5839.3 Ų39.325%0.25219%0.191SC..Hα-helixtrans-61.7-43.8173.3-70.5168.2-167.6172.20111.1R56 L95 E96 A97 S102 N103 L142R56-K99 HydrophobicContact CG-CB 4.23Å; L95-K99 WeakPolarHBondContact O-CB 3.33Å; L95-K99 VanDerWaalsContact O-CG 3.22Å; L95-K99 WeakPolarHBondContact O-CG 3.32Å; L95-K99 PolarHBondContact O-N 2.85Å; E96-K99 IonicContact OE1-NZ 2.97Å; E96-K99 PolarHBondContact OE1-NZ 3.14Å; A97-K99 PolarHBondContact O-N 3.15Å; K99-S102 PolarHBondContact O-N 3.46Å; K99-N103 PolarHBondContact O-N 3.42Å; K99-L142 HydrophobicContact CG-CD1 4.04Å; K99-L142 HydrophobicContact CG-CD2 3.95Å
100S94.8Very high91Very high1 Ų138.7 Ų38.71%0.00720%0.197CC..Hα-helixtrans-62.1-48.1177.2-58.70000111.8R56 E96 A97 L98 S102 N103 I104R56-S100 VanDerWaalsContact CA-OG 3.3Å; R56-S100 WeakPolarHBondContact CA-OG 3.48Å; R56-S100 WeakPolarHBondContact CB-OG 3.35Å; R56-S100 PolarHBondContact N-OG 2.97Å; E96-S100 WeakPolarHBondContact O-CB 3.34Å; E96-S100 PolarHBondContact O-N 3.38Å; E96-S100 PolarHBondContact O-OG 3.08Å; A97-S100 WeakPolarHBondContact O-CB 3.41Å; A97-S100 PolarHBondContact O-N 2.9Å; L98-S100 VanDerWaalsContact C-N 3.35Å; S100-S102 VanDerWaalsContact C-N 3.32Å; S100-S102 PolarHBondContact O-N 2.82Å; S100-N103 PolarHBondContact O-N 3.15Å; S100-I104 VanDerWaalsContact O-CG1 3.3Å; S100-I104 WeakPolarHBondContact O-CG1 3.46Å; S100-I104 PolarHBondContact O-N 2.93Å
101L95.7Very high92.3Very high2 Ų236.4 Ų36.41%0.0119%0.189CC..Hα-helixtrans-57.6-45.6175.4-72.9176.9000111.6V77 A81 F82 A97 L98 N103 I104 L105 L115 L146V77-L101 HydrophobicContact CB-CD2 4.17Å; V77-L101 HydrophobicContact CG1-CD2 3.74Å; V77-L101 HydrophobicContact CG1-CG 3.65Å; A81-L101 HydrophobicContact CB-CD1 3.54Å; F82-L101 HydrophobicContact CE2-CD1 4.01Å; F82-L101 HydrophobicContact CZ-CD1 4.49Å; A97-L101 WeakPolarHBondContact O-CG 3.31Å; A97-L101 PolarHBondContact O-N 3.2Å; L98-L101 PolarHBondContact O-N 3.39Å; L101-N103 VanDerWaalsContact C-N 3.34Å; L101-N103 PolarHBondContact O-N 3.3Å; L101-I104 PolarHBondContact O-N 3.47Å; L101-L105 WeakPolarHBondContact O-CB 3.37Å; L101-L105 PolarHBondContact O-N 3.2Å; L101-L115 HydrophobicContact CD2-CD2 4.22Å; L101-L146 HydrophobicContact CB-CD1 4.32Å
102S94.7Very high93.1Very high13 Ų1335.1 Ų35.19%0.09118%0.178CC..Hα-helixtrans-60.8-43.6179.6-58.20000111.7L98 K99 S100 L105 F106 L149L98-S102 WeakPolarHBondContact O-CB 3.18Å; L98-S102 PolarHBondContact O-N 3.12Å; L98-S102 PolarHBondContact O-OG 3.39Å; K99-S102 PolarHBondContact O-N 3.46Å; S100-S102 VanDerWaalsContact C-N 3.32Å; S100-S102 PolarHBondContact O-N 2.82Å; S102-L105 PolarHBondContact O-N 3.05Å; S102-F106 VanDerWaalsContact O-CB 3.31Å; S102-F106 WeakPolarHBondContact O-CB 3.24Å; S102-F106 PolarHBondContact O-N 3.3Å; S102-L149 WeakPolarHBondContact O-CD1 3.35Å
103N93.5Very high93.5Very high59 Ų5934.5 Ų34.532%0.31618%0.177SC..Hα-helixtrans-64.8-43.9177.7-73.4-4.7000112.4T59 K99 S100 L101 K107T59-N103 HydrophobicContact CG2-CB 4.25Å; T59-N103 VanDerWaalsContact OG1-CB 3.24Å; T59-N103 WeakPolarHBondContact OG1-CB 3.27Å; T59-N103 PolarHBondContact OG1-ND2 3.09Å; K99-N103 PolarHBondContact O-N 3.42Å; S100-N103 PolarHBondContact O-N 3.15Å; L101-N103 VanDerWaalsContact C-N 3.34Å; L101-N103 PolarHBondContact O-N 3.3Å; N103-K107 PolarHBondContact O-N 3.42Å
104I95.1Very high93.8Very high3 Ų337 Ų372%0.01519%0.194CC..Hα-helixtrans-61.8-51.9177-65.6166.1000109.1T59 L68 T69 L74 S100 L101 F106 K107 E108 V111T59-I104 HydrophobicContact CG2-CD1 4.1Å; T59-I104 HydrophobicContact CG2-CG1 3.61Å; L68-I104 HydrophobicContact CB-CD1 4.18Å; T69-I104 HydrophobicContact CG2-CG2 3.83Å; L74-I104 HydrophobicContact CD2-CD1 4.41Å; L74-I104 HydrophobicContact CD2-CG2 4.34Å; S100-I104 VanDerWaalsContact O-CG1 3.3Å; S100-I104 WeakPolarHBondContact O-CG1 3.46Å; S100-I104 PolarHBondContact O-N 2.93Å; L101-I104 PolarHBondContact O-N 3.47Å; I104-F106 VanDerWaalsContact C-N 3.33Å; I104-F106 PolarHBondContact O-N 2.99Å; I104-K107 PolarHBondContact O-N 2.96Å; I104-E108 HydrophobicContact CG2-CB 4.48Å; I104-E108 WeakPolarHBondContact O-CB 3.39Å; I104-E108 PolarHBondContact O-N 3.27Å; I104-V111 HydrophobicContact CG2-CG1 3.89Å; I104-V111 HydrophobicContact CG2-CG2 4.16Å
105L94.4Very high94Very high0 Ų037 Ų370%019%0.193CC..Hα-helixtrans-58.6-42-177.5-171.472.1000112.9L101 S102 K107 V111 I112 L115 L146 L149 V150 L153L101-L105 WeakPolarHBondContact O-CB 3.37Å; L101-L105 PolarHBondContact O-N 3.2Å; S102-L105 PolarHBondContact O-N 3.05Å; L105-K107 PolarHBondContact O-N 3.42Å; L105-V111 HydrophobicContact CB-CG2 4.5Å; L105-V111 HydrophobicContact CD1-CG2 3.68Å; L105-I112 HydrophobicContact CD1-CD1 4.16Å; L105-I112 HydrophobicContact CD1-CG1 3.36Å; L105-L115 HydrophobicContact CD1-CD1 4.38Å; L105-L146 HydrophobicContact CD2-CD1 3.67Å; L105-L149 HydrophobicContact CD2-CB 3.6Å; L105-L149 HydrophobicContact CD2-CD1 4.42Å; L105-L149 HydrophobicContact CG-CB 4.38Å; L105-V150 HydrophobicContact CD2-CB 4.43Å; L105-V150 HydrophobicContact CD2-CG2 3.44Å; L105-V150 VanDerWaalsContact CD2-CG2 3.44Å; L105-L153 HydrophobicContact CG-CD1 4.46Å; L105-L153 WeakPolarHBondContact O-CD1 3.4Å
106F92.6Very high94.2Very high125 Ų12538.1 Ų38.155%0.54820%0.198SC..Hα-helixtrans-64.1-29-178.9-179.8-118.5000113.1S102 I104 L149S102-F106 VanDerWaalsContact O-CB 3.31Å; S102-F106 WeakPolarHBondContact O-CB 3.24Å; S102-F106 PolarHBondContact O-N 3.3Å; I104-F106 VanDerWaalsContact C-N 3.33Å; I104-F106 PolarHBondContact O-N 2.99Å; F106-L149 HydrophobicContact CB-CD1 4.15Å; F106-L149 HydrophobicContact CB-CD2 4.29Å; F106-L149 HydrophobicContact CD2-CD2 3.63Å; F106-L149 HydrophobicContact CE2-CD2 4.44Å; F106-L149 HydrophobicContact CG-CD2 4.37Å
107K91.5Very high94.2Very high124 Ų12443.4 Ų43.454%0.53923%0.231SC..Hα-helixtrans-103.2-30-177.6-64.3-60.7-172.4-179.60113.5N103 I104 L105N103-K107 PolarHBondContact O-N 3.42Å; I104-K107 PolarHBondContact O-N 2.96Å; L105-K107 PolarHBondContact O-N 3.42Å
108E93.6Very high94.2Very high35 Ų3546.1 Ų46.116%0.16425%0.245CC..  trans-123.675.9-174.8-53.1-59.3153.400109.8R65 T69 I104 C110 V111R65-E108 HydrophobicContact CG-CG 3.93Å; R65-E108 IonicContact CZ-OE1 2.68Å; R65-E108 IonicContact NE-OE1 3.58Å; R65-E108 PolarHBondContact NE-OE1 3.29Å; R65-E108 IonicContact NH2-OE1 3.27Å; R65-E108 PolarHBondContact NH2-OE1 2.86Å; T69-E108 HydrophobicContact CG2-CB 4.01Å; T69-E108 HydrophobicContact CG2-CG 3.96Å; I104-E108 HydrophobicContact CG2-CB 4.48Å; I104-E108 WeakPolarHBondContact O-CB 3.39Å; I104-E108 PolarHBondContact O-N 3.27Å; E108-C110 PolarHBondContact O-N 3.32Å; E108-V111 HydrophobicContact CB-CG1 4.15Å; E108-V111 VanDerWaalsContact O-CG2 3.28Å; E108-V111 WeakPolarHBondContact O-CG2 3.35Å; E108-V111 PolarHBondContact O-N 3.42Å; E108-V111 VanDerWaalsContact O-N 3.13Å
109S92.3Very high94.2Very high68 Ų6847.2 Ų47.248%0.47626%0.256SS..G310 helixtrans-60.3-18.7-176.859.10000114.2V111 I112S109-V111 PolarHBondContact O-N 2.94Å; S109-V111 VanDerWaalsContact O-N 3.15Å; S109-I112 WeakPolarHBondContact O-CB 3.04Å; S109-I112 WeakPolarHBondContact O-CD1 3.4Å; S109-I112 VanDerWaalsContact O-CG1 3.3Å; S109-I112 WeakPolarHBondContact O-CG1 3.22Å; S109-I112 PolarHBondContact O-N 3.02Å
110C92.8Very high94.2Very high87 Ų8744.5 Ų44.559%0.58824%0.244SC*.G310 helixtrans-60.6-19.9175.462.60000113.8E108 I112 P114E108-C110 PolarHBondContact O-N 3.32Å; C110-I112 PolarHBondContact O-N 2.76Å; C110-P114 WeakPolarHBondContact O-CD 3.31Å
111V94.8Very high94.1Very high3 Ų344.5 Ų44.52%0.01824%0.244CC..G310 helixtrans-74.4-12.4178.8-52.50000113.6T69 L74 I104 L105 E108 S109 E113 P114 L115T69-V111 HydrophobicContact CG2-CG1 3.48Å; T69-V111 VanDerWaalsContact CG2-CG1 3.48Å; L74-V111 HydrophobicContact CD1-CB 4.16Å; L74-V111 HydrophobicContact CD1-CG1 4.12Å; L74-V111 HydrophobicContact CD2-CG1 4.44Å; I104-V111 HydrophobicContact CG2-CG1 3.89Å; I104-V111 HydrophobicContact CG2-CG2 4.16Å; L105-V111 HydrophobicContact CB-CG2 4.5Å; L105-V111 HydrophobicContact CD1-CG2 3.68Å; E108-V111 HydrophobicContact CB-CG1 4.15Å; E108-V111 VanDerWaalsContact O-CG2 3.28Å; E108-V111 WeakPolarHBondContact O-CG2 3.35Å; E108-V111 PolarHBondContact O-N 3.42Å; E108-V111 VanDerWaalsContact O-N 3.13Å; S109-V111 PolarHBondContact O-N 2.94Å; S109-V111 VanDerWaalsContact O-N 3.15Å; V111-E113 VanDerWaalsContact C-N 3.33Å; V111-E113 PolarHBondContact O-N 3.44Å; V111-P114 WeakPolarHBondContact O-CD 3.45Å; V111-L115 HydrophobicContact CB-CD1 4.35Å; V111-L115 HydrophobicContact CG2-CD1 3.82Å; V111-L115 WeakPolarHBondContact O-CB 3.41Å; V111-L115 WeakPolarHBondContact O-CG 3.35Å; V111-L115 PolarHBondContact O-N 2.98Å
112I94.8Very high94Very high8 Ų850.8 Ų50.84%0.04127%0.271CS..Hα-helixtrans-57.2-46.4-179.2-70.4166.9000111.2L105 S109 C110 L115 K116 L153 D154L105-I112 HydrophobicContact CD1-CD1 4.16Å; L105-I112 HydrophobicContact CD1-CG1 3.36Å; S109-I112 WeakPolarHBondContact O-CB 3.04Å; S109-I112 WeakPolarHBondContact O-CD1 3.4Å; S109-I112 VanDerWaalsContact O-CG1 3.3Å; S109-I112 WeakPolarHBondContact O-CG1 3.22Å; S109-I112 PolarHBondContact O-N 3.02Å; C110-I112 PolarHBondContact O-N 2.76Å; I112-L115 PolarHBondContact O-N 3.31Å; I112-K116 HydrophobicContact CG2-CD 3.53Å; I112-K116 HydrophobicContact CG2-CG 4.22Å; I112-K116 WeakPolarHBondContact O-CB 3.32Å; I112-K116 VanDerWaalsContact O-CG 3.3Å; I112-K116 WeakPolarHBondContact O-CG 3.48Å; I112-K116 PolarHBondContact O-N 2.87Å; I112-L153 HydrophobicContact CD1-CB 3.57Å; I112-L153 HydrophobicContact CD1-CD1 4.43Å; I112-D154 HydrophobicContact CD1-CB 4.01Å; I112-D154 HydrophobicContact CG2-CB 3.88Å
113E94.5Very high94Very high107 Ų10751.3 Ų51.350%0.528%0.275SS..Hα-helixtrans-65.8-48.4-177.3-74.3-61.313700113.1V111 L115 K116 T117V111-E113 VanDerWaalsContact C-N 3.33Å; V111-E113 PolarHBondContact O-N 3.44Å; E113-L115 VanDerWaalsContact C-N 3.33Å; E113-L115 PolarHBondContact O-N 3.48Å; E113-K116 PolarHBondContact O-N 2.88Å; E113-K116 IonicContact OE1-NZ 3.24Å; E113-K116 PolarHBondContact OE1-NZ 2.97Å; E113-T117 PolarHBondContact O-N 2.81Å; E113-T117 PolarHBondContact O-OG1 2.84Å
114P95.1Very high94Very high57 Ų5748.5 Ų48.537%0.3726%0.26SS..Hα-helixtrans-54.9-45.3169.8-27.733.1000113.3L74 C110 V111 K116 T117 M118L74-P114 HydrophobicContact CD1-CB 4.39Å; C110-P114 WeakPolarHBondContact O-CD 3.31Å; V111-P114 WeakPolarHBondContact O-CD 3.45Å; P114-K116 PolarHBondContact O-N 2.82Å; P114-T117 WeakPolarHBondContact O-CB 3.37Å; P114-T117 PolarHBondContact O-N 3.23Å; P114-M118 WeakPolarHBondContact O-CG 3.35Å; P114-M118 PolarHBondContact O-N 3.29Å; P114-M118 VanDerWaalsContact O-N 3.09Å
115L95.8Very high93.9Very high1 Ų149.1 Ų49.11%0.00526%0.263CS..Hα-helixtrans-67.7-36.4-179.7-67.5173000112.3F78 L101 L105 V111 I112 E113 T117 M118 G119 L120F78-L115 HydrophobicContact CB-CD2 4.42Å; F78-L115 HydrophobicContact CD2-CD2 3.86Å; F78-L115 HydrophobicContact CG-CD2 4.5Å; L101-L115 HydrophobicContact CD2-CD2 4.22Å; L105-L115 HydrophobicContact CD1-CD1 4.38Å; V111-L115 HydrophobicContact CB-CD1 4.35Å; V111-L115 HydrophobicContact CG2-CD1 3.82Å; V111-L115 WeakPolarHBondContact O-CB 3.41Å; V111-L115 WeakPolarHBondContact O-CG 3.35Å; V111-L115 PolarHBondContact O-N 2.98Å; I112-L115 PolarHBondContact O-N 3.31Å; E113-L115 VanDerWaalsContact C-N 3.33Å; E113-L115 PolarHBondContact O-N 3.48Å; L115-T117 VanDerWaalsContact C-N 3.31Å; L115-T117 PolarHBondContact O-N 3.31Å; L115-M118 HydrophobicContact CD2-SD 4.28Å; L115-M118 CarbonylContact O-C 3.51Å; L115-M118 WeakPolarHBondContact O-CA 3.48Å; L115-M118 WeakPolarHBondContact O-CB 3.32Å; L115-M118 PolarHBondContact O-N 3Å; L115-M118 VanDerWaalsContact O-N 3.12Å; L115-G119 PolarHBondContact O-N 3.05Å; L115-L120 HydrophobicContact CB-CB 4.04Å; L115-L120 HydrophobicContact CB-CD2 3.84Å; L115-L120 HydrophobicContact CB-CG 4.42Å; L115-L120 HydrophobicContact CD1-CD2 4.25Å; L115-L120 VanDerWaalsContact O-CB 3.22Å; L115-L120 WeakPolarHBondContact O-CB 3Å; L115-L120 PolarHBondContact O-N 2.95Å
116K94.1Very high93.9Very high36 Ų3654 Ų5416%0.15729%0.286CS..Hα-helixtrans-62-40.4172.2-78.5166.268-1750111.4I112 E113 P114 M118 G119 D154I112-K116 HydrophobicContact CG2-CD 3.53Å; I112-K116 HydrophobicContact CG2-CG 4.22Å; I112-K116 WeakPolarHBondContact O-CB 3.32Å; I112-K116 VanDerWaalsContact O-CG 3.3Å; I112-K116 WeakPolarHBondContact O-CG 3.48Å; I112-K116 PolarHBondContact O-N 2.87Å; E113-K116 PolarHBondContact O-N 2.88Å; E113-K116 IonicContact OE1-NZ 3.24Å; E113-K116 PolarHBondContact OE1-NZ 2.97Å; P114-K116 PolarHBondContact O-N 2.82Å; K116-M118 PolarHBondContact O-N 2.77Å; K116-G119 WeakPolarHBondContact O-CA 3.47Å; K116-G119 PolarHBondContact O-N 2.8Å; K116-D154 IonicContact NZ-OD2 2.82Å; K116-D154 PolarHBondContact NZ-OD2 3.32Å
117T94.2Very high93.8Very high124 Ų12448.7 Ų48.776%0.76126%0.264SS*.Hα-helixtrans-61.4-33.5173.7-53.90000111.8E113 P114 L115 G119E113-T117 PolarHBondContact O-N 2.81Å; E113-T117 PolarHBondContact O-OG1 2.84Å; P114-T117 WeakPolarHBondContact O-CB 3.37Å; P114-T117 PolarHBondContact O-N 3.23Å; L115-T117 VanDerWaalsContact C-N 3.31Å; L115-T117 PolarHBondContact O-N 3.31Å; T117-G119 PolarHBondContact O-N 3.08Å
118M94.5Very high93.9Very high57 Ų5742.9 Ų42.928%0.28124%0.239SC..THydrogen-bonded Turntrans-76.2-1.9172.3-61.5175.4-175.500113.8L74 F78 P114 L115 K116L74-M118 HydrophobicContact CB-CE 4.33Å; F78-M118 HydrophobicContact CB-SD 4.13Å; F78-M118 HydrophobicContact CD1-CB 4.01Å; F78-M118 HydrophobicContact CD1-SD 4.4Å; F78-M118 HydrophobicContact CD2-CB 4.44Å; F78-M118 HydrophobicContact CE1-CB 3.82Å; F78-M118 VanDerWaalsContact CE1-O 3.26Å; F78-M118 WeakPolarHBondContact CE1-O 3.42Å; F78-M118 HydrophobicContact CE2-CB 4.24Å; F78-M118 HydrophobicContact CG-CB 4.31Å; F78-M118 HydrophobicContact CG-SD 4.14Å; F78-M118 HydrophobicContact CZ-CB 3.93Å; F78-M118 VanDerWaalsContact CZ-O 3.25Å; F78-M118 WeakPolarHBondContact CZ-O 3.48Å; P114-M118 WeakPolarHBondContact O-CG 3.35Å; P114-M118 PolarHBondContact O-N 3.29Å; P114-M118 VanDerWaalsContact O-N 3.09Å; L115-M118 HydrophobicContact CD2-SD 4.28Å; L115-M118 CarbonylContact O-C 3.51Å; L115-M118 WeakPolarHBondContact O-CA 3.48Å; L115-M118 WeakPolarHBondContact O-CB 3.32Å; L115-M118 PolarHBondContact O-N 3Å; L115-M118 VanDerWaalsContact O-N 3.12Å; K116-M118 PolarHBondContact O-N 2.77Å
119G93.8Very high93.7Very high23 Ų2344.9 Ų44.924%0.23725%0.251CS..THydrogen-bonded Turntrans85.628.7179.300000114.7L115 K116 T117 I121 K122 S123L115-G119 PolarHBondContact O-N 3.05Å; K116-G119 WeakPolarHBondContact O-CA 3.47Å; K116-G119 PolarHBondContact O-N 2.8Å; T117-G119 PolarHBondContact O-N 3.08Å; G119-I121 PolarHBondContact O-N 3.28Å; G119-K122 PolarHBondContact O-N 3.23Å; G119-S123 PolarHBondContact O-N 2.71Å; G119-S123 PolarHBondContact O-OG 3.41Å
120L94.8Very high93.6Very high1 Ų144.9 Ų44.91%0.00525%0.245CC..Hα-helixtrans-47.1-53.7-176.1176.565.9000114.6F78 F82 L115 K122 S123 V124 L146 V150F78-L120 HydrophobicContact CD2-CD1 4.44Å; F78-L120 HydrophobicContact CE2-CB 4Å; F78-L120 HydrophobicContact CE2-CD1 3.88Å; F82-L120 HydrophobicContact CE2-CD1 3.84Å; F82-L120 HydrophobicContact CZ-CD1 3.91Å; L115-L120 HydrophobicContact CB-CB 4.04Å; L115-L120 HydrophobicContact CB-CD2 3.84Å; L115-L120 HydrophobicContact CB-CG 4.42Å; L115-L120 HydrophobicContact CD1-CD2 4.25Å; L115-L120 VanDerWaalsContact O-CB 3.22Å; L115-L120 WeakPolarHBondContact O-CB 3Å; L115-L120 PolarHBondContact O-N 2.95Å; L120-K122 VanDerWaalsContact C-N 3.35Å; L120-K122 PolarHBondContact O-N 3.17Å; L120-S123 PolarHBondContact O-N 2.92Å; L120-V124 HydrophobicContact CD1-CG2 3.77Å; L120-V124 HydrophobicContact CG-CG2 4.36Å; L120-V124 WeakPolarHBondContact O-CB 3.31Å; L120-V124 WeakPolarHBondContact O-CG2 3.19Å; L120-V124 PolarHBondContact O-N 3.26Å; L120-L146 HydrophobicContact CD1-CD2 3.95Å; L120-V150 HydrophobicContact CD2-CG2 3.65Å
121I93.4Very high93.4Very high2 Ų241 Ų411%0.0122%0.218CC..Hα-helixtrans-60.4-48.3-177.2-64.2-60.1000110.3G119 S123 V124 M125 L147 V150 E160 L161G119-I121 PolarHBondContact O-N 3.28Å; I121-S123 PolarHBondContact O-N 3.11Å; I121-V124 PolarHBondContact O-N 3.1Å; I121-M125 HydrophobicContact CG2-CG 4.24Å; I121-M125 WeakPolarHBondContact O-CB 3.41Å; I121-M125 WeakPolarHBondContact O-CG 3.33Å; I121-M125 PolarHBondContact O-N 2.79Å; I121-L147 HydrophobicContact CD1-CD2 4.44Å; I121-V150 HydrophobicContact CD1-CG1 3.93Å; I121-E160 HydrophobicContact CB-CG 4.47Å; I121-E160 WeakPolarHBondContact CB-OE1 3.32Å; I121-E160 HydrophobicContact CG1-CG 4.49Å; I121-E160 HydrophobicContact CG2-CG 4.16Å; I121-L161 HydrophobicContact CD1-CD1 4.43Å; I121-L161 HydrophobicContact CD1-CD2 4.41Å; I121-L161 HydrophobicContact CD1-CG 4.27Å; I121-L161 HydrophobicContact CG2-CD2 3.65Å; I121-L161 HydrophobicContact CG2-CG 4.1Å
122K93.7Very high93Very high133 Ų13341.3 Ų41.358%0.57822%0.22SC*.Hα-helixtrans-57.6-51.4177.4-177.4-179.6172.5-177.10111.8G119 L120 V124 M125 E126G119-K122 PolarHBondContact O-N 3.23Å; L120-K122 VanDerWaalsContact C-N 3.35Å; L120-K122 PolarHBondContact O-N 3.17Å; K122-V124 VanDerWaalsContact C-N 3.34Å; K122-V124 PolarHBondContact O-N 3.46Å; K122-M125 PolarHBondContact O-N 3.12Å; K122-E126 WeakPolarHBondContact CE-OE1 3.44Å; K122-E126 HydrophobicContact CG-CG 4.48Å; K122-E126 IonicContact NZ-OE1 2.64Å; K122-E126 WeakPolarHBondContact O-CG 3.31Å; K122-E126 PolarHBondContact O-N 3.43Å
123S94.3Very high92.6Very high24 Ų2447.2 Ų47.217%0.16825%0.247CC..Hα-helixtrans-62-39.7-178.5-60.80000112.8G119 L120 I121 S127G119-S123 PolarHBondContact O-N 2.71Å; G119-S123 PolarHBondContact O-OG 3.41Å; L120-S123 PolarHBondContact O-N 2.92Å; I121-S123 PolarHBondContact O-N 3.11Å; S123-S127 VanDerWaalsContact O-CB 3.31Å; S123-S127 WeakPolarHBondContact O-CB 3.25Å; S123-S127 PolarHBondContact O-N 2.85Å; S123-S127 PolarHBondContact O-OG 3.38Å
124V94.5Very high92.2Very high1 Ų145.6 Ų45.61%0.00625%0.245CC..Hα-helixtrans-68.1-44.4176.5179.10000110.6F82 L120 I121 K122 S127 V128 C143 L146 L147F82-V124 HydrophobicContact CE1-CB 4.22Å; F82-V124 HydrophobicContact CE1-CG2 3.43Å; F82-V124 VanDerWaalsContact CE1-CG2 3.43Å; F82-V124 HydrophobicContact CE2-CG2 4.33Å; F82-V124 HydrophobicContact CZ-CG2 3.3Å; L120-V124 HydrophobicContact CD1-CG2 3.77Å; L120-V124 HydrophobicContact CG-CG2 4.36Å; L120-V124 WeakPolarHBondContact O-CB 3.31Å; L120-V124 WeakPolarHBondContact O-CG2 3.19Å; L120-V124 PolarHBondContact O-N 3.26Å; I121-V124 PolarHBondContact O-N 3.1Å; K122-V124 VanDerWaalsContact C-N 3.34Å; K122-V124 PolarHBondContact O-N 3.46Å; V124-S127 WeakPolarHBondContact O-CB 3.38Å; V124-S127 PolarHBondContact O-N 2.87Å; V124-V128 HydrophobicContact CG1-CG2 4.16Å; V124-V128 WeakPolarHBondContact O-CB 3.38Å; V124-V128 VanDerWaalsContact O-CG2 3.26Å; V124-V128 WeakPolarHBondContact O-CG2 3.22Å; V124-V128 PolarHBondContact O-N 3.32Å; V124-C143 HydrophobicContact CG1-CB 4.15Å; V124-L146 HydrophobicContact CG2-CD2 3.98Å; V124-L147 HydrophobicContact CB-CD2 4.11Å; V124-L147 HydrophobicContact CG1-CD1 3.94Å; V124-L147 HydrophobicContact CG1-CD2 3.6Å; V124-L147 HydrophobicContact CG1-CG 3.56Å
125M93.5Very high91.6Very high16 Ų1649.8 Ų49.88%0.07926%0.259CS..Hα-helixtrans-63.5-44.9-179.9-71.7-61.8-68.800112.3I121 K122 S127 V128 D129 L147 L161 A166 M169I121-M125 HydrophobicContact CG2-CG 4.24Å; I121-M125 WeakPolarHBondContact O-CB 3.41Å; I121-M125 WeakPolarHBondContact O-CG 3.33Å; I121-M125 PolarHBondContact O-N 2.79Å; K122-M125 PolarHBondContact O-N 3.12Å; M125-S127 VanDerWaalsContact C-N 3.32Å; M125-S127 PolarHBondContact O-N 3.23Å; M125-V128 PolarHBondContact O-N 2.89Å; M125-D129 PolarHBondContact O-N 3.44Å; M125-L147 HydrophobicContact SD-CD1 4.39Å; M125-L161 HydrophobicContact CG-CD2 3.96Å; M125-L161 HydrophobicContact SD-CD2 3.61Å; M125-A166 HydrophobicContact CE-CB 3.59Å; M125-A166 HydrophobicContact SD-CB 4.05Å; M125-M169 HydrophobicContact CE-CB 4.24Å; M125-M169 HydrophobicContact CE-CE 3.46Å; M125-M169 VanDerWaalsContact CE-CE 3.46Å; M125-M169 HydrophobicContact CE-CG 4.44Å; M125-M169 HydrophobicContact CE-SD 3.35Å; M125-M169 WeakPolarHBondContact CE-SD 3.02Å; M125-M169 HydrophobicContact SD-SD 4.03Å
126E92.5Very high91.2Very high103 Ų10352 Ų5248%0.48127%0.271SS..Hα-helixtrans-61.8-41.1174-71.7174.2175.100111.4K122 D129 I130K122-E126 WeakPolarHBondContact CE-OE1 3.44Å; K122-E126 HydrophobicContact CG-CG 4.48Å; K122-E126 IonicContact NZ-OE1 2.64Å; K122-E126 WeakPolarHBondContact O-CG 3.31Å; K122-E126 PolarHBondContact O-N 3.43Å; E126-D129 PolarHBondContact O-N 2.85Å; E126-I130 WeakPolarHBondContact O-CG1 3.39Å; E126-I130 PolarHBondContact O-N 3.04Å
127S91.8Very high90.9Very high13 Ų1351.5 Ų51.59%0.09127%0.27CS..Hα-helixtrans-63.5-45175.3-630000111.7S123 V124 M125 D129 I130 L131S123-S127 VanDerWaalsContact O-CB 3.31Å; S123-S127 WeakPolarHBondContact O-CB 3.25Å; S123-S127 PolarHBondContact O-N 2.85Å; S123-S127 PolarHBondContact O-OG 3.38Å; V124-S127 WeakPolarHBondContact O-CB 3.38Å; V124-S127 PolarHBondContact O-N 2.87Å; M125-S127 VanDerWaalsContact C-N 3.32Å; M125-S127 PolarHBondContact O-N 3.23Å; S127-D129 VanDerWaalsContact C-N 3.33Å; S127-D129 PolarHBondContact O-N 3.33Å; S127-I130 PolarHBondContact O-N 3.37Å; S127-L131 WeakPolarHBondContact O-CB 3.29Å; S127-L131 WeakPolarHBondContact O-CD1 3.39Å; S127-L131 WeakPolarHBondContact O-CG 3.4Å; S127-L131 PolarHBondContact O-N 2.73Å
128V92.5Very high90.7Very high1 Ų151.1 Ų51.11%0.00626%0.26CS..Hα-helixtrans-60.4-44179.11670000110.6V124 M125 I130 L131 I132 L140 C143 M169 I173V124-V128 HydrophobicContact CG1-CG2 4.16Å; V124-V128 WeakPolarHBondContact O-CB 3.38Å; V124-V128 VanDerWaalsContact O-CG2 3.26Å; V124-V128 WeakPolarHBondContact O-CG2 3.22Å; V124-V128 PolarHBondContact O-N 3.32Å; M125-V128 PolarHBondContact O-N 2.89Å; V128-I130 PolarHBondContact O-N 3.41Å; V128-L131 PolarHBondContact O-N 3.25Å; V128-L131 VanDerWaalsContact O-N 3.15Å; V128-I132 HydrophobicContact CG1-CD1 3.84Å; V128-I132 HydrophobicContact CG1-CG1 4.34Å; V128-I132 VanDerWaalsContact O-CG1 3.24Å; V128-I132 WeakPolarHBondContact O-CG1 3.22Å; V128-I132 PolarHBondContact O-N 3.11Å; V128-L140 HydrophobicContact CB-CD1 4.37Å; V128-L140 HydrophobicContact CG1-CD1 3.93Å; V128-L140 HydrophobicContact CG2-CD1 4.13Å; V128-C143 HydrophobicContact CG2-CB 3.81Å; V128-M169 HydrophobicContact CB-SD 3.99Å; V128-M169 HydrophobicContact CG1-CG 4Å; V128-M169 HydrophobicContact CG1-SD 3.57Å; V128-M169 VanDerWaalsContact CG1-SD 3.57Å; V128-I173 HydrophobicContact CG1-CD1 3.73Å
129D90.6Very high90.4Very high78 Ų7849 Ų4942%0.41725%0.249SC..Hα-helixtrans-59.4-44.8178.9-164.742.3000112M125 E126 S127 L131 M169M125-D129 PolarHBondContact O-N 3.44Å; E126-D129 PolarHBondContact O-N 2.85Å; S127-D129 VanDerWaalsContact C-N 3.33Å; S127-D129 PolarHBondContact O-N 3.33Å; D129-L131 PolarHBondContact O-N 3.13Å; D129-M169 HydrophobicContact CB-CE 4.12Å
130I89.8Confident90.4Very high68 Ų6847.9 Ų47.935%0.34924%0.237SC..Hα-helixtrans-65-39.9174.9-63.7166.2000111.7Y84 E126 S127 V128 I132 E133 T134Y84-I130 HydrophobicContact CE2-CG2 3.99Å; E126-I130 WeakPolarHBondContact O-CG1 3.39Å; E126-I130 PolarHBondContact O-N 3.04Å; S127-I130 PolarHBondContact O-N 3.37Å; V128-I130 PolarHBondContact O-N 3.41Å; I130-I132 VanDerWaalsContact C-N 3.34Å; I130-E133 PolarHBondContact O-N 3.1Å; I130-T134 HydrophobicContact CG2-CG2 4.37Å; I130-T134 WeakPolarHBondContact O-CG2 3.42Å; I130-T134 PolarHBondContact O-N 3.17Å; I130-T134 VanDerWaalsContact O-N 3.08Å; I130-T134 PolarHBondContact O-OG1 2.78Å
131L89.4Confident90.3Very high4 Ų449.4 Ų49.42%0.02125%0.245CC..Hα-helixtrans-72.1-28.4-176.4-68.2167.7000113S127 V128 D129 T134 E135 N136 R139 L140S127-L131 WeakPolarHBondContact O-CB 3.29Å; S127-L131 WeakPolarHBondContact O-CD1 3.39Å; S127-L131 WeakPolarHBondContact O-CG 3.4Å; S127-L131 PolarHBondContact O-N 2.73Å; V128-L131 PolarHBondContact O-N 3.25Å; V128-L131 VanDerWaalsContact O-N 3.15Å; D129-L131 PolarHBondContact O-N 3.13Å; L131-T134 WeakPolarHBondContact CA-OG1 3.38Å; L131-E135 PolarHBondContact O-N 3.15Å; L131-E135 VanDerWaalsContact O-N 3.1Å; L131-N136 HydrophobicContact CD2-CB 3.72Å; L131-N136 PolarHBondContact O-N 3.27Å; L131-R139 HydrophobicContact CD1-CB 4.14Å; L131-R139 HydrophobicContact CD1-CG 3.77Å; L131-R139 HydrophobicContact CD2-CB 4.05Å; L131-R139 HydrophobicContact CD2-CG 4.17Å; L131-L140 HydrophobicContact CB-CB 4.24Å; L131-L140 HydrophobicContact CB-CD1 4.27Å
132I86.5Confident90.3Very high10 Ų1050.2 Ų50.25%0.05125%0.25CC..Hα-helixtrans-62.7-45.4171.4-69.6163.3000110.4V128 I130 M169 K172 I173 M176V128-I132 HydrophobicContact CG1-CD1 3.84Å; V128-I132 HydrophobicContact CG1-CG1 4.34Å; V128-I132 VanDerWaalsContact O-CG1 3.24Å; V128-I132 WeakPolarHBondContact O-CG1 3.22Å; V128-I132 PolarHBondContact O-N 3.11Å; I130-I132 VanDerWaalsContact C-N 3.34Å; I132-M169 HydrophobicContact CD1-CG 3.94Å; I132-K172 HydrophobicContact CD1-CD 4.45Å; I132-K172 HydrophobicContact CG2-CD 4.01Å; I132-K172 HydrophobicContact CG2-CG 4.27Å; I132-I173 HydrophobicContact CD1-CD1 4.03Å; I132-I173 HydrophobicContact CD1-CG1 3.49Å; I132-I173 VanDerWaalsContact CD1-CG1 3.49Å; I132-I173 HydrophobicContact CG1-CD1 4.34Å; I132-I173 HydrophobicContact CG1-CG1 3.68Å; I132-M176 HydrophobicContact CG2-SD 4.22Å
133E86.5Confident90.4Very high132 Ų13243.9 Ų43.962%0.61722%0.222SC*.Hα-helixtrans-73.2-29.2-179-62.6-58.4142.700113.1I130 K172I130-E133 PolarHBondContact O-N 3.1Å; E133-K172 IonicContact OE1-NZ 2.8Å; E133-K172 PolarHBondContact OE1-NZ 3.34Å
134T85.9Confident90.5Very high73 Ų7342.8 Ų42.845%0.44821%0.214SC..THydrogen-bonded Turntrans-93-0.8-179.154.20000114I130 L131 N136I130-T134 HydrophobicContact CG2-CG2 4.37Å; I130-T134 WeakPolarHBondContact O-CG2 3.42Å; I130-T134 PolarHBondContact O-N 3.17Å; I130-T134 VanDerWaalsContact O-N 3.08Å; I130-T134 PolarHBondContact O-OG1 2.78Å; L131-T134 WeakPolarHBondContact CA-OG1 3.38Å; T134-N136 PolarHBondContact O-N 3.1Å; T134-N136 VanDerWaalsContact O-N 3.13Å
135E82.5Confident90.5Very high145 Ų14546.9 Ų46.968%0.67823%0.232SC*.THydrogen-bonded Turntrans52.229.3-178.5-59-173.2171.600114.6L131 N137 M176L131-E135 PolarHBondContact O-N 3.15Å; L131-E135 VanDerWaalsContact O-N 3.1Å; E135-N137 VanDerWaalsContact C-N 3.33Å; E135-N137 PolarHBondContact O-N 3.45Å; E135-M176 HydrophobicContact CG-CE 4.38Å
136N86.3Confident90.7Very high48 Ų4846.2 Ų46.226%0.25723%0.229SC..  trans-83.878.1177.9-174.9-19.2000111.1L131 T134 E138 R139 L140L131-N136 HydrophobicContact CD2-CB 3.72Å; L131-N136 PolarHBondContact O-N 3.27Å; T134-N136 PolarHBondContact O-N 3.1Å; T134-N136 VanDerWaalsContact O-N 3.13Å; N136-E138 VanDerWaalsContact C-N 3.32Å; N136-E138 PolarHBondContact O-N 3.49Å; N136-R139 PolarHBondContact O-N 2.9Å; N136-R139 PolarHBondContact OD1-N 3.48Å; N136-L140 VanDerWaalsContact O-CB 3.28Å; N136-L140 WeakPolarHBondContact O-CB 2.8Å; N136-L140 PolarHBondContact O-N 3.38Å
137N88.2Confident90.8Very high26 Ų2641.4 Ų41.414%0.13921%0.206CC..Hα-helixtrans-63.7-30-174.4-71.8-19.8000114.4E135 L141 T182 D183 V186E135-N137 VanDerWaalsContact C-N 3.33Å; E135-N137 PolarHBondContact O-N 3.45Å; N137-L141 VanDerWaalsContact O-CB 3.27Å; N137-L141 WeakPolarHBondContact O-CB 3.46Å; N137-L141 PolarHBondContact O-N 3.14Å; N137-T182 HydrophobicContact CB-CG2 3.82Å; N137-D183 PolarHBondContact ND2-OD1 3.36Å; N137-V186 HydrophobicContact CB-CG2 4.08Å
138E88.9Confident91.1Very high115 Ų11543.7 Ų43.754%0.53722%0.215SC..Hα-helixtrans-66.3-49.7179.3-174.6-178.6-173.700111L95 N136 L141 L142L95-E138 HydrophobicContact CD1-CG 4.34Å; L95-E138 HydrophobicContact CD2-CG 4.16Å; N136-E138 VanDerWaalsContact C-N 3.32Å; N136-E138 PolarHBondContact O-N 3.49Å; E138-L141 PolarHBondContact O-N 2.68Å; E138-L142 PolarHBondContact O-N 3.04Å
139R90Very high91.2Very high13 Ų1344.7 Ų44.75%0.04922%0.22CC..Hα-helixtrans-69.9-39.8177.5-170.9173.1172.7-1773.7111.3A81 L95 L98 L131 N136 L141 L142 C143A81-R139 PolarHBondContact O-NH2 3.32Å; L95-R139 HydrophobicContact CD2-CB 3.8Å; L95-R139 HydrophobicContact CD2-CG 4.16Å; L98-R139 HydrophobicContact CD1-CG 3.72Å; L131-R139 HydrophobicContact CD1-CB 4.14Å; L131-R139 HydrophobicContact CD1-CG 3.77Å; L131-R139 HydrophobicContact CD2-CB 4.05Å; L131-R139 HydrophobicContact CD2-CG 4.17Å; N136-R139 PolarHBondContact O-N 2.9Å; N136-R139 PolarHBondContact OD1-N 3.48Å; R139-L141 VanDerWaalsContact C-N 3.29Å; R139-L141 PolarHBondContact O-N 2.84Å; R139-L142 PolarHBondContact O-N 3.4Å; R139-L142 VanDerWaalsContact O-N 3.12Å; R139-C143 PolarHBondContact O-N 3.48Å; R139-C143 PolarHBondContact O-SG 2.86Å
140L92.4Very high91.5Very high0 Ų041 Ų410%020%0.201CC..Hα-helixtrans-56.5-44.1175.8-17957.1000111.4V128 L131 N136 L142 C143 L144 I173 V186V128-L140 HydrophobicContact CB-CD1 4.37Å; V128-L140 HydrophobicContact CG1-CD1 3.93Å; V128-L140 HydrophobicContact CG2-CD1 4.13Å; L131-L140 HydrophobicContact CB-CB 4.24Å; L131-L140 HydrophobicContact CB-CD1 4.27Å; N136-L140 VanDerWaalsContact O-CB 3.28Å; N136-L140 WeakPolarHBondContact O-CB 2.8Å; N136-L140 PolarHBondContact O-N 3.38Å; L140-L142 VanDerWaalsContact C-N 3.33Å; L140-L142 PolarHBondContact O-N 3.16Å; L140-C143 PolarHBondContact O-N 3.46Å; L140-L144 HydrophobicContact CD1-CD1 4.36Å; L140-L144 HydrophobicContact CD1-CG 4.31Å; L140-L144 HydrophobicContact CG-CD1 4.15Å; L140-L144 WeakPolarHBondContact O-CG 3.29Å; L140-L144 PolarHBondContact O-N 2.79Å; L140-I173 HydrophobicContact CD1-CD1 4.17Å; L140-I173 HydrophobicContact CD2-CG2 4.41Å; L140-V186 HydrophobicContact CD2-CG1 3.7Å; L140-V186 HydrophobicContact CG-CG1 4.11Å
141L93Very high91.7Very high33 Ų3337.8 Ų37.817%0.17318%0.184CC..Hα-helixtrans-60.5-39.8177.2-176.664.2000112.5N137 E138 R139 L144 K145 V186 E189N137-L141 VanDerWaalsContact O-CB 3.27Å; N137-L141 WeakPolarHBondContact O-CB 3.46Å; N137-L141 PolarHBondContact O-N 3.14Å; E138-L141 PolarHBondContact O-N 2.68Å; R139-L141 VanDerWaalsContact C-N 3.29Å; R139-L141 PolarHBondContact O-N 2.84Å; L141-L144 PolarHBondContact O-N 3.1Å; L141-K145 VanDerWaalsContact O-CG 3.31Å; L141-K145 WeakPolarHBondContact O-CG 3.37Å; L141-K145 PolarHBondContact O-N 2.86Å; L141-V186 HydrophobicContact CB-CG2 4.25Å; L141-E189 HydrophobicContact CD1-CB 3.8Å; L141-E189 HydrophobicContact CD1-CG 4.14Å
142L94.1Very high91.9Very high19 Ų1939.7 Ų39.710%0.09920%0.2CC..Hα-helixtrans-68.1-40.5176-67.6176.1000112.1L95 L98 K99 E138 R139 L140 L144 K145 L146L95-L142 HydrophobicContact CB-CD1 4.17Å; L95-L142 HydrophobicContact CD2-CD1 3.59Å; L95-L142 HydrophobicContact CG-CD1 4.49Å; L98-L142 HydrophobicContact CB-CB 4.08Å; L98-L142 HydrophobicContact CB-CD1 4.08Å; L98-L142 HydrophobicContact CD1-CB 4.16Å; L98-L142 HydrophobicContact CD1-CD1 4.49Å; K99-L142 HydrophobicContact CG-CD1 4.04Å; K99-L142 HydrophobicContact CG-CD2 3.95Å; E138-L142 PolarHBondContact O-N 3.04Å; R139-L142 PolarHBondContact O-N 3.4Å; R139-L142 VanDerWaalsContact O-N 3.12Å; L140-L142 VanDerWaalsContact C-N 3.33Å; L140-L142 PolarHBondContact O-N 3.16Å; L142-L144 VanDerWaalsContact C-N 3.34Å; L142-L144 PolarHBondContact O-N 3.26Å; L142-K145 PolarHBondContact O-N 3.34Å; L142-L146 WeakPolarHBondContact O-CB 3.23Å; L142-L146 PolarHBondContact O-N 3.26Å
143C95Very high92.3Very high0 Ų043.1 Ų43.10%022%0.218CC..Hα-helixtrans-60.6-43.5173.9-69.90000111.6V124 V128 R139 L140 L146 L147V124-C143 HydrophobicContact CG1-CB 4.15Å; V128-C143 HydrophobicContact CG2-CB 3.81Å; R139-C143 PolarHBondContact O-N 3.48Å; R139-C143 PolarHBondContact O-SG 2.86Å; L140-C143 PolarHBondContact O-N 3.46Å; C143-L146 WeakPolarHBondContact O-CB 3.49Å; C143-L146 PolarHBondContact O-N 2.73Å; C143-L147 PolarHBondContact O-N 3.08Å
144L96.2Very high92.6Very high0 Ų038 Ų380%020%0.195CC..Hα-helixtrans-65.8-41.1177.3-69172.6000112.4L140 L141 L142 L146 L147 F148 L170 I173 V186 E189 A190 V193L140-L144 HydrophobicContact CD1-CD1 4.36Å; L140-L144 HydrophobicContact CD1-CG 4.31Å; L140-L144 HydrophobicContact CG-CD1 4.15Å; L140-L144 WeakPolarHBondContact O-CG 3.29Å; L140-L144 PolarHBondContact O-N 2.79Å; L141-L144 PolarHBondContact O-N 3.1Å; L142-L144 VanDerWaalsContact C-N 3.34Å; L142-L144 PolarHBondContact O-N 3.26Å; L144-L146 VanDerWaalsContact C-N 3.29Å; L144-L146 PolarHBondContact O-N 2.96Å; L144-L147 PolarHBondContact O-N 3.11Å; L144-F148 WeakPolarHBondContact O-CB 3.38Å; L144-F148 PolarHBondContact O-N 2.91Å; L144-L170 HydrophobicContact CD2-CD2 3.66Å; L144-I173 HydrophobicContact CD1-CD1 4.4Å; L144-I173 HydrophobicContact CD1-CG2 4.39Å; L144-I173 HydrophobicContact CD2-CD1 3.89Å; L144-V186 HydrophobicContact CD1-CG1 3.84Å; L144-E189 HydrophobicContact CB-CB 4Å; L144-E189 HydrophobicContact CB-CG 3.61Å; L144-E189 HydrophobicContact CD1-CB 4.33Å; L144-A190 HydrophobicContact CD1-CB 4.11Å; L144-A190 HydrophobicContact CD2-CB 4.28Å; L144-V193 WeakPolarHBondContact O-CG2 3.44Å
145K95.6Very high92.8Very high87 Ų8738.2 Ų38.238%0.37820%0.2SC..Hα-helixtrans-59.7-40.8172.7-76.6175.3179.7-176.30111.8L141 L142 F148 L149 E189L141-K145 VanDerWaalsContact O-CG 3.31Å; L141-K145 WeakPolarHBondContact O-CG 3.37Å; L141-K145 PolarHBondContact O-N 2.86Å; L142-K145 PolarHBondContact O-N 3.34Å; K145-F148 PolarHBondContact O-N 3.43Å; K145-L149 WeakPolarHBondContact O-CG 3.5Å; K145-L149 PolarHBondContact O-N 3.26Å; K145-E189 HydrophobicContact CG-CG 3.86Å; K145-E189 WeakPolarHBondContact CG-OE1 3.06Å
146L96.2Very high93.2Very high2 Ų233.5 Ų33.51%0.0119%0.185CC..Hα-helixtrans-64.7-46.5176.6-169.765000110.9F82 L98 L101 L105 L120 V124 L142 C143 L144 F148 L149 V150F82-L146 HydrophobicContact CZ-CD2 3.85Å; L98-L146 HydrophobicContact CD2-CD2 4.24Å; L101-L146 HydrophobicContact CB-CD1 4.32Å; L105-L146 HydrophobicContact CD2-CD1 3.67Å; L120-L146 HydrophobicContact CD1-CD2 3.95Å; V124-L146 HydrophobicContact CG2-CD2 3.98Å; L142-L146 WeakPolarHBondContact O-CB 3.23Å; L142-L146 PolarHBondContact O-N 3.26Å; C143-L146 WeakPolarHBondContact O-CB 3.49Å; C143-L146 PolarHBondContact O-N 2.73Å; L144-L146 VanDerWaalsContact C-N 3.29Å; L144-L146 PolarHBondContact O-N 2.96Å; L146-F148 VanDerWaalsContact C-N 3.3Å; L146-F148 PolarHBondContact O-N 3.03Å; L146-L149 PolarHBondContact O-N 3.19Å; L146-V150 VanDerWaalsContact O-CG2 3.27Å; L146-V150 WeakPolarHBondContact O-CG2 3.49Å; L146-V150 PolarHBondContact O-N 2.99Å
147L96.1Very high93.5Very high3 Ų331.2 Ų31.22%0.01617%0.173CC..Hα-helixtrans-58.9-41173.6-71.5179.4000112.2I121 V124 M125 C143 L144 V150 T151 L161 V193I121-L147 HydrophobicContact CD1-CD2 4.44Å; V124-L147 HydrophobicContact CB-CD2 4.11Å; V124-L147 HydrophobicContact CG1-CD1 3.94Å; V124-L147 HydrophobicContact CG1-CD2 3.6Å; V124-L147 HydrophobicContact CG1-CG 3.56Å; M125-L147 HydrophobicContact SD-CD1 4.39Å; C143-L147 PolarHBondContact O-N 3.08Å; L144-L147 PolarHBondContact O-N 3.11Å; L147-V150 PolarHBondContact O-N 2.77Å; L147-T151 WeakPolarHBondContact O-CB 3.46Å; L147-T151 VanDerWaalsContact O-CG2 3.3Å; L147-T151 WeakPolarHBondContact O-CG2 3.08Å; L147-T151 PolarHBondContact O-N 3.4Å; L147-T151 PolarHBondContact O-OG1 3.13Å; L147-L161 HydrophobicContact CD2-CD1 4.32Å; L147-L161 HydrophobicContact CD2-CD2 4.15Å; L147-V193 HydrophobicContact CB-CG1 3.98Å; L147-V193 HydrophobicContact CB-CG2 3.87Å
148F96.5Very high93.6Very high60 Ų6031.8 Ų31.826%0.26317%0.173SC..Hα-helixtrans-60-48.3176.9169.1-107.9000111.1L144 K145 L146 T151 A152 K192 V193 N196L144-F148 WeakPolarHBondContact O-CB 3.38Å; L144-F148 PolarHBondContact O-N 2.91Å; K145-F148 PolarHBondContact O-N 3.43Å; L146-F148 VanDerWaalsContact C-N 3.3Å; L146-F148 PolarHBondContact O-N 3.03Å; F148-T151 PolarHBondContact O-N 3.29Å; F148-T151 PolarHBondContact O-OG1 3.13Å; F148-T151 VanDerWaalsContact O-OG1 3.04Å; F148-A152 VanDerWaalsContact O-CB 3.23Å; F148-A152 WeakPolarHBondContact O-CB 3.1Å; F148-A152 PolarHBondContact O-N 3.38Å; F148-K192 HydrophobicContact CD2-CB 3.54Å; F148-K192 HydrophobicContact CD2-CD 4.31Å; F148-K192 HydrophobicContact CD2-CG 4.47Å; F148-K192 HydrophobicContact CE2-CB 3.9Å; F148-K192 HydrophobicContact CE2-CD 4.34Å; F148-K192 HydrophobicContact CE2-CG 4.49Å; F148-K192 HydrophobicContact CG-CB 4.24Å; F148-V193 HydrophobicContact CB-CG2 3.99Å; F148-N196 WeakPolarHBondContact CD2-ND2 3.37Å; F148-N196 WeakPolarHBondContact CE2-ND2 3.31Å; F148-N196 PolarHBondContact O-ND2 3.18Å; F148-N196 VanDerWaalsContact O-ND2 3.1Å
149L96.1Very high93.7Very high23 Ų2329.8 Ų29.812%0.1216%0.164CC..Hα-helixtrans-62.3-47.8177.7-71.3176.4000112.3S102 L105 F106 K145 L146 T151 A152 L153S102-L149 WeakPolarHBondContact O-CD1 3.35Å; L105-L149 HydrophobicContact CD2-CB 3.6Å; L105-L149 HydrophobicContact CD2-CD1 4.42Å; L105-L149 HydrophobicContact CG-CB 4.38Å; F106-L149 HydrophobicContact CB-CD1 4.15Å; F106-L149 HydrophobicContact CB-CD2 4.29Å; F106-L149 HydrophobicContact CD2-CD2 3.63Å; F106-L149 HydrophobicContact CE2-CD2 4.44Å; F106-L149 HydrophobicContact CG-CD2 4.37Å; K145-L149 WeakPolarHBondContact O-CG 3.5Å; K145-L149 PolarHBondContact O-N 3.26Å; L146-L149 PolarHBondContact O-N 3.19Å; L149-T151 VanDerWaalsContact C-N 3.34Å; L149-T151 PolarHBondContact O-N 3.45Å; L149-A152 PolarHBondContact O-N 3.47Å; L149-L153 WeakPolarHBondContact O-CB 3.25Å; L149-L153 VanDerWaalsContact O-CG 3.31Å; L149-L153 WeakPolarHBondContact O-CG 3.46Å; L149-L153 PolarHBondContact O-N 3.25Å
150V95.4Very high93.8Very high1 Ų132.4 Ų32.41%0.00618%0.177CC..Hα-helixtrans-59.7-46.8179.6174.40000110.5L105 L120 I121 L146 L147 A152 L153 D154 S157L105-V150 HydrophobicContact CD2-CB 4.43Å; L105-V150 HydrophobicContact CD2-CG2 3.44Å; L105-V150 VanDerWaalsContact CD2-CG2 3.44Å; L120-V150 HydrophobicContact CD2-CG2 3.65Å; I121-V150 HydrophobicContact CD1-CG1 3.93Å; L146-V150 VanDerWaalsContact O-CG2 3.27Å; L146-V150 WeakPolarHBondContact O-CG2 3.49Å; L146-V150 PolarHBondContact O-N 2.99Å; L147-V150 PolarHBondContact O-N 2.77Å; V150-A152 PolarHBondContact O-N 2.96Å; V150-L153 PolarHBondContact O-N 3.22Å; V150-D154 PolarHBondContact O-N 3.49Å; V150-S157 WeakPolarHBondContact CG1-OG 3.32Å
151T94.6Very high93.8Very high0 Ų032.4 Ų32.40%018%0.177CC..Hα-helixtrans-71.8-28.6-179.853.40000113.6L147 F148 L149 R158 L161 N196 I197L147-T151 WeakPolarHBondContact O-CB 3.46Å; L147-T151 VanDerWaalsContact O-CG2 3.3Å; L147-T151 WeakPolarHBondContact O-CG2 3.08Å; L147-T151 PolarHBondContact O-N 3.4Å; L147-T151 PolarHBondContact O-OG1 3.13Å; F148-T151 PolarHBondContact O-N 3.29Å; F148-T151 PolarHBondContact O-OG1 3.13Å; F148-T151 VanDerWaalsContact O-OG1 3.04Å; L149-T151 VanDerWaalsContact C-N 3.34Å; L149-T151 PolarHBondContact O-N 3.45Å; T151-R158 HydrophobicContact CG2-CG 4.4Å; T151-R158 PolarHBondContact O-NE 3.03Å; T151-R158 PolarHBondContact O-NH2 3.16Å; T151-L161 HydrophobicContact CG2-CD1 3.23Å; T151-N196 VanDerWaalsContact OG1-CB 3.31Å; T151-N196 WeakPolarHBondContact OG1-CB 3.36Å; T151-N196 PolarHBondContact OG1-ND2 3.05Å; T151-I197 HydrophobicContact CG2-CG1 4.35Å
152A94.1Very high93.7Very high43 Ų4331.8 Ų31.836%0.35517%0.174SC..Hα-helixtrans-68.7-42.817400000111.1F148 L149 V150 R158 N196F148-A152 VanDerWaalsContact O-CB 3.23Å; F148-A152 WeakPolarHBondContact O-CB 3.1Å; F148-A152 PolarHBondContact O-N 3.38Å; L149-A152 PolarHBondContact O-N 3.47Å; V150-A152 PolarHBondContact O-N 2.96Å; A152-R158 PolarHBondContact O-NH2 3.5Å; A152-N196 PolarHBondContact N-ND2 3.33Å
153L93.5Very high93.5Very high82 Ų8239.1 Ų39.143%0.42921%0.205SC..Hα-helixtrans-90.4-25.7-171.6-63.6172.6000114.3L105 I112 L149 V150L105-L153 HydrophobicContact CG-CD1 4.46Å; L105-L153 WeakPolarHBondContact O-CD1 3.4Å; I112-L153 HydrophobicContact CD1-CB 3.57Å; I112-L153 HydrophobicContact CD1-CD1 4.43Å; L149-L153 WeakPolarHBondContact O-CB 3.25Å; L149-L153 VanDerWaalsContact O-CG 3.31Å; L149-L153 WeakPolarHBondContact O-CG 3.46Å; L149-L153 PolarHBondContact O-N 3.25Å; V150-L153 PolarHBondContact O-N 3.22Å
154D92.7Very high93.2Very high24 Ų2441.8 Ų41.813%0.12822%0.223CC..  trans-126.5119.3178.1-179.929.4000112.6I112 K116 V150 A156 S157I112-D154 HydrophobicContact CD1-CB 4.01Å; I112-D154 HydrophobicContact CG2-CB 3.88Å; K116-D154 IonicContact NZ-OD2 2.82Å; K116-D154 PolarHBondContact NZ-OD2 3.32Å; V150-D154 PolarHBondContact O-N 3.49Å; D154-A156 VanDerWaalsContact C-N 3.34Å; D154-A156 PolarHBondContact OD1-N 2.89Å; D154-S157 PolarHBondContact OD2-N 3.22Å; D154-S157 PolarHBondContact OD2-OG 3.04Å
155S90.3Very high93Very high79 Ų7946.5 Ų46.555%0.55225%0.248SC*.Hα-helixtrans-70.3-28175.868.30000113.2R158S155-R158 WeakPolarHBondContact O-CB 3.36Å; S155-R158 PolarHBondContact O-N 3.2Å
156A90.9Very high92.9Very high46 Ų4642.4 Ų42.438%0.3823%0.231SC..Hα-helixtrans-69.4-38.6179.100000111.3D154 R158 Q159 E160D154-A156 VanDerWaalsContact C-N 3.34Å; D154-A156 PolarHBondContact OD1-N 2.89Å; A156-R158 PolarHBondContact O-N 3.27Å; A156-Q159 PolarHBondContact O-N 3.26Å; A156-Q159 VanDerWaalsContact O-N 3.12Å; A156-E160 PolarHBondContact O-N 3.29Å; A156-E160 VanDerWaalsContact O-N 3.08Å
157S92.4Very high92.7Very high0 Ų042.5 Ų42.50%023%0.231CC..Hα-helixtrans-58.6-30.7172.5-680000114.1V150 D154 E160 L161V150-S157 WeakPolarHBondContact CG1-OG 3.32Å; D154-S157 PolarHBondContact OD2-N 3.22Å; D154-S157 PolarHBondContact OD2-OG 3.04Å; S157-E160 PolarHBondContact O-N 3.24Å; S157-L161 WeakPolarHBondContact O-CG 3.32Å; S157-L161 PolarHBondContact O-N 3.17Å
158R92.4Very high92.6Very high38 Ų3846.9 Ų46.914%0.14325%0.252CS..Hα-helixtrans-62.3-46174.4-57.5170.3-164.8172.16.8110.8T151 A152 S155 A156 E160 L161 I162 N196T151-R158 HydrophobicContact CG2-CG 4.4Å; T151-R158 PolarHBondContact O-NE 3.03Å; T151-R158 PolarHBondContact O-NH2 3.16Å; A152-R158 PolarHBondContact O-NH2 3.5Å; S155-R158 WeakPolarHBondContact O-CB 3.36Å; S155-R158 PolarHBondContact O-N 3.2Å; A156-R158 PolarHBondContact O-N 3.27Å; R158-E160 VanDerWaalsContact C-N 3.34Å; R158-E160 PolarHBondContact O-N 3.27Å; R158-L161 PolarHBondContact O-N 3.05Å; R158-I162 VanDerWaalsContact O-CG1 3.29Å; R158-I162 WeakPolarHBondContact O-CG1 3.22Å; R158-I162 PolarHBondContact O-N 3.23Å; R158-N196 VanDerWaalsContact CD-O 3.26Å; R158-N196 WeakPolarHBondContact CD-O 3.5Å
159Q89.8Confident92.5Very high72 Ų7245.8 Ų45.834%0.33625%0.248SC..Hα-helixtrans-66.2-37.6179.2-62.6-60-44.800112A156 I162 K163A156-Q159 PolarHBondContact O-N 3.26Å; A156-Q159 VanDerWaalsContact O-N 3.12Å; Q159-I162 PolarHBondContact O-N 3.06Å; Q159-K163 WeakPolarHBondContact O-CG 3.49Å; Q159-K163 PolarHBondContact O-N 3.38Å; Q159-K163 VanDerWaalsContact O-N 3.14Å
160E91.7Very high92.4Very high68 Ų6844.9 Ų44.932%0.31824%0.243SC..Hα-helixtrans-63.4-42.6175.5-167.6178.3163.700112.1I121 A156 S157 R158 K163 S164I121-E160 HydrophobicContact CB-CG 4.47Å; I121-E160 WeakPolarHBondContact CB-OE1 3.32Å; I121-E160 HydrophobicContact CG1-CG 4.49Å; I121-E160 HydrophobicContact CG2-CG 4.16Å; A156-E160 PolarHBondContact O-N 3.29Å; A156-E160 VanDerWaalsContact O-N 3.08Å; S157-E160 PolarHBondContact O-N 3.24Å; R158-E160 VanDerWaalsContact C-N 3.34Å; R158-E160 PolarHBondContact O-N 3.27Å; E160-K163 PolarHBondContact O-N 3.02Å; E160-S164 WeakPolarHBondContact O-CB 3.49Å; E160-S164 PolarHBondContact O-N 3.49Å; E160-S164 PolarHBondContact O-OG 2.95Å
161L93.2Very high92.3Very high0 Ų045.3 Ų45.30%025%0.245CC..Hα-helixtrans-67.1-38.4176.6-77169.2000112.9I121 M125 L147 T151 S157 R158 S164 N165 A166 I197I121-L161 HydrophobicContact CD1-CD1 4.43Å; I121-L161 HydrophobicContact CD1-CD2 4.41Å; I121-L161 HydrophobicContact CD1-CG 4.27Å; I121-L161 HydrophobicContact CG2-CD2 3.65Å; I121-L161 HydrophobicContact CG2-CG 4.1Å; M125-L161 HydrophobicContact CG-CD2 3.96Å; M125-L161 HydrophobicContact SD-CD2 3.61Å; L147-L161 HydrophobicContact CD2-CD1 4.32Å; L147-L161 HydrophobicContact CD2-CD2 4.15Å; T151-L161 HydrophobicContact CG2-CD1 3.23Å; S157-L161 WeakPolarHBondContact O-CG 3.32Å; S157-L161 PolarHBondContact O-N 3.17Å; R158-L161 PolarHBondContact O-N 3.05Å; L161-S164 CarbonylContact O-C 3.6Å; L161-S164 PolarHBondContact O-N 3.01Å; L161-S164 VanDerWaalsContact O-N 3.12Å; L161-N165 PolarHBondContact O-N 3.32Å; L161-A166 HydrophobicContact CB-CB 3.78Å; L161-A166 HydrophobicContact CD2-CB 3.79Å; L161-A166 HydrophobicContact CG-CB 4.36Å; L161-A166 WeakPolarHBondContact O-CB 3.31Å; L161-A166 PolarHBondContact O-N 3.16Å; L161-I197 HydrophobicContact CB-CD1 3.98Å; L161-I197 HydrophobicContact CB-CG1 4.29Å; L161-I197 HydrophobicContact CD1-CD1 4.08Å; L161-I197 HydrophobicContact CD1-CG1 4.22Å
162I90.5Very high92.1Very high21 Ų2149.3 Ų49.311%0.10826%0.262CS..Hα-helixtrans-58.6-49.5174.2-69.1168000110.1R158 Q159 S164 N165 I197 T201 V205 L209R158-I162 VanDerWaalsContact O-CG1 3.29Å; R158-I162 WeakPolarHBondContact O-CG1 3.22Å; R158-I162 PolarHBondContact O-N 3.23Å; Q159-I162 PolarHBondContact O-N 3.06Å; I162-S164 PolarHBondContact O-N 3.36Å; I162-N165 PolarHBondContact O-N 3.17Å; I162-N165 VanDerWaalsContact O-N 3.12Å; I162-I197 HydrophobicContact CD1-CG2 4.05Å; I162-I197 HydrophobicContact CG1-CG2 3.49Å; I162-I197 VanDerWaalsContact CG1-CG2 3.49Å; I162-T201 HydrophobicContact CD1-CG2 3.72Å; I162-V205 HydrophobicContact CD1-CG1 4.07Å; I162-V205 HydrophobicContact CG2-CG1 3.97Å; I162-L209 HydrophobicContact CG2-CD1 4.1Å
163K89.4Confident92Very high173 Ų17347.3 Ų47.375%0.75225%0.246SC*.Hα-helixtrans-62.4-24.5177-69.3175.5-177.2-178.80113.3Q159 E160 N165Q159-K163 WeakPolarHBondContact O-CG 3.49Å; Q159-K163 PolarHBondContact O-N 3.38Å; Q159-K163 VanDerWaalsContact O-N 3.14Å; E160-K163 PolarHBondContact O-N 3.02Å; K163-N165 VanDerWaalsContact C-N 3.3Å
164S90.4Very high91.9Very high56 Ų5643.8 Ų43.839%0.39223%0.228SC..THydrogen-bonded Turntrans-9115.3179.2-53.40000113.2E160 L161 I162 A166E160-S164 WeakPolarHBondContact O-CB 3.49Å; E160-S164 PolarHBondContact O-N 3.49Å; E160-S164 PolarHBondContact O-OG 2.95Å; L161-S164 CarbonylContact O-C 3.6Å; L161-S164 PolarHBondContact O-N 3.01Å; L161-S164 VanDerWaalsContact O-N 3.12Å; I162-S164 PolarHBondContact O-N 3.36Å; S164-A166 PolarHBondContact O-N 2.97Å; S164-A166 VanDerWaalsContact O-N 3.15Å
165N90.5Very high91.4Very high98 Ų9849.5 Ų49.552%0.52425%0.251SS..THydrogen-bonded Turntrans54.929.4-177.9-61.7-37.8000114L161 I162 K163 L167 Q168 M169L161-N165 PolarHBondContact O-N 3.32Å; I162-N165 PolarHBondContact O-N 3.17Å; I162-N165 VanDerWaalsContact O-N 3.12Å; K163-N165 VanDerWaalsContact C-N 3.3Å; N165-L167 PolarHBondContact O-N 3.31Å; N165-L167 VanDerWaalsContact O-N 3.16Å; N165-Q168 PolarHBondContact O-N 3.08Å; N165-M169 PolarHBondContact O-N 3.37Å
166A93.2Very high90.9Very high1 Ų148 Ų481%0.00824%0.236CC..Hα-helixtrans-61.1-29.3-17600000113.1M125 L161 S164 Q168 M169 L170 I197M125-A166 HydrophobicContact CE-CB 3.59Å; M125-A166 HydrophobicContact SD-CB 4.05Å; L161-A166 HydrophobicContact CB-CB 3.78Å; L161-A166 HydrophobicContact CD2-CB 3.79Å; L161-A166 HydrophobicContact CG-CB 4.36Å; L161-A166 WeakPolarHBondContact O-CB 3.31Å; L161-A166 PolarHBondContact O-N 3.16Å; S164-A166 PolarHBondContact O-N 2.97Å; S164-A166 VanDerWaalsContact O-N 3.15Å; A166-Q168 PolarHBondContact O-N 3.05Å; A166-M169 PolarHBondContact O-N 3.07Å; A166-L170 WeakPolarHBondContact O-CB 3.21Å; A166-L170 WeakPolarHBondContact O-CD1 3.29Å; A166-L170 WeakPolarHBondContact O-CG 3.47Å; A166-L170 PolarHBondContact O-N 3.19Å; A166-I197 HydrophobicContact CB-CD1 4.02Å
167L93.7Very high89.7Confident5 Ų555.1 Ų55.13%0.02626%0.259CS..Hα-helixtrans-58.8-46.7176.9-179.459.1000111.8N165 M169 L170 M171 V194 L198 L209 D212 I213 L216N165-L167 PolarHBondContact O-N 3.31Å; N165-L167 VanDerWaalsContact O-N 3.16Å; L167-M169 VanDerWaalsContact C-N 3.33Å; L167-M169 PolarHBondContact O-N 3.4Å; L167-L170 PolarHBondContact O-N 3.36Å; L167-M171 HydrophobicContact CD1-CG 4.33Å; L167-M171 HydrophobicContact CD1-SD 4.13Å; L167-M171 HydrophobicContact CG-SD 3.9Å; L167-M171 VanDerWaalsContact O-CB 3.31Å; L167-M171 WeakPolarHBondContact O-CB 3.42Å; L167-M171 WeakPolarHBondContact O-CG 3.32Å; L167-M171 PolarHBondContact O-N 2.85Å; L167-V194 HydrophobicContact CD1-CG1 4.06Å; L167-V194 HydrophobicContact CD1-CG2 4.28Å; L167-L198 HydrophobicContact CD2-CD2 4.41Å; L167-L209 HydrophobicContact CD2-CB 4.48Å; L167-L209 HydrophobicContact CD2-CD1 4.28Å; L167-L209 HydrophobicContact CD2-CD2 4.42Å; L167-D212 HydrophobicContact CD2-CB 3.71Å; L167-D212 HydrophobicContact CG-CB 4.42Å; L167-I213 HydrophobicContact CD2-CG1 4.49Å; L167-L216 HydrophobicContact CD1-CD2 4.39Å
168Q93.1Very high88.6Confident95 Ų9556.4 Ų56.444%0.44427%0.268SS..Hα-helixtrans-65.7-38.4179.6-66.4178.62.800111.7N165 A166 M171 K172 D212N165-Q168 PolarHBondContact O-N 3.08Å; A166-Q168 PolarHBondContact O-N 3.05Å; Q168-M171 WeakPolarHBondContact O-CB 3.32Å; Q168-M171 PolarHBondContact O-N 2.78Å; Q168-K172 PolarHBondContact O-N 3.24Å; Q168-D212 PolarHBondContact NE2-OD1 3.09Å; Q168-D212 PolarHBondContact NE2-OD2 3.32Å
169M93.7Very high87.5Confident36 Ų3658.5 Ų58.518%0.17729%0.288CS..Hα-helixtrans-64.7-46.9175.3-172.3178.5-6400111.8M125 V128 D129 I132 N165 A166 L167 M171 K172 I173M125-M169 HydrophobicContact CE-CB 4.24Å; M125-M169 HydrophobicContact CE-CE 3.46Å; M125-M169 VanDerWaalsContact CE-CE 3.46Å; M125-M169 HydrophobicContact CE-CG 4.44Å; M125-M169 HydrophobicContact CE-SD 3.35Å; M125-M169 WeakPolarHBondContact CE-SD 3.02Å; M125-M169 HydrophobicContact SD-SD 4.03Å; V128-M169 HydrophobicContact CB-SD 3.99Å; V128-M169 HydrophobicContact CG1-CG 4Å; V128-M169 HydrophobicContact CG1-SD 3.57Å; V128-M169 VanDerWaalsContact CG1-SD 3.57Å; D129-M169 HydrophobicContact CB-CE 4.12Å; I132-M169 HydrophobicContact CD1-CG 3.94Å; N165-M169 PolarHBondContact O-N 3.37Å; A166-M169 PolarHBondContact O-N 3.07Å; L167-M169 VanDerWaalsContact C-N 3.33Å; L167-M169 PolarHBondContact O-N 3.4Å; M169-M171 VanDerWaalsContact C-N 3.29Å; M169-M171 PolarHBondContact O-N 3.43Å; M169-K172 VanDerWaalsContact O-CB 3.31Å; M169-K172 WeakPolarHBondContact O-CB 3.45Å; M169-K172 PolarHBondContact O-N 2.71Å; M169-K172 VanDerWaalsContact O-N 3.09Å; M169-I173 PolarHBondContact O-N 3.23Å; M169-I173 VanDerWaalsContact O-N 3.14Å
170L95Very high86.7Confident4 Ų461.4 Ų61.42%0.02130%0.3CS..Hα-helixtrans-62.9-38.2176.2-67.9165.1000111.4L144 A166 L167 K172 I173 V174 A190 V193 V194 I197L144-L170 HydrophobicContact CD2-CD2 3.66Å; A166-L170 WeakPolarHBondContact O-CB 3.21Å; A166-L170 WeakPolarHBondContact O-CD1 3.29Å; A166-L170 WeakPolarHBondContact O-CG 3.47Å; A166-L170 PolarHBondContact O-N 3.19Å; L167-L170 PolarHBondContact O-N 3.36Å; L170-K172 VanDerWaalsContact C-N 3.32Å; L170-K172 PolarHBondContact O-N 3.47Å; L170-I173 HydrophobicContact CD2-CD1 4.31Å; L170-I173 WeakPolarHBondContact O-CB 3.27Å; L170-I173 PolarHBondContact O-N 3.33Å; L170-V174 WeakPolarHBondContact O-CG2 3.35Å; L170-V174 PolarHBondContact O-N 3.05Å; L170-A190 HydrophobicContact CD2-CB 4.07Å; L170-V193 HydrophobicContact CD1-CB 3.97Å; L170-V193 HydrophobicContact CD1-CG1 3.67Å; L170-V193 HydrophobicContact CD2-CB 4.07Å; L170-V193 HydrophobicContact CD2-CG1 4.23Å; L170-V194 HydrophobicContact CB-CG2 3.69Å; L170-V194 HydrophobicContact CD1-CG2 3.79Å; L170-V194 HydrophobicContact CG-CG2 4.32Å; L170-I197 HydrophobicContact CD1-CD1 3.59Å
171M93.1Very high85.7Confident11 Ų1162.8 Ų62.85%0.05431%0.308CS..Hα-helixtrans-63.2-35.6172.8-77.7172.869.200112.5L167 Q168 M169 I173 V174 K175 D212 N215 L216 M219L167-M171 HydrophobicContact CD1-CG 4.33Å; L167-M171 HydrophobicContact CD1-SD 4.13Å; L167-M171 HydrophobicContact CG-SD 3.9Å; L167-M171 VanDerWaalsContact O-CB 3.31Å; L167-M171 WeakPolarHBondContact O-CB 3.42Å; L167-M171 WeakPolarHBondContact O-CG 3.32Å; L167-M171 PolarHBondContact O-N 2.85Å; Q168-M171 WeakPolarHBondContact O-CB 3.32Å; Q168-M171 PolarHBondContact O-N 2.78Å; M169-M171 VanDerWaalsContact C-N 3.29Å; M169-M171 PolarHBondContact O-N 3.43Å; M171-I173 VanDerWaalsContact C-N 3.35Å; M171-V174 PolarHBondContact O-N 2.96Å; M171-K175 WeakPolarHBondContact O-CG 3.48Å; M171-K175 PolarHBondContact O-N 3.34Å; M171-K175 VanDerWaalsContact O-N 3.07Å; M171-D212 WeakPolarHBondContact CE-O 3.14Å; M171-D212 HydrophobicContact SD-CB 4.48Å; M171-N215 HydrophobicContact CE-CB 3.58Å; M171-L216 HydrophobicContact CE-CB 4.25Å; M171-L216 HydrophobicContact CG-CD1 4.2Å; M171-L216 HydrophobicContact SD-CB 4.19Å; M171-M219 HydrophobicContact CB-CE 3.6Å; M171-M219 HydrophobicContact CB-SD 4.46Å; M171-M219 HydrophobicContact CE-CE 3.82Å; M171-M219 HydrophobicContact CG-CE 3.85Å; M171-M219 WeakPolarHBondContact O-CE 3.48Å
172K91.6Very high84.7Confident83 Ų8365.9 Ų65.936%0.36133%0.327SS..Hα-helixtrans-62.7-42.3173.2-173.2-177.5176.5-169.30111.2I132 E133 Q168 M169 L170 K175 M176I132-K172 HydrophobicContact CD1-CD 4.45Å; I132-K172 HydrophobicContact CG2-CD 4.01Å; I132-K172 HydrophobicContact CG2-CG 4.27Å; E133-K172 IonicContact OE1-NZ 2.8Å; E133-K172 PolarHBondContact OE1-NZ 3.34Å; Q168-K172 PolarHBondContact O-N 3.24Å; M169-K172 VanDerWaalsContact O-CB 3.31Å; M169-K172 WeakPolarHBondContact O-CB 3.45Å; M169-K172 PolarHBondContact O-N 2.71Å; M169-K172 VanDerWaalsContact O-N 3.09Å; L170-K172 VanDerWaalsContact C-N 3.32Å; L170-K172 PolarHBondContact O-N 3.47Å; K172-K175 PolarHBondContact O-N 2.85Å; K172-M176 PolarHBondContact O-N 2.79Å
173I91.7Very high84.3Confident1 Ų165.7 Ų65.71%0.00533%0.326CS..Hα-helixtrans-61-49.2176.2-62.7168.9000110.9V128 I132 L140 L144 M169 L170 M171 K175 M176 V186 A190V128-I173 HydrophobicContact CG1-CD1 3.73Å; I132-I173 HydrophobicContact CD1-CD1 4.03Å; I132-I173 HydrophobicContact CD1-CG1 3.49Å; I132-I173 VanDerWaalsContact CD1-CG1 3.49Å; I132-I173 HydrophobicContact CG1-CD1 4.34Å; I132-I173 HydrophobicContact CG1-CG1 3.68Å; L140-I173 HydrophobicContact CD1-CD1 4.17Å; L140-I173 HydrophobicContact CD2-CG2 4.41Å; L144-I173 HydrophobicContact CD1-CD1 4.4Å; L144-I173 HydrophobicContact CD1-CG2 4.39Å; L144-I173 HydrophobicContact CD2-CD1 3.89Å; M169-I173 PolarHBondContact O-N 3.23Å; M169-I173 VanDerWaalsContact O-N 3.14Å; L170-I173 HydrophobicContact CD2-CD1 4.31Å; L170-I173 WeakPolarHBondContact O-CB 3.27Å; L170-I173 PolarHBondContact O-N 3.33Å; M171-I173 VanDerWaalsContact C-N 3.35Å; I173-K175 PolarHBondContact O-N 3.09Å; I173-M176 VanDerWaalsContact O-CB 3.28Å; I173-M176 WeakPolarHBondContact O-CB 3.46Å; I173-M176 VanDerWaalsContact O-CG 3.31Å; I173-M176 WeakPolarHBondContact O-CG 3.12Å; I173-M176 PolarHBondContact O-N 3.33Å; I173-V186 HydrophobicContact CG2-CG1 3.4Å; I173-V186 VanDerWaalsContact CG2-CG1 3.4Å; I173-A190 HydrophobicContact CB-CB 4.37Å; I173-A190 HydrophobicContact CG2-CB 4.01Å
174V89.8Confident84.1Confident9 Ų957.6 Ų57.66%0.05529%0.291CS..Hα-helixtrans-67.2-24.2-178.1177.70000112.1L170 M171 A190 L191 M219 I223L170-V174 WeakPolarHBondContact O-CG2 3.35Å; L170-V174 PolarHBondContact O-N 3.05Å; M171-V174 PolarHBondContact O-N 2.96Å; V174-A190 HydrophobicContact CG2-CB 3.82Å; V174-L191 HydrophobicContact CG1-CD2 4.4Å; V174-L191 HydrophobicContact CG2-CD2 4.05Å; V174-L191 HydrophobicContact CG2-CG 4.13Å; V174-M219 HydrophobicContact CB-SD 3.54Å; V174-M219 VanDerWaalsContact CB-SD 3.54Å; V174-M219 HydrophobicContact CG1-CG 4.03Å; V174-M219 HydrophobicContact CG1-SD 3.4Å; V174-M219 WeakPolarHBondContact CG1-SD 3.41Å; V174-I223 HydrophobicContact CG1-CD1 3.34Å; V174-I223 HydrophobicContact CG1-CG1 4.31Å
175K83.9Confident84.1Confident143 Ų14358.5 Ų58.562%0.62229%0.292SS*.THydrogen-bonded Turntrans-77.8-14.2172.7-79178.9-179.7-176.70114.3M171 K172 I173 K177 M219M171-K175 WeakPolarHBondContact O-CG 3.48Å; M171-K175 PolarHBondContact O-N 3.34Å; M171-K175 VanDerWaalsContact O-N 3.07Å; K172-K175 PolarHBondContact O-N 2.85Å; I173-K175 PolarHBondContact O-N 3.09Å; K175-K177 PolarHBondContact O-N 3.4Å; K175-M219 HydrophobicContact CD-CE 3.83Å; K175-M219 HydrophobicContact CG-CE 3.47Å; K175-M219 VanDerWaalsContact CG-CE 3.47Å; K175-M219 HydrophobicContact CG-CG 4.3Å; K175-M219 HydrophobicContact CG-SD 3.91Å
176M79.1Confident84.2Confident47 Ų4754 Ų5423%0.23227%0.268CS..SBendtrans-56.9132.9179-65.5178.871.800108.6I132 E135 K172 I173 S178I132-M176 HydrophobicContact CG2-SD 4.22Å; E135-M176 HydrophobicContact CG-CE 4.38Å; K172-M176 PolarHBondContact O-N 2.79Å; I173-M176 VanDerWaalsContact O-CB 3.28Å; I173-M176 WeakPolarHBondContact O-CB 3.46Å; I173-M176 VanDerWaalsContact O-CG 3.31Å; I173-M176 WeakPolarHBondContact O-CG 3.12Å; I173-M176 PolarHBondContact O-N 3.33Å; M176-S178 PolarHBondContact O-N 3.13Å
177K65.5Low84.1Confident196 Ų19654.2 Ų54.285%0.85227%0.269SS*.  trans-59.9116-176.5-77.5-174.3175.4-179.10109.5K175 S179K175-K177 PolarHBondContact O-N 3.4Å; K177-S179 PolarHBondContact O-N 2.83Å
178S69.7Low84.1Confident27 Ų2754.3 Ų54.319%0.18927%0.271CS..  trans-67.799.8174.2-59.60000109.7M176M176-S178 PolarHBondContact O-N 3.13Å
179S69Low84.2Confident82 Ų8250.4 Ų50.457%0.57325%0.253SS*.  trans-106.3-19.9173.3650000112.1K177 D183K177-S179 PolarHBondContact O-N 2.83Å; S179-D183 PolarHBondContact N-OD2 3.07Å; S179-D183 PolarHBondContact OG-OD2 2.9Å
180K72.3Confident84.3Confident133 Ų13348.7 Ų48.758%0.57824%0.244SC*.SBendtrans-133.8155-175-63.1169.6-172.81680111.1T182 D183 L184K180-T182 PolarHBondContact O-N 3.47Å; K180-D183 PolarHBondContact N-OD2 3.44Å; K180-D183 VanDerWaalsContact O-CB 3.31Å; K180-D183 WeakPolarHBondContact O-CB 3.46Å; K180-D183 PolarHBondContact O-N 3.32Å; K180-L184 PolarHBondContact O-N 3.3Å
181I71.1Confident84.3Confident97 Ų9748.5 Ų48.550%0.49724%0.243SC..Hα-helixtrans-53.1-37.5172.2-63.8172.2000111.6D183 L184 N185 F232I181-D183 VanDerWaalsContact C-N 3.26Å; I181-D183 PolarHBondContact O-N 2.94Å; I181-L184 WeakPolarHBondContact O-CB 3.47Å; I181-L184 PolarHBondContact O-N 3.29Å; I181-L184 VanDerWaalsContact O-N 3.15Å; I181-N185 PolarHBondContact O-N 2.97Å; I181-N185 VanDerWaalsContact O-N 3.14Å; I181-F232 HydrophobicContact CD1-CD1 3.68Å; I181-F232 HydrophobicContact CD1-CE1 3.81Å; I181-F232 HydrophobicContact CG1-CD1 3.28Å; I181-F232 HydrophobicContact CG1-CE1 3.35Å; I181-F232 HydrophobicContact CG1-CG 3.96Å; I181-F232 HydrophobicContact CG1-CZ 4.06Å
182T72.7Confident84.5Confident65 Ų6550.6 Ų50.640%0.39925%0.252SS..Hα-helixtrans-59.7-36.6177.7-47.60000112.2N137 K180 L184 N185 V186N137-T182 HydrophobicContact CB-CG2 3.82Å; K180-T182 PolarHBondContact O-N 3.47Å; T182-L184 VanDerWaalsContact C-N 3.3Å; T182-L184 PolarHBondContact O-N 3.24Å; T182-N185 PolarHBondContact O-N 3.24Å; T182-V186 WeakPolarHBondContact O-CG2 3.31Å; T182-V186 PolarHBondContact O-N 3.41Å
183D81.6Confident84.7Confident17 Ų1746.6 Ų46.69%0.09124%0.235CC..Hα-helixtrans-66.5-35.4179.1-50.6-21.4000110.6N137 S179 K180 I181 V186 S187N137-D183 PolarHBondContact ND2-OD1 3.36Å; S179-D183 PolarHBondContact N-OD2 3.07Å; S179-D183 PolarHBondContact OG-OD2 2.9Å; K180-D183 PolarHBondContact N-OD2 3.44Å; K180-D183 VanDerWaalsContact O-CB 3.31Å; K180-D183 WeakPolarHBondContact O-CB 3.46Å; K180-D183 PolarHBondContact O-N 3.32Å; I181-D183 VanDerWaalsContact C-N 3.26Å; I181-D183 PolarHBondContact O-N 2.94Å; D183-V186 PolarHBondContact O-N 2.84Å; D183-S187 WeakPolarHBondContact O-CB 3.46Å; D183-S187 PolarHBondContact O-N 2.88Å; D183-S187 PolarHBondContact O-OG 3.42Å
184L86.3Confident84.9Confident4 Ų446.6 Ų46.62%0.02123%0.234CC..Hα-helixtrans-67.7-38.4174.3-59.9177.8000112.1K180 I181 T182 S187 A188 F232 L237K180-L184 PolarHBondContact O-N 3.3Å; I181-L184 WeakPolarHBondContact O-CB 3.47Å; I181-L184 PolarHBondContact O-N 3.29Å; I181-L184 VanDerWaalsContact O-N 3.15Å; T182-L184 VanDerWaalsContact C-N 3.3Å; T182-L184 PolarHBondContact O-N 3.24Å; L184-S187 PolarHBondContact O-N 3.27Å; L184-A188 WeakPolarHBondContact O-CB 3.37Å; L184-A188 PolarHBondContact O-N 3.37Å; L184-F232 HydrophobicContact CD1-CB 3.96Å; L184-F232 HydrophobicContact CD1-CD2 3.59Å; L184-F232 HydrophobicContact CD1-CE2 4.42Å; L184-F232 HydrophobicContact CD1-CG 4.01Å; L184-L237 HydrophobicContact CB-CD2 4.44Å; L184-L237 HydrophobicContact CD2-CD2 3.7Å
185N89.3Confident85.2Confident75 Ų7549.3 Ų49.340%0.40124%0.244SC..Hα-helixtrans-66.7-40.8176.2-74.1-28.4000111.8I181 T182 A188 E189I181-N185 PolarHBondContact O-N 2.97Å; I181-N185 VanDerWaalsContact O-N 3.14Å; T182-N185 PolarHBondContact O-N 3.24Å; N185-A188 PolarHBondContact O-N 3.28Å; N185-E189 WeakPolarHBondContact O-CB 3.45Å; N185-E189 PolarHBondContact O-N 3.44Å
186V92.3Very high85.7Confident3 Ų343.1 Ų43.12%0.01822%0.218CC..Hα-helixtrans-61.8-46.5173.8168.10000110.3N137 L140 L141 L144 I173 T182 D183 A188 E189 A190N137-V186 HydrophobicContact CB-CG2 4.08Å; L140-V186 HydrophobicContact CD2-CG1 3.7Å; L140-V186 HydrophobicContact CG-CG1 4.11Å; L141-V186 HydrophobicContact CB-CG2 4.25Å; L144-V186 HydrophobicContact CD1-CG1 3.84Å; I173-V186 HydrophobicContact CG2-CG1 3.4Å; I173-V186 VanDerWaalsContact CG2-CG1 3.4Å; T182-V186 WeakPolarHBondContact O-CG2 3.31Å; T182-V186 PolarHBondContact O-N 3.41Å; D183-V186 PolarHBondContact O-N 2.84Å; V186-A188 PolarHBondContact O-N 3.37Å; V186-E189 PolarHBondContact O-N 3.47Å; V186-A190 WeakPolarHBondContact O-CB 3.31Å; V186-A190 PolarHBondContact O-N 3.4Å
187S92.6Very high86.4Confident5 Ų541 Ų414%0.03521%0.207CC..Hα-helixtrans-60.9-43.5176.3-62.60000112.2D183 L184 E189 A190 L191D183-S187 WeakPolarHBondContact O-CB 3.46Å; D183-S187 PolarHBondContact O-N 2.88Å; D183-S187 PolarHBondContact O-OG 3.42Å; L184-S187 PolarHBondContact O-N 3.27Å; S187-E189 PolarHBondContact O-N 3.02Å; S187-A190 PolarHBondContact O-N 3.38Å; S187-L191 WeakPolarHBondContact O-CG 3.48Å; S187-L191 PolarHBondContact O-N 2.69Å
188A93.3Very high87.6Confident8 Ų832 Ų327%0.06617%0.169CC..Hα-helixtrans-62.7-43.2177.200000111.5L184 N185 V186 L191 K192 L237 Q240L184-A188 WeakPolarHBondContact O-CB 3.37Å; L184-A188 PolarHBondContact O-N 3.37Å; N185-A188 PolarHBondContact O-N 3.28Å; V186-A188 PolarHBondContact O-N 3.37Å; A188-L191 PolarHBondContact O-N 2.99Å; A188-K192 WeakPolarHBondContact O-CG 3.41Å; A188-K192 PolarHBondContact O-N 3.18Å; A188-K192 VanDerWaalsContact O-N 3.11Å; A188-L237 HydrophobicContact CB-CD1 3.92Å; A188-Q240 HydrophobicContact CB-CG 4.18Å
189E94.5Very high88.5Confident13 Ų1335.8 Ų35.86%0.06118%0.18CC..Hα-helixtrans-67.5-40.1177.7-158.165.5-151.900111.8L141 L144 K145 N185 V186 S187 L191 K192 V193L141-E189 HydrophobicContact CD1-CB 3.8Å; L141-E189 HydrophobicContact CD1-CG 4.14Å; L144-E189 HydrophobicContact CB-CB 4Å; L144-E189 HydrophobicContact CB-CG 3.61Å; L144-E189 HydrophobicContact CD1-CB 4.33Å; K145-E189 HydrophobicContact CG-CG 3.86Å; K145-E189 WeakPolarHBondContact CG-OE1 3.06Å; N185-E189 WeakPolarHBondContact O-CB 3.45Å; N185-E189 PolarHBondContact O-N 3.44Å; V186-E189 PolarHBondContact O-N 3.47Å; S187-E189 PolarHBondContact O-N 3.02Å; E189-L191 VanDerWaalsContact C-N 3.33Å; E189-L191 PolarHBondContact O-N 2.84Å; E189-K192 WeakPolarHBondContact O-CB 3.42Å; E189-K192 PolarHBondContact O-N 3.23Å; E189-K192 IonicContact OE1-NZ 3.52Å; E189-K192 IonicContact OE2-NZ 3.33Å; E189-K192 PolarHBondContact OE2-NZ 3.01Å; E189-V193 PolarHBondContact O-N 3.05Å
190A95.7Very high88.6Confident0 Ų036 Ų360%018%0.182CC..Hα-helixtrans-59.6-43.1173.400000111.6L144 L170 I173 V174 V186 S187 K192 V193 V194L144-A190 HydrophobicContact CD1-CB 4.11Å; L144-A190 HydrophobicContact CD2-CB 4.28Å; L170-A190 HydrophobicContact CD2-CB 4.07Å; I173-A190 HydrophobicContact CB-CB 4.37Å; I173-A190 HydrophobicContact CG2-CB 4.01Å; V174-A190 HydrophobicContact CG2-CB 3.82Å; V186-A190 WeakPolarHBondContact O-CB 3.31Å; V186-A190 PolarHBondContact O-N 3.4Å; S187-A190 PolarHBondContact O-N 3.38Å; A190-K192 VanDerWaalsContact C-N 3.31Å; A190-K192 PolarHBondContact O-N 2.75Å; A190-V193 WeakPolarHBondContact O-CB 3.43Å; A190-V193 PolarHBondContact O-N 3.3Å; A190-V193 VanDerWaalsContact O-N 3.14Å; A190-V194 WeakPolarHBondContact O-CG2 3.32Å; A190-V194 PolarHBondContact O-N 3.04Å
191L96.4Very high88.6Confident0 Ų030.9 Ų30.90%016%0.161CC..Hα-helixtrans-64.3-31.6176.3-71.8179.8000113.2V174 S187 A188 E189 V193 V194 Y195 L220 I223 L237 Q240 V241 V244V174-L191 HydrophobicContact CG1-CD2 4.4Å; V174-L191 HydrophobicContact CG2-CD2 4.05Å; V174-L191 HydrophobicContact CG2-CG 4.13Å; S187-L191 WeakPolarHBondContact O-CG 3.48Å; S187-L191 PolarHBondContact O-N 2.69Å; A188-L191 PolarHBondContact O-N 2.99Å; E189-L191 VanDerWaalsContact C-N 3.33Å; E189-L191 PolarHBondContact O-N 2.84Å; L191-V193 VanDerWaalsContact C-N 3.34Å; L191-V194 PolarHBondContact O-N 3.21Å; L191-Y195 WeakPolarHBondContact O-CB 3.39Å; L191-Y195 PolarHBondContact O-N 3.37Å; L191-L220 HydrophobicContact CD1-CD2 4.16Å; L191-L220 HydrophobicContact CD2-CD2 3.73Å; L191-I223 HydrophobicContact CD1-CD1 4.37Å; L191-L237 HydrophobicContact CD1-CD1 3.81Å; L191-Q240 HydrophobicContact CB-CB 3.86Å; L191-Q240 HydrophobicContact CD1-CB 4.22Å; L191-V241 HydrophobicContact CD1-CG2 3.79Å; L191-V244 HydrophobicContact CB-CG2 4.26Å; L191-V244 HydrophobicContact CD2-CG2 4.31Å; L191-V244 WeakPolarHBondContact O-CG2 3.42Å
192K96.3Very high88.3Confident54 Ų5434.9 Ų34.924%0.23517%0.17CC..Hα-helixtrans-64-40.7171.8-66.6174.2-169.31690111.9F148 A188 E189 A190 Y195 N196 Q240F148-K192 HydrophobicContact CD2-CB 3.54Å; F148-K192 HydrophobicContact CD2-CD 4.31Å; F148-K192 HydrophobicContact CD2-CG 4.47Å; F148-K192 HydrophobicContact CE2-CB 3.9Å; F148-K192 HydrophobicContact CE2-CD 4.34Å; F148-K192 HydrophobicContact CE2-CG 4.49Å; F148-K192 HydrophobicContact CG-CB 4.24Å; A188-K192 WeakPolarHBondContact O-CG 3.41Å; A188-K192 PolarHBondContact O-N 3.18Å; A188-K192 VanDerWaalsContact O-N 3.11Å; E189-K192 WeakPolarHBondContact O-CB 3.42Å; E189-K192 PolarHBondContact O-N 3.23Å; E189-K192 IonicContact OE1-NZ 3.52Å; E189-K192 IonicContact OE2-NZ 3.33Å; E189-K192 PolarHBondContact OE2-NZ 3.01Å; A190-K192 VanDerWaalsContact C-N 3.31Å; A190-K192 PolarHBondContact O-N 2.75Å; K192-Y195 WeakPolarHBondContact O-CB 3.47Å; K192-Y195 PolarHBondContact O-N 2.93Å; K192-N196 PolarHBondContact O-N 3.27Å; K192-Q240 HydrophobicContact CG-CG 4.09Å
193V96.4Very high88.1Confident0 Ų038 Ų380%018%0.184CC..Hα-helixtrans-66.1-43.5175.1-173.40000110.3L144 L147 F148 L170 E189 A190 L191 Y195 N196 I197L144-V193 WeakPolarHBondContact O-CG2 3.44Å; L147-V193 HydrophobicContact CB-CG1 3.98Å; L147-V193 HydrophobicContact CB-CG2 3.87Å; F148-V193 HydrophobicContact CB-CG2 3.99Å; L170-V193 HydrophobicContact CD1-CB 3.97Å; L170-V193 HydrophobicContact CD1-CG1 3.67Å; L170-V193 HydrophobicContact CD2-CB 4.07Å; L170-V193 HydrophobicContact CD2-CG1 4.23Å; E189-V193 PolarHBondContact O-N 3.05Å; A190-V193 WeakPolarHBondContact O-CB 3.43Å; A190-V193 PolarHBondContact O-N 3.3Å; A190-V193 VanDerWaalsContact O-N 3.14Å; L191-V193 VanDerWaalsContact C-N 3.34Å; V193-Y195 VanDerWaalsContact C-N 3.3Å; V193-Y195 PolarHBondContact O-N 3.26Å; V193-N196 PolarHBondContact O-N 3.43Å; V193-I197 HydrophobicContact CG1-CD1 3.78Å; V193-I197 HydrophobicContact CG1-CG1 4.24Å; V193-I197 WeakPolarHBondContact O-CB 3.49Å; V193-I197 WeakPolarHBondContact O-CG1 3.4Å; V193-I197 PolarHBondContact O-N 3.41Å
194V95.8Very high87.5Confident0 Ų041 Ų410%020%0.201CC..Hα-helixtrans-56.3-46.1174.1171.30000110.9L167 L170 A190 L191 N196 I197 L198 L216 V244L167-V194 HydrophobicContact CD1-CG1 4.06Å; L167-V194 HydrophobicContact CD1-CG2 4.28Å; L170-V194 HydrophobicContact CB-CG2 3.69Å; L170-V194 HydrophobicContact CD1-CG2 3.79Å; L170-V194 HydrophobicContact CG-CG2 4.32Å; A190-V194 WeakPolarHBondContact O-CG2 3.32Å; A190-V194 PolarHBondContact O-N 3.04Å; L191-V194 PolarHBondContact O-N 3.21Å; V194-N196 PolarHBondContact O-N 3.21Å; V194-I197 PolarHBondContact O-N 2.77Å; V194-L198 HydrophobicContact CG1-CD1 3.78Å; V194-L198 HydrophobicContact CG1-CG 4.41Å; V194-L198 WeakPolarHBondContact O-CB 3.41Å; V194-L198 WeakPolarHBondContact O-CG 3.36Å; V194-L198 PolarHBondContact O-N 2.86Å; V194-L216 HydrophobicContact CG1-CD1 4.39Å; V194-L216 HydrophobicContact CG1-CD2 3.62Å; V194-V244 HydrophobicContact CG1-CG1 4.13Å; V194-V244 HydrophobicContact CG1-CG2 4.31Å
195Y95.8Very high86.8Confident67 Ų6741.5 Ų41.526%0.26320%0.203SC..Hα-helixtrans-55.6-52.7175.3173.1-92.8000111L191 K192 V193 I197 L198 Y199 N243 I247L191-Y195 WeakPolarHBondContact O-CB 3.39Å; L191-Y195 PolarHBondContact O-N 3.37Å; K192-Y195 WeakPolarHBondContact O-CB 3.47Å; K192-Y195 PolarHBondContact O-N 2.93Å; V193-Y195 VanDerWaalsContact C-N 3.3Å; V193-Y195 PolarHBondContact O-N 3.26Å; Y195-I197 VanDerWaalsContact C-N 3.35Å; Y195-I197 PolarHBondContact O-N 3.49Å; Y195-L198 PolarHBondContact O-N 3.22Å; Y195-Y199 HydrophobicContact CE1-CD2 4.12Å; Y195-Y199 HydrophobicContact CE1-CG 4.48Å; Y195-Y199 AromaticContact CZ-CD2 3.8Å; Y195-Y199 WeakPolarHBondContact O-CB 3.4Å; Y195-Y199 PolarHBondContact O-N 2.61Å; Y195-Y199 WeakPolarHBondContact OH-CD2 2.96Å; Y195-N243 HydrophobicContact CD2-CB 3.99Å; Y195-N243 VanDerWaalsContact CD2-O 3.31Å; Y195-N243 WeakPolarHBondContact CD2-O 3.43Å; Y195-N243 HydrophobicContact CE2-CB 4.29Å; Y195-N243 WeakPolarHBondContact CE2-O 3.35Å; Y195-I247 HydrophobicContact CD2-CD1 3.8Å; Y195-I247 HydrophobicContact CD2-CG1 4.24Å; Y195-I247 HydrophobicContact CD2-CG2 4.04Å; Y195-I247 HydrophobicContact CE2-CD1 4.42Å; Y195-I247 HydrophobicContact CE2-CG2 3.6Å; Y195-I247 HydrophobicContact CG-CD1 4.35Å; Y195-I247 WeakPolarHBondContact O-CD1 3.47Å
196N94.7Very high85.9Confident13 Ų1339.4 Ų39.47%0.0719%0.193CC..Hα-helixtrans-63.3-38.6-178.7-73.1-8.7000113.1F148 T151 A152 R158 K192 V193 V194 Y199F148-N196 WeakPolarHBondContact CD2-ND2 3.37Å; F148-N196 WeakPolarHBondContact CE2-ND2 3.31Å; F148-N196 PolarHBondContact O-ND2 3.18Å; F148-N196 VanDerWaalsContact O-ND2 3.1Å; T151-N196 VanDerWaalsContact OG1-CB 3.31Å; T151-N196 WeakPolarHBondContact OG1-CB 3.36Å; T151-N196 PolarHBondContact OG1-ND2 3.05Å; A152-N196 PolarHBondContact N-ND2 3.33Å; R158-N196 VanDerWaalsContact CD-O 3.26Å; R158-N196 WeakPolarHBondContact CD-O 3.5Å; K192-N196 PolarHBondContact O-N 3.27Å; V193-N196 PolarHBondContact O-N 3.43Å; V194-N196 PolarHBondContact O-N 3.21Å; N196-Y199 PolarHBondContact O-N 2.85Å
197I92.3Very high85.3Confident1 Ų147.2 Ų47.21%0.00523%0.227CC..Hα-helixtrans-64.1-44.4178.8-74.9173.3000110.6T151 L161 I162 A166 L170 V193 V194 Y195 T201T151-I197 HydrophobicContact CG2-CG1 4.35Å; L161-I197 HydrophobicContact CB-CD1 3.98Å; L161-I197 HydrophobicContact CB-CG1 4.29Å; L161-I197 HydrophobicContact CD1-CD1 4.08Å; L161-I197 HydrophobicContact CD1-CG1 4.22Å; I162-I197 HydrophobicContact CD1-CG2 4.05Å; I162-I197 HydrophobicContact CG1-CG2 3.49Å; I162-I197 VanDerWaalsContact CG1-CG2 3.49Å; A166-I197 HydrophobicContact CB-CD1 4.02Å; L170-I197 HydrophobicContact CD1-CD1 3.59Å; V193-I197 HydrophobicContact CG1-CD1 3.78Å; V193-I197 HydrophobicContact CG1-CG1 4.24Å; V193-I197 WeakPolarHBondContact O-CB 3.49Å; V193-I197 WeakPolarHBondContact O-CG1 3.4Å; V193-I197 PolarHBondContact O-N 3.41Å; V194-I197 PolarHBondContact O-N 2.77Å; Y195-I197 VanDerWaalsContact C-N 3.35Å; Y195-I197 PolarHBondContact O-N 3.49Å; I197-T201 WeakPolarHBondContact O-CG2 3.33Å
198L91.6Very high84.8Confident9 Ų954.8 Ų54.85%0.04726%0.262CS..Hα-helixtrans-81.7-17.5-178.1-66.2-179.9000112.4L167 V194 Y195 S200 T201 L209 I213 L216 I247 I248L167-L198 HydrophobicContact CD2-CD2 4.41Å; V194-L198 HydrophobicContact CG1-CD1 3.78Å; V194-L198 HydrophobicContact CG1-CG 4.41Å; V194-L198 WeakPolarHBondContact O-CB 3.41Å; V194-L198 WeakPolarHBondContact O-CG 3.36Å; V194-L198 PolarHBondContact O-N 2.86Å; Y195-L198 PolarHBondContact O-N 3.22Å; L198-S200 PolarHBondContact O-N 2.92Å; L198-T201 PolarHBondContact O-N 3.09Å; L198-T201 PolarHBondContact O-OG1 3.04Å; L198-L209 HydrophobicContact CD2-CD1 4.32Å; L198-I213 HydrophobicContact CD2-CD1 4.37Å; L198-I213 HydrophobicContact CD2-CG1 4.39Å; L198-L216 HydrophobicContact CD1-CD2 3.84Å; L198-I247 HydrophobicContact CB-CD1 3.38Å; L198-I247 HydrophobicContact CB-CG1 4.43Å; L198-I247 HydrophobicContact CD1-CD1 4.37Å; L198-I247 HydrophobicContact CG-CD1 4.49Å; L198-I248 HydrophobicContact CD1-CD1 4.09Å
199Y87.8Confident84.5Confident105 Ų10555.4 Ų55.441%0.41226%0.264SS..THydrogen-bonded Turntrans-64.7121.2178-177.2-94.9000111.6Y195 N196 T201 I247Y195-Y199 HydrophobicContact CE1-CD2 4.12Å; Y195-Y199 HydrophobicContact CE1-CG 4.48Å; Y195-Y199 AromaticContact CZ-CD2 3.8Å; Y195-Y199 WeakPolarHBondContact O-CB 3.4Å; Y195-Y199 PolarHBondContact O-N 2.61Å; Y195-Y199 WeakPolarHBondContact OH-CD2 2.96Å; N196-Y199 PolarHBondContact O-N 2.85Å; Y199-T201 PolarHBondContact O-N 3.26Å; Y199-I247 HydrophobicContact CD2-CG2 4.42Å
200S72.3Confident84.2Confident88 Ų8856 Ų5662%0.61527%0.274SS*.THydrogen-bonded Turntrans60.726.3-176.5-52.10000114.3L198 R202L198-S200 PolarHBondContact O-N 2.92Å; S200-R202 PolarHBondContact O-N 2.81Å
201T71.1Confident84Confident24 Ų2460.9 Ų60.915%0.14730%0.3CS..  trans-61.2135.8165.245.70000109.5I162 I197 L198 Y199 V205 T206I162-T201 HydrophobicContact CD1-CG2 3.72Å; I197-T201 WeakPolarHBondContact O-CG2 3.33Å; L198-T201 PolarHBondContact O-N 3.09Å; L198-T201 PolarHBondContact O-OG1 3.04Å; Y199-T201 PolarHBondContact O-N 3.26Å; T201-V205 HydrophobicContact CG2-CG1 4.19Å; T201-T206 VanDerWaalsContact OG1-CG2 3.31Å; T201-T206 WeakPolarHBondContact OG1-CG2 3.29Å
202R65.7Low83.8Confident182 Ų18262.3 Ų62.369%0.68731%0.307SS*.  trans-67.9155.2176.6-68.7178-176.8-172.90.2109.8S200 D204 V205 T206S200-R202 PolarHBondContact O-N 2.81Å; R202-D204 WeakPolarHBondContact CB-OD1 3.4Å; R202-D204 PolarHBondContact O-N 3.23Å; R202-D204 VanDerWaalsContact O-N 3.11Å; R202-V205 PolarHBondContact O-N 3.3Å; R202-V205 VanDerWaalsContact O-N 3.1Å; R202-T206 PolarHBondContact O-N 2.97Å
203D68.6Low83.7Confident129 Ų12959.9 Ų59.969%0.6930%0.297SS*.Hα-helixtrans-61.2-19-178.1-70.3-29000114T206 K207D203-T206 WeakPolarHBondContact CA-OG1 3.38Å; D203-T206 PolarHBondContact O-OG1 3.42Å; D203-T206 VanDerWaalsContact O-OG1 3.1Å; D203-K207 WeakPolarHBondContact O-CD 3.31Å; D203-K207 WeakPolarHBondContact O-CG 3.19Å
204D68.6Low83.5Confident82 Ų8263.7 Ų63.744%0.43931%0.311SS..Hα-helixtrans-73.2-50171.954-10.6000111.5R202 T206 K207 E208R202-D204 WeakPolarHBondContact CB-OD1 3.4Å; R202-D204 PolarHBondContact O-N 3.23Å; R202-D204 VanDerWaalsContact O-N 3.11Å; D204-T206 VanDerWaalsContact C-N 3.3Å; D204-T206 PolarHBondContact O-N 2.85Å; D204-K207 WeakPolarHBondContact O-CB 3.41Å; D204-K207 PolarHBondContact O-N 3Å; D204-K207 VanDerWaalsContact O-N 3.08Å; D204-E208 PolarHBondContact O-N 2.99Å
205V70.9Confident83.4Confident13 Ų1367.1 Ų67.18%0.07933%0.33CS..Hα-helixtrans-63.2-37179.8178.90000111.6I162 T201 R202 K207 E208 L209I162-V205 HydrophobicContact CD1-CG1 4.07Å; I162-V205 HydrophobicContact CG2-CG1 3.97Å; T201-V205 HydrophobicContact CG2-CG1 4.19Å; R202-V205 PolarHBondContact O-N 3.3Å; R202-V205 VanDerWaalsContact O-N 3.1Å; V205-K207 VanDerWaalsContact C-N 3.25Å; V205-K207 PolarHBondContact O-N 3.22Å; V205-E208 PolarHBondContact O-N 3.27Å; V205-L209 HydrophobicContact CG1-CD1 3.86Å; V205-L209 HydrophobicContact CG1-CG 4.39Å; V205-L209 WeakPolarHBondContact O-CG 3.37Å; V205-L209 PolarHBondContact O-N 2.89Å
206T71.9Confident83.4Confident31 Ų3164 Ų6419%0.1932%0.317CS..Hα-helixtrans-66.2-27.2176.557.60000113T201 R202 D203 D204 G210T201-T206 VanDerWaalsContact OG1-CG2 3.31Å; T201-T206 WeakPolarHBondContact OG1-CG2 3.29Å; R202-T206 PolarHBondContact O-N 2.97Å; D203-T206 WeakPolarHBondContact CA-OG1 3.38Å; D203-T206 PolarHBondContact O-OG1 3.42Å; D203-T206 VanDerWaalsContact O-OG1 3.1Å; D204-T206 VanDerWaalsContact C-N 3.3Å; D204-T206 PolarHBondContact O-N 2.85Å; T206-G210 PolarHBondContact O-N 3.26Å
207K78.4Confident83.4Confident168 Ų16863.3 Ų63.373%0.7331%0.314SS*.Hα-helixtrans-75.1-42.8173.9-70.5171.4-173.4176.40111.6D203 D204 V205 L209 G210D203-K207 WeakPolarHBondContact O-CD 3.31Å; D203-K207 WeakPolarHBondContact O-CG 3.19Å; D204-K207 WeakPolarHBondContact O-CB 3.41Å; D204-K207 PolarHBondContact O-N 3Å; D204-K207 VanDerWaalsContact O-N 3.08Å; V205-K207 VanDerWaalsContact C-N 3.25Å; V205-K207 PolarHBondContact O-N 3.22Å; K207-L209 VanDerWaalsContact C-N 3.33Å; K207-L209 PolarHBondContact O-N 3.18Å; K207-G210 PolarHBondContact O-N 3.25Å; K207-G210 VanDerWaalsContact O-N 3.16Å
208E83Confident83.5Confident163 Ų16365.4 Ų65.476%0.76233%0.327SS*.Hα-helixtrans-61.9-41.8176.9-68.7-178171.500111.7D204 V205 G210D204-E208 PolarHBondContact O-N 2.99Å; V205-E208 PolarHBondContact O-N 3.27Å; E208-G210 PolarHBondContact O-N 3.27Å
209L86.4Confident83.6Confident21 Ų2165.5 Ų65.511%0.1133%0.327CS..THydrogen-bonded Turntrans-84.511.3177.2-62.2175.4000113.4I162 L167 L198 V205 K207 D211 D212 I213I162-L209 HydrophobicContact CG2-CD1 4.1Å; L167-L209 HydrophobicContact CD2-CB 4.48Å; L167-L209 HydrophobicContact CD2-CD1 4.28Å; L167-L209 HydrophobicContact CD2-CD2 4.42Å; L198-L209 HydrophobicContact CD2-CD1 4.32Å; V205-L209 HydrophobicContact CG1-CD1 3.86Å; V205-L209 HydrophobicContact CG1-CG 4.39Å; V205-L209 WeakPolarHBondContact O-CG 3.37Å; V205-L209 PolarHBondContact O-N 2.89Å; K207-L209 VanDerWaalsContact C-N 3.33Å; K207-L209 PolarHBondContact O-N 3.18Å; L209-D211 PolarHBondContact O-N 3.32Å; L209-D212 PolarHBondContact O-N 3.46Å; L209-D212 VanDerWaalsContact O-N 3.09Å; L209-I213 HydrophobicContact CB-CD1 3.95Å; L209-I213 HydrophobicContact CB-CG1 4.13Å; L209-I213 WeakPolarHBondContact O-CG1 3.22Å; L209-I213 PolarHBondContact O-N 2.83Å
210G88Confident83.9Confident26 Ų2660.5 Ų60.527%0.26831%0.307SS..Hα-helixtrans-56.1-43.9-168.900000114.1T206 K207 E208 R214T206-G210 PolarHBondContact O-N 3.26Å; K207-G210 PolarHBondContact O-N 3.25Å; K207-G210 VanDerWaalsContact O-N 3.16Å; E208-G210 PolarHBondContact O-N 3.27Å; G210-R214 WeakPolarHBondContact O-CB 3.32Å; G210-R214 PolarHBondContact O-N 3.48Å
211D91.5Very high84.9Confident103 Ų10358.1 Ų58.155%0.55129%0.285SS*.Hα-helixtrans-67.8-40.2177.6-81.5-39.1000112.5L209 R214 N215L209-D211 PolarHBondContact O-N 3.32Å; D211-R214 PolarHBondContact O-N 3.22Å; D211-R214 IonicContact OD1-CZ 3.63Å; D211-R214 IonicContact OD1-NE 3.4Å; D211-R214 IonicContact OD1-NH1 2.95Å; D211-R214 IonicContact OD1-NH2 2.62Å; D211-R214 PolarHBondContact OD1-NH2 3.28Å; D211-N215 WeakPolarHBondContact O-CB 3.47Å; D211-N215 PolarHBondContact O-N 2.89Å; D211-N215 PolarHBondContact O-ND2 2.99Å
212D92.9Very high85.8Confident29 Ų2960.2 Ų60.216%0.15530%0.299CS..Hα-helixtrans-66.9-41.6177.6-74.5-29.6000111.2L167 Q168 M171 L209 N215 L216L167-D212 HydrophobicContact CD2-CB 3.71Å; L167-D212 HydrophobicContact CG-CB 4.42Å; Q168-D212 PolarHBondContact NE2-OD1 3.09Å; Q168-D212 PolarHBondContact NE2-OD2 3.32Å; M171-D212 WeakPolarHBondContact CE-O 3.14Å; M171-D212 HydrophobicContact SD-CB 4.48Å; L209-D212 PolarHBondContact O-N 3.46Å; L209-D212 VanDerWaalsContact O-N 3.09Å; D212-N215 PolarHBondContact O-N 3.4Å; D212-L216 WeakPolarHBondContact O-CB 3.32Å; D212-L216 PolarHBondContact O-N 3.01Å
213I93.4Very high87.1Confident3 Ų352.5 Ų52.52%0.01527%0.272CS..Hα-helixtrans-64.8-41.3175.4-64.1168.5000110.5L167 L198 L209 N215 L216 V217 I248 L252L167-I213 HydrophobicContact CD2-CG1 4.49Å; L198-I213 HydrophobicContact CD2-CD1 4.37Å; L198-I213 HydrophobicContact CD2-CG1 4.39Å; L209-I213 HydrophobicContact CB-CD1 3.95Å; L209-I213 HydrophobicContact CB-CG1 4.13Å; L209-I213 WeakPolarHBondContact O-CG1 3.22Å; L209-I213 PolarHBondContact O-N 2.83Å; I213-N215 VanDerWaalsContact C-N 3.35Å; I213-N215 PolarHBondContact O-N 3.36Å; I213-L216 WeakPolarHBondContact O-CB 3.27Å; I213-L216 PolarHBondContact O-N 3.45Å; I213-V217 WeakPolarHBondContact O-CG2 3.44Å; I213-V217 PolarHBondContact O-N 3.4Å; I213-I248 HydrophobicContact CG2-CD1 3.69Å; I213-I248 HydrophobicContact CG2-CG1 4.48Å; I213-I248 HydrophobicContact CG2-CG2 4.15Å; I213-L252 HydrophobicContact CB-CD1 4.37Å; I213-L252 HydrophobicContact CG2-CD1 3.58Å
214R93.6Very high88.2Confident81 Ų8146.5 Ų46.531%0.30624%0.24SC..Hα-helixtrans-59.2-47.3173.6-178.9-173.365.4-172.1-14.3111.1G210 D211 L216 V217 V218 L252G210-R214 WeakPolarHBondContact O-CB 3.32Å; G210-R214 PolarHBondContact O-N 3.48Å; D211-R214 PolarHBondContact O-N 3.22Å; D211-R214 IonicContact OD1-CZ 3.63Å; D211-R214 IonicContact OD1-NE 3.4Å; D211-R214 IonicContact OD1-NH1 2.95Å; D211-R214 IonicContact OD1-NH2 2.62Å; D211-R214 PolarHBondContact OD1-NH2 3.28Å; R214-L216 VanDerWaalsContact C-N 3.28Å; R214-L216 PolarHBondContact O-N 2.99Å; R214-V217 PolarHBondContact O-N 3.48Å; R214-V218 PolarHBondContact O-N 2.98Å; R214-L252 HydrophobicContact CB-CD2 4.49Å
215N93.9Very high89.2Confident71 Ų7145.3 Ų45.338%0.3823%0.231SC..Hα-helixtrans-63.5-34.9178.1-72.7-24.8000112.1M171 D211 D212 I213 V218 M219M171-N215 HydrophobicContact CE-CB 3.58Å; D211-N215 WeakPolarHBondContact O-CB 3.47Å; D211-N215 PolarHBondContact O-N 2.89Å; D211-N215 PolarHBondContact O-ND2 2.99Å; D212-N215 PolarHBondContact O-N 3.4Å; I213-N215 VanDerWaalsContact C-N 3.35Å; I213-N215 PolarHBondContact O-N 3.36Å; N215-V218 PolarHBondContact O-N 3.44Å; N215-M219 PolarHBondContact O-N 2.94Å
216L94.9Very high90Very high1 Ų147 Ų471%0.00524%0.24CC..Hα-helixtrans-61.5-47.3172.6175.265.2000110.7L167 M171 V194 L198 D212 I213 R214 V218 M219 L220 V244 I248L167-L216 HydrophobicContact CD1-CD2 4.39Å; M171-L216 HydrophobicContact CE-CB 4.25Å; M171-L216 HydrophobicContact CG-CD1 4.2Å; M171-L216 HydrophobicContact SD-CB 4.19Å; V194-L216 HydrophobicContact CG1-CD1 4.39Å; V194-L216 HydrophobicContact CG1-CD2 3.62Å; L198-L216 HydrophobicContact CD1-CD2 3.84Å; D212-L216 WeakPolarHBondContact O-CB 3.32Å; D212-L216 PolarHBondContact O-N 3.01Å; I213-L216 WeakPolarHBondContact O-CB 3.27Å; I213-L216 PolarHBondContact O-N 3.45Å; R214-L216 VanDerWaalsContact C-N 3.28Å; R214-L216 PolarHBondContact O-N 2.99Å; L216-V218 VanDerWaalsContact C-N 3.29Å; L216-V218 PolarHBondContact O-N 2.94Å; L216-M219 WeakPolarHBondContact O-CA 3.26Å; L216-M219 VanDerWaalsContact O-CB 3.3Å; L216-M219 WeakPolarHBondContact O-CB 3.31Å; L216-M219 PolarHBondContact O-N 3.27Å; L216-L220 HydrophobicContact CD1-CD2 4.36Å; L216-L220 HydrophobicContact CD1-CG 4.33Å; L216-L220 HydrophobicContact CG-CD1 4.37Å; L216-L220 HydrophobicContact CG-CG 4.43Å; L216-L220 WeakPolarHBondContact O-CG 3.5Å; L216-L220 PolarHBondContact O-N 3.36Å; L216-V244 HydrophobicContact CD2-CG1 3.88Å; L216-V244 HydrophobicContact CG-CG1 4.5Å; L216-I248 HydrophobicContact CD2-CD1 4.38Å
217V95.2Very high90.5Very high0 Ų050 Ų500%026%0.26CS..Hα-helixtrans-59.9-40.7177.9179.90000111.9I213 R214 M219 L220 R221 I248 L252 H255 L256I213-V217 WeakPolarHBondContact O-CG2 3.44Å; I213-V217 PolarHBondContact O-N 3.4Å; R214-V217 PolarHBondContact O-N 3.48Å; V217-M219 VanDerWaalsContact C-N 3.29Å; V217-M219 PolarHBondContact O-N 3.29Å; V217-L220 PolarHBondContact O-N 3.31Å; V217-R221 PolarHBondContact O-N 3.46Å; V217-I248 HydrophobicContact CG2-CG1 4.23Å; V217-I248 HydrophobicContact CG2-CG2 3.69Å; V217-L252 HydrophobicContact CG2-CB 4.22Å; V217-H255 HydrophobicContact CB-CB 4.26Å; V217-H255 HydrophobicContact CG1-CB 3.81Å; V217-L256 HydrophobicContact CG1-CD2 3.9Å; V217-L256 HydrophobicContact CG1-CG 4Å
218V93.6Very high90.5Very high45 Ų4545 Ų4527%0.27324%0.24SC..Hα-helixtrans-61.3-39.4174.71710000111.4R214 N215 L216 R221 C222 H255R214-V218 PolarHBondContact O-N 2.98Å; N215-V218 PolarHBondContact O-N 3.44Å; L216-V218 VanDerWaalsContact C-N 3.29Å; L216-V218 PolarHBondContact O-N 2.94Å; V218-R221 WeakPolarHBondContact O-CB 3.42Å; V218-R221 PolarHBondContact O-N 3.22Å; V218-C222 PolarHBondContact O-N 2.92Å; V218-C222 VanDerWaalsContact O-N 3.12Å; V218-C222 PolarHBondContact O-SG 3.12Å; V218-H255 HydrophobicContact CG2-CB 4.13Å
219M92.9Very high90.3Very high11 Ų1137.9 Ų37.95%0.05421%0.207CC..Hα-helixtrans-66.8-43.6175.7-173-174.8-5200112.3M171 V174 K175 N215 L216 V217 R221 C222 I223M171-M219 HydrophobicContact CB-CE 3.6Å; M171-M219 HydrophobicContact CB-SD 4.46Å; M171-M219 HydrophobicContact CE-CE 3.82Å; M171-M219 HydrophobicContact CG-CE 3.85Å; M171-M219 WeakPolarHBondContact O-CE 3.48Å; V174-M219 HydrophobicContact CB-SD 3.54Å; V174-M219 VanDerWaalsContact CB-SD 3.54Å; V174-M219 HydrophobicContact CG1-CG 4.03Å; V174-M219 HydrophobicContact CG1-SD 3.4Å; V174-M219 WeakPolarHBondContact CG1-SD 3.41Å; K175-M219 HydrophobicContact CD-CE 3.83Å; K175-M219 HydrophobicContact CG-CE 3.47Å; K175-M219 VanDerWaalsContact CG-CE 3.47Å; K175-M219 HydrophobicContact CG-CG 4.3Å; K175-M219 HydrophobicContact CG-SD 3.91Å; N215-M219 PolarHBondContact O-N 2.94Å; L216-M219 WeakPolarHBondContact O-CA 3.26Å; L216-M219 VanDerWaalsContact O-CB 3.3Å; L216-M219 WeakPolarHBondContact O-CB 3.31Å; L216-M219 PolarHBondContact O-N 3.27Å; V217-M219 VanDerWaalsContact C-N 3.29Å; V217-M219 PolarHBondContact O-N 3.29Å; M219-R221 VanDerWaalsContact C-N 3.25Å; M219-R221 PolarHBondContact O-N 2.78Å; M219-C222 WeakPolarHBondContact O-CB 3.08Å; M219-C222 PolarHBondContact O-N 2.98Å; M219-I223 WeakPolarHBondContact O-CG1 3.41Å; M219-I223 PolarHBondContact O-N 2.95Å
220L94.9Very high89.8Confident0 Ų041.1 Ų41.10%023%0.232CC..Hα-helixtrans-59.8-38.4175.3-62.9178.8000111.1L191 L216 V217 I223 L224 V241 V244 L245L191-L220 HydrophobicContact CD1-CD2 4.16Å; L191-L220 HydrophobicContact CD2-CD2 3.73Å; L216-L220 HydrophobicContact CD1-CD2 4.36Å; L216-L220 HydrophobicContact CD1-CG 4.33Å; L216-L220 HydrophobicContact CG-CD1 4.37Å; L216-L220 HydrophobicContact CG-CG 4.43Å; L216-L220 WeakPolarHBondContact O-CG 3.5Å; L216-L220 PolarHBondContact O-N 3.36Å; V217-L220 PolarHBondContact O-N 3.31Å; L220-I223 HydrophobicContact CD2-CD1 4.2Å; L220-I223 PolarHBondContact O-N 3.32Å; L220-L224 VanDerWaalsContact O-CG 3.28Å; L220-L224 WeakPolarHBondContact O-CG 3.44Å; L220-L224 PolarHBondContact O-N 3.41Å; L220-V241 HydrophobicContact CB-CG1 4.01Å; L220-V241 HydrophobicContact CD1-CG1 4.44Å; L220-V241 HydrophobicContact CD2-CB 4.41Å; L220-V241 HydrophobicContact CD2-CG1 4.12Å; L220-V241 HydrophobicContact CD2-CG2 4.05Å; L220-V241 HydrophobicContact CG-CG1 4.39Å; L220-V244 HydrophobicContact CD1-CB 4.25Å; L220-V244 HydrophobicContact CD1-CG1 3.79Å; L220-L245 HydrophobicContact CD1-CD2 3.78Å; L220-L245 HydrophobicContact CD1-CG 4.01Å
221R93.5Very high88.9Confident38 Ų3845.8 Ų45.814%0.14325%0.247CC..Hα-helixtrans-57.7-49.5170.9-177.1-173.166.9-151.7-1.8111.2V217 V218 M219 I223 L224 Q225 H255 L256 L257 D258V217-R221 PolarHBondContact O-N 3.46Å; V218-R221 WeakPolarHBondContact O-CB 3.42Å; V218-R221 PolarHBondContact O-N 3.22Å; M219-R221 VanDerWaalsContact C-N 3.25Å; M219-R221 PolarHBondContact O-N 2.78Å; R221-I223 VanDerWaalsContact C-N 3.31Å; R221-I223 PolarHBondContact O-N 2.94Å; R221-L224 PolarHBondContact O-N 3.46Å; R221-L224 VanDerWaalsContact O-N 3.15Å; R221-Q225 HydrophobicContact CG-CG 4.43Å; R221-Q225 VanDerWaalsContact O-CG 3.3Å; R221-Q225 WeakPolarHBondContact O-CG 3.49Å; R221-Q225 PolarHBondContact O-N 3.06Å; R221-H255 WeakPolarHBondContact CD-O 3.3Å; R221-H255 PolarHBondContact NH1-O 3.44Å; R221-L256 HydrophobicContact CB-CD2 4.31Å; R221-L256 VanDerWaalsContact CD-C 3.48Å; R221-L256 WeakPolarHBondContact CD-O 3.4Å; R221-L256 VanDerWaalsContact CG-O 3.31Å; R221-L256 WeakPolarHBondContact CG-O 3.36Å; R221-L257 PolarHBondContact NH1-O 3.49Å; R221-D258 IonicContact NE-OD1 2.72Å
222C90.9Very high87.6Confident67 Ų6744 Ų4445%0.45323%0.234SC..Hα-helixtrans-58.9-40.3178.1-69.50000112.7V218 M219 Q225 D226V218-C222 PolarHBondContact O-N 2.92Å; V218-C222 VanDerWaalsContact O-N 3.12Å; V218-C222 PolarHBondContact O-SG 3.12Å; M219-C222 WeakPolarHBondContact O-CB 3.08Å; M219-C222 PolarHBondContact O-N 2.98Å; C222-Q225 CarbonylContact O-C 3.51Å; C222-Q225 PolarHBondContact O-N 3.44Å; C222-D226 PolarHBondContact O-N 3.23Å; C222-D226 VanDerWaalsContact O-N 3.1Å
223I91.1Very high86.5Confident21 Ų2147.7 Ų47.711%0.10825%0.254CS..Hα-helixtrans-61.7-45.3174.9-63.5167.1000111V174 L191 M219 L220 R221 Q225 D226 L237 V241V174-I223 HydrophobicContact CG1-CD1 3.34Å; V174-I223 HydrophobicContact CG1-CG1 4.31Å; L191-I223 HydrophobicContact CD1-CD1 4.37Å; M219-I223 WeakPolarHBondContact O-CG1 3.41Å; M219-I223 PolarHBondContact O-N 2.95Å; L220-I223 HydrophobicContact CD2-CD1 4.2Å; L220-I223 PolarHBondContact O-N 3.32Å; R221-I223 VanDerWaalsContact C-N 3.31Å; R221-I223 PolarHBondContact O-N 2.94Å; I223-Q225 PolarHBondContact O-N 3.03Å; I223-D226 WeakPolarHBondContact O-CB 3.44Å; I223-D226 PolarHBondContact O-N 3.46Å; I223-L237 HydrophobicContact CG2-CD2 3.75Å; I223-L237 HydrophobicContact CG2-CG 4.09Å; I223-V241 HydrophobicContact CD1-CG2 4.49Å; I223-V241 HydrophobicContact CG2-CG2 4.12Å
224L92.1Very high85.9Confident2 Ų248.4 Ų48.41%0.0126%0.259CS..Hα-helixtrans-67.3-20.7179.9-68169.7000113.1L220 R221 V238 V241 T287 L288L220-L224 VanDerWaalsContact O-CG 3.28Å; L220-L224 WeakPolarHBondContact O-CG 3.44Å; L220-L224 PolarHBondContact O-N 3.41Å; R221-L224 PolarHBondContact O-N 3.46Å; R221-L224 VanDerWaalsContact O-N 3.15Å; L224-V238 HydrophobicContact CD2-CG1 4.13Å; L224-V241 HydrophobicContact CD1-CG1 3.97Å; L224-V241 HydrophobicContact CD2-CG1 4.06Å; L224-V241 HydrophobicContact CG-CG1 4.03Å; L224-T287 HydrophobicContact CB-CG2 4.48Å; L224-T287 HydrophobicContact CD2-CG2 4.04Å; L224-T287 PolarHBondContact O-OG1 3.29Å; L224-L288 HydrophobicContact CD1-CD1 4.12Å; L224-L288 HydrophobicContact CD1-CD2 4.13Å; L224-L288 HydrophobicContact CD1-CG 4Å; L224-L288 HydrophobicContact CD2-CD2 3.98Å; L224-L288 HydrophobicContact CD2-CG 4.37Å
225Q89.9Confident85.5Confident57 Ų5749 Ų4927%0.26626%0.262SS..THydrogen-bonded Turntrans-96-4.8177.6-69173.4-31.200113.1R221 C222 I223 P227 D258 S283R221-Q225 HydrophobicContact CG-CG 4.43Å; R221-Q225 VanDerWaalsContact O-CG 3.3Å; R221-Q225 WeakPolarHBondContact O-CG 3.49Å; R221-Q225 PolarHBondContact O-N 3.06Å; C222-Q225 CarbonylContact O-C 3.51Å; C222-Q225 PolarHBondContact O-N 3.44Å; I223-Q225 PolarHBondContact O-N 3.03Å; Q225-P227 WeakPolarHBondContact O-CD 3.43Å; Q225-D258 PolarHBondContact NE2-OD1 3.04Å; Q225-S283 WeakPolarHBondContact CG-OG 3.37Å; Q225-S283 PolarHBondContact NE2-OG 2.84Å
226D87.4Confident85.3Confident50 Ų5048.5 Ų48.527%0.26727%0.268SS..  trans-70.2120.1-176.9-171-16.5000110.6C222 I223 M228 L229C222-D226 PolarHBondContact O-N 3.23Å; C222-D226 VanDerWaalsContact O-N 3.1Å; I223-D226 WeakPolarHBondContact O-CB 3.44Å; I223-D226 PolarHBondContact O-N 3.46Å; D226-M228 PolarHBondContact O-N 3.22Å; D226-M228 WeakPolarHBondContact OD1-CB 3.39Å; D226-M228 WeakPolarHBondContact OD1-CG 3.3Å; D226-M228 PolarHBondContact OD1-N 2.64Å; D226-L229 WeakPolarHBondContact O-CB 3.33Å; D226-L229 PolarHBondContact O-N 3.4Å
227P82.2Confident85.2Confident94 Ų9448.6 Ų48.661%0.6127%0.268SS*.Hα-helixtrans-55.8-32.2175.8-24.935000113.6Q225 L229 S230Q225-P227 WeakPolarHBondContact O-CD 3.43Å; P227-L229 PolarHBondContact O-N 3.27Å; P227-S230 PolarHBondContact O-N 3Å; P227-S230 VanDerWaalsContact O-N 3.12Å; P227-S230 PolarHBondContact O-OG 3.4Å
228M78.4Confident85.1Confident61 Ų6148.9 Ų48.930%0.327%0.27SS..Hα-helixtrans-62.3-26.5179-62.4-70.998.500112.2D226 S230 E231 F232D226-M228 PolarHBondContact O-N 3.22Å; D226-M228 WeakPolarHBondContact OD1-CB 3.39Å; D226-M228 WeakPolarHBondContact OD1-CG 3.3Å; D226-M228 PolarHBondContact OD1-N 2.64Å; M228-S230 PolarHBondContact O-N 3.3Å; M228-E231 WeakPolarHBondContact CE-OE2 3.19Å; M228-E231 PolarHBondContact O-N 3.03Å; M228-F232 HydrophobicContact CB-CD2 4.37Å; M228-F232 HydrophobicContact CB-CE2 4.27Å; M228-F232 WeakPolarHBondContact O-CD2 3.47Å; M228-F232 PolarHBondContact O-N 3.13Å; M228-F232 HydrophobicContact SD-CE2 4.42Å
229L80.7Confident85.2Confident15 Ų1548.7 Ų48.78%0.07927%0.271CS..Hα-helixtrans-60.5-37.5177.2-174.863.2000111.8D226 P227 N233 S234 L237 V238 T287D226-L229 WeakPolarHBondContact O-CB 3.33Å; D226-L229 PolarHBondContact O-N 3.4Å; P227-L229 PolarHBondContact O-N 3.27Å; L229-N233 PolarHBondContact O-N 2.79Å; L229-S234 PolarHBondContact O-N 3.01Å; L229-L237 HydrophobicContact CD1-CD2 4.4Å; L229-V238 HydrophobicContact CD1-CG2 3.88Å; L229-V238 HydrophobicContact CD2-CG2 3.72Å; L229-V238 HydrophobicContact CG-CG2 4.17Å; L229-T287 HydrophobicContact CD2-CG2 3.99Å
230S74.5Confident85.3Confident89 Ų8949.7 Ų49.762%0.62228%0.275SS*.Hα-helixtrans-73.6-35.7178.371.40000112.7P227 M228P227-S230 PolarHBondContact O-N 3Å; P227-S230 VanDerWaalsContact O-N 3.12Å; P227-S230 PolarHBondContact O-OG 3.4Å; M228-S230 PolarHBondContact O-N 3.3Å
231E68.9Low85.4Confident124 Ų12449.7 Ų49.758%0.57928%0.275SS*.Hα-helixtrans-64.9-43.6178.9-175.6175.8176.100111.7M228M228-E231 WeakPolarHBondContact CE-OE2 3.19Å; M228-E231 PolarHBondContact O-N 3.03Å
232F64.5Low85.6Confident64 Ų6448 Ų4828%0.28127%0.269SS..Hα-helixtrans-89-6.1-177.7-62.6-61.8000114.4I181 L184 M228 S234I181-F232 HydrophobicContact CD1-CD1 3.68Å; I181-F232 HydrophobicContact CD1-CE1 3.81Å; I181-F232 HydrophobicContact CG1-CD1 3.28Å; I181-F232 HydrophobicContact CG1-CE1 3.35Å; I181-F232 HydrophobicContact CG1-CG 3.96Å; I181-F232 HydrophobicContact CG1-CZ 4.06Å; L184-F232 HydrophobicContact CD1-CB 3.96Å; L184-F232 HydrophobicContact CD1-CD2 3.59Å; L184-F232 HydrophobicContact CD1-CE2 4.42Å; L184-F232 HydrophobicContact CD1-CG 4.01Å; M228-F232 HydrophobicContact CB-CD2 4.37Å; M228-F232 HydrophobicContact CB-CE2 4.27Å; M228-F232 WeakPolarHBondContact O-CD2 3.47Å; M228-F232 PolarHBondContact O-N 3.13Å; M228-F232 HydrophobicContact SD-CE2 4.42Å; F232-S234 PolarHBondContact O-N 3.03Å
233N69.2Low85.8Confident108 Ų10846.7 Ų46.758%0.57826%0.257SS*.THydrogen-bonded Turntrans47.545.3-171.4-70.3-62.2000112.5L229 Y235L229-N233 PolarHBondContact O-N 2.79Å; N233-Y235 PolarHBondContact O-N 3.43Å
234S81.6Confident86.1Confident18 Ų1845.7 Ų45.713%0.12625%0.252CS..  trans-79.966-171.3-1680000112.9L229 F232 A236 L237 V238L229-S234 PolarHBondContact O-N 3.01Å; F232-S234 PolarHBondContact O-N 3.03Å; S234-A236 PolarHBondContact O-N 3.4Å; S234-L237 PolarHBondContact O-N 3.44Å; S234-V238 PolarHBondContact O-N 3.12Å
235Y85.8Confident86.3Confident94 Ų9445.6 Ų45.637%0.36925%0.252SS..Hα-helixtrans-57.7-27174-71.4-46.2000113.2N233 S239 F291 S294N233-Y235 PolarHBondContact O-N 3.43Å; Y235-S239 VanDerWaalsContact O-CB 3.28Å; Y235-S239 WeakPolarHBondContact O-CB 3.43Å; Y235-S239 PolarHBondContact O-N 3.06Å; Y235-F291 AromaticContact CD1-CD2 3.4Å; Y235-F291 HydrophobicContact CD1-CD2 3.4Å; Y235-F291 VanDerWaalsContact CD1-CD2 3.4Å; Y235-F291 AromaticContact CD1-CE2 3.66Å; Y235-F291 HydrophobicContact CD1-CE2 3.66Å; Y235-F291 AromaticContact CE1-CD2 3.92Å; Y235-F291 HydrophobicContact CE1-CD2 3.92Å; Y235-F291 HydrophobicContact CG-CD2 4.31Å; Y235-F291 HydrophobicContact CG-CE2 4.13Å; Y235-S294 WeakPolarHBondContact OH-CB 3.15Å; Y235-S294 PolarHBondContact OH-OG 3.27Å
236A88.8Confident86.6Confident60 Ų6044.1 Ų44.150%0.49625%0.245SC..Hα-helixtrans-62.4-42.6174.400000111.7S234 S239 Q240S234-A236 PolarHBondContact O-N 3.4Å; A236-S239 WeakPolarHBondContact O-CB 3.3Å; A236-Q240 WeakPolarHBondContact O-CG 3.46Å; A236-Q240 PolarHBondContact O-N 3.04Å
237L92.5Very high86.9Confident3 Ų343.9 Ų43.92%0.01624%0.244CC..Hα-helixtrans-69.4-45.7177.6-178.859.9000111.2L184 A188 L191 I223 L229 S234 S239 Q240 V241L184-L237 HydrophobicContact CB-CD2 4.44Å; L184-L237 HydrophobicContact CD2-CD2 3.7Å; A188-L237 HydrophobicContact CB-CD1 3.92Å; L191-L237 HydrophobicContact CD1-CD1 3.81Å; I223-L237 HydrophobicContact CG2-CD2 3.75Å; I223-L237 HydrophobicContact CG2-CG 4.09Å; L229-L237 HydrophobicContact CD1-CD2 4.4Å; S234-L237 PolarHBondContact O-N 3.44Å; L237-S239 VanDerWaalsContact C-N 3.26Å; L237-S239 PolarHBondContact O-N 3.38Å; L237-Q240 PolarHBondContact O-N 2.86Å; L237-V241 WeakPolarHBondContact O-CG2 3.41Å; L237-V241 PolarHBondContact O-N 3.46Å
238V94.4Very high87.4Confident6 Ų639.5 Ų39.54%0.03622%0.215CC..Hα-helixtrans-58.5-40.3176.4-1750000111.3L224 L229 S234 Q240 V241 V242 L288 F291L224-V238 HydrophobicContact CD2-CG1 4.13Å; L229-V238 HydrophobicContact CD1-CG2 3.88Å; L229-V238 HydrophobicContact CD2-CG2 3.72Å; L229-V238 HydrophobicContact CG-CG2 4.17Å; S234-V238 PolarHBondContact O-N 3.12Å; V238-Q240 VanDerWaalsContact C-N 3.32Å; V238-Q240 PolarHBondContact O-N 2.94Å; V238-V241 WeakPolarHBondContact O-CB 3.28Å; V238-V241 PolarHBondContact O-N 3.17Å; V238-V242 HydrophobicContact CG1-CG2 4.43Å; V238-V242 WeakPolarHBondContact O-CG2 3.47Å; V238-V242 PolarHBondContact O-N 3.37Å; V238-L288 HydrophobicContact CG1-CD2 4.4Å; V238-F291 HydrophobicContact CB-CD2 4.16Å; V238-F291 HydrophobicContact CB-CE2 4.28Å; V238-F291 HydrophobicContact CB-CG 4.35Å; V238-F291 HydrophobicContact CG1-CB 3.93Å; V238-F291 HydrophobicContact CG1-CD1 3.81Å; V238-F291 HydrophobicContact CG1-CD2 3.91Å; V238-F291 HydrophobicContact CG1-CE1 4.27Å; V238-F291 HydrophobicContact CG1-CE2 4.34Å; V238-F291 HydrophobicContact CG1-CG 3.6Å
239S94.8Very high88Confident41 Ų4138.5 Ų38.529%0.28721%0.213SC..Hα-helixtrans-57.8-43.1174.3-178.60000112.1Y235 A236 L237 V242 N243Y235-S239 VanDerWaalsContact O-CB 3.28Å; Y235-S239 WeakPolarHBondContact O-CB 3.43Å; Y235-S239 PolarHBondContact O-N 3.06Å; A236-S239 WeakPolarHBondContact O-CB 3.3Å; L237-S239 VanDerWaalsContact C-N 3.26Å; L237-S239 PolarHBondContact O-N 3.38Å; S239-V242 PolarHBondContact O-N 3.03Å; S239-N243 VanDerWaalsContact O-CG 3.25Å; S239-N243 PolarHBondContact O-N 3.28Å; S239-N243 PolarHBondContact O-ND2 3.15Å
240Q95.5Very high88.5Confident32 Ų3243 Ų4315%0.1523%0.232CC..Hα-helixtrans-68.4-37.4175.7-55.8-41.3-42.900112.7A188 L191 K192 A236 L237 V238 V242 N243 V244A188-Q240 HydrophobicContact CB-CG 4.18Å; L191-Q240 HydrophobicContact CB-CB 3.86Å; L191-Q240 HydrophobicContact CD1-CB 4.22Å; K192-Q240 HydrophobicContact CG-CG 4.09Å; A236-Q240 WeakPolarHBondContact O-CG 3.46Å; A236-Q240 PolarHBondContact O-N 3.04Å; L237-Q240 PolarHBondContact O-N 2.86Å; V238-Q240 VanDerWaalsContact C-N 3.32Å; V238-Q240 PolarHBondContact O-N 2.94Å; Q240-V242 VanDerWaalsContact C-N 3.32Å; Q240-V242 PolarHBondContact O-N 3.34Å; Q240-N243 PolarHBondContact O-N 2.83Å; Q240-N243 PolarHBondContact OE1-ND2 3.49Å; Q240-V244 WeakPolarHBondContact O-CG2 3.33Å; Q240-V244 PolarHBondContact O-N 3.11Å
241V96.5Very high89.2Confident0 Ų044.4 Ų44.40%023%0.229CC..Hα-helixtrans-58-46.5172.5172.90000110.6L191 L220 I223 L224 L237 V238 N243 V244 L245L191-V241 HydrophobicContact CD1-CG2 3.79Å; L220-V241 HydrophobicContact CB-CG1 4.01Å; L220-V241 HydrophobicContact CD1-CG1 4.44Å; L220-V241 HydrophobicContact CD2-CB 4.41Å; L220-V241 HydrophobicContact CD2-CG1 4.12Å; L220-V241 HydrophobicContact CD2-CG2 4.05Å; L220-V241 HydrophobicContact CG-CG1 4.39Å; I223-V241 HydrophobicContact CD1-CG2 4.49Å; I223-V241 HydrophobicContact CG2-CG2 4.12Å; L224-V241 HydrophobicContact CD1-CG1 3.97Å; L224-V241 HydrophobicContact CD2-CG1 4.06Å; L224-V241 HydrophobicContact CG-CG1 4.03Å; L237-V241 WeakPolarHBondContact O-CG2 3.41Å; L237-V241 PolarHBondContact O-N 3.46Å; V238-V241 WeakPolarHBondContact O-CB 3.28Å; V238-V241 PolarHBondContact O-N 3.17Å; V241-N243 PolarHBondContact O-N 2.87Å; V241-V244 PolarHBondContact O-N 2.97Å; V241-L245 HydrophobicContact CG1-CD1 3.98Å; V241-L245 HydrophobicContact CG1-CG 4.36Å; V241-L245 WeakPolarHBondContact O-CG 3.46Å; V241-L245 PolarHBondContact O-N 3.2Å
242V97.7Very high90.4Very high2 Ų239.2 Ų39.21%0.01221%0.205CC..Hα-helixtrans-60.4-44.4177.2168.90000111.7V238 S239 Q240 V244 L245 N246 L288 F291 P318 I319 C322V238-V242 HydrophobicContact CG1-CG2 4.43Å; V238-V242 WeakPolarHBondContact O-CG2 3.47Å; V238-V242 PolarHBondContact O-N 3.37Å; S239-V242 PolarHBondContact O-N 3.03Å; Q240-V242 VanDerWaalsContact C-N 3.32Å; Q240-V242 PolarHBondContact O-N 3.34Å; V242-V244 PolarHBondContact O-N 2.98Å; V242-L245 PolarHBondContact O-N 3.4Å; V242-N246 PolarHBondContact O-N 3.01Å; V242-N246 PolarHBondContact O-ND2 3.41Å; V242-N246 VanDerWaalsContact O-ND2 3.13Å; V242-L288 HydrophobicContact CG2-CD2 3.7Å; V242-F291 HydrophobicContact CG2-CD1 4.18Å; V242-F291 HydrophobicContact CG2-CE1 4.14Å; V242-P318 HydrophobicContact CG1-CB 3.96Å; V242-P318 WeakPolarHBondContact CG1-O 3.45Å; V242-I319 HydrophobicContact CG1-CB 4.13Å; V242-I319 HydrophobicContact CG1-CD1 4.38Å; V242-I319 HydrophobicContact CG2-CD1 3.7Å; V242-C322 HydrophobicContact CG1-CB 4.02Å
243N96.4Very high91.8Very high39 Ų3936.2 Ų36.221%0.20919%0.192CC..Hα-helixtrans-60.2-45.8177.5-69.6-23.1000111.5Y195 S239 Q240 V241 N246Y195-N243 HydrophobicContact CD2-CB 3.99Å; Y195-N243 VanDerWaalsContact CD2-O 3.31Å; Y195-N243 WeakPolarHBondContact CD2-O 3.43Å; Y195-N243 HydrophobicContact CE2-CB 4.29Å; Y195-N243 WeakPolarHBondContact CE2-O 3.35Å; S239-N243 VanDerWaalsContact O-CG 3.25Å; S239-N243 PolarHBondContact O-N 3.28Å; S239-N243 PolarHBondContact O-ND2 3.15Å; Q240-N243 PolarHBondContact O-N 2.83Å; Q240-N243 PolarHBondContact OE1-ND2 3.49Å; V241-N243 PolarHBondContact O-N 2.87Å; N243-N246 PolarHBondContact O-N 3.12Å
244V96.6Very high93Very high0 Ų034.6 Ų34.60%018%0.18CC..Hα-helixtrans-63.9-43.51761760000111L191 V194 L216 L220 Q240 V241 V242 N246 I247 I248L191-V244 HydrophobicContact CB-CG2 4.26Å; L191-V244 HydrophobicContact CD2-CG2 4.31Å; L191-V244 WeakPolarHBondContact O-CG2 3.42Å; V194-V244 HydrophobicContact CG1-CG1 4.13Å; V194-V244 HydrophobicContact CG1-CG2 4.31Å; L216-V244 HydrophobicContact CD2-CG1 3.88Å; L216-V244 HydrophobicContact CG-CG1 4.5Å; L220-V244 HydrophobicContact CD1-CB 4.25Å; L220-V244 HydrophobicContact CD1-CG1 3.79Å; Q240-V244 WeakPolarHBondContact O-CG2 3.33Å; Q240-V244 PolarHBondContact O-N 3.11Å; V241-V244 PolarHBondContact O-N 2.97Å; V242-V244 PolarHBondContact O-N 2.98Å; V244-N246 PolarHBondContact O-N 3.07Å; V244-I247 WeakPolarHBondContact O-CG1 3.43Å; V244-I247 PolarHBondContact O-N 3.12Å; V244-I248 HydrophobicContact CG1-CD1 4.37Å; V244-I248 HydrophobicContact CG1-CG1 4.49Å; V244-I248 WeakPolarHBondContact O-CG1 3.47Å; V244-I248 PolarHBondContact O-N 2.9Å
245L97Very high93.6Very high1 Ų135.5 Ų35.51%0.00518%0.182CC..Hα-helixtrans-58.9-37.1177.8-73172.8000112.5L220 V241 V242 I247 I248 Y253 L256 L288L220-L245 HydrophobicContact CD1-CD2 3.78Å; L220-L245 HydrophobicContact CD1-CG 4.01Å; V241-L245 HydrophobicContact CG1-CD1 3.98Å; V241-L245 HydrophobicContact CG1-CG 4.36Å; V241-L245 WeakPolarHBondContact O-CG 3.46Å; V241-L245 PolarHBondContact O-N 3.2Å; V242-L245 PolarHBondContact O-N 3.4Å; L245-I247 PolarHBondContact O-N 3.14Å; L245-I248 PolarHBondContact O-N 3.45Å; L245-Y253 HydrophobicContact CB-CE1 4.36Å; L245-Y253 PolarHBondContact O-OH 3.15Å; L245-L256 HydrophobicContact CD1-CD1 4.24Å; L245-L256 HydrophobicContact CD1-CD2 4.45Å; L245-L256 HydrophobicContact CD2-CD1 4.24Å; L245-L256 HydrophobicContact CD2-CD2 4.09Å; L245-L288 HydrophobicContact CD1-CD1 4.22Å
246N95.9Very high94Very high25 Ų2531 Ų3113%0.13416%0.164CC..Hα-helixtrans-61.9-24.8-179.8-81.5-45.5000114.6V242 N243 V244 P318 N321 C322V242-N246 PolarHBondContact O-N 3.01Å; V242-N246 PolarHBondContact O-ND2 3.41Å; V242-N246 VanDerWaalsContact O-ND2 3.13Å; N243-N246 PolarHBondContact O-N 3.12Å; V244-N246 PolarHBondContact O-N 3.07Å; N246-P318 PolarHBondContact ND2-O 3.37Å; N246-P318 PolarHBondContact OD1-O 3.16Å; N246-N321 PolarHBondContact OD1-ND2 3.35Å; N246-C322 WeakPolarHBondContact OD1-CA 3.3Å; N246-C322 PolarHBondContact OD1-N 3.32Å; N246-C322 VanDerWaalsContact OD1-N 3.09Å
247I92.7Very high94.2Very high46 Ų4628.6 Ų28.624%0.23614%0.143CC..Hα-helixtrans-94.3-12.6176.458.5171000113Y195 L198 Y199 V244 L245Y195-I247 HydrophobicContact CD2-CD1 3.8Å; Y195-I247 HydrophobicContact CD2-CG1 4.24Å; Y195-I247 HydrophobicContact CD2-CG2 4.04Å; Y195-I247 HydrophobicContact CE2-CD1 4.42Å; Y195-I247 HydrophobicContact CE2-CG2 3.6Å; Y195-I247 HydrophobicContact CG-CD1 4.35Å; Y195-I247 WeakPolarHBondContact O-CD1 3.47Å; L198-I247 HydrophobicContact CB-CD1 3.38Å; L198-I247 HydrophobicContact CB-CG1 4.43Å; L198-I247 HydrophobicContact CD1-CD1 4.37Å; L198-I247 HydrophobicContact CG-CD1 4.49Å; Y199-I247 HydrophobicContact CD2-CG2 4.42Å; V244-I247 WeakPolarHBondContact O-CG1 3.43Å; V244-I247 PolarHBondContact O-N 3.12Å; L245-I247 PolarHBondContact O-N 3.14Å
248I92.4Very high93.8Very high2 Ų231.5 Ų31.51%0.0116%0.158CC..SBendtrans-72.6141178-62.1-38.1000111.1L198 I213 L216 V217 V244 L245 K250 L252 R325L198-I248 HydrophobicContact CD1-CD1 4.09Å; I213-I248 HydrophobicContact CG2-CD1 3.69Å; I213-I248 HydrophobicContact CG2-CG1 4.48Å; I213-I248 HydrophobicContact CG2-CG2 4.15Å; L216-I248 HydrophobicContact CD2-CD1 4.38Å; V217-I248 HydrophobicContact CG2-CG1 4.23Å; V217-I248 HydrophobicContact CG2-CG2 3.69Å; V244-I248 HydrophobicContact CG1-CD1 4.37Å; V244-I248 HydrophobicContact CG1-CG1 4.49Å; V244-I248 WeakPolarHBondContact O-CG1 3.47Å; V244-I248 PolarHBondContact O-N 2.9Å; L245-I248 PolarHBondContact O-N 3.45Å; I248-K250 PolarHBondContact O-N 2.93Å; I248-L252 HydrophobicContact CG2-CB 3.79Å; I248-L252 HydrophobicContact CG2-CD1 3.91Å; I248-L252 HydrophobicContact CG2-CG 4.41Å; I248-R325 PolarHBondContact O-NH2 3.25Å
249P91.5Very high92.4Very high40 Ų4033.5 Ų33.526%0.2618%0.18SC..  trans-52.1135.9171.4-28.935000114H251 L252P249-H251 VanDerWaalsContact C-N 3.26Å; P249-H251 VanDerWaalsContact CB-CE1 3.48Å; P249-H251 WeakPolarHBondContact CB-CE1 3.38Å; P249-H251 PolarHBondContact O-N 3.49Å; P249-H251 VanDerWaalsContact O-N 3.1Å; P249-L252 HydrophobicContact CB-CD1 4.4Å; P249-L252 HydrophobicContact CB-CG 4.47Å; P249-L252 HydrophobicContact CG-CD1 4.33Å; P249-L252 PolarHBondContact O-N 2.78Å
250K91.1Very high90.1Very high108 Ų10839.5 Ų39.547%0.4721%0.209SC..G310 helixtrans-52.7-39.5-174.565.6175180170.70113.7I248 L252 Y253 S329I248-K250 PolarHBondContact O-N 2.93Å; K250-L252 PolarHBondContact O-N 3.29Å; K250-Y253 WeakPolarHBondContact O-CB 3.41Å; K250-Y253 WeakPolarHBondContact O-CD2 3.41Å; K250-Y253 PolarHBondContact O-N 2.91Å; K250-S329 WeakPolarHBondContact O-CB 3.28Å; K250-S329 PolarHBondContact O-OG 3.2Å
251H90Very high87.9Confident120 Ų12044.2 Ų44.256%0.55623%0.229SC*.G310 helixtrans-66.9-18.3-175.869-89.2000113.9P249 K254P249-H251 VanDerWaalsContact C-N 3.26Å; P249-H251 VanDerWaalsContact CB-CE1 3.48Å; P249-H251 WeakPolarHBondContact CB-CE1 3.38Å; P249-H251 PolarHBondContact O-N 3.49Å; P249-H251 VanDerWaalsContact O-N 3.1Å; H251-K254 WeakPolarHBondContact O-CG 3.5Å
252L93.7Very high84.8Confident15 Ų1551.3 Ų51.38%0.07927%0.267CS..G310 helixtrans-83.4-13.6179.5-62.6179.2000113.3I213 R214 V217 I248 P249 K250 K254 H255I213-L252 HydrophobicContact CB-CD1 4.37Å; I213-L252 HydrophobicContact CG2-CD1 3.58Å; R214-L252 HydrophobicContact CB-CD2 4.49Å; V217-L252 HydrophobicContact CG2-CB 4.22Å; I248-L252 HydrophobicContact CG2-CB 3.79Å; I248-L252 HydrophobicContact CG2-CD1 3.91Å; I248-L252 HydrophobicContact CG2-CG 4.41Å; P249-L252 HydrophobicContact CB-CD1 4.4Å; P249-L252 HydrophobicContact CB-CG 4.47Å; P249-L252 HydrophobicContact CG-CD1 4.33Å; P249-L252 PolarHBondContact O-N 2.78Å; K250-L252 PolarHBondContact O-N 3.29Å; L252-K254 PolarHBondContact O-N 3.41Å; L252-H255 WeakPolarHBondContact O-CB 3.43Å; L252-H255 PolarHBondContact O-CD2 3.36Å; L252-H255 VanDerWaalsContact O-CD2 3.27Å; L252-H255 PolarHBondContact O-N 3.35Å
253Y94.9Very high81.9Confident0 Ų056.2 Ų56.20%029%0.293CS..G310 helixtrans-59.7-19.7175.8-81.7-106000113L245 K250 H255 L256 R325 A326 S329L245-Y253 HydrophobicContact CB-CE1 4.36Å; L245-Y253 PolarHBondContact O-OH 3.15Å; K250-Y253 WeakPolarHBondContact O-CB 3.41Å; K250-Y253 WeakPolarHBondContact O-CD2 3.41Å; K250-Y253 PolarHBondContact O-N 2.91Å; Y253-H255 PolarHBondContact O-N 3.02Å; Y253-H255 VanDerWaalsContact O-N 3.17Å; Y253-L256 HydrophobicContact CD1-CD1 3.69Å; Y253-L256 HydrophobicContact CE1-CD1 4.38Å; Y253-L256 HydrophobicContact CG-CD1 4.43Å; Y253-L256 VanDerWaalsContact O-CB 3.32Å; Y253-L256 WeakPolarHBondContact O-CB 3.31Å; Y253-L256 PolarHBondContact O-N 3.08Å; Y253-R325 HydrophobicContact CE1-CB 4.47Å; Y253-R325 HydrophobicContact CE2-CB 4.27Å; Y253-R325 PolarHBondContact OH-NE 2.93Å; Y253-A326 HydrophobicContact CD1-CB 3.37Å; Y253-A326 HydrophobicContact CE1-CB 3.73Å; Y253-A326 HydrophobicContact CG-CB 4.27Å; Y253-S329 VanDerWaalsContact CB-OG 3.31Å; Y253-S329 WeakPolarHBondContact CB-OG 3.31Å
254K92.9Very high78.7Confident75 Ų7562.2 Ų62.233%0.32632%0.32SS..G310 helixtrans-55.8-28.617171.5-179.5178.8165.80112.9H251 L252 L256 L257H251-K254 WeakPolarHBondContact O-CG 3.5Å; L252-K254 PolarHBondContact O-N 3.41Å; K254-L256 PolarHBondContact O-N 3.5Å; K254-L257 PolarHBondContact O-N 3.04Å
255H94.2Very high75.6Confident37 Ų3767.3 Ų67.317%0.17136%0.362CS..G310 helixtrans-77.4-5.7179.2-61.1-70.2000113.6V217 V218 R221 L252 Y253V217-H255 HydrophobicContact CB-CB 4.26Å; V217-H255 HydrophobicContact CG1-CB 3.81Å; V218-H255 HydrophobicContact CG2-CB 4.13Å; R221-H255 WeakPolarHBondContact CD-O 3.3Å; R221-H255 PolarHBondContact NH1-O 3.44Å; L252-H255 WeakPolarHBondContact O-CB 3.43Å; L252-H255 PolarHBondContact O-CD2 3.36Å; L252-H255 VanDerWaalsContact O-CD2 3.27Å; L252-H255 PolarHBondContact O-N 3.35Å; Y253-H255 PolarHBondContact O-N 3.02Å; Y253-H255 VanDerWaalsContact O-N 3.17Å
256L94.7Very high72.2Confident0 Ų073.1 Ų73.10%040%0.398CS..G310 helixtrans-72.1-17.1166.5-66.3175.6000112.4V217 R221 L245 Y253 K254 S284 I285V217-L256 HydrophobicContact CG1-CD2 3.9Å; V217-L256 HydrophobicContact CG1-CG 4Å; R221-L256 HydrophobicContact CB-CD2 4.31Å; R221-L256 VanDerWaalsContact CD-C 3.48Å; R221-L256 WeakPolarHBondContact CD-O 3.4Å; R221-L256 VanDerWaalsContact CG-O 3.31Å; R221-L256 WeakPolarHBondContact CG-O 3.36Å; L245-L256 HydrophobicContact CD1-CD1 4.24Å; L245-L256 HydrophobicContact CD1-CD2 4.45Å; L245-L256 HydrophobicContact CD2-CD1 4.24Å; L245-L256 HydrophobicContact CD2-CD2 4.09Å; Y253-L256 HydrophobicContact CD1-CD1 3.69Å; Y253-L256 HydrophobicContact CE1-CD1 4.38Å; Y253-L256 HydrophobicContact CG-CD1 4.43Å; Y253-L256 VanDerWaalsContact O-CB 3.32Å; Y253-L256 WeakPolarHBondContact O-CB 3.31Å; Y253-L256 PolarHBondContact O-N 3.08Å; K254-L256 PolarHBondContact O-N 3.5Å; L256-S284 PolarHBondContact O-OG 2.88Å; L256-I285 HydrophobicContact CB-CD1 4.02Å; L256-I285 HydrophobicContact CD1-CD1 3.99Å
257L92.9Very high69Low8 Ų878.9 Ų78.94%0.04243%0.429CS..SBendtrans-86.3149.2176.3-55.2-178.2000110.6R221 K254 G259 F261 G281 M282 I285 Q332 I333R221-L257 PolarHBondContact NH1-O 3.49Å; K254-L257 PolarHBondContact O-N 3.04Å; L257-G259 PolarHBondContact O-N 3.4Å; L257-F261 HydrophobicContact CB-CE2 4.38Å; L257-G281 WeakPolarHBondContact CA-O 3.19Å; L257-G281 WeakPolarHBondContact CD2-O 3.31Å; L257-M282 HydrophobicContact CD1-CE 4.17Å; L257-M282 HydrophobicContact CD2-CE 3.48Å; L257-M282 VanDerWaalsContact CD2-CE 3.48Å; L257-M282 HydrophobicContact CD2-SD 3.5Å; L257-M282 VanDerWaalsContact CD2-SD 3.5Å; L257-M282 HydrophobicContact CG-CE 4.49Å; L257-I285 HydrophobicContact CD2-CG1 4.1Å; L257-Q332 HydrophobicContact CD1-CB 4.48Å; L257-I333 HydrophobicContact CD1-CG1 4.21Å; L257-I333 HydrophobicContact CD2-CD1 4.36Å; L257-I333 HydrophobicContact CD2-CG1 3.84Å; L257-I333 HydrophobicContact CG-CD1 4.46Å; L257-I333 HydrophobicContact CG-CG1 4.23Å
258D83.8Confident65.9Low64 Ų6483 Ų8334%0.34245%0.451SS..  trans-61.2123.9172-67.8-27000109.9R221 Q225 N260 G281R221-D258 IonicContact NE-OD1 2.72Å; Q225-D258 PolarHBondContact NE2-OD1 3.04Å; D258-N260 PolarHBondContact O-N 3.39Å; D258-G281 PolarHBondContact N-O 3.19Å; D258-G281 WeakPolarHBondContact OD2-CA 3.21Å
259G65.7Low62.9Low48 Ų4890.1 Ų90.150%0.49549%0.488SS..  trans-84.2114.1-169.300000112.5L257L257-G259 PolarHBondContact O-N 3.4Å
260N45.6Very low60.1Low168 Ų16896.1 Ų96.190%0.89852%0.516SS*.  trans-115.347.7138.4-90.6-3.5000108.9D258D258-N260 PolarHBondContact O-N 3.39Å
261F48.9Very low57Low130 Ų13099.3 Ų99.357%0.5753%0.53SS*.  trans-96.187.9171.4-65-78.5000108.1L257 D263L257-F261 HydrophobicContact CB-CE2 4.38Å; F261-D263 PolarHBondContact O-N 2.85Å
262N33.1Very low54.3Low150 Ų150101.6 Ų101.680%0.80255%0.546SS*.  trans-63117.3160.6-78.2-19.6000106.9H264N262-H264 PolarHBondContact O-N 2.92Å
263D36.7Very low51.1Low104 Ų104105.8 Ų105.856%0.55658%0.577SS**SBendtrans-68.963.9166.9-85.4-31.7000109.1F261F261-D263 PolarHBondContact O-N 2.85Å
264H28.8Very low48Very low166 Ų166109.8 Ų109.877%0.76961%0.61SS**SBendtrans-146122.4160.7-77.6-59000108.2N262 T266N262-H264 PolarHBondContact O-N 2.92Å; H264-T266 PolarHBondContact O-N 3.36Å
265A30.6Very low45.5Very low107 Ų107111.7 Ų111.788%0.88463%0.63SS**  trans-52.297.2173.200000111
266T25.6Very low42.7Very low123 Ų123117.8 Ų117.876%0.75566%0.659SS**  trans-12377.3150.351.80000106.7H264H264-T266 PolarHBondContact O-N 3.36Å
267D29.1Very low39.9Very low146 Ų146124.8 Ų124.878%0.78170%0.696SS**  trans-48.9133144.2-140.9-5.2000107
268N27.8Very low37.7Very low133 Ų133131.5 Ų131.571%0.71173%0.725SS**SBendtrans100.4121.2-178.7-51.7-52.5000117.5
269L28.7Very low36.1Very low151 Ų151132.6 Ų132.679%0.79173%0.734SS**  trans82.587.9158.7-50.8169.1000116.8
270I33.1Very low35.8Very low165 Ų165135.8 Ų135.885%0.84674%0.74SS**  -150.3111.2122.4-85.7133000107.7
271K26.6Very low37.6Very low176 Ų176128.6 Ų128.677%0.76571%0.705SS**  trans-67.7151.7168.4-71.5173171.9176.60110.2S273K271-S273 PolarHBondContact O-N 3.18Å
272D32.6Very low39.6Very low167 Ų167122.6 Ų122.689%0.89368%0.679SS**  trans-7103.1162.9-61-46.1000117.3
273S27.2Very low42.3Very low104 Ų104117.1 Ų117.173%0.72765%0.653SS**  trans-155.3118.2152.945.40000111.5K271K271-S273 PolarHBondContact O-N 3.18Å
274A29.5Very low45Very low84 Ų84112.2 Ų112.269%0.69463%0.626SS**  trans64.6117.6160.200000120.1
275P41.3Very low48.2Very low114 Ų114104.3 Ų104.374%0.7459%0.59SS**SBendtrans-79.3-7.5178.9-13.129.2000117.3
276E34.9Very low51.3Low166 Ų166102.3 Ų102.378%0.77656%0.562SS**G310 helixtrans-83.7-18.2-163-68-177.8174.700115.7T279E276-T279 PolarHBondContact O-OG1 2.96Å
277N36.1Very low54.6Low146 Ų14698.3 Ų98.378%0.78154%0.537SS*.G310 helixtrans-92.62179.2-76.7-12.9000114.7
278K46.7Very low57.8Low150 Ų15091.3 Ų91.365%0.65250%0.5SS*.G310 helixtrans-84.3-14.3-178-79-174.3-176.3177.90114.5
279T49.3Very low61.1Low87 Ų8785.1 Ų85.153%0.53447%0.467SS..SBendtrans-75.3-35.2-178.138.90000112.8E276 G281 M282E276-T279 PolarHBondContact O-OG1 2.96Å; T279-G281 PolarHBondContact O-N 2.91Å; T279-M282 PolarHBondContact O-N 3.41Å
280N59.6Low64.2Low114 Ų11482.1 Ų82.161%0.6145%0.452SS*.G310 helixtrans-56.1-39.4-179.1-71.42.3000112M282 S283N280-M282 PolarHBondContact O-N 3.03Å; N280-S283 PolarHBondContact O-N 3.25Å; N280-S283 PolarHBondContact O-OG 3.32Å
281G83.4Confident67.2Low17 Ų1774.6 Ų74.618%0.17541%0.413CS..G310 helixtrans-69.4-0.7179.800000116.8L257 D258 T279L257-G281 WeakPolarHBondContact CA-O 3.19Å; L257-G281 WeakPolarHBondContact CD2-O 3.31Å; D258-G281 PolarHBondContact N-O 3.19Å; D258-G281 WeakPolarHBondContact OD2-CA 3.21Å; T279-G281 PolarHBondContact O-N 2.91Å
282M90.7Very high70.5Confident5 Ų566.2 Ų66.23%0.02538%0.377CS..G310 helixtrans-110.91179.2-75.7-70.5170.800113.9L257 T279 N280 S284 I285 E286 Q332 I333 F336L257-M282 HydrophobicContact CD1-CE 4.17Å; L257-M282 HydrophobicContact CD2-CE 3.48Å; L257-M282 VanDerWaalsContact CD2-CE 3.48Å; L257-M282 HydrophobicContact CD2-SD 3.5Å; L257-M282 VanDerWaalsContact CD2-SD 3.5Å; L257-M282 HydrophobicContact CG-CE 4.49Å; T279-M282 PolarHBondContact O-N 3.41Å; N280-M282 PolarHBondContact O-N 3.03Å; M282-S284 VanDerWaalsContact C-N 3.31Å; M282-S284 PolarHBondContact O-N 3.32Å; M282-I285 CarbonylContact O-C 3.38Å; M282-I285 WeakPolarHBondContact O-CA 3.23Å; M282-I285 WeakPolarHBondContact O-CB 3.43Å; M282-I285 PolarHBondContact O-N 3Å; M282-I285 HydrophobicContact SD-CB 4.14Å; M282-I285 HydrophobicContact SD-CG1 3.93Å; M282-E286 PolarHBondContact O-N 3.36Å; M282-Q332 VanDerWaalsContact CE-C 3.43Å; M282-Q332 HydrophobicContact CE-CB 4.06Å; M282-Q332 HydrophobicContact CE-CG 3.47Å; M282-Q332 VanDerWaalsContact CE-CG 3.47Å; M282-Q332 VanDerWaalsContact CE-O 3.32Å; M282-Q332 WeakPolarHBondContact CE-O 3.33Å; M282-I333 HydrophobicContact CE-CG1 4.48Å; M282-F336 HydrophobicContact CB-CD1 4.08Å; M282-F336 HydrophobicContact CB-CD2 3.81Å; M282-F336 HydrophobicContact CB-CE1 3.94Å; M282-F336 HydrophobicContact CB-CE2 3.66Å; M282-F336 HydrophobicContact CB-CG 4.01Å; M282-F336 HydrophobicContact CB-CZ 3.73Å; M282-F336 HydrophobicContact CE-CB 4.03Å; M282-F336 HydrophobicContact CG-CB 4.14Å; M282-F336 HydrophobicContact CG-CD1 4.19Å; M282-F336 HydrophobicContact CG-CD2 3.67Å; M282-F336 HydrophobicContact CG-CE2 4.07Å; M282-F336 HydrophobicContact CG-CG 3.73Å; M282-F336 HydrophobicContact CG-CZ 4.48Å; M282-F336 HydrophobicContact SD-CB 3.69Å; M282-F336 HydrophobicContact SD-CD1 3.92Å; M282-F336 HydrophobicContact SD-CD2 4.29Å; M282-F336 HydrophobicContact SD-CG 3.71Å
283S91.3Very high73.5Confident35 Ų3560 Ų6025%0.24534%0.342CS..Hα-helixtrans-50.6-44.8-175.945.10000113.6Q225 N280 I285 E286 T287Q225-S283 WeakPolarHBondContact CG-OG 3.37Å; Q225-S283 PolarHBondContact NE2-OG 2.84Å; N280-S283 PolarHBondContact O-N 3.25Å; N280-S283 PolarHBondContact O-OG 3.32Å; S283-I285 VanDerWaalsContact C-N 3.34Å; S283-I285 PolarHBondContact O-N 2.71Å; S283-E286 WeakPolarHBondContact O-CB 3.34Å; S283-E286 PolarHBondContact O-N 2.92Å; S283-T287 PolarHBondContact O-N 3.39Å; S283-T287 PolarHBondContact O-OG1 3.32Å; S283-T287 VanDerWaalsContact O-OG1 3.11Å
284S93.2Very high76.7Confident0 Ų056.5 Ų56.50%032%0.318CS..Hα-helixtrans-67.1-33.4177.566.60000113.4L256 M282 L288L256-S284 PolarHBondContact O-OG 2.88Å; M282-S284 VanDerWaalsContact C-N 3.31Å; M282-S284 PolarHBondContact O-N 3.32Å; S284-L288 WeakPolarHBondContact O-CG 3.4Å; S284-L288 PolarHBondContact O-N 3.01Å
285I95.9Very high79.7Confident0 Ų053.4 Ų53.40%029%0.289CS..Hα-helixtrans-72-36.7175.9-55.4-58.1000109.8L256 L257 M282 S283 L288 I289 I333 F336L256-I285 HydrophobicContact CB-CD1 4.02Å; L256-I285 HydrophobicContact CD1-CD1 3.99Å; L257-I285 HydrophobicContact CD2-CG1 4.1Å; M282-I285 CarbonylContact O-C 3.38Å; M282-I285 WeakPolarHBondContact O-CA 3.23Å; M282-I285 WeakPolarHBondContact O-CB 3.43Å; M282-I285 PolarHBondContact O-N 3Å; M282-I285 HydrophobicContact SD-CB 4.14Å; M282-I285 HydrophobicContact SD-CG1 3.93Å; S283-I285 VanDerWaalsContact C-N 3.34Å; S283-I285 PolarHBondContact O-N 2.71Å; I285-L288 HydrophobicContact CD1-CD1 4.43Å; I285-L288 PolarHBondContact O-N 3.04Å; I285-I289 HydrophobicContact CG2-CD1 4.1Å; I285-I289 VanDerWaalsContact O-CG1 3.31Å; I285-I289 WeakPolarHBondContact O-CG1 3.4Å; I285-I289 PolarHBondContact O-N 2.99Å; I285-I333 HydrophobicContact CD1-CD1 4.05Å; I285-I333 HydrophobicContact CD1-CG1 4.3Å; I285-I333 HydrophobicContact CD1-CG2 4.26Å; I285-I333 HydrophobicContact CG1-CG1 4.34Å; I285-I333 HydrophobicContact CG1-CG2 4.49Å; I285-I333 HydrophobicContact CG2-CG2 4.22Å; I285-F336 HydrophobicContact CB-CD1 4.2Å; I285-F336 HydrophobicContact CB-CE1 4.31Å; I285-F336 HydrophobicContact CG2-CD1 3.75Å; I285-F336 HydrophobicContact CG2-CE1 4.15Å
286E94.8Very high82.2Confident66 Ų6648.1 Ų48.131%0.30825%0.254SS..Hα-helixtrans-60.1-48.7172.9-170.9156.1-142.500111.1M282 S283 L288 I289 D290 F336 K340M282-E286 PolarHBondContact O-N 3.36Å; S283-E286 WeakPolarHBondContact O-CB 3.34Å; S283-E286 PolarHBondContact O-N 2.92Å; E286-L288 VanDerWaalsContact C-N 3.26Å; E286-L288 PolarHBondContact O-N 3.44Å; E286-I289 WeakPolarHBondContact O-CB 3.48Å; E286-I289 PolarHBondContact O-N 3.47Å; E286-D290 PolarHBondContact O-N 3.1Å; E286-F336 HydrophobicContact CB-CE1 4.07Å; E286-F336 HydrophobicContact CB-CZ 4Å; E286-F336 HydrophobicContact CG-CZ 4.44Å; E286-K340 IonicContact OE1-NZ 3.51Å; E286-K340 PolarHBondContact OE1-NZ 3.02Å
287T94.3Very high84.9Confident38 Ų3845.3 Ų45.323%0.23324%0.239CC..Hα-helixtrans-55.1-39.5174.1-53.90000112.5L224 L229 S283 F291L224-T287 HydrophobicContact CB-CG2 4.48Å; L224-T287 HydrophobicContact CD2-CG2 4.04Å; L224-T287 PolarHBondContact O-OG1 3.29Å; L229-T287 HydrophobicContact CD2-CG2 3.99Å; S283-T287 PolarHBondContact O-N 3.39Å; S283-T287 PolarHBondContact O-OG1 3.32Å; S283-T287 VanDerWaalsContact O-OG1 3.11Å; T287-F291 WeakPolarHBondContact O-CB 3.31Å; T287-F291 PolarHBondContact O-N 2.87Å
288L96.6Very high87.5Confident0 Ų043 Ų430%023%0.227CC..Hα-helixtrans-69.5-35.8176.6-69.4173.2000112.8L224 V238 V242 L245 S284 I285 E286 L292 I319 L323L224-L288 HydrophobicContact CD1-CD1 4.12Å; L224-L288 HydrophobicContact CD1-CD2 4.13Å; L224-L288 HydrophobicContact CD1-CG 4Å; L224-L288 HydrophobicContact CD2-CD2 3.98Å; L224-L288 HydrophobicContact CD2-CG 4.37Å; V238-L288 HydrophobicContact CG1-CD2 4.4Å; V242-L288 HydrophobicContact CG2-CD2 3.7Å; L245-L288 HydrophobicContact CD1-CD1 4.22Å; S284-L288 WeakPolarHBondContact O-CG 3.4Å; S284-L288 PolarHBondContact O-N 3.01Å; I285-L288 HydrophobicContact CD1-CD1 4.43Å; I285-L288 PolarHBondContact O-N 3.04Å; E286-L288 VanDerWaalsContact C-N 3.26Å; E286-L288 PolarHBondContact O-N 3.44Å; L288-L292 PolarHBondContact O-N 3.41Å; L288-I319 HydrophobicContact CB-CD1 4.18Å; L288-I319 HydrophobicContact CD2-CD1 4.07Å; L288-L323 HydrophobicContact CB-CD2 4.03Å
289I96.9Very high89.3Confident3 Ų337 Ų372%0.01520%0.201CC..Hα-helixtrans-69.6-42175.6-69.6169.5000110.4I285 E286 F291 L292 H293 L323 F336 C337 K340 V341 I359I285-I289 HydrophobicContact CG2-CD1 4.1Å; I285-I289 VanDerWaalsContact O-CG1 3.31Å; I285-I289 WeakPolarHBondContact O-CG1 3.4Å; I285-I289 PolarHBondContact O-N 2.99Å; E286-I289 WeakPolarHBondContact O-CB 3.48Å; E286-I289 PolarHBondContact O-N 3.47Å; I289-F291 VanDerWaalsContact C-N 3.32Å; I289-L292 WeakPolarHBondContact O-CB 3.36Å; I289-L292 PolarHBondContact O-N 3.03Å; I289-H293 PolarHBondContact O-N 3.13Å; I289-L323 HydrophobicContact CG1-CD1 4.45Å; I289-L323 HydrophobicContact CG1-CD2 4.23Å; I289-F336 HydrophobicContact CD1-CD1 3.97Å; I289-F336 HydrophobicContact CD1-CE1 3.88Å; I289-C337 HydrophobicContact CD1-CB 4.46Å; I289-K340 HydrophobicContact CD1-CB 4.01Å; I289-K340 HydrophobicContact CD1-CG 4.32Å; I289-K340 HydrophobicContact CG2-CB 4.31Å; I289-V341 HydrophobicContact CG2-CG2 4.46Å; I289-I359 HydrophobicContact CG2-CD1 3.37Å
290D94.9Very high91.1Very high87 Ų8734.5 Ų34.547%0.46519%0.19SC..Hα-helixtrans-64.1-40.7176.1-67.7-19000110.6E286 L292 H293 S294E286-D290 PolarHBondContact O-N 3.1Å; D290-L292 PolarHBondContact O-N 3.37Å; D290-H293 PolarHBondContact O-N 2.84Å; D290-S294 PolarHBondContact O-N 2.85Å; D290-S294 PolarHBondContact O-OG 2.98Å
291F95.4Very high92Very high8 Ų832 Ų324%0.03519%0.19CC..Hα-helixtrans-59-46.1171.7-179.5-116.4000112.4Y235 V238 V242 T287 I289 H293 S294 Q295 I319Y235-F291 AromaticContact CD1-CD2 3.4Å; Y235-F291 HydrophobicContact CD1-CD2 3.4Å; Y235-F291 VanDerWaalsContact CD1-CD2 3.4Å; Y235-F291 AromaticContact CD1-CE2 3.66Å; Y235-F291 HydrophobicContact CD1-CE2 3.66Å; Y235-F291 AromaticContact CE1-CD2 3.92Å; Y235-F291 HydrophobicContact CE1-CD2 3.92Å; Y235-F291 HydrophobicContact CG-CD2 4.31Å; Y235-F291 HydrophobicContact CG-CE2 4.13Å; V238-F291 HydrophobicContact CB-CD2 4.16Å; V238-F291 HydrophobicContact CB-CE2 4.28Å; V238-F291 HydrophobicContact CB-CG 4.35Å; V238-F291 HydrophobicContact CG1-CB 3.93Å; V238-F291 HydrophobicContact CG1-CD1 3.81Å; V238-F291 HydrophobicContact CG1-CD2 3.91Å; V238-F291 HydrophobicContact CG1-CE1 4.27Å; V238-F291 HydrophobicContact CG1-CE2 4.34Å; V238-F291 HydrophobicContact CG1-CG 3.6Å; V242-F291 HydrophobicContact CG2-CD1 4.18Å; V242-F291 HydrophobicContact CG2-CE1 4.14Å; T287-F291 WeakPolarHBondContact O-CB 3.31Å; T287-F291 PolarHBondContact O-N 2.87Å; I289-F291 VanDerWaalsContact C-N 3.32Å; F291-H293 VanDerWaalsContact C-N 3.33Å; F291-H293 PolarHBondContact O-N 2.89Å; F291-S294 PolarHBondContact O-N 3.4Å; F291-Q295 HydrophobicContact CD2-CG 4.48Å; F291-Q295 HydrophobicContact CE1-CG 4.24Å; F291-Q295 HydrophobicContact CE2-CG 4.15Å; F291-Q295 HydrophobicContact CZ-CG 4.02Å; F291-Q295 VanDerWaalsContact CZ-NE2 3.31Å; F291-Q295 WeakPolarHBondContact O-CG 3.21Å; F291-Q295 PolarHBondContact O-N 2.85Å; F291-I319 HydrophobicContact CD1-CB 4.21Å; F291-I319 HydrophobicContact CD1-CD1 4.01Å; F291-I319 HydrophobicContact CD1-CG1 3.93Å; F291-I319 HydrophobicContact CE1-CB 4.25Å; F291-I319 HydrophobicContact CE1-CG1 4.47Å
292L96.6Very high91.5Very high0 Ų034.3 Ų34.30%020%0.196CC..Hα-helixtrans-57.3-46.8173.5172.864.7000111L288 I289 D290 S294 Q295 L296 I319 L320 L323 I359 F381L288-L292 PolarHBondContact O-N 3.41Å; I289-L292 WeakPolarHBondContact O-CB 3.36Å; I289-L292 PolarHBondContact O-N 3.03Å; D290-L292 PolarHBondContact O-N 3.37Å; L292-S294 VanDerWaalsContact C-N 3.34Å; L292-S294 PolarHBondContact O-N 3.01Å; L292-Q295 PolarHBondContact O-N 3.5Å; L292-L296 HydrophobicContact CD1-CD1 3.92Å; L292-L296 HydrophobicContact CD1-CG 4.05Å; L292-L296 HydrophobicContact CD2-CD1 4.39Å; L292-L296 HydrophobicContact CG-CD1 3.77Å; L292-L296 HydrophobicContact CG-CG 4.34Å; L292-L296 VanDerWaalsContact O-CG 3.27Å; L292-L296 WeakPolarHBondContact O-CG 3.49Å; L292-L296 PolarHBondContact O-N 3.29Å; L292-I319 HydrophobicContact CB-CG1 3.84Å; L292-I319 HydrophobicContact CD1-CG1 4.38Å; L292-I319 HydrophobicContact CD1-CG2 3.8Å; L292-L320 HydrophobicContact CD1-CD2 3.75Å; L292-L320 HydrophobicContact CD1-CG 4.15Å; L292-L320 HydrophobicContact CD2-CD2 4.06Å; L292-L323 HydrophobicContact CB-CD1 4.11Å; L292-L323 HydrophobicContact CD2-CD1 3.71Å; L292-L323 HydrophobicContact CG-CD1 4.48Å; L292-I359 HydrophobicContact CD2-CG2 4.13Å; L292-F381 HydrophobicContact CD2-CE1 3.94Å
293H95.6Very high89.8Confident37 Ų3743.6 Ų43.617%0.17124%0.239CC..Hα-helixtrans-61.5-43.1-179.3-164.4-176.3000111.7I289 D290 F291 L296 K297 D357 I359 Y362I289-H293 PolarHBondContact O-N 3.13Å; D290-H293 PolarHBondContact O-N 2.84Å; F291-H293 VanDerWaalsContact C-N 3.33Å; F291-H293 PolarHBondContact O-N 2.89Å; H293-L296 PolarHBondContact O-N 3.4Å; H293-K297 VanDerWaalsContact NE2-CE 3.32Å; H293-K297 WeakPolarHBondContact NE2-CE 3.38Å; H293-K297 WeakPolarHBondContact O-CG 3.18Å; H293-K297 PolarHBondContact O-N 3.28Å; H293-D357 PolarHBondContact NE2-O 3.39Å; H293-I359 HydrophobicContact CB-CD1 3.94Å; H293-I359 HydrophobicContact CB-CG1 3.83Å; H293-Y362 AromaticContact CD2-CD2 3.93Å; H293-Y362 AromaticContact CD2-CE2 3.89Å; H293-Y362 AromaticContact NE2-CD2 3.95Å; H293-Y362 AromaticContact NE2-CE2 3.63Å
294S93.1Very high87.9Confident30 Ų3045.6 Ų45.621%0.2125%0.253CS..Hα-helixtrans-61-44174.8-69.10000112Y235 D290 F291 L292 L296 K297 L298Y235-S294 WeakPolarHBondContact OH-CB 3.15Å; Y235-S294 PolarHBondContact OH-OG 3.27Å; D290-S294 PolarHBondContact O-N 2.85Å; D290-S294 PolarHBondContact O-OG 2.98Å; F291-S294 PolarHBondContact O-N 3.4Å; L292-S294 VanDerWaalsContact C-N 3.34Å; L292-S294 PolarHBondContact O-N 3.01Å; S294-L296 VanDerWaalsContact C-N 3.35Å; S294-L296 PolarHBondContact O-N 3.1Å; S294-K297 PolarHBondContact O-N 3.46Å; S294-L298 VanDerWaalsContact O-CG 3.31Å; S294-L298 WeakPolarHBondContact O-CG 3.43Å; S294-L298 PolarHBondContact O-N 3.41Å
295Q92.7Very high85.9Confident19 Ų1952.2 Ų52.29%0.08928%0.284CS..Hα-helixtrans-62.9-40.3176.3-68.1-61.4-15.700112.5F291 L292 L298 D299F291-Q295 HydrophobicContact CD2-CG 4.48Å; F291-Q295 HydrophobicContact CE1-CG 4.24Å; F291-Q295 HydrophobicContact CE2-CG 4.15Å; F291-Q295 HydrophobicContact CZ-CG 4.02Å; F291-Q295 VanDerWaalsContact CZ-NE2 3.31Å; F291-Q295 WeakPolarHBondContact O-CG 3.21Å; F291-Q295 PolarHBondContact O-N 2.85Å; L292-Q295 PolarHBondContact O-N 3.5Å; Q295-L298 PolarHBondContact O-N 2.74Å; Q295-D299 WeakPolarHBondContact O-CB 3.35Å; Q295-D299 PolarHBondContact O-N 3.26Å
296L94.3Very high83.4Confident3 Ų356 Ų562%0.01631%0.308CS..Hα-helixtrans-65.1-41.7176.8-71.1167.7000112.3L292 H293 S294 D299 A300 I316 I359 Y362 L363 L366L292-L296 HydrophobicContact CD1-CD1 3.92Å; L292-L296 HydrophobicContact CD1-CG 4.05Å; L292-L296 HydrophobicContact CD2-CD1 4.39Å; L292-L296 HydrophobicContact CG-CD1 3.77Å; L292-L296 HydrophobicContact CG-CG 4.34Å; L292-L296 VanDerWaalsContact O-CG 3.27Å; L292-L296 WeakPolarHBondContact O-CG 3.49Å; L292-L296 PolarHBondContact O-N 3.29Å; H293-L296 PolarHBondContact O-N 3.4Å; S294-L296 VanDerWaalsContact C-N 3.35Å; S294-L296 PolarHBondContact O-N 3.1Å; L296-D299 PolarHBondContact O-N 3.19Å; L296-A300 WeakPolarHBondContact O-CB 3.43Å; L296-A300 PolarHBondContact O-N 3.3Å; L296-I316 HydrophobicContact CD2-CD1 4.28Å; L296-I316 HydrophobicContact CD2-CG2 4.43Å; L296-I359 HydrophobicContact CD1-CG2 3.82Å; L296-Y362 HydrophobicContact CB-CD2 4.16Å; L296-Y362 HydrophobicContact CB-CG 3.99Å; L296-L363 HydrophobicContact CD1-CD2 4.11Å; L296-L363 HydrophobicContact CD1-CG 4.36Å; L296-L363 HydrophobicContact CD2-CD2 4.26Å; L296-L366 HydrophobicContact CD2-CD1 3.47Å; L296-L366 VanDerWaalsContact CD2-CD1 3.47Å; L296-L366 HydrophobicContact CD2-CG 4.21Å
297K92.3Very high81.1Confident106 Ų10658.5 Ų58.546%0.46134%0.339SS..Hα-helixtrans-63.2-43.7175.4-76.1-179.4178.4178.40112.1H293 S294 D299 A300 G301 Y362H293-K297 VanDerWaalsContact NE2-CE 3.32Å; H293-K297 WeakPolarHBondContact NE2-CE 3.38Å; H293-K297 WeakPolarHBondContact O-CG 3.18Å; H293-K297 PolarHBondContact O-N 3.28Å; S294-K297 PolarHBondContact O-N 3.46Å; K297-D299 VanDerWaalsContact C-N 3.26Å; K297-D299 PolarHBondContact O-N 3.47Å; K297-A300 PolarHBondContact O-N 3.43Å; K297-G301 PolarHBondContact O-N 2.95Å; K297-G301 VanDerWaalsContact O-N 3.13Å; K297-Y362 HydrophobicContact CG-CE2 3.82Å
298L89.3Confident78.6Confident99 Ų9961.5 Ų61.552%0.51836%0.362SS..Hα-helixtrans-60.9-38.3176.7-72.8173.8000111.7S294 Q295S294-L298 VanDerWaalsContact O-CG 3.31Å; S294-L298 WeakPolarHBondContact O-CG 3.43Å; S294-L298 PolarHBondContact O-N 3.41Å; Q295-L298 PolarHBondContact O-N 2.74Å
299D85.7Confident76.5Confident22 Ų2266.1 Ų66.112%0.11839%0.386CS..Hα-helixtrans-70.8-43.3177.8-161.465.1000112.6Q295 L296 K297 G301 K302 T312 R315 I316Q295-D299 WeakPolarHBondContact O-CB 3.35Å; Q295-D299 PolarHBondContact O-N 3.26Å; L296-D299 PolarHBondContact O-N 3.19Å; K297-D299 VanDerWaalsContact C-N 3.26Å; K297-D299 PolarHBondContact O-N 3.47Å; D299-G301 PolarHBondContact O-N 3.09Å; D299-K302 PolarHBondContact O-N 3.07Å; D299-K302 VanDerWaalsContact O-N 3.13Å; D299-T312 VanDerWaalsContact CG-CG2 3.49Å; D299-T312 WeakPolarHBondContact OD1-CB 3.36Å; D299-T312 WeakPolarHBondContact OD1-CG2 3.41Å; D299-T312 PolarHBondContact OD1-OG1 3.49Å; D299-T312 WeakPolarHBondContact OD2-CG2 3.35Å; D299-R315 IonicContact OD1-NH2 2.64Å; D299-R315 PolarHBondContact OD1-NH2 3.47Å; D299-I316 HydrophobicContact CB-CD1 3.82Å
300A85.7Confident74.7Confident36 Ų3671.3 Ų71.330%0.29841%0.413SS..Hα-helixtrans-65.3-25.5178.900000113.9L296 K297 K302 Y362L296-A300 WeakPolarHBondContact O-CB 3.43Å; L296-A300 PolarHBondContact O-N 3.3Å; K297-A300 PolarHBondContact O-N 3.43Å; A300-K302 VanDerWaalsContact C-N 3.32Å; A300-Y362 HydrophobicContact CB-CD1 3.77Å; A300-Y362 HydrophobicContact CB-CE1 3.43Å; A300-Y362 VanDerWaalsContact CB-CE1 3.43Å
301G79.8Confident74Confident60 Ų6073.8 Ų73.862%0.61942%0.416SS*.THydrogen-bonded Turntrans-78.9-8.2175.700000114.7K297 D299 E303K297-G301 PolarHBondContact O-N 2.95Å; K297-G301 VanDerWaalsContact O-N 3.13Å; D299-G301 PolarHBondContact O-N 3.09Å; G301-E303 PolarHBondContact O-N 3.41Å
302K72.7Confident73.5Confident67 Ų6774.1 Ų74.129%0.29142%0.418SS..  trans-80.9103.4174.4-65.3-175.2177.1-175.50109.2D299 A300 S304 D309D299-K302 PolarHBondContact O-N 3.07Å; D299-K302 VanDerWaalsContact O-N 3.13Å; A300-K302 VanDerWaalsContact C-N 3.32Å; K302-S304 PolarHBondContact O-N 2.88Å; K302-D309 IonicContact NZ-OD2 2.77Å
303E54.3Low73.2Confident200 Ų20075.2 Ų75.294%0.93542%0.424SS*.SBendtrans-73.9-11.9175.4-67-175.9170.300113G301G301-E303 PolarHBondContact O-N 3.41Å
304S51.9Low72.9Confident76 Ų7678.7 Ų78.753%0.53144%0.44SS..SBendtrans-153.5128.2-179.1-174.60000110.8K302 T306K302-S304 PolarHBondContact O-N 2.88Å; S304-T306 PolarHBondContact O-N 3.04Å
305E51.3Low72.7Confident139 Ų13979 Ų7965%0.6544%0.437SS*.  trans-68.470.4161.4-71.7-177.6166.500108.6
306T42.8Very low72.8Confident81 Ų8178.1 Ų78.150%0.49743%0.433SS..  trans-66.9134.5160.651.80000107.5S304 S308S304-T306 PolarHBondContact O-N 3.04Å; T306-S308 PolarHBondContact O-N 3.18Å
307A46.2Very low72.9Confident118 Ų11878.8 Ų78.898%0.97544%0.438SS*.THydrogen-bonded Turntrans-60.38.3-169.300000116.4
308S43.5Very low73.1Confident100 Ų10075.1 Ų75.170%0.69943%0.425SS*.THydrogen-bonded Turntrans-108.95.2-173.7620000115.7T306T306-S308 PolarHBondContact O-N 3.18Å
309D51.2Low73.5Confident97 Ų9770.4 Ų70.452%0.51940%0.4SS..SBendtrans-122.5125.9-171.9-97-2.8000113.2K302 R311K302-D309 IonicContact NZ-OD2 2.77Å; D309-R311 PolarHBondContact O-N 2.87Å
310I60.2Low74.1Confident112 Ų11269.3 Ų69.357%0.57439%0.394SS*.  trans-20.8115.9177.5-54.3168.3000112.7T312 R315I310-T312 PolarHBondContact O-N 2.93Å; I310-R315 HydrophobicContact CB-CG 4.45Å; I310-R315 HydrophobicContact CG2-CG 3.55Å; I310-R315 PolarHBondContact O-NE 3.46Å
311R78.6Confident74.7Confident140 Ų14070.8 Ų70.853%0.52840%0.397SS..  trans-47.5125.2-178-71.6-17764.7-1400.8110.9D309 D313 E314 R315D309-R311 PolarHBondContact O-N 2.87Å; R311-D313 VanDerWaalsContact CB-OD1 3.31Å; R311-D313 WeakPolarHBondContact CB-OD1 3.16Å; R311-D313 IonicContact CZ-OD1 2.91Å; R311-D313 IonicContact CZ-OD2 2.84Å; R311-D313 IonicContact NE-OD1 3.63Å; R311-D313 PolarHBondContact NE-OD1 3.22Å; R311-D313 IonicContact NE-OD2 2.85Å; R311-D313 IonicContact NH1-OD2 3.78Å; R311-D313 PolarHBondContact NH1-OD2 2.88Å; R311-D313 VanDerWaalsContact NH2-CG 3.32Å; R311-D313 IonicContact NH2-OD1 2.72Å; R311-D313 PolarHBondContact NH2-OD1 3.39Å; R311-D313 IonicContact NH2-OD2 3.98Å; R311-D313 PolarHBondContact NH2-OD2 3.17Å; R311-D313 PolarHBondContact O-N 3.27Å; R311-E314 HydrophobicContact CB-CB 4.39Å; R311-E314 HydrophobicContact CB-CG 4.05Å; R311-E314 WeakPolarHBondContact CD-OE1 3.46Å; R311-E314 IonicContact CZ-OE1 2.76Å; R311-E314 IonicContact NH1-OE1 3.86Å; R311-E314 PolarHBondContact NH1-OE1 3.35Å; R311-E314 PolarHBondContact O-N 3.43Å; R311-R315 PolarHBondContact O-N 3.28Å
312T85.5Confident75.6Confident14 Ų1467.9 Ų67.99%0.08637%0.368CS..Hα-helixtrans-56.6-35.4-176.9-69.90000112.4D299 I310 E314 R315 I316 V374D299-T312 VanDerWaalsContact CG-CG2 3.49Å; D299-T312 WeakPolarHBondContact OD1-CB 3.36Å; D299-T312 WeakPolarHBondContact OD1-CG2 3.41Å; D299-T312 PolarHBondContact OD1-OG1 3.49Å; D299-T312 WeakPolarHBondContact OD2-CG2 3.35Å; I310-T312 PolarHBondContact O-N 2.93Å; T312-E314 PolarHBondContact O-N 3.11Å; T312-R315 PolarHBondContact O-N 2.95Å; T312-R315 PolarHBondContact OG1-NH2 3.37Å; T312-I316 HydrophobicContact CG2-CD1 3.56Å; T312-I316 HydrophobicContact CG2-CG1 4.15Å; T312-I316 WeakPolarHBondContact O-CB 3.5Å; T312-I316 PolarHBondContact O-N 3.41Å; T312-V374 HydrophobicContact CG2-CG1 4.38Å; T312-V374 HydrophobicContact CG2-CG2 4.39Å
313D89.9Confident76.8Confident23 Ų2364.7 Ų64.712%0.12335%0.354CS..Hα-helixtrans-63.1-38.9175.757.5-55.2000113R311 R315 C317 P318 V371 I373 V374R311-D313 VanDerWaalsContact CB-OD1 3.31Å; R311-D313 WeakPolarHBondContact CB-OD1 3.16Å; R311-D313 IonicContact CZ-OD1 2.91Å; R311-D313 IonicContact CZ-OD2 2.84Å; R311-D313 IonicContact NE-OD1 3.63Å; R311-D313 PolarHBondContact NE-OD1 3.22Å; R311-D313 IonicContact NE-OD2 2.85Å; R311-D313 IonicContact NH1-OD2 3.78Å; R311-D313 PolarHBondContact NH1-OD2 2.88Å; R311-D313 VanDerWaalsContact NH2-CG 3.32Å; R311-D313 IonicContact NH2-OD1 2.72Å; R311-D313 PolarHBondContact NH2-OD1 3.39Å; R311-D313 IonicContact NH2-OD2 3.98Å; R311-D313 PolarHBondContact NH2-OD2 3.17Å; R311-D313 PolarHBondContact O-N 3.27Å; D313-R315 VanDerWaalsContact C-N 3.28Å; D313-R315 PolarHBondContact O-N 3.14Å; D313-C317 WeakPolarHBondContact O-CB 3.41Å; D313-C317 PolarHBondContact O-N 2.85Å; D313-C317 PolarHBondContact O-SG 3.06Å; D313-P318 WeakPolarHBondContact O-CD 3.33Å; D313-V371 HydrophobicContact CB-CG1 4.49Å; D313-I373 HydrophobicContact CB-CG2 3.9Å; D313-V374 HydrophobicContact CB-CG2 3.72Å
314E89.7Confident78.9Confident110 Ų11055.5 Ų55.551%0.51431%0.311SS..Hα-helixtrans-69.5-24.5179.4-66.1174-170.400112.9R311 T312 P318R311-E314 HydrophobicContact CB-CB 4.39Å; R311-E314 HydrophobicContact CB-CG 4.05Å; R311-E314 WeakPolarHBondContact CD-OE1 3.46Å; R311-E314 IonicContact CZ-OE1 2.76Å; R311-E314 IonicContact NH1-OE1 3.86Å; R311-E314 PolarHBondContact NH1-OE1 3.35Å; R311-E314 PolarHBondContact O-N 3.43Å; T312-E314 PolarHBondContact O-N 3.11Å; E314-P318 WeakPolarHBondContact O-CD 3.45Å; E314-P318 VanDerWaalsContact O-CG 3.31Å; E314-P318 WeakPolarHBondContact O-CG 3.43Å
315R90.1Very high81.1Confident37 Ų3755.4 Ų55.414%0.1430%0.299CS..Hα-helixtrans-89.3-47.1176.8-66.2-174.6-65.4120.75.3112.8D299 I310 R311 T312 D313D299-R315 IonicContact OD1-NH2 2.64Å; D299-R315 PolarHBondContact OD1-NH2 3.47Å; I310-R315 HydrophobicContact CB-CG 4.45Å; I310-R315 HydrophobicContact CG2-CG 3.55Å; I310-R315 PolarHBondContact O-NE 3.46Å; R311-R315 PolarHBondContact O-N 3.28Å; T312-R315 PolarHBondContact O-N 2.95Å; T312-R315 PolarHBondContact OG1-NH2 3.37Å; D313-R315 VanDerWaalsContact C-N 3.28Å; D313-R315 PolarHBondContact O-N 3.14Å
316I93.6Very high83.3Confident0 Ų048.8 Ų48.80%027%0.268CS..Hα-helixtrans-88.7-41.2-169.1-59.8-175.2000111.7L296 D299 T312 I319 L320 L366L296-I316 HydrophobicContact CD2-CD1 4.28Å; L296-I316 HydrophobicContact CD2-CG2 4.43Å; D299-I316 HydrophobicContact CB-CD1 3.82Å; T312-I316 HydrophobicContact CG2-CD1 3.56Å; T312-I316 HydrophobicContact CG2-CG1 4.15Å; T312-I316 WeakPolarHBondContact O-CB 3.5Å; T312-I316 PolarHBondContact O-N 3.41Å; I316-I319 WeakPolarHBondContact O-CG2 3.49Å; I316-I319 PolarHBondContact O-N 3.18Å; I316-L320 HydrophobicContact CG2-CD1 3.52Å; I316-L320 HydrophobicContact CG2-CG 3.87Å; I316-L320 WeakPolarHBondContact O-CG 3.45Å; I316-L320 PolarHBondContact O-N 3.29Å; I316-L366 HydrophobicContact CD1-CD1 4.17Å; I316-L366 HydrophobicContact CD1-CD2 4.5Å; I316-L366 HydrophobicContact CG2-CD1 3.91Å
317C96.7Very high85.9Confident17 Ų1744.9 Ų44.912%0.11524%0.244CC..Hα-helixtrans-63-40.6-174.3-57.60000113D313 I319 L320 N321D313-C317 WeakPolarHBondContact O-CB 3.41Å; D313-C317 PolarHBondContact O-N 2.85Å; D313-C317 PolarHBondContact O-SG 3.06Å; C317-I319 PolarHBondContact O-N 2.81Å; C317-L320 PolarHBondContact O-N 3.39Å; C317-N321 VanDerWaalsContact O-CB 3.27Å; C317-N321 WeakPolarHBondContact O-CB 3.38Å; C317-N321 PolarHBondContact O-N 2.84Å
318P97Very high88.2Confident29 Ų2942.9 Ų42.919%0.18821%0.213CC..Hα-helixtrans-59.4-43.5178.5-2837.1000113.3V242 N246 D313 E314 C322V242-P318 HydrophobicContact CG1-CB 3.96Å; V242-P318 WeakPolarHBondContact CG1-O 3.45Å; N246-P318 PolarHBondContact ND2-O 3.37Å; N246-P318 PolarHBondContact OD1-O 3.16Å; D313-P318 WeakPolarHBondContact O-CD 3.33Å; E314-P318 WeakPolarHBondContact O-CD 3.45Å; E314-P318 VanDerWaalsContact O-CG 3.31Å; E314-P318 WeakPolarHBondContact O-CG 3.43Å; P318-C322 VanDerWaalsContact O-CB 3.29Å; P318-C322 WeakPolarHBondContact O-CB 3.41Å; P318-C322 PolarHBondContact O-N 3.46Å
319I97.8Very high90.6Very high0 Ų039.9 Ų39.90%019%0.193CC..Hα-helixtrans-72.4-38.8179.9-179.760.1000111.8V242 L288 F291 L292 I316 C317 C322 L323V242-I319 HydrophobicContact CG1-CB 4.13Å; V242-I319 HydrophobicContact CG1-CD1 4.38Å; V242-I319 HydrophobicContact CG2-CD1 3.7Å; L288-I319 HydrophobicContact CB-CD1 4.18Å; L288-I319 HydrophobicContact CD2-CD1 4.07Å; F291-I319 HydrophobicContact CD1-CB 4.21Å; F291-I319 HydrophobicContact CD1-CD1 4.01Å; F291-I319 HydrophobicContact CD1-CG1 3.93Å; F291-I319 HydrophobicContact CE1-CB 4.25Å; F291-I319 HydrophobicContact CE1-CG1 4.47Å; L292-I319 HydrophobicContact CB-CG1 3.84Å; L292-I319 HydrophobicContact CD1-CG1 4.38Å; L292-I319 HydrophobicContact CD1-CG2 3.8Å; I316-I319 WeakPolarHBondContact O-CG2 3.49Å; I316-I319 PolarHBondContact O-N 3.18Å; C317-I319 PolarHBondContact O-N 2.81Å; I319-C322 PolarHBondContact O-N 2.72Å; I319-L323 HydrophobicContact CD1-CD1 4.06Å; I319-L323 HydrophobicContact CD1-CG 4.09Å; I319-L323 HydrophobicContact CG1-CD1 4.1Å; I319-L323 PolarHBondContact O-N 3.22Å
320L98.4Very high92.6Very high0 Ų036.5 Ų36.50%018%0.175CC..Hα-helixtrans-60.6-46.7173.3-73.6179.2000111.6L292 I316 C317 C322 L323 T324 L363 A378 F381L292-L320 HydrophobicContact CD1-CD2 3.75Å; L292-L320 HydrophobicContact CD1-CG 4.15Å; L292-L320 HydrophobicContact CD2-CD2 4.06Å; I316-L320 HydrophobicContact CG2-CD1 3.52Å; I316-L320 HydrophobicContact CG2-CG 3.87Å; I316-L320 WeakPolarHBondContact O-CG 3.45Å; I316-L320 PolarHBondContact O-N 3.29Å; C317-L320 PolarHBondContact O-N 3.39Å; L320-C322 VanDerWaalsContact C-N 3.33Å; L320-C322 PolarHBondContact O-N 3.5Å; L320-L323 PolarHBondContact O-N 3Å; L320-T324 VanDerWaalsContact O-CB 3.23Å; L320-T324 WeakPolarHBondContact O-CB 3.27Å; L320-T324 PolarHBondContact O-N 2.89Å; L320-T324 PolarHBondContact O-OG1 3.5Å; L320-L363 HydrophobicContact CD2-CD2 3.74Å; L320-A378 HydrophobicContact CD1-CB 4.17Å; L320-F381 HydrophobicContact CD2-CB 4.32Å; L320-F381 HydrophobicContact CD2-CD1 3.65Å; L320-F381 HydrophobicContact CD2-CE1 4.34Å; L320-F381 HydrophobicContact CD2-CG 4.27Å
321N98.1Very high94.2Very high66 Ų6637.7 Ų37.735%0.35317%0.172SC..Hα-helixtrans-62.8-41.9177.4-175.658000111.2N246 C317 T324 R325N246-N321 PolarHBondContact OD1-ND2 3.35Å; C317-N321 VanDerWaalsContact O-CB 3.27Å; C317-N321 WeakPolarHBondContact O-CB 3.38Å; C317-N321 PolarHBondContact O-N 2.84Å; N321-T324 PolarHBondContact O-N 3.34Å; N321-R325 WeakPolarHBondContact ND2-CD 3.34Å; N321-R325 WeakPolarHBondContact O-CB 3.37Å; N321-R325 VanDerWaalsContact O-CG 3.25Å; N321-R325 WeakPolarHBondContact O-CG 3.36Å; N321-R325 PolarHBondContact O-N 3.3Å
322C98.1Very high94.9Very high0 Ų034.6 Ų34.60%016%0.163CC..Hα-helixtrans-59.9-50.3177.21780000111.6V242 N246 P318 I319 L320 T324 R325 A326V242-C322 HydrophobicContact CG1-CB 4.02Å; N246-C322 WeakPolarHBondContact OD1-CA 3.3Å; N246-C322 PolarHBondContact OD1-N 3.32Å; N246-C322 VanDerWaalsContact OD1-N 3.09Å; P318-C322 VanDerWaalsContact O-CB 3.29Å; P318-C322 WeakPolarHBondContact O-CB 3.41Å; P318-C322 PolarHBondContact O-N 3.46Å; I319-C322 PolarHBondContact O-N 2.72Å; L320-C322 VanDerWaalsContact C-N 3.33Å; L320-C322 PolarHBondContact O-N 3.5Å; C322-T324 VanDerWaalsContact C-N 3.34Å; C322-T324 PolarHBondContact O-N 2.82Å; C322-R325 PolarHBondContact O-N 3.33Å; C322-A326 WeakPolarHBondContact O-CB 3.21Å; C322-A326 PolarHBondContact O-N 2.99Å
323L98.5Very high95.3Very high0 Ų033.9 Ų33.90%016%0.159CC..Hα-helixtrans-67.6-33.1178.4-72.7169.6000112.6L288 I289 L292 I319 L320 S327 F381L288-L323 HydrophobicContact CB-CD2 4.03Å; I289-L323 HydrophobicContact CG1-CD1 4.45Å; I289-L323 HydrophobicContact CG1-CD2 4.23Å; L292-L323 HydrophobicContact CB-CD1 4.11Å; L292-L323 HydrophobicContact CD2-CD1 3.71Å; L292-L323 HydrophobicContact CG-CD1 4.48Å; I319-L323 HydrophobicContact CD1-CD1 4.06Å; I319-L323 HydrophobicContact CD1-CG 4.09Å; I319-L323 HydrophobicContact CG1-CD1 4.1Å; I319-L323 PolarHBondContact O-N 3.22Å; L320-L323 PolarHBondContact O-N 3Å; L323-S327 VanDerWaalsContact O-CB 3.22Å; L323-S327 WeakPolarHBondContact O-CB 3.3Å; L323-S327 PolarHBondContact O-N 3.4Å; L323-S327 PolarHBondContact O-OG 3.19Å; L323-F381 HydrophobicContact CB-CD2 4.35Å; L323-F381 HydrophobicContact CB-CE2 3.67Å; L323-F381 HydrophobicContact CB-CZ 3.76Å; L323-F381 HydrophobicContact CD1-CE1 4.47Å; L323-F381 HydrophobicContact CD1-CZ 4.16Å
324T98.4Very high95.6Very high6 Ų633.5 Ų33.54%0.03716%0.156CC..Hα-helixtrans-63.7-50.9173.4-61.20000110.7L320 N321 C322 A326 S327 K328 L380 F381 V384L320-T324 VanDerWaalsContact O-CB 3.23Å; L320-T324 WeakPolarHBondContact O-CB 3.27Å; L320-T324 PolarHBondContact O-N 2.89Å; L320-T324 PolarHBondContact O-OG1 3.5Å; N321-T324 PolarHBondContact O-N 3.34Å; C322-T324 VanDerWaalsContact C-N 3.34Å; C322-T324 PolarHBondContact O-N 2.82Å; T324-A326 PolarHBondContact O-N 3Å; T324-S327 PolarHBondContact O-N 3.39Å; T324-K328 PolarHBondContact O-N 3.37Å; T324-L380 HydrophobicContact CG2-CD2 4.2Å; T324-L380 HydrophobicContact CG2-CG 3.98Å; T324-F381 WeakPolarHBondContact OG1-CA 3.31Å; T324-F381 VanDerWaalsContact OG1-CB 3.29Å; T324-F381 WeakPolarHBondContact OG1-CB 3.4Å; T324-F381 WeakPolarHBondContact OG1-CD2 3.39Å; T324-V384 HydrophobicContact CG2-CB 4.45Å; T324-V384 HydrophobicContact CG2-CG2 3.87Å
325R97.5Very high95.8Very high74 Ų7433.4 Ų33.428%0.27915%0.154SC..Hα-helixtrans-59.8-45.2176.5-71.7170.667.790.8-4.3111.4I248 Y253 N321 C322 S327 K328 S329I248-R325 PolarHBondContact O-NH2 3.25Å; Y253-R325 HydrophobicContact CE1-CB 4.47Å; Y253-R325 HydrophobicContact CE2-CB 4.27Å; Y253-R325 PolarHBondContact OH-NE 2.93Å; N321-R325 WeakPolarHBondContact ND2-CD 3.34Å; N321-R325 WeakPolarHBondContact O-CB 3.37Å; N321-R325 VanDerWaalsContact O-CG 3.25Å; N321-R325 WeakPolarHBondContact O-CG 3.36Å; N321-R325 PolarHBondContact O-N 3.3Å; C322-R325 PolarHBondContact O-N 3.33Å; R325-S327 VanDerWaalsContact C-N 3.33Å; R325-S327 PolarHBondContact O-N 3.04Å; R325-K328 PolarHBondContact O-N 3.15Å; R325-S329 WeakPolarHBondContact O-CB 3.42Å; R325-S329 PolarHBondContact O-N 3.34Å; R325-S329 PolarHBondContact O-OG 3.13Å
326A97.2Very high96.1Very high0 Ų033 Ų330%015%0.153CC..Hα-helixtrans-59-45.4176.100000111.4Y253 C322 T324 S329 N330 I333Y253-A326 HydrophobicContact CD1-CB 3.37Å; Y253-A326 HydrophobicContact CE1-CB 3.73Å; Y253-A326 HydrophobicContact CG-CB 4.27Å; C322-A326 WeakPolarHBondContact O-CB 3.21Å; C322-A326 PolarHBondContact O-N 2.99Å; T324-A326 PolarHBondContact O-N 3Å; A326-S329 PolarHBondContact O-N 3.32Å; A326-S329 PolarHBondContact O-OG 3.02Å; A326-N330 PolarHBondContact O-N 2.8Å; A326-N330 VanDerWaalsContact O-N 3.12Å; A326-I333 HydrophobicContact CB-CD1 4.3Å; A326-I333 HydrophobicContact CB-CG2 3.85Å
327S96.9Very high96.3Very high0 Ų033 Ų330%015%0.153CC..Hα-helixtrans-68.5-35179.1-63.30000113.3L323 T324 R325 R334L323-S327 VanDerWaalsContact O-CB 3.22Å; L323-S327 WeakPolarHBondContact O-CB 3.3Å; L323-S327 PolarHBondContact O-N 3.4Å; L323-S327 PolarHBondContact O-OG 3.19Å; T324-S327 PolarHBondContact O-N 3.39Å; R325-S327 VanDerWaalsContact C-N 3.33Å; R325-S327 PolarHBondContact O-N 3.04Å; S327-R334 WeakPolarHBondContact O-CB 3.45Å; S327-R334 PolarHBondContact O-NH1 3.31Å
328K95.8Very high96.3Very high75 Ų7534 Ų3433%0.32616%0.155SC..Hα-helixtrans-66-42.9171.1-73.2-165.1169.9-154.60110.8T324 R325 N330 V384 E388T324-K328 PolarHBondContact O-N 3.37Å; R325-K328 PolarHBondContact O-N 3.15Å; K328-N330 PolarHBondContact O-N 2.98Å; K328-V384 HydrophobicContact CD-CG2 4.12Å; K328-V384 HydrophobicContact CG-CB 4.49Å; K328-V384 HydrophobicContact CG-CG1 3.72Å; K328-V384 HydrophobicContact CG-CG2 3.86Å; K328-E388 VanDerWaalsContact CE-OE1 3.28Å; K328-E388 WeakPolarHBondContact CE-OE1 3.42Å; K328-E388 IonicContact NZ-OE1 2.84Å; K328-E388 PolarHBondContact NZ-OE1 2.76Å
329S94.2Very high96.1Very high38 Ų3836.3 Ų36.327%0.26617%0.165SC..Hα-helixtrans-69.9-31-174.874.20000115.7K250 Y253 R325 A326K250-S329 WeakPolarHBondContact O-CB 3.28Å; K250-S329 PolarHBondContact O-OG 3.2Å; Y253-S329 VanDerWaalsContact CB-OG 3.31Å; Y253-S329 WeakPolarHBondContact CB-OG 3.31Å; R325-S329 WeakPolarHBondContact O-CB 3.42Å; R325-S329 PolarHBondContact O-N 3.34Å; R325-S329 PolarHBondContact O-OG 3.13Å; A326-S329 PolarHBondContact O-N 3.32Å; A326-S329 PolarHBondContact O-OG 3.02Å
330N93.4Very high96Very high26 Ų2641 Ų4114%0.13919%0.185CC..  trans-143.4121-169.2-172.9-55.3000111.6A326 K328 Q332 I333 R334A326-N330 PolarHBondContact O-N 2.8Å; A326-N330 VanDerWaalsContact O-N 3.12Å; K328-N330 PolarHBondContact O-N 2.98Å; N330-Q332 VanDerWaalsContact C-N 3.29Å; N330-Q332 PolarHBondContact O-N 3.48Å; N330-Q332 WeakPolarHBondContact OD1-CA 3.48Å; N330-Q332 VanDerWaalsContact OD1-CB 3.31Å; N330-Q332 WeakPolarHBondContact OD1-CB 3.41Å; N330-Q332 PolarHBondContact OD1-N 2.91Å; N330-I333 HydrophobicContact CB-CB 4.11Å; N330-I333 HydrophobicContact CB-CD1 3.78Å; N330-I333 HydrophobicContact CB-CG1 3.87Å; N330-I333 PolarHBondContact O-N 3.4Å; N330-I333 PolarHBondContact OD1-N 3.32Å; N330-R334 PolarHBondContact O-N 3.17Å
331R92.6Very high95.9Very high136 Ų13641 Ų4151%0.51319%0.185SC..Hα-helixtrans-57.8-38.3-179.7178.1-178.7173.7-1731.3113.3K335 S432R331-K335 WeakPolarHBondContact O-CB 3.28Å; R331-K335 PolarHBondContact O-N 3.02Å; R331-S432 PolarHBondContact NH1-OG 3.02Å; R331-S432 PolarHBondContact NH2-OG 3.38Å
332Q92.9Very high95.8Very high75 Ų7537.9 Ų37.935%0.3517%0.168SC..Hα-helixtrans-73.5-39.6-176-171.249.81400110.4L257 M282 N330 K335 F336L257-Q332 HydrophobicContact CD1-CB 4.48Å; M282-Q332 VanDerWaalsContact CE-C 3.43Å; M282-Q332 HydrophobicContact CE-CB 4.06Å; M282-Q332 HydrophobicContact CE-CG 3.47Å; M282-Q332 VanDerWaalsContact CE-CG 3.47Å; M282-Q332 VanDerWaalsContact CE-O 3.32Å; M282-Q332 WeakPolarHBondContact CE-O 3.33Å; N330-Q332 VanDerWaalsContact C-N 3.29Å; N330-Q332 PolarHBondContact O-N 3.48Å; N330-Q332 WeakPolarHBondContact OD1-CA 3.48Å; N330-Q332 VanDerWaalsContact OD1-CB 3.31Å; N330-Q332 WeakPolarHBondContact OD1-CB 3.41Å; N330-Q332 PolarHBondContact OD1-N 2.91Å; Q332-K335 PolarHBondContact O-N 3.04Å; Q332-F336 PolarHBondContact O-N 3.36Å
333I95.3Very high95.4Very high0 Ų039.8 Ų39.80%018%0.181CC..Hα-helixtrans-58.8-52.8169.8-63.9179.5000109.9L257 M282 I285 A326 N330 K335 F336 C337L257-I333 HydrophobicContact CD1-CG1 4.21Å; L257-I333 HydrophobicContact CD2-CD1 4.36Å; L257-I333 HydrophobicContact CD2-CG1 3.84Å; L257-I333 HydrophobicContact CG-CD1 4.46Å; L257-I333 HydrophobicContact CG-CG1 4.23Å; M282-I333 HydrophobicContact CE-CG1 4.48Å; I285-I333 HydrophobicContact CD1-CD1 4.05Å; I285-I333 HydrophobicContact CD1-CG1 4.3Å; I285-I333 HydrophobicContact CD1-CG2 4.26Å; I285-I333 HydrophobicContact CG1-CG1 4.34Å; I285-I333 HydrophobicContact CG1-CG2 4.49Å; I285-I333 HydrophobicContact CG2-CG2 4.22Å; A326-I333 HydrophobicContact CB-CD1 4.3Å; A326-I333 HydrophobicContact CB-CG2 3.85Å; N330-I333 HydrophobicContact CB-CB 4.11Å; N330-I333 HydrophobicContact CB-CD1 3.78Å; N330-I333 HydrophobicContact CB-CG1 3.87Å; N330-I333 PolarHBondContact O-N 3.4Å; N330-I333 PolarHBondContact OD1-N 3.32Å; I333-K335 VanDerWaalsContact C-N 3.3Å; I333-K335 PolarHBondContact O-N 3.23Å; I333-F336 WeakPolarHBondContact O-CB 3.18Å; I333-F336 PolarHBondContact O-N 3.03Å; I333-F336 VanDerWaalsContact O-N 3.08Å; I333-C337 PolarHBondContact O-N 2.91Å; I333-C337 PolarHBondContact O-SG 2.64Å; I333-C337 VanDerWaalsContact O-SG 3.38Å
334R96.1Very high95.1Very high14 Ų1443.7 Ų43.75%0.05320%0.196CC..Hα-helixtrans-55.5-43.8179.3-174171.258.5-115.416.2112.7S327 N330 R338 V384 L385 Y431S327-R334 WeakPolarHBondContact O-CB 3.45Å; S327-R334 PolarHBondContact O-NH1 3.31Å; N330-R334 PolarHBondContact O-N 3.17Å; R334-R338 WeakPolarHBondContact O-CB 3.31Å; R334-R338 PolarHBondContact O-N 3.27Å; R334-V384 WeakPolarHBondContact CD-O 3.31Å; R334-L385 HydrophobicContact CG-CD2 4.37Å; R334-Y431 VanDerWaalsContact NE-CE1 3.3Å
335K94.5Very high94.5Very high109 Ų10943.9 Ų43.947%0.47420%0.197SC..Hα-helixtrans-62.2-43.7178-175.1179.8178.6-177.70111.2R331 Q332 I333 L339R331-K335 WeakPolarHBondContact O-CB 3.28Å; R331-K335 PolarHBondContact O-N 3.02Å; Q332-K335 PolarHBondContact O-N 3.04Å; I333-K335 VanDerWaalsContact C-N 3.3Å; I333-K335 PolarHBondContact O-N 3.23Å; K335-L339 HydrophobicContact CG-CD1 4.22Å; K335-L339 WeakPolarHBondContact O-CD1 3.35Å; K335-L339 WeakPolarHBondContact O-CG 3.41Å; K335-L339 PolarHBondContact O-N 3.14Å; K335-L339 VanDerWaalsContact O-N 3.11Å
336F95.7Very high94Very high28 Ų2840.9 Ų40.912%0.12319%0.189CC..Hα-helixtrans-64.6-51177.4-175.8-100.5000111.6M282 I285 E286 I289 Q332 I333 R338 L339 K340M282-F336 HydrophobicContact CB-CD1 4.08Å; M282-F336 HydrophobicContact CB-CD2 3.81Å; M282-F336 HydrophobicContact CB-CE1 3.94Å; M282-F336 HydrophobicContact CB-CE2 3.66Å; M282-F336 HydrophobicContact CB-CG 4.01Å; M282-F336 HydrophobicContact CB-CZ 3.73Å; M282-F336 HydrophobicContact CE-CB 4.03Å; M282-F336 HydrophobicContact CG-CB 4.14Å; M282-F336 HydrophobicContact CG-CD1 4.19Å; M282-F336 HydrophobicContact CG-CD2 3.67Å; M282-F336 HydrophobicContact CG-CE2 4.07Å; M282-F336 HydrophobicContact CG-CG 3.73Å; M282-F336 HydrophobicContact CG-CZ 4.48Å; M282-F336 HydrophobicContact SD-CB 3.69Å; M282-F336 HydrophobicContact SD-CD1 3.92Å; M282-F336 HydrophobicContact SD-CD2 4.29Å; M282-F336 HydrophobicContact SD-CG 3.71Å; I285-F336 HydrophobicContact CB-CD1 4.2Å; I285-F336 HydrophobicContact CB-CE1 4.31Å; I285-F336 HydrophobicContact CG2-CD1 3.75Å; I285-F336 HydrophobicContact CG2-CE1 4.15Å; E286-F336 HydrophobicContact CB-CE1 4.07Å; E286-F336 HydrophobicContact CB-CZ 4Å; E286-F336 HydrophobicContact CG-CZ 4.44Å; I289-F336 HydrophobicContact CD1-CD1 3.97Å; I289-F336 HydrophobicContact CD1-CE1 3.88Å; Q332-F336 PolarHBondContact O-N 3.36Å; I333-F336 WeakPolarHBondContact O-CB 3.18Å; I333-F336 PolarHBondContact O-N 3.03Å; I333-F336 VanDerWaalsContact O-N 3.08Å; F336-R338 VanDerWaalsContact C-N 3.34Å; F336-R338 PolarHBondContact O-N 3.22Å; F336-L339 PolarHBondContact O-N 3.25Å; F336-L339 VanDerWaalsContact O-N 3.13Å; F336-K340 HydrophobicContact CE1-CG 4.19Å; F336-K340 HydrophobicContact CE2-CG 4.48Å; F336-K340 HydrophobicContact CZ-CG 4.15Å; F336-K340 PolarHBondContact O-N 2.66Å; F336-K340 VanDerWaalsContact O-N 3.09Å
337C97.2Very high93.4Very high0 Ų048 Ų480%022%0.22CC..Hα-helixtrans-56.8-45.3175.4-64.90000111.7I289 I333 L339 K340 V341 L385I289-C337 HydrophobicContact CD1-CB 4.46Å; I333-C337 PolarHBondContact O-N 2.91Å; I333-C337 PolarHBondContact O-SG 2.64Å; I333-C337 VanDerWaalsContact O-SG 3.38Å; C337-L339 VanDerWaalsContact C-N 3.3Å; C337-L339 PolarHBondContact O-N 3.33Å; C337-K340 PolarHBondContact O-N 3.12Å; C337-V341 WeakPolarHBondContact O-CB 3.42Å; C337-V341 WeakPolarHBondContact O-CG2 3.42Å; C337-V341 PolarHBondContact O-N 3.29Å; C337-L385 HydrophobicContact CB-CD2 3.55Å
338R96Very high92.9Very high39 Ų3949.3 Ų49.315%0.14723%0.227CC..Hα-helixtrans-58.3-40.7177.2-177.8-117.377.377.2-6.2112.3R334 F336 L342 L385 Y396R334-R338 WeakPolarHBondContact O-CB 3.31Å; R334-R338 PolarHBondContact O-N 3.27Å; F336-R338 VanDerWaalsContact C-N 3.34Å; F336-R338 PolarHBondContact O-N 3.22Å; R338-L342 PolarHBondContact NH1-O 2.92Å; R338-L342 CarbonylContact O-C 3.34Å; R338-L342 VanDerWaalsContact O-C 3.26Å; R338-L342 WeakPolarHBondContact O-CA 2.82Å; R338-L342 PolarHBondContact O-N 3.18Å; R338-L342 VanDerWaalsContact O-O 3.1Å; R338-L385 HydrophobicContact CB-CB 4.42Å; R338-L385 HydrophobicContact CB-CD2 4.47Å; R338-Y396 PolarHBondContact NH1-OH 3.48Å
339L94.4Very high92.6Very high77 Ų7745.9 Ų45.940%0.40321%0.212SC..Hα-helixtrans-68.2-39.2179.1-76.3162000112.6K335 F336 C337 Y344K335-L339 HydrophobicContact CG-CD1 4.22Å; K335-L339 WeakPolarHBondContact O-CD1 3.35Å; K335-L339 WeakPolarHBondContact O-CG 3.41Å; K335-L339 PolarHBondContact O-N 3.14Å; K335-L339 VanDerWaalsContact O-N 3.11Å; F336-L339 PolarHBondContact O-N 3.25Å; F336-L339 VanDerWaalsContact O-N 3.13Å; C337-L339 VanDerWaalsContact C-N 3.3Å; C337-L339 PolarHBondContact O-N 3.33Å; L339-Y344 HydrophobicContact CD2-CE2 4.4Å
340K95.5Very high92.4Very high97 Ų9749.1 Ų49.142%0.42222%0.221SC..Hα-helixtrans-81-42.6-178.5-70.6-80.8-178.7160.50112.9E286 I289 F336 C337E286-K340 IonicContact OE1-NZ 3.51Å; E286-K340 PolarHBondContact OE1-NZ 3.02Å; I289-K340 HydrophobicContact CD1-CB 4.01Å; I289-K340 HydrophobicContact CD1-CG 4.32Å; I289-K340 HydrophobicContact CG2-CB 4.31Å; F336-K340 HydrophobicContact CE1-CG 4.19Å; F336-K340 HydrophobicContact CE2-CG 4.48Å; F336-K340 HydrophobicContact CZ-CG 4.15Å; F336-K340 PolarHBondContact O-N 2.66Å; F336-K340 VanDerWaalsContact O-N 3.09Å; C337-K340 PolarHBondContact O-N 3.12Å
341V96.8Very high92.4Very high1 Ų153.3 Ų53.31%0.00624%0.235CC..Hα-helixtrans-84.4-40.9-174.5176.70000112.1I289 C337 P343 I359 R360 L363 F381 L385I289-V341 HydrophobicContact CG2-CG2 4.46Å; C337-V341 WeakPolarHBondContact O-CB 3.42Å; C337-V341 WeakPolarHBondContact O-CG2 3.42Å; C337-V341 PolarHBondContact O-N 3.29Å; V341-P343 VanDerWaalsContact O-CD 3.29Å; V341-P343 WeakPolarHBondContact O-CD 3.26Å; V341-I359 HydrophobicContact CB-CG2 4.42Å; V341-I359 HydrophobicContact CG1-CB 4.46Å; V341-I359 HydrophobicContact CG1-CG2 3.83Å; V341-I359 HydrophobicContact CG2-CD1 4.44Å; V341-I359 HydrophobicContact CG2-CG2 4.23Å; V341-R360 WeakPolarHBondContact O-CB 3.26Å; V341-R360 PolarHBondContact O-N 3.47Å; V341-L363 HydrophobicContact CG1-CD1 3.45Å; V341-L363 VanDerWaalsContact CG1-CD1 3.45Å; V341-F381 HydrophobicContact CG1-CE1 4.06Å; V341-F381 HydrophobicContact CG2-CE1 4.12Å; V341-F381 HydrophobicContact CG2-CZ 4.12Å; V341-L385 HydrophobicContact CB-CD1 3.8Å; V341-L385 HydrophobicContact CG1-CD1 3.8Å; V341-L385 HydrophobicContact CG2-CD1 4.34Å
342L95Very high92.5Very high0 Ų048.4 Ų48.40%022%0.219CC..SBendtrans-119.765.1-177.7-58.9178.2000110.6R338 R360 I382 L385 Y396R338-L342 PolarHBondContact NH1-O 2.92Å; R338-L342 CarbonylContact O-C 3.34Å; R338-L342 VanDerWaalsContact O-C 3.26Å; R338-L342 WeakPolarHBondContact O-CA 2.82Å; R338-L342 PolarHBondContact O-N 3.18Å; R338-L342 VanDerWaalsContact O-O 3.1Å; L342-R360 HydrophobicContact CD2-CB 4.21Å; L342-R360 HydrophobicContact CD2-CG 3.79Å; L342-I382 HydrophobicContact CD1-CG2 4.26Å; L342-L385 HydrophobicContact CD1-CB 3.88Å; L342-L385 HydrophobicContact CD1-CD1 4.18Å; L342-L385 HydrophobicContact CG-CD1 4.25Å; L342-Y396 HydrophobicContact CB-CD1 4.25Å; L342-Y396 HydrophobicContact CB-CE1 4.3Å; L342-Y396 HydrophobicContact CB-CG 4.47Å; L342-Y396 HydrophobicContact CD1-CD2 4.46Å; L342-Y396 HydrophobicContact CD2-CG 4.48Å
343P90.2Very high92.5Very high40 Ų4045.1 Ų45.126%0.2620%0.204SC..  trans-58.9157.6177.928.3-35.5000110.8V341 L345 Y396V341-P343 VanDerWaalsContact O-CD 3.29Å; V341-P343 WeakPolarHBondContact O-CD 3.26Å; P343-L345 PolarHBondContact O-N 2.93Å; P343-Y396 WeakPolarHBondContact O-CE1 3.47Å
344Y90.9Very high92.5Very high83 Ų8347.7 Ų47.733%0.32522%0.216SC..  trans-61.7136178.7-59.2-62000110.9L339 G346 S438L339-Y344 HydrophobicContact CD2-CE2 4.4Å; Y344-G346 PolarHBondContact O-N 3.41Å; Y344-S438 WeakPolarHBondContact CD1-O 3.45Å; Y344-S438 WeakPolarHBondContact CE1-O 3.46Å; Y344-S438 VanDerWaalsContact CG-O 3.31Å; Y344-S438 VanDerWaalsContact CZ-CB 3.47Å; Y344-S438 VanDerWaalsContact OH-CB 3.26Å; Y344-S438 WeakPolarHBondContact OH-CB 3.43Å; Y344-S438 PolarHBondContact OH-OG 2.95Å
345L87.6Confident92.3Very high10 Ų1051 Ų515%0.05224%0.235CC..  trans-60-38.5-164.5-64.2174.8000113.7P343 K347 D348 V349 K395 Y396 Y443P343-L345 PolarHBondContact O-N 2.93Å; L345-K347 PolarHBondContact O-N 3.47Å; L345-K347 VanDerWaalsContact O-N 3.15Å; L345-D348 WeakPolarHBondContact O-CA 3.33Å; L345-D348 WeakPolarHBondContact O-CB 3.49Å; L345-D348 PolarHBondContact O-N 3.45Å; L345-V349 HydrophobicContact CB-CB 4.33Å; L345-K395 HydrophobicContact CD1-CG 3.94Å; L345-K395 WeakPolarHBondContact CD1-O 3.24Å; L345-Y396 HydrophobicContact CD2-CD1 3.62Å; L345-Y396 HydrophobicContact CD2-CE1 3.94Å; L345-Y396 HydrophobicContact CG-CD1 4.06Å; L345-Y396 HydrophobicContact CG-CE1 3.96Å; L345-Y443 HydrophobicContact CB-CD2 4.04Å; L345-Y443 HydrophobicContact CD1-CD2 3.73Å; L345-Y443 HydrophobicContact CD1-CE2 3.53Å; L345-Y443 HydrophobicContact CG-CD2 4.46Å
346G85.8Confident92.1Very high10 Ų1047.3 Ų47.310%0.10323%0.228CC..G310 helixtrans46.7-125.1179.500000112.3Y344 D348 V349 T440Y344-G346 PolarHBondContact O-N 3.41Å; G346-D348 VanDerWaalsContact C-N 3.31Å; G346-D348 PolarHBondContact O-N 3.27Å; G346-V349 WeakPolarHBondContact O-CG1 3.44Å; G346-T440 WeakPolarHBondContact CA-OG1 3.07Å; G346-T440 PolarHBondContact N-OG1 3.15Å; G346-T440 VanDerWaalsContact N-OG1 3.15Å
347K84.2Confident92Very high150 Ų15050.6 Ų50.665%0.65225%0.247SC*.G310 helixtrans-67.7-25.1175.9-64-176.9177.7178.90114.2L345 V349 K350 E442L345-K347 PolarHBondContact O-N 3.47Å; L345-K347 VanDerWaalsContact O-N 3.15Å; K347-V349 PolarHBondContact O-N 3.23Å; K347-V349 VanDerWaalsContact O-N 3.16Å; K347-K350 PolarHBondContact O-N 3.15Å; K347-K350 VanDerWaalsContact O-N 3.14Å; K347-E442 VanDerWaalsContact CG-CD 3.5Å; K347-E442 VanDerWaalsContact CG-OE1 3.31Å; K347-E442 WeakPolarHBondContact CG-OE1 3.49Å; K347-E442 WeakPolarHBondContact CG-OE2 3.35Å; K347-E442 PolarHBondContact N-OE2 3.49Å
348D87.4Confident91.8Very high28 Ų2853.6 Ų53.615%0.1526%0.263CS..G310 helixtrans-66.2-18.3-175.1-67.8-24.6000112.7L345 G346 K350 R351 R360L345-D348 WeakPolarHBondContact O-CA 3.33Å; L345-D348 WeakPolarHBondContact O-CB 3.49Å; L345-D348 PolarHBondContact O-N 3.45Å; G346-D348 VanDerWaalsContact C-N 3.31Å; G346-D348 PolarHBondContact O-N 3.27Å; D348-K350 PolarHBondContact O-N 3.4Å; D348-K350 VanDerWaalsContact O-N 3.11Å; D348-R351 PolarHBondContact O-N 2.92Å; D348-R351 VanDerWaalsContact O-N 3.08Å; D348-R351 IonicContact OD1-CZ 3Å; D348-R351 IonicContact OD1-NE 3.9Å; D348-R351 IonicContact OD1-NH2 3.86Å; D348-R351 PolarHBondContact OD1-NH2 3.42Å; D348-R360 IonicContact OD2-NH1 2.66Å
349V89.7Confident91.9Very high2 Ų252.3 Ų52.31%0.01226%0.259CS..G310 helixtrans-59.4-19.6173.975.10000112.6L345 G346 K347 R351 Y443 L446 V450 R456 W457L345-V349 HydrophobicContact CB-CB 4.33Å; G346-V349 WeakPolarHBondContact O-CG1 3.44Å; K347-V349 PolarHBondContact O-N 3.23Å; K347-V349 VanDerWaalsContact O-N 3.16Å; V349-R351 VanDerWaalsContact C-N 3.32Å; V349-Y443 HydrophobicContact CB-CD2 4.23Å; V349-Y443 HydrophobicContact CG2-CD2 3.88Å; V349-Y443 HydrophobicContact CG2-CE2 3.95Å; V349-L446 HydrophobicContact CG1-CB 4.29Å; V349-L446 HydrophobicContact CG1-CD1 3.53Å; V349-V450 HydrophobicContact CG2-CG1 4.48Å; V349-V450 HydrophobicContact CG2-CG2 3.51Å; V349-R456 CarbonylContact O-C 3.5Å; V349-R456 WeakPolarHBondContact O-CA 3.34Å; V349-W457 PolarHBondContact O-N 3.01Å
350K90.3Very high92Very high106 Ų10648.9 Ų48.946%0.46124%0.24SC..G310 helixtrans-80.8-11.2178.4-61.8179.8-178.8173.90113.9K347 D348 E442 L446 W457K347-K350 PolarHBondContact O-N 3.15Å; K347-K350 VanDerWaalsContact O-N 3.14Å; D348-K350 PolarHBondContact O-N 3.4Å; D348-K350 VanDerWaalsContact O-N 3.11Å; K350-E442 IonicContact NZ-OE1 3.03Å; K350-L446 HydrophobicContact CG-CD1 4.3Å; K350-W457 HydrophobicContact CG-CE3 4.2Å
351R92.6Very high92Very high114 Ų11444.2 Ų44.243%0.4322%0.22SC..SBendtrans-110.8161-179.6-64.8-174.1-71.8174.4-1.1109.6D348 V349 D355 R456D348-R351 PolarHBondContact O-N 2.92Å; D348-R351 VanDerWaalsContact O-N 3.08Å; D348-R351 IonicContact OD1-CZ 3Å; D348-R351 IonicContact OD1-NE 3.9Å; D348-R351 IonicContact OD1-NH2 3.86Å; D348-R351 PolarHBondContact OD1-NH2 3.42Å; V349-R351 VanDerWaalsContact C-N 3.32Å; R351-D355 HydrophobicContact CB-CB 4.45Å; R351-R456 VanDerWaalsContact O-CB 3.31Å; R351-R456 WeakPolarHBondContact O-CB 3.44Å
352L93.8Very high92Very high34 Ų3446.1 Ų46.118%0.17823%0.228CC..  trans-61.1145.5171.6-72.5166000110.1E354 D355 R456L352-E354 HydrophobicContact CB-CG 4.28Å; L352-E354 PolarHBondContact O-N 3.23Å; L352-D355 HydrophobicContact CB-CB 4.17Å; L352-D355 WeakPolarHBondContact O-CB 3.2Å; L352-D355 PolarHBondContact O-N 2.93Å; L352-R456 HydrophobicContact CD2-CG 4.31Å
353P94.7Very high92.2Very high5 Ų546.1 Ų46.13%0.03223%0.228CC..THydrogen-bonded Turntrans-55.2-33.7178.8-2936.8000113.8N361 C364 T397 T454P353-N361 VanDerWaalsContact O-CA 3.25Å; P353-N361 WeakPolarHBondContact O-CA 3.47Å; P353-N361 PolarHBondContact O-ND2 2.81Å; P353-C364 HydrophobicContact CB-CB 4.1Å; P353-T397 WeakPolarHBondContact CB-O 3.48Å; P353-T397 WeakPolarHBondContact CG-O 3.49Å; P353-T454 WeakPolarHBondContact CD-O 3.07Å; P353-T454 WeakPolarHBondContact CG-O 3.31Å
354E93.8Very high92.5Very high54 Ų5444.2 Ų44.225%0.25222%0.215SC..THydrogen-bonded Turntrans-79-16.3176.362.6-85.9-162.400114.3L352 G356 C364 K365 N401L352-E354 HydrophobicContact CB-CG 4.28Å; L352-E354 PolarHBondContact O-N 3.23Å; E354-G356 PolarHBondContact O-N 3.25Å; E354-C364 HydrophobicContact CB-CB 4.12Å; E354-K365 HydrophobicContact CB-CB 4.23Å; E354-N401 PolarHBondContact OE2-ND2 3.45Å
355D92.1Very high92.7Very high83 Ų8345.8 Ų45.844%0.44422%0.224SC..SBendtrans-86.6105.7-178.6-73.8-16.2000111.3R351 L352 N361R351-D355 HydrophobicContact CB-CB 4.45Å; L352-D355 HydrophobicContact CB-CB 4.17Å; L352-D355 WeakPolarHBondContact O-CB 3.2Å; L352-D355 PolarHBondContact O-N 2.93Å; D355-N361 VanDerWaalsContact C-ND2 3.29Å; D355-N361 PolarHBondContact O-ND2 3.17Å
356G91.3Very high93.1Very high32 Ų3245.7 Ų45.733%0.3322%0.223SC..SBendtrans153.3-173.4173.800000113.2E354 N361E354-G356 PolarHBondContact O-N 3.25Å; G356-N361 VanDerWaalsContact CA-CG 3.46Å; G356-N361 WeakPolarHBondContact CA-OD1 3.42Å
357D92.2Very high93.6Very high98 Ų9846.1 Ų46.152%0.52422%0.223SC..SBendtrans-1183.4-172.262.3-20.3000113.5H293 Y362H293-D357 PolarHBondContact NE2-O 3.39Å; D357-Y362 WeakPolarHBondContact O-CE2 3.22Å
358N94.4Very high93.9Very high63 Ų6343.4 Ų43.434%0.33722%0.219SC..SBendtrans-82.6160.3173.4-68.1-43.2000111.3R360 N361 Y362N358-R360 VanDerWaalsContact C-N 3.26Å; N358-R360 PolarHBondContact O-N 3.14Å; N358-N361 PolarHBondContact N-OD1 3.45Å; N358-N361 WeakPolarHBondContact O-CB 3.25Å; N358-N361 PolarHBondContact O-N 3.36Å; N358-Y362 WeakPolarHBondContact O-CD2 3.41Å; N358-Y362 PolarHBondContact O-N 2.97Å
359I97.1Very high94.1Very high12 Ų1243.6 Ų43.66%0.06222%0.219CC..Hα-helixtrans-54.3-43.6179.3-56.4177.4000111.2I289 L292 H293 L296 V341 N361 Y362 L363I289-I359 HydrophobicContact CG2-CD1 3.37Å; L292-I359 HydrophobicContact CD2-CG2 4.13Å; H293-I359 HydrophobicContact CB-CD1 3.94Å; H293-I359 HydrophobicContact CB-CG1 3.83Å; L296-I359 HydrophobicContact CD1-CG2 3.82Å; V341-I359 HydrophobicContact CB-CG2 4.42Å; V341-I359 HydrophobicContact CG1-CB 4.46Å; V341-I359 HydrophobicContact CG1-CG2 3.83Å; V341-I359 HydrophobicContact CG2-CD1 4.44Å; V341-I359 HydrophobicContact CG2-CG2 4.23Å; I359-N361 VanDerWaalsContact C-N 3.28Å; I359-N361 PolarHBondContact O-N 3.49Å; I359-Y362 PolarHBondContact O-N 3.02Å; I359-L363 HydrophobicContact CG2-CD1 3.95Å; I359-L363 HydrophobicContact CG2-CG 4.1Å; I359-L363 VanDerWaalsContact O-CG 3.32Å; I359-L363 WeakPolarHBondContact O-CG 3.49Å; I359-L363 PolarHBondContact O-N 3.17Å
360R96.6Very high94Very high4 Ų448.9 Ų48.92%0.01525%0.253CS..Hα-helixtrans-49.4-49.8174.2-174.5-160.472.6-1691.8111.7V341 L342 D348 N358 L363 C364V341-R360 WeakPolarHBondContact O-CB 3.26Å; V341-R360 PolarHBondContact O-N 3.47Å; L342-R360 HydrophobicContact CD2-CB 4.21Å; L342-R360 HydrophobicContact CD2-CG 3.79Å; D348-R360 IonicContact OD2-NH1 2.66Å; N358-R360 VanDerWaalsContact C-N 3.26Å; N358-R360 PolarHBondContact O-N 3.14Å; R360-L363 PolarHBondContact O-N 3.22Å; R360-C364 PolarHBondContact O-N 2.9Å; R360-C364 PolarHBondContact O-SG 2.98Å
361N96.1Very high94.1Very high0 Ų046 Ų460%025%0.245CC..Hα-helixtrans-63.6-46.9-174.7-61.4111.9000111.5P353 D355 G356 N358 I359 L363 C364 K365P353-N361 VanDerWaalsContact O-CA 3.25Å; P353-N361 WeakPolarHBondContact O-CA 3.47Å; P353-N361 PolarHBondContact O-ND2 2.81Å; D355-N361 VanDerWaalsContact C-ND2 3.29Å; D355-N361 PolarHBondContact O-ND2 3.17Å; G356-N361 VanDerWaalsContact CA-CG 3.46Å; G356-N361 WeakPolarHBondContact CA-OD1 3.42Å; N358-N361 PolarHBondContact N-OD1 3.45Å; N358-N361 WeakPolarHBondContact O-CB 3.25Å; N358-N361 PolarHBondContact O-N 3.36Å; I359-N361 VanDerWaalsContact C-N 3.28Å; I359-N361 PolarHBondContact O-N 3.49Å; N361-L363 VanDerWaalsContact C-N 3.34Å; N361-L363 PolarHBondContact O-N 2.94Å; N361-C364 PolarHBondContact O-N 3.27Å; N361-K365 PolarHBondContact O-N 3.42Å
362Y97Very high94Very high41 Ų4146.4 Ų46.416%0.16125%0.251CS..Hα-helixtrans-61.5-41.7175.2-67.2-59.7000112.4H293 L296 K297 A300 D357 N358 I359 C364 K365 L366H293-Y362 AromaticContact CD2-CD2 3.93Å; H293-Y362 AromaticContact CD2-CE2 3.89Å; H293-Y362 AromaticContact NE2-CD2 3.95Å; H293-Y362 AromaticContact NE2-CE2 3.63Å; L296-Y362 HydrophobicContact CB-CD2 4.16Å; L296-Y362 HydrophobicContact CB-CG 3.99Å; K297-Y362 HydrophobicContact CG-CE2 3.82Å; A300-Y362 HydrophobicContact CB-CD1 3.77Å; A300-Y362 HydrophobicContact CB-CE1 3.43Å; A300-Y362 VanDerWaalsContact CB-CE1 3.43Å; D357-Y362 WeakPolarHBondContact O-CE2 3.22Å; N358-Y362 WeakPolarHBondContact O-CD2 3.41Å; N358-Y362 PolarHBondContact O-N 2.97Å; I359-Y362 PolarHBondContact O-N 3.02Å; Y362-C364 PolarHBondContact O-N 3.27Å; Y362-K365 WeakPolarHBondContact O-CB 3.47Å; Y362-K365 PolarHBondContact O-N 3.5Å; Y362-L366 WeakPolarHBondContact O-CG 3.42Å; Y362-L366 PolarHBondContact O-N 3.47Å
363L97.8Very high94Very high0 Ų049.1 Ų49.10%027%0.265CS..Hα-helixtrans-63.8-40.3175.7-66.7178000112L296 L320 V341 I359 R360 N361 K365 L366 L367 A378 F381 I382L296-L363 HydrophobicContact CD1-CD2 4.11Å; L296-L363 HydrophobicContact CD1-CG 4.36Å; L296-L363 HydrophobicContact CD2-CD2 4.26Å; L320-L363 HydrophobicContact CD2-CD2 3.74Å; V341-L363 HydrophobicContact CG1-CD1 3.45Å; V341-L363 VanDerWaalsContact CG1-CD1 3.45Å; I359-L363 HydrophobicContact CG2-CD1 3.95Å; I359-L363 HydrophobicContact CG2-CG 4.1Å; I359-L363 VanDerWaalsContact O-CG 3.32Å; I359-L363 WeakPolarHBondContact O-CG 3.49Å; I359-L363 PolarHBondContact O-N 3.17Å; R360-L363 PolarHBondContact O-N 3.22Å; N361-L363 VanDerWaalsContact C-N 3.34Å; N361-L363 PolarHBondContact O-N 2.94Å; L363-K365 VanDerWaalsContact C-N 3.32Å; L363-K365 PolarHBondContact O-N 2.95Å; L363-L366 WeakPolarHBondContact O-CB 3.42Å; L363-L366 PolarHBondContact O-N 3.38Å; L363-L366 VanDerWaalsContact O-N 3.13Å; L363-L367 WeakPolarHBondContact O-CG 3.19Å; L363-L367 PolarHBondContact O-N 3.36Å; L363-A378 HydrophobicContact CD2-CB 4.3Å; L363-F381 HydrophobicContact CD1-CD1 4Å; L363-F381 HydrophobicContact CD1-CE1 4.21Å; L363-I382 HydrophobicContact CB-CD1 3.98Å; L363-I382 HydrophobicContact CB-CG1 4.49Å; L363-I382 HydrophobicContact CD1-CG1 4.2Å
364C96.9Very high94Very high0 Ų048.9 Ų48.90%026%0.264CS..Hα-helixtrans-60.9-41.3174.5-70.20000111.6P353 E354 R360 N361 Y362 L366 L367P353-C364 HydrophobicContact CB-CB 4.1Å; E354-C364 HydrophobicContact CB-CB 4.12Å; R360-C364 PolarHBondContact O-N 2.9Å; R360-C364 PolarHBondContact O-SG 2.98Å; N361-C364 PolarHBondContact O-N 3.27Å; Y362-C364 PolarHBondContact O-N 3.27Å; C364-L366 VanDerWaalsContact C-N 3.27Å; C364-L366 PolarHBondContact O-N 2.98Å; C364-L367 WeakPolarHBondContact O-CB 3.28Å; C364-L367 PolarHBondContact O-N 3.23Å; C364-L367 VanDerWaalsContact O-N 3.13Å
365K95.3Very high94.1Very high116 Ų11646.5 Ų46.550%0.50425%0.253SS..Hα-helixtrans-61.4-34.6173.8-171.5176.2-180-1780112.4E354 N361 Y362 L363 L367 T368E354-K365 HydrophobicContact CB-CB 4.23Å; N361-K365 PolarHBondContact O-N 3.42Å; Y362-K365 WeakPolarHBondContact O-CB 3.47Å; Y362-K365 PolarHBondContact O-N 3.5Å; L363-K365 VanDerWaalsContact C-N 3.32Å; L363-K365 PolarHBondContact O-N 2.95Å; K365-L367 VanDerWaalsContact C-N 3.3Å; K365-L367 PolarHBondContact O-N 3.09Å; K365-T368 PolarHBondContact O-OG1 2.8Å
366L95.5Very high94.3Very high8 Ų844.2 Ų44.24%0.04224%0.24CC..Hα-helixtrans-70.5-21.8176-67.4-173.3000113.8L296 I316 Y362 L363 C364 T368 H369 V374 G375 A378L296-L366 HydrophobicContact CD2-CD1 3.47Å; L296-L366 VanDerWaalsContact CD2-CD1 3.47Å; L296-L366 HydrophobicContact CD2-CG 4.21Å; I316-L366 HydrophobicContact CD1-CD1 4.17Å; I316-L366 HydrophobicContact CD1-CD2 4.5Å; I316-L366 HydrophobicContact CG2-CD1 3.91Å; Y362-L366 WeakPolarHBondContact O-CG 3.42Å; Y362-L366 PolarHBondContact O-N 3.47Å; L363-L366 WeakPolarHBondContact O-CB 3.42Å; L363-L366 PolarHBondContact O-N 3.38Å; L363-L366 VanDerWaalsContact O-N 3.13Å; C364-L366 VanDerWaalsContact C-N 3.27Å; C364-L366 PolarHBondContact O-N 2.98Å; L366-T368 PolarHBondContact O-N 3.12Å; L366-T368 VanDerWaalsContact O-N 3.16Å; L366-H369 WeakPolarHBondContact O-CB 3.09Å; L366-H369 PolarHBondContact O-N 3.5Å; L366-V374 HydrophobicContact CB-CG1 4.39Å; L366-V374 HydrophobicContact CD1-CG1 4.05Å; L366-V374 HydrophobicContact CD2-CG1 3.89Å; L366-V374 HydrophobicContact CG-CG1 4.34Å; L366-G375 WeakPolarHBondContact O-CA 3.42Å; L366-A378 HydrophobicContact CB-CB 3.89Å; L366-A378 HydrophobicContact CD1-CB 4.35Å
367L96.4Very high94.5Very high18 Ų1843.7 Ų43.79%0.09423%0.231CC..THydrogen-bonded Turntrans-62-26.2-177.1-64.4175.7000113.2L363 C364 K365 A378 A379 I382 T397 N401 F402L363-L367 WeakPolarHBondContact O-CG 3.19Å; L363-L367 PolarHBondContact O-N 3.36Å; C364-L367 WeakPolarHBondContact O-CB 3.28Å; C364-L367 PolarHBondContact O-N 3.23Å; C364-L367 VanDerWaalsContact O-N 3.13Å; K365-L367 VanDerWaalsContact C-N 3.3Å; K365-L367 PolarHBondContact O-N 3.09Å; L367-A378 HydrophobicContact CD2-CB 4.34Å; L367-A379 HydrophobicContact CD2-CB 3.57Å; L367-I382 HydrophobicContact CD1-CD1 4.36Å; L367-I382 HydrophobicContact CD2-CD1 4.29Å; L367-T397 HydrophobicContact CD1-CG2 3.8Å; L367-N401 HydrophobicContact CB-CB 4.33Å; L367-N401 WeakPolarHBondContact CB-O 3.48Å; L367-N401 HydrophobicContact CD1-CB 3.83Å; L367-F402 HydrophobicContact CD1-CD2 4.17Å; L367-F402 HydrophobicContact CD2-CD2 4.34Å
368T90.6Very high94.8Very high93 Ų9339 Ų3957%0.57121%0.206SC*.THydrogen-bonded Turntrans-107.917.8178.256.40000112.5K365 L366K365-T368 PolarHBondContact O-OG1 2.8Å; L366-T368 PolarHBondContact O-N 3.12Å; L366-T368 VanDerWaalsContact O-N 3.16Å
369H91.6Very high95Very high33 Ų3336 Ų3615%0.15319%0.19CC..  trans-62.7139.8-179.4-168.2-83.3000112L366 V371 V374L366-H369 WeakPolarHBondContact O-CB 3.09Å; L366-H369 PolarHBondContact O-N 3.5Å; H369-V371 VanDerWaalsContact C-N 3.3Å; H369-V371 WeakPolarHBondContact ND1-CB 3.37Å; H369-V371 PolarHBondContact ND1-N 3.34Å; H369-V371 PolarHBondContact O-N 2.86Å; H369-V374 HydrophobicContact CB-CB 4.38Å; H369-V374 HydrophobicContact CB-CG1 4.31Å
370P89.2Confident95Very high112 Ų11238.1 Ų38.173%0.72720%0.201SC*.SBendtrans-57.8-39-179.2-25.933.8000113.9Q372P370-Q372 PolarHBondContact O-N 2.98Å
371V90.6Very high95.1Very high47 Ų4738 Ų3829%0.28520%0.201SC..SBendtrans-77.9103.9174.1-177.20000109.9D313 H369 I373 V374D313-V371 HydrophobicContact CB-CG1 4.49Å; H369-V371 VanDerWaalsContact C-N 3.3Å; H369-V371 WeakPolarHBondContact ND1-CB 3.37Å; H369-V371 PolarHBondContact ND1-N 3.34Å; H369-V371 PolarHBondContact O-N 2.86Å; V371-I373 VanDerWaalsContact C-N 3.33Å; V371-I373 HydrophobicContact CG1-CG2 3.76Å; V371-I373 PolarHBondContact O-N 3.45Å; V371-V374 HydrophobicContact CB-CG2 3.99Å; V371-V374 HydrophobicContact CG1-CG2 3.92Å; V371-V374 WeakPolarHBondContact O-CB 3.36Å; V371-V374 PolarHBondContact O-N 3.26Å
372Q90.8Very high95.2Very high121 Ų12138 Ų3857%0.56520%0.201SC*.Hα-helixtrans-53.3-41.8-172.3-173.7-177.8-2.100114.2P370 V374 G375 E376P370-Q372 PolarHBondContact O-N 2.98Å; Q372-V374 PolarHBondContact O-N 2.99Å; Q372-G375 PolarHBondContact O-N 3.36Å; Q372-E376 VanDerWaalsContact O-CB 3.22Å; Q372-E376 WeakPolarHBondContact O-CB 3.01Å; Q372-E376 PolarHBondContact O-N 2.97Å
373I93.9Very high95.3Very high92 Ų9236.9 Ų36.947%0.47220%0.197SC..Hα-helixtrans-62.8-27.3-178-170.462.9000112.7D313 V371 S377D313-I373 HydrophobicContact CB-CG2 3.9Å; V371-I373 VanDerWaalsContact C-N 3.33Å; V371-I373 HydrophobicContact CG1-CG2 3.76Å; V371-I373 PolarHBondContact O-N 3.45Å; I373-S377 WeakPolarHBondContact O-CB 3.4Å; I373-S377 PolarHBondContact O-N 3.21Å; I373-S377 PolarHBondContact O-OG 3.23Å
374V94.8Very high95.3Very high0 Ų036.9 Ų36.90%020%0.197CC..Hα-helixtrans-70-52.5176.7179.50000110T312 D313 L366 H369 V371 Q372 E376 S377 A378T312-V374 HydrophobicContact CG2-CG1 4.38Å; T312-V374 HydrophobicContact CG2-CG2 4.39Å; D313-V374 HydrophobicContact CB-CG2 3.72Å; L366-V374 HydrophobicContact CB-CG1 4.39Å; L366-V374 HydrophobicContact CD1-CG1 4.05Å; L366-V374 HydrophobicContact CD2-CG1 3.89Å; L366-V374 HydrophobicContact CG-CG1 4.34Å; H369-V374 HydrophobicContact CB-CB 4.38Å; H369-V374 HydrophobicContact CB-CG1 4.31Å; V371-V374 HydrophobicContact CB-CG2 3.99Å; V371-V374 HydrophobicContact CG1-CG2 3.92Å; V371-V374 WeakPolarHBondContact O-CB 3.36Å; V371-V374 PolarHBondContact O-N 3.26Å; Q372-V374 PolarHBondContact O-N 2.99Å; V374-E376 VanDerWaalsContact C-N 3.28Å; V374-E376 PolarHBondContact O-N 3.41Å; V374-S377 PolarHBondContact O-N 2.82Å; V374-A378 PolarHBondContact O-N 3.14Å
375G95.2Very high95.3Very high3 Ų337.1 Ų37.13%0.03120%0.198CC..Hα-helixtrans-63-36.4177.200000112.5L366 Q372 A378 A379L366-G375 WeakPolarHBondContact O-CA 3.42Å; Q372-G375 PolarHBondContact O-N 3.36Å; G375-A378 PolarHBondContact O-N 3.25Å; G375-A379 VanDerWaalsContact O-CB 3.24Å; G375-A379 WeakPolarHBondContact O-CB 3.36Å; G375-A379 PolarHBondContact O-N 3.49Å
376E96.2Very high95.3Very high36 Ų3632 Ų3217%0.16818%0.177CC..Hα-helixtrans-61.6-46.3174.7-166.459.4-140.500112.3Q372 V374 A379 L380 F405 R408 H409Q372-E376 VanDerWaalsContact O-CB 3.22Å; Q372-E376 WeakPolarHBondContact O-CB 3.01Å; Q372-E376 PolarHBondContact O-N 2.97Å; V374-E376 VanDerWaalsContact C-N 3.28Å; V374-E376 PolarHBondContact O-N 3.41Å; E376-A379 PolarHBondContact O-N 3.23Å; E376-L380 WeakPolarHBondContact O-CB 3.38Å; E376-L380 PolarHBondContact O-N 3.33Å; E376-F405 WeakPolarHBondContact OE1-CD2 3.45Å; E376-F405 VanDerWaalsContact OE1-CE2 3.27Å; E376-F405 WeakPolarHBondContact OE1-CE2 3.2Å; E376-R408 IonicContact OE2-CZ 3.38Å; E376-R408 IonicContact OE2-NE 2.79Å; E376-R408 PolarHBondContact OE2-NE 2.97Å; E376-R408 IonicContact OE2-NH2 3.65Å; E376-R408 PolarHBondContact OE2-NH2 2.77Å; E376-H409 IonicContact OE1-CD2 3.35Å; E376-H409 IonicContact OE1-CE1 2.65Å; E376-H409 IonicContact OE1-NE2 3.84Å; E376-H409 PolarHBondContact OE1-NE2 3.39Å
377S97.2Very high95.3Very high20 Ų2033.7 Ų33.714%0.1418%0.184CC..Hα-helixtrans-65-41.2178.1-61.20000112I373 V374 F381I373-S377 WeakPolarHBondContact O-CB 3.4Å; I373-S377 PolarHBondContact O-N 3.21Å; I373-S377 PolarHBondContact O-OG 3.23Å; V374-S377 PolarHBondContact O-N 2.82Å; S377-F381 WeakPolarHBondContact O-CB 3.31Å; S377-F381 PolarHBondContact O-N 2.81Å; S377-F381 VanDerWaalsContact O-N 3.1Å
378A97.9Very high95.1Very high0 Ų036.6 Ų36.60%020%0.197CC..Hα-helixtrans-66-45.1177.500000111.3L320 L363 L366 L367 V374 G375 F381 I382L320-A378 HydrophobicContact CD1-CB 4.17Å; L363-A378 HydrophobicContact CD2-CB 4.3Å; L366-A378 HydrophobicContact CB-CB 3.89Å; L366-A378 HydrophobicContact CD1-CB 4.35Å; L367-A378 HydrophobicContact CD2-CB 4.34Å; V374-A378 PolarHBondContact O-N 3.14Å; G375-A378 PolarHBondContact O-N 3.25Å; A378-F381 PolarHBondContact O-N 3.33Å; A378-I382 WeakPolarHBondContact O-CG1 3.24Å; A378-I382 PolarHBondContact O-N 2.92Å
379A98Very high95.2Very high1 Ų135.7 Ų35.71%0.00819%0.189CC..Hα-helixtrans-62.6-46.4178.700000112L367 G375 E376 F381 I382 F383 F402 F405L367-A379 HydrophobicContact CD2-CB 3.57Å; G375-A379 VanDerWaalsContact O-CB 3.24Å; G375-A379 WeakPolarHBondContact O-CB 3.36Å; G375-A379 PolarHBondContact O-N 3.49Å; E376-A379 PolarHBondContact O-N 3.23Å; A379-F381 VanDerWaalsContact C-N 3.33Å; A379-F381 PolarHBondContact O-N 2.75Å; A379-I382 PolarHBondContact O-N 3.36Å; A379-F383 WeakPolarHBondContact O-CB 3.31Å; A379-F383 PolarHBondContact O-N 3.02Å; A379-F402 HydrophobicContact CB-CD2 4.47Å; A379-F402 HydrophobicContact CB-CE2 3.87Å; A379-F405 HydrophobicContact CB-CB 3.71Å; A379-F405 HydrophobicContact CB-CD1 4.24Å; A379-F405 HydrophobicContact CB-CD2 3.26Å; A379-F405 HydrophobicContact CB-CE2 3.85Å; A379-F405 HydrophobicContact CB-CG 3.47Å; A379-F405 VanDerWaalsContact CB-CG 3.47Å
380L98.1Very high95.3Very high56 Ų5637.1 Ų37.129%0.29320%0.197SC..Hα-helixtrans-60.2-43.2177.1179.960.6000111.6T324 E376 F383 V384 F405T324-L380 HydrophobicContact CG2-CD2 4.2Å; T324-L380 HydrophobicContact CG2-CG 3.98Å; E376-L380 WeakPolarHBondContact O-CB 3.38Å; E376-L380 PolarHBondContact O-N 3.33Å; L380-F383 PolarHBondContact O-N 3.24Å; L380-V384 HydrophobicContact CD1-CG2 4.37Å; L380-V384 WeakPolarHBondContact O-CG2 3.44Å; L380-V384 PolarHBondContact O-N 3.34Å; L380-F405 HydrophobicContact CB-CE2 4.29Å
381F98.6Very high95.3Very high0 Ų034.1 Ų34.10%019%0.186CC..Hα-helixtrans-60.6-49.8177.5-179.2-139.5000111.6L292 L320 L323 T324 V341 L363 S377 A378 A379 F383 V384 L385L292-F381 HydrophobicContact CD2-CE1 3.94Å; L320-F381 HydrophobicContact CD2-CB 4.32Å; L320-F381 HydrophobicContact CD2-CD1 3.65Å; L320-F381 HydrophobicContact CD2-CE1 4.34Å; L320-F381 HydrophobicContact CD2-CG 4.27Å; L323-F381 HydrophobicContact CB-CD2 4.35Å; L323-F381 HydrophobicContact CB-CE2 3.67Å; L323-F381 HydrophobicContact CB-CZ 3.76Å; L323-F381 HydrophobicContact CD1-CE1 4.47Å; L323-F381 HydrophobicContact CD1-CZ 4.16Å; T324-F381 WeakPolarHBondContact OG1-CA 3.31Å; T324-F381 VanDerWaalsContact OG1-CB 3.29Å; T324-F381 WeakPolarHBondContact OG1-CB 3.4Å; T324-F381 WeakPolarHBondContact OG1-CD2 3.39Å; V341-F381 HydrophobicContact CG1-CE1 4.06Å; V341-F381 HydrophobicContact CG2-CE1 4.12Å; V341-F381 HydrophobicContact CG2-CZ 4.12Å; L363-F381 HydrophobicContact CD1-CD1 4Å; L363-F381 HydrophobicContact CD1-CE1 4.21Å; S377-F381 WeakPolarHBondContact O-CB 3.31Å; S377-F381 PolarHBondContact O-N 2.81Å; S377-F381 VanDerWaalsContact O-N 3.1Å; A378-F381 PolarHBondContact O-N 3.33Å; A379-F381 VanDerWaalsContact C-N 3.33Å; A379-F381 PolarHBondContact O-N 2.75Å; F381-F383 VanDerWaalsContact C-N 3.29Å; F381-F383 PolarHBondContact O-N 3.15Å; F381-V384 PolarHBondContact O-N 3.42Å; F381-L385 HydrophobicContact CD2-CD1 4.34Å; F381-L385 HydrophobicContact CD2-CD2 4.49Å; F381-L385 HydrophobicContact CD2-CG 4.14Å; F381-L385 HydrophobicContact CE1-CD1 4.07Å; F381-L385 HydrophobicContact CE2-CD1 3.85Å; F381-L385 HydrophobicContact CE2-CD2 3.83Å; F381-L385 HydrophobicContact CE2-CG 3.82Å; F381-L385 HydrophobicContact CZ-CD1 3.72Å; F381-L385 HydrophobicContact CZ-CD2 4.32Å; F381-L385 HydrophobicContact CZ-CG 4.22Å; F381-L385 WeakPolarHBondContact O-CG 3.37Å; F381-L385 PolarHBondContact O-N 3.45Å
382I98.2Very high95.4Very high0 Ų035.9 Ų35.90%019%0.187CC..Hα-helixtrans-57.3-45.1176-68.3172.4000110.6L342 L363 L367 A378 A379 V384 L385 C386 T397 F402L342-I382 HydrophobicContact CD1-CG2 4.26Å; L363-I382 HydrophobicContact CB-CD1 3.98Å; L363-I382 HydrophobicContact CB-CG1 4.49Å; L363-I382 HydrophobicContact CD1-CG1 4.2Å; L367-I382 HydrophobicContact CD1-CD1 4.36Å; L367-I382 HydrophobicContact CD2-CD1 4.29Å; A378-I382 WeakPolarHBondContact O-CG1 3.24Å; A378-I382 PolarHBondContact O-N 2.92Å; A379-I382 PolarHBondContact O-N 3.36Å; I382-V384 VanDerWaalsContact C-N 3.35Å; I382-V384 PolarHBondContact O-N 3.49Å; I382-L385 PolarHBondContact O-N 3.45Å; I382-C386 WeakPolarHBondContact O-CB 3.07Å; I382-C386 PolarHBondContact O-N 3.39Å; I382-C386 PolarHBondContact O-SG 2.9Å; I382-T397 HydrophobicContact CD1-CG2 3.79Å; I382-T397 HydrophobicContact CG2-CG2 3.89Å; I382-F402 HydrophobicContact CG2-CE2 4.47Å
383F97.8Very high95.6Very high18 Ų1830.1 Ų30.18%0.07916%0.16CC..Hα-helixtrans-59.6-46-178.7-164.1-131.4000111.4A379 L380 F381 L385 C386 K387 E388 I390 A393 F402 F405 L411A379-F383 WeakPolarHBondContact O-CB 3.31Å; A379-F383 PolarHBondContact O-N 3.02Å; L380-F383 PolarHBondContact O-N 3.24Å; F381-F383 VanDerWaalsContact C-N 3.29Å; F381-F383 PolarHBondContact O-N 3.15Å; F383-L385 PolarHBondContact O-N 2.94Å; F383-C386 CarbonylContact O-C 3.26Å; F383-C386 WeakPolarHBondContact O-CA 3.27Å; F383-C386 WeakPolarHBondContact O-CB 3.28Å; F383-C386 PolarHBondContact O-N 3.1Å; F383-C386 VanDerWaalsContact O-N 3.09Å; F383-K387 PolarHBondContact O-N 2.91Å; F383-E388 HydrophobicContact CD1-CB 3.83Å; F383-E388 HydrophobicContact CD1-CG 3.69Å; F383-E388 HydrophobicContact CE1-CB 3.42Å; F383-E388 VanDerWaalsContact CE1-CB 3.42Å; F383-E388 HydrophobicContact CE1-CG 3.75Å; F383-E388 VanDerWaalsContact CE2-CA 3.45Å; F383-E388 HydrophobicContact CE2-CB 4.22Å; F383-E388 VanDerWaalsContact CE2-O 3.23Å; F383-E388 WeakPolarHBondContact CE2-O 3.5Å; F383-E388 HydrophobicContact CG-CB 4.38Å; F383-E388 HydrophobicContact CG-CG 4.34Å; F383-E388 VanDerWaalsContact CZ-CA 3.4Å; F383-E388 HydrophobicContact CZ-CB 3.64Å; F383-E388 HydrophobicContact CZ-CG 4.44Å; F383-E388 WeakPolarHBondContact CZ-O 3.36Å; F383-E388 WeakPolarHBondContact O-CA 3.1Å; F383-E388 PolarHBondContact O-N 3.33Å; F383-I390 HydrophobicContact CE2-CG1 4.25Å; F383-A393 HydrophobicContact CD2-CB 4.29Å; F383-F402 HydrophobicContact CB-CZ 4.13Å; F383-F402 HydrophobicContact CD2-CE1 4.26Å; F383-F402 HydrophobicContact CD2-CZ 4.1Å; F383-F402 HydrophobicContact CG-CZ 4.39Å; F383-F405 HydrophobicContact CB-CE1 4.28Å; F383-F405 HydrophobicContact CB-CZ 4.42Å; F383-F405 HydrophobicContact CD1-CE1 4.09Å; F383-F405 HydrophobicContact CD1-CZ 4.26Å; F383-F405 HydrophobicContact CG-CE1 4.09Å; F383-F405 HydrophobicContact CG-CZ 4.48Å; F383-L411 HydrophobicContact CE1-CD1 4.03Å; F383-L411 HydrophobicContact CE2-CD1 4.36Å; F383-L411 HydrophobicContact CZ-CD1 3.75Å
384V97.9Very high95.6Very high0 Ų026.8 Ų26.80%014%0.144CC..Hα-helixtrans-61.1-44.1175.4171.10000112.1T324 K328 R334 L380 F381 I382 C386 K387T324-V384 HydrophobicContact CG2-CB 4.45Å; T324-V384 HydrophobicContact CG2-CG2 3.87Å; K328-V384 HydrophobicContact CD-CG2 4.12Å; K328-V384 HydrophobicContact CG-CB 4.49Å; K328-V384 HydrophobicContact CG-CG1 3.72Å; K328-V384 HydrophobicContact CG-CG2 3.86Å; R334-V384 WeakPolarHBondContact CD-O 3.31Å; L380-V384 HydrophobicContact CD1-CG2 4.37Å; L380-V384 WeakPolarHBondContact O-CG2 3.44Å; L380-V384 PolarHBondContact O-N 3.34Å; F381-V384 PolarHBondContact O-N 3.42Å; I382-V384 VanDerWaalsContact C-N 3.35Å; I382-V384 PolarHBondContact O-N 3.49Å; V384-C386 PolarHBondContact O-N 3.15Å; V384-K387 PolarHBondContact O-N 2.78Å
385L97.4Very high95.4Very high6 Ų628.8 Ų28.83%0.03115%0.153CC..Hα-helixtrans-61.8-32.4175.9-65-175.2000112R334 C337 R338 V341 L342 F381 I382 F383 K387R334-L385 HydrophobicContact CG-CD2 4.37Å; C337-L385 HydrophobicContact CB-CD2 3.55Å; R338-L385 HydrophobicContact CB-CB 4.42Å; R338-L385 HydrophobicContact CB-CD2 4.47Å; V341-L385 HydrophobicContact CB-CD1 3.8Å; V341-L385 HydrophobicContact CG1-CD1 3.8Å; V341-L385 HydrophobicContact CG2-CD1 4.34Å; L342-L385 HydrophobicContact CD1-CB 3.88Å; L342-L385 HydrophobicContact CD1-CD1 4.18Å; L342-L385 HydrophobicContact CG-CD1 4.25Å; F381-L385 HydrophobicContact CD2-CD1 4.34Å; F381-L385 HydrophobicContact CD2-CD2 4.49Å; F381-L385 HydrophobicContact CD2-CG 4.14Å; F381-L385 HydrophobicContact CE1-CD1 4.07Å; F381-L385 HydrophobicContact CE2-CD1 3.85Å; F381-L385 HydrophobicContact CE2-CD2 3.83Å; F381-L385 HydrophobicContact CE2-CG 3.82Å; F381-L385 HydrophobicContact CZ-CD1 3.72Å; F381-L385 HydrophobicContact CZ-CD2 4.32Å; F381-L385 HydrophobicContact CZ-CG 4.22Å; F381-L385 WeakPolarHBondContact O-CG 3.37Å; F381-L385 PolarHBondContact O-N 3.45Å; I382-L385 PolarHBondContact O-N 3.45Å; F383-L385 PolarHBondContact O-N 2.94Å; L385-K387 PolarHBondContact O-N 2.96Å
386C95.8Very high95.4Very high7 Ų729.4 Ų29.45%0.04715%0.154CC..THydrogen-bonded Turntrans-80.67.4174.6-72.50000114.2I382 F383 V384 E388 N389 R392 A393I382-C386 WeakPolarHBondContact O-CB 3.07Å; I382-C386 PolarHBondContact O-N 3.39Å; I382-C386 PolarHBondContact O-SG 2.9Å; F383-C386 CarbonylContact O-C 3.26Å; F383-C386 WeakPolarHBondContact O-CA 3.27Å; F383-C386 WeakPolarHBondContact O-CB 3.28Å; F383-C386 PolarHBondContact O-N 3.1Å; F383-C386 VanDerWaalsContact O-N 3.09Å; V384-C386 PolarHBondContact O-N 3.15Å; C386-E388 VanDerWaalsContact C-N 3.26Å; C386-E388 PolarHBondContact O-N 3.18Å; C386-N389 WeakPolarHBondContact O-CB 3.32Å; C386-N389 PolarHBondContact O-N 3.03Å; C386-R392 HydrophobicContact CB-CB 3.88Å; C386-A393 HydrophobicContact CB-CB 4.35Å
387K94.5Very high95.3Very high45 Ų4527.7 Ų27.720%0.19615%0.146CC..THydrogen-bonded Turntrans57.837.3-173.7-50.1-174.9179.1-176.50112.9F383 V384 L385 N389 Y431 S432F383-K387 PolarHBondContact O-N 2.91Å; V384-K387 PolarHBondContact O-N 2.78Å; L385-K387 PolarHBondContact O-N 2.96Å; K387-N389 PolarHBondContact O-N 3.5Å; K387-N389 VanDerWaalsContact O-N 3.08Å; K387-Y431 HydrophobicContact CB-CD1 3.66Å; K387-Y431 HydrophobicContact CB-CE1 3.99Å; K387-Y431 HydrophobicContact CB-CG 4.22Å; K387-Y431 HydrophobicContact CD-CD1 3.94Å; K387-Y431 HydrophobicContact CD-CG 4.49Å; K387-Y431 HydrophobicContact CG-CD1 3.65Å; K387-Y431 HydrophobicContact CG-CE1 4.11Å; K387-S432 PolarHBondContact NZ-O 2.85Å
388E94Very high95.2Very high79 Ų7926.8 Ų26.837%0.36914%0.14SC..THydrogen-bonded Turntrans56.929.6179.5-56.6-174.3172.800112.2K328 F383 C386K328-E388 VanDerWaalsContact CE-OE1 3.28Å; K328-E388 WeakPolarHBondContact CE-OE1 3.42Å; K328-E388 IonicContact NZ-OE1 2.84Å; K328-E388 PolarHBondContact NZ-OE1 2.76Å; F383-E388 HydrophobicContact CD1-CB 3.83Å; F383-E388 HydrophobicContact CD1-CG 3.69Å; F383-E388 HydrophobicContact CE1-CB 3.42Å; F383-E388 VanDerWaalsContact CE1-CB 3.42Å; F383-E388 HydrophobicContact CE1-CG 3.75Å; F383-E388 VanDerWaalsContact CE2-CA 3.45Å; F383-E388 HydrophobicContact CE2-CB 4.22Å; F383-E388 VanDerWaalsContact CE2-O 3.23Å; F383-E388 WeakPolarHBondContact CE2-O 3.5Å; F383-E388 HydrophobicContact CG-CB 4.38Å; F383-E388 HydrophobicContact CG-CG 4.34Å; F383-E388 VanDerWaalsContact CZ-CA 3.4Å; F383-E388 HydrophobicContact CZ-CB 3.64Å; F383-E388 HydrophobicContact CZ-CG 4.44Å; F383-E388 WeakPolarHBondContact CZ-O 3.36Å; F383-E388 WeakPolarHBondContact O-CA 3.1Å; F383-E388 PolarHBondContact O-N 3.33Å; C386-E388 VanDerWaalsContact C-N 3.26Å; C386-E388 PolarHBondContact O-N 3.18Å
389N92.7Very high95Very high74 Ų7430.5 Ų30.540%0.39616%0.156SC..  trans-99.3118.4177.2-177.3-78.1000110.7C386 K387 G391 R392 A393C386-N389 WeakPolarHBondContact O-CB 3.32Å; C386-N389 PolarHBondContact O-N 3.03Å; K387-N389 PolarHBondContact O-N 3.5Å; K387-N389 VanDerWaalsContact O-N 3.08Å; N389-G391 PolarHBondContact O-N 3.37Å; N389-G391 PolarHBondContact OD1-N 2.94Å; N389-G391 VanDerWaalsContact OD1-N 3.13Å; N389-R392 HydrophobicContact CB-CB 4.16Å; N389-R392 HydrophobicContact CB-CG 4.26Å; N389-R392 PolarHBondContact O-N 3.38Å; N389-R392 PolarHBondContact OD1-N 2.99Å; N389-A393 PolarHBondContact O-N 3.38Å
390I91.9Very high94.8Very high63 Ų6332.4 Ų32.432%0.32318%0.176SC..Hα-helixtrans-59.5-48.5-177.4-60.5166.2000111.3F383 R392 A393 V394 L406 L411F383-I390 HydrophobicContact CE2-CG1 4.25Å; I390-R392 VanDerWaalsContact C-N 3.29Å; I390-R392 PolarHBondContact O-N 3.22Å; I390-A393 PolarHBondContact O-N 3.48Å; I390-A393 VanDerWaalsContact O-N 3.14Å; I390-V394 HydrophobicContact CG2-CG2 4.09Å; I390-V394 WeakPolarHBondContact O-CB 3.45Å; I390-V394 WeakPolarHBondContact O-CG2 3.38Å; I390-V394 PolarHBondContact O-N 3.12Å; I390-L406 HydrophobicContact CG1-CD2 4.05Å; I390-L406 HydrophobicContact CG2-CD1 4.05Å; I390-L406 HydrophobicContact CG2-CD2 3.99Å; I390-L411 HydrophobicContact CD1-CB 3.98Å; I390-L411 VanDerWaalsContact CD1-O 3.3Å; I390-L411 WeakPolarHBondContact CD1-O 3.18Å
391G90.6Very high94.6Very high48 Ų4831 Ų3150%0.49517%0.168SC..Hα-helixtrans-60.2-38.7-178.500000112.7N389 K395N389-G391 PolarHBondContact O-N 3.37Å; N389-G391 PolarHBondContact OD1-N 2.94Å; N389-G391 VanDerWaalsContact OD1-N 3.13Å; G391-K395 VanDerWaalsContact O-CB 3.26Å; G391-K395 WeakPolarHBondContact O-CB 3.3Å; G391-K395 PolarHBondContact O-N 3.47Å
392R91.9Very high94.5Very high85 Ų8531 Ų3132%0.32117%0.168SC..Hα-helixtrans-68.5-44.1174-72.4-178.9173.5165-0.8112.1C386 N389 I390 K395 Y396C386-R392 HydrophobicContact CB-CB 3.88Å; N389-R392 HydrophobicContact CB-CB 4.16Å; N389-R392 HydrophobicContact CB-CG 4.26Å; N389-R392 PolarHBondContact O-N 3.38Å; N389-R392 PolarHBondContact OD1-N 2.99Å; I390-R392 VanDerWaalsContact C-N 3.29Å; I390-R392 PolarHBondContact O-N 3.22Å; R392-K395 WeakPolarHBondContact O-CB 3.39Å; R392-K395 PolarHBondContact O-N 2.91Å; R392-Y396 WeakPolarHBondContact O-CD2 3.49Å; R392-Y396 PolarHBondContact O-N 2.98Å
393A94.4Very high94.2Very high0 Ų032.1 Ų32.10%018%0.178CC..Hα-helixtrans-59.8-53.3177.200000110.9F383 C386 N389 I390 K395 Y396 T397 F402F383-A393 HydrophobicContact CD2-CB 4.29Å; C386-A393 HydrophobicContact CB-CB 4.35Å; N389-A393 PolarHBondContact O-N 3.38Å; I390-A393 PolarHBondContact O-N 3.48Å; I390-A393 VanDerWaalsContact O-N 3.14Å; A393-K395 VanDerWaalsContact C-N 3.29Å; A393-K395 PolarHBondContact O-N 2.84Å; A393-Y396 PolarHBondContact O-N 3.48Å; A393-T397 PolarHBondContact O-N 2.97Å; A393-T397 PolarHBondContact O-OG1 2.88Å; A393-F402 HydrophobicContact CB-CD1 4.15Å; A393-F402 HydrophobicContact CB-CE1 3.73Å; A393-F402 HydrophobicContact CB-CE2 4.3Å; A393-F402 HydrophobicContact CB-CZ 3.83Å
394V94Very high93.9Very high21 Ų2132.9 Ų32.913%0.12719%0.191CC..Hα-helixtrans-57.1-39.6177.6169.10000112I390 Y396 T397 G398 F399 L406I390-V394 HydrophobicContact CG2-CG2 4.09Å; I390-V394 WeakPolarHBondContact O-CB 3.45Å; I390-V394 WeakPolarHBondContact O-CG2 3.38Å; I390-V394 PolarHBondContact O-N 3.12Å; V394-Y396 PolarHBondContact O-N 2.94Å; V394-T397 PolarHBondContact O-N 3.23Å; V394-G398 VanDerWaalsContact O-CA 3.31Å; V394-G398 WeakPolarHBondContact O-CA 3.3Å; V394-G398 PolarHBondContact O-N 3.43Å; V394-F399 HydrophobicContact CG1-CB 3.88Å; V394-F399 HydrophobicContact CG2-CB 4.4Å; V394-F399 HydrophobicContact CG2-CD2 4.21Å; V394-L406 HydrophobicContact CG2-CD1 4.41Å
395K91.9Very high93.7Very high42 Ų4233.2 Ų33.218%0.18319%0.193CC..Hα-helixtrans-55.9-38.1174.4166.7175.9174.9175.50112.9L345 G391 R392 A393 E439 Y443L345-K395 HydrophobicContact CD1-CG 3.94Å; L345-K395 WeakPolarHBondContact CD1-O 3.24Å; G391-K395 VanDerWaalsContact O-CB 3.26Å; G391-K395 WeakPolarHBondContact O-CB 3.3Å; G391-K395 PolarHBondContact O-N 3.47Å; R392-K395 WeakPolarHBondContact O-CB 3.39Å; R392-K395 PolarHBondContact O-N 2.91Å; A393-K395 VanDerWaalsContact C-N 3.29Å; A393-K395 PolarHBondContact O-N 2.84Å; K395-E439 VanDerWaalsContact NZ-CD 3.34Å; K395-E439 IonicContact NZ-OE1 3.37Å; K395-E439 PolarHBondContact NZ-OE1 3.27Å; K395-Y443 HydrophobicContact CD-CE1 4.12Å; K395-Y443 WeakPolarHBondContact CD-OH 3.42Å; K395-Y443 HydrophobicContact CG-CE2 4.48Å; K395-Y443 WeakPolarHBondContact CG-OH 3.43Å; K395-Y443 VanDerWaalsContact NZ-CE1 3.29Å
396Y94.1Very high93.5Very high17 Ų1733 Ų337%0.06719%0.192CC..Hα-helixtrans-89.7-22.8-177.4-76.3-73.7000113.9R338 L342 P343 L345 R392 A393 V394R338-Y396 PolarHBondContact NH1-OH 3.48Å; L342-Y396 HydrophobicContact CB-CD1 4.25Å; L342-Y396 HydrophobicContact CB-CE1 4.3Å; L342-Y396 HydrophobicContact CB-CG 4.47Å; L342-Y396 HydrophobicContact CD1-CD2 4.46Å; L342-Y396 HydrophobicContact CD2-CG 4.48Å; P343-Y396 WeakPolarHBondContact O-CE1 3.47Å; L345-Y396 HydrophobicContact CD2-CD1 3.62Å; L345-Y396 HydrophobicContact CD2-CE1 3.94Å; L345-Y396 HydrophobicContact CG-CD1 4.06Å; L345-Y396 HydrophobicContact CG-CE1 3.96Å; R392-Y396 WeakPolarHBondContact O-CD2 3.49Å; R392-Y396 PolarHBondContact O-N 2.98Å; A393-Y396 PolarHBondContact O-N 3.48Å; V394-Y396 PolarHBondContact O-N 2.94Å
397T95.4Very high93.2Very high0 Ų034.1 Ų34.10%020%0.201CC..Hα-helixtrans-114.6-20-171.7620000114.5P353 L367 I382 A393 V394 N401 F402P353-T397 WeakPolarHBondContact CB-O 3.48Å; P353-T397 WeakPolarHBondContact CG-O 3.49Å; L367-T397 HydrophobicContact CD1-CG2 3.8Å; I382-T397 HydrophobicContact CD1-CG2 3.79Å; I382-T397 HydrophobicContact CG2-CG2 3.89Å; A393-T397 PolarHBondContact O-N 2.97Å; A393-T397 PolarHBondContact O-OG1 2.88Å; V394-T397 PolarHBondContact O-N 3.23Å; T397-N401 WeakPolarHBondContact O-CB 3.44Å; T397-N401 PolarHBondContact O-ND2 3.44Å; T397-F402 HydrophobicContact CG2-CD2 4.29Å; T397-F402 WeakPolarHBondContact OG1-CB 3.47Å
398G94Very high93Very high0 Ų036.8 Ų36.80%021%0.21CC..  trans76146.2-160.500000111.8V394 G400 F402V394-G398 VanDerWaalsContact O-CA 3.31Å; V394-G398 WeakPolarHBondContact O-CA 3.3Å; V394-G398 PolarHBondContact O-N 3.43Å; G398-G400 VanDerWaalsContact C-N 3.35Å; G398-F402 PolarHBondContact O-N 3.21Å
399F94.1Very high92.8Very high78 Ų7837.2 Ų37.234%0.34221%0.212SC..Hα-helixtrans-66.6-37.8178.9176.1-95.5000111.1V394 N401 F402 A403 L406 L412 P452 V453V394-F399 HydrophobicContact CG1-CB 3.88Å; V394-F399 HydrophobicContact CG2-CB 4.4Å; V394-F399 HydrophobicContact CG2-CD2 4.21Å; F399-N401 PolarHBondContact O-N 3.43Å; F399-F402 CarbonylContact O-C 3.58Å; F399-F402 PolarHBondContact O-N 3.46Å; F399-F402 VanDerWaalsContact O-N 3.14Å; F399-A403 HydrophobicContact CD1-CB 4.29Å; F399-A403 HydrophobicContact CE1-CB 4Å; F399-A403 HydrophobicContact CZ-CB 4.17Å; F399-A403 WeakPolarHBondContact O-CA 3.26Å; F399-A403 WeakPolarHBondContact O-CB 3.23Å; F399-A403 PolarHBondContact O-N 3.03Å; F399-L406 HydrophobicContact CD2-CD1 3.98Å; F399-L406 HydrophobicContact CE2-CD1 3.78Å; F399-L412 HydrophobicContact CE2-CD2 3.73Å; F399-L412 HydrophobicContact CZ-CD2 3.78Å; F399-P452 VanDerWaalsContact CB-O 3.3Å; F399-P452 WeakPolarHBondContact CB-O 3.36Å; F399-P452 PolarHBondContact N-O 2.81Å; F399-V453 PolarHBondContact N-O 2.89Å
400G93.6Very high92.4Very high41 Ų4135 Ų3542%0.42320%0.204SC..Hα-helixtrans-57.3-47.1179.100000112.7G398 F402 V453G398-G400 VanDerWaalsContact C-N 3.35Å; G400-F402 VanDerWaalsContact C-N 3.35Å; G400-F402 PolarHBondContact O-N 2.92Å; G400-V453 PolarHBondContact N-O 2.95Å
401N95.1Very high92.1Very high26 Ų2634.4 Ų34.414%0.13920%0.201CC..Hα-helixtrans-67.4-34.3177.4-68.3-32.7000112.4E354 L367 T397 F399E354-N401 PolarHBondContact OE2-ND2 3.45Å; L367-N401 HydrophobicContact CB-CB 4.33Å; L367-N401 WeakPolarHBondContact CB-O 3.48Å; L367-N401 HydrophobicContact CD1-CB 3.83Å; T397-N401 WeakPolarHBondContact O-CB 3.44Å; T397-N401 PolarHBondContact O-ND2 3.44Å; F399-N401 PolarHBondContact O-N 3.43Å
402F95.6Very high91.8Very high0 Ų033.8 Ų33.80%019%0.186CC..Hα-helixtrans-93.3-14.6-174.5-151.2-110.7000114.1L367 A379 I382 F383 A393 T397 G398 F399 G400 G404 F405 L406L367-F402 HydrophobicContact CD1-CD2 4.17Å; L367-F402 HydrophobicContact CD2-CD2 4.34Å; A379-F402 HydrophobicContact CB-CD2 4.47Å; A379-F402 HydrophobicContact CB-CE2 3.87Å; I382-F402 HydrophobicContact CG2-CE2 4.47Å; F383-F402 HydrophobicContact CB-CZ 4.13Å; F383-F402 HydrophobicContact CD2-CE1 4.26Å; F383-F402 HydrophobicContact CD2-CZ 4.1Å; F383-F402 HydrophobicContact CG-CZ 4.39Å; A393-F402 HydrophobicContact CB-CD1 4.15Å; A393-F402 HydrophobicContact CB-CE1 3.73Å; A393-F402 HydrophobicContact CB-CE2 4.3Å; A393-F402 HydrophobicContact CB-CZ 3.83Å; T397-F402 HydrophobicContact CG2-CD2 4.29Å; T397-F402 WeakPolarHBondContact OG1-CB 3.47Å; G398-F402 PolarHBondContact O-N 3.21Å; F399-F402 CarbonylContact O-C 3.58Å; F399-F402 PolarHBondContact O-N 3.46Å; F399-F402 VanDerWaalsContact O-N 3.14Å; G400-F402 VanDerWaalsContact C-N 3.35Å; G400-F402 PolarHBondContact O-N 2.92Å; F402-G404 VanDerWaalsContact C-N 3.29Å; F402-G404 PolarHBondContact O-N 3.29Å; F402-F405 HydrophobicContact CD1-CD1 4.34Å; F402-F405 AromaticContact CE1-CD1 3.55Å; F402-F405 HydrophobicContact CE1-CD1 3.55Å; F402-F405 HydrophobicContact CE1-CE1 4.08Å; F402-F405 HydrophobicContact CE1-CG 4.5Å; F402-F405 HydrophobicContact CE2-CD1 4.12Å; F402-F405 HydrophobicContact CE2-CG 4.47Å; F402-F405 AromaticContact CZ-CD1 3.4Å; F402-F405 HydrophobicContact CZ-CD1 3.4Å; F402-F405 VanDerWaalsContact CZ-CD1 3.4Å; F402-F405 AromaticContact CZ-CE1 3.76Å; F402-F405 HydrophobicContact CZ-CE1 3.76Å; F402-F405 HydrophobicContact CZ-CG 4.18Å; F402-F405 WeakPolarHBondContact O-CB 3.38Å; F402-F405 PolarHBondContact O-N 2.95Å; F402-L406 HydrophobicContact CD1-CD1 3.99Å; F402-L406 HydrophobicContact CD1-CD2 3.65Å; F402-L406 HydrophobicContact CD1-CG 3.58Å; F402-L406 HydrophobicContact CE1-CD2 3.59Å; F402-L406 HydrophobicContact CE1-CG 4.02Å; F402-L406 PolarHBondContact O-N 3.24Å; F402-L406 VanDerWaalsContact O-N 3.1Å
403A92.1Very high91Very high24 Ų2430.8 Ų30.820%0.19818%0.181CC..Hα-helixtrans-58.2-39.1-172.500000112.6F399 F405 L406 A407F399-A403 HydrophobicContact CD1-CB 4.29Å; F399-A403 HydrophobicContact CE1-CB 4Å; F399-A403 HydrophobicContact CZ-CB 4.17Å; F399-A403 WeakPolarHBondContact O-CA 3.26Å; F399-A403 WeakPolarHBondContact O-CB 3.23Å; F399-A403 PolarHBondContact O-N 3.03Å; A403-F405 VanDerWaalsContact C-N 3.31Å; A403-F405 PolarHBondContact O-N 2.9Å; A403-L406 PolarHBondContact O-N 3.42Å; A403-A407 WeakPolarHBondContact O-CB 3.35Å; A403-A407 PolarHBondContact O-N 3.06Å
404G90.8Very high89.5Confident35 Ų3537.4 Ų37.436%0.36121%0.21SC..Hα-helixtrans-59.7-41.2177.500000112.5F402 R408F402-G404 VanDerWaalsContact C-N 3.29Å; F402-G404 PolarHBondContact O-N 3.29Å; G404-R408 WeakPolarHBondContact O-CG 3.2Å; G404-R408 VanDerWaalsContact O-CZ 3.27Å; G404-R408 PolarHBondContact O-N 2.59Å; G404-R408 PolarHBondContact O-NH1 3.14Å; G404-R408 VanDerWaalsContact O-NH1 3.12Å
405F94.2Very high87.6Confident7 Ų741.6 Ų41.63%0.03124%0.238CC..Hα-helixtrans-67.2-47.4175.1177.4-95.5000111.2E376 A379 L380 F383 F402 A403 A407 R408 H409 L411E376-F405 WeakPolarHBondContact OE1-CD2 3.45Å; E376-F405 VanDerWaalsContact OE1-CE2 3.27Å; E376-F405 WeakPolarHBondContact OE1-CE2 3.2Å; A379-F405 HydrophobicContact CB-CB 3.71Å; A379-F405 HydrophobicContact CB-CD1 4.24Å; A379-F405 HydrophobicContact CB-CD2 3.26Å; A379-F405 HydrophobicContact CB-CE2 3.85Å; A379-F405 HydrophobicContact CB-CG 3.47Å; A379-F405 VanDerWaalsContact CB-CG 3.47Å; L380-F405 HydrophobicContact CB-CE2 4.29Å; F383-F405 HydrophobicContact CB-CE1 4.28Å; F383-F405 HydrophobicContact CB-CZ 4.42Å; F383-F405 HydrophobicContact CD1-CE1 4.09Å; F383-F405 HydrophobicContact CD1-CZ 4.26Å; F383-F405 HydrophobicContact CG-CE1 4.09Å; F383-F405 HydrophobicContact CG-CZ 4.48Å; F402-F405 HydrophobicContact CD1-CD1 4.34Å; F402-F405 AromaticContact CE1-CD1 3.55Å; F402-F405 HydrophobicContact CE1-CD1 3.55Å; F402-F405 HydrophobicContact CE1-CE1 4.08Å; F402-F405 HydrophobicContact CE1-CG 4.5Å; F402-F405 HydrophobicContact CE2-CD1 4.12Å; F402-F405 HydrophobicContact CE2-CG 4.47Å; F402-F405 AromaticContact CZ-CD1 3.4Å; F402-F405 HydrophobicContact CZ-CD1 3.4Å; F402-F405 VanDerWaalsContact CZ-CD1 3.4Å; F402-F405 AromaticContact CZ-CE1 3.76Å; F402-F405 HydrophobicContact CZ-CE1 3.76Å; F402-F405 HydrophobicContact CZ-CG 4.18Å; F402-F405 WeakPolarHBondContact O-CB 3.38Å; F402-F405 PolarHBondContact O-N 2.95Å; A403-F405 VanDerWaalsContact C-N 3.31Å; A403-F405 PolarHBondContact O-N 2.9Å; F405-A407 VanDerWaalsContact C-N 3.31Å; F405-A407 PolarHBondContact O-N 3.1Å; F405-R408 PolarHBondContact O-N 2.99Å; F405-H409 AromaticContact CD2-CD2 3.52Å; F405-H409 AromaticContact CD2-NE2 3.78Å; F405-H409 AromaticContact CE2-CD2 3.31Å; F405-H409 WeakPolarHBondContact CE2-CD2 3.48Å; F405-H409 AromaticContact CE2-NE2 3.3Å; F405-H409 VanDerWaalsContact CE2-NE2 3.3Å; F405-H409 WeakPolarHBondContact CE2-NE2 3.43Å; F405-H409 AromaticContact CG-CD2 3.99Å; F405-H409 AromaticContact CZ-CD2 3.56Å; F405-H409 AromaticContact CZ-NE2 3.8Å; F405-H409 PolarHBondContact O-CD2 3.09Å; F405-H409 PolarHBondContact O-N 2.94Å; F405-H409 VanDerWaalsContact O-N 3.07Å; F405-L411 HydrophobicContact CE1-CD1 4.12Å
406L93.3Very high85.1Confident1 Ų143.4 Ų43.41%0.00526%0.256CS..Hα-helixtrans-58.3-43.1179.3-63.3176.1000112.2I390 V394 F399 F402 A403 H409 A410 L411 L412I390-L406 HydrophobicContact CG1-CD2 4.05Å; I390-L406 HydrophobicContact CG2-CD1 4.05Å; I390-L406 HydrophobicContact CG2-CD2 3.99Å; V394-L406 HydrophobicContact CG2-CD1 4.41Å; F399-L406 HydrophobicContact CD2-CD1 3.98Å; F399-L406 HydrophobicContact CE2-CD1 3.78Å; F402-L406 HydrophobicContact CD1-CD1 3.99Å; F402-L406 HydrophobicContact CD1-CD2 3.65Å; F402-L406 HydrophobicContact CD1-CG 3.58Å; F402-L406 HydrophobicContact CE1-CD2 3.59Å; F402-L406 HydrophobicContact CE1-CG 4.02Å; F402-L406 PolarHBondContact O-N 3.24Å; F402-L406 VanDerWaalsContact O-N 3.1Å; A403-L406 PolarHBondContact O-N 3.42Å; L406-H409 PolarHBondContact O-N 3.04Å; L406-A410 PolarHBondContact O-N 3.05Å; L406-A410 VanDerWaalsContact O-N 3.15Å; L406-L411 HydrophobicContact CB-CB 4.22Å; L406-L411 HydrophobicContact CD2-CB 3.66Å; L406-L411 HydrophobicContact CD2-CD1 3.91Å; L406-L411 HydrophobicContact CD2-CG 4.45Å; L406-L411 PolarHBondContact O-N 3.49Å; L406-L412 HydrophobicContact CB-CD2 3.6Å; L406-L412 HydrophobicContact CB-CG 3.92Å; L406-L412 HydrophobicContact CD1-CD2 3.97Å; L406-L412 HydrophobicContact CG-CD2 4.44Å
407A89.6Confident82.4Confident30 Ų3052 Ų5225%0.24829%0.293CS..Hα-helixtrans-62.1-43.8178.900000112.3A403 F405 H409 A410 L412 V504A403-A407 WeakPolarHBondContact O-CB 3.35Å; A403-A407 PolarHBondContact O-N 3.06Å; F405-A407 VanDerWaalsContact C-N 3.31Å; F405-A407 PolarHBondContact O-N 3.1Å; A407-H409 VanDerWaalsContact C-N 3.35Å; A407-A410 PolarHBondContact O-N 3.02Å; A407-L412 HydrophobicContact CB-CD1 3.79Å; A407-V504 HydrophobicContact CB-CG2 4.01Å
408R89.8Confident79.6Confident101 Ų10154.7 Ų54.738%0.38131%0.31SS..Hα-helixtrans-70-30.4-179.6-70.3-171.6-60.9-89.93.5113.2E376 G404 F405E376-R408 IonicContact OE2-CZ 3.38Å; E376-R408 IonicContact OE2-NE 2.79Å; E376-R408 PolarHBondContact OE2-NE 2.97Å; E376-R408 IonicContact OE2-NH2 3.65Å; E376-R408 PolarHBondContact OE2-NH2 2.77Å; G404-R408 WeakPolarHBondContact O-CG 3.2Å; G404-R408 VanDerWaalsContact O-CZ 3.27Å; G404-R408 PolarHBondContact O-N 2.59Å; G404-R408 PolarHBondContact O-NH1 3.14Å; G404-R408 VanDerWaalsContact O-NH1 3.12Å; F405-R408 PolarHBondContact O-N 2.99Å
409H89.6Confident76.9Confident89 Ų8960.8 Ų60.841%0.41234%0.342SS..THydrogen-bonded Turntrans-94.88.7178.7-75.1-79.3000114.6E376 F405 L406 A407 L411E376-H409 IonicContact OE1-CD2 3.35Å; E376-H409 IonicContact OE1-CE1 2.65Å; E376-H409 IonicContact OE1-NE2 3.84Å; E376-H409 PolarHBondContact OE1-NE2 3.39Å; F405-H409 AromaticContact CD2-CD2 3.52Å; F405-H409 AromaticContact CD2-NE2 3.78Å; F405-H409 AromaticContact CE2-CD2 3.31Å; F405-H409 WeakPolarHBondContact CE2-CD2 3.48Å; F405-H409 AromaticContact CE2-NE2 3.3Å; F405-H409 VanDerWaalsContact CE2-NE2 3.3Å; F405-H409 WeakPolarHBondContact CE2-NE2 3.43Å; F405-H409 AromaticContact CG-CD2 3.99Å; F405-H409 AromaticContact CZ-CD2 3.56Å; F405-H409 AromaticContact CZ-NE2 3.8Å; F405-H409 PolarHBondContact O-CD2 3.09Å; F405-H409 PolarHBondContact O-N 2.94Å; F405-H409 VanDerWaalsContact O-N 3.07Å; L406-H409 PolarHBondContact O-N 3.04Å; A407-H409 VanDerWaalsContact C-N 3.35Å; H409-L411 HydrophobicContact CB-CD1 3.86Å; H409-L411 HydrophobicContact CB-CG 3.83Å; H409-L411 PolarHBondContact O-N 2.95Å
410A85.3Confident73.9Confident27 Ų2768.1 Ų68.122%0.22337%0.368CS..THydrogen-bonded Turntrans59.532.7-179.900000113.9L406 A407 D501 G502 R503L406-A410 PolarHBondContact O-N 3.05Å; L406-A410 VanDerWaalsContact O-N 3.15Å; A407-A410 PolarHBondContact O-N 3.02Å; A410-D501 WeakPolarHBondContact CB-O 3.23Å; A410-G502 CarbonylContact C-O 3.44Å; A410-G502 WeakPolarHBondContact CA-O 3.48Å; A410-R503 HydrophobicContact CB-CG 3.43Å; A410-R503 VanDerWaalsContact CB-CG 3.43Å
411L85.9Confident71.1Confident50 Ų5074.8 Ų74.826%0.26239%0.388SS..  trans-96.75.5-176.5-62.2176.9000113.2F383 I390 F405 L406 H409F383-L411 HydrophobicContact CE1-CD1 4.03Å; F383-L411 HydrophobicContact CE2-CD1 4.36Å; F383-L411 HydrophobicContact CZ-CD1 3.75Å; I390-L411 HydrophobicContact CD1-CB 3.98Å; I390-L411 VanDerWaalsContact CD1-O 3.3Å; I390-L411 WeakPolarHBondContact CD1-O 3.18Å; F405-L411 HydrophobicContact CE1-CD1 4.12Å; L406-L411 HydrophobicContact CB-CB 4.22Å; L406-L411 HydrophobicContact CD2-CB 3.66Å; L406-L411 HydrophobicContact CD2-CD1 3.91Å; L406-L411 HydrophobicContact CD2-CG 4.45Å; L406-L411 PolarHBondContact O-N 3.49Å; H409-L411 HydrophobicContact CB-CD1 3.86Å; H409-L411 HydrophobicContact CB-CG 3.83Å; H409-L411 PolarHBondContact O-N 2.95Å
412L82.8Confident67.9Low36 Ų3676.8 Ų76.819%0.18840%0.404CS..  trans-85.7-14.9178.7-67.3177.1000113.3F399 L406 A407 I498 G502 V504F399-L412 HydrophobicContact CE2-CD2 3.73Å; F399-L412 HydrophobicContact CZ-CD2 3.78Å; L406-L412 HydrophobicContact CB-CD2 3.6Å; L406-L412 HydrophobicContact CB-CG 3.92Å; L406-L412 HydrophobicContact CD1-CD2 3.97Å; L406-L412 HydrophobicContact CG-CD2 4.44Å; A407-L412 HydrophobicContact CB-CD1 3.79Å; L412-I498 HydrophobicContact CB-CD1 3.9Å; L412-I498 HydrophobicContact CB-CG1 4Å; L412-I498 HydrophobicContact CB-CG2 4.2Å; L412-G502 PolarHBondContact N-O 3Å; L412-V504 HydrophobicContact CD1-CG2 3.85Å
413G75.4Confident64.8Low21 Ų2184 Ų8422%0.21644%0.443CS..SBendtrans-57.5159.2179.400000112.9G502G413-G502 VanDerWaalsContact CA-CA 3.49Å
414K63.2Low61.8Low140 Ų14085.5 Ų85.561%0.60945%0.451SS*.  trans-49.1128.3169.9-70.4179.7-179.7173.40107.2S416 E519K414-S416 VanDerWaalsContact C-N 3.31Å; K414-S416 PolarHBondContact O-N 2.76Å; K414-E519 IonicContact NZ-OE2 3.9Å
415P53.4Low58.8Low108 Ų10891.3 Ų91.370%0.70147%0.474SS*.  trans-58.1105.7172.423.7-30.8000105.5K417P415-K417 PolarHBondContact O-N 3.08Å; P415-K417 VanDerWaalsContact O-N 3.16Å
416S40.3Very low56Low80 Ų8096.8 Ų96.856%0.55951%0.508SS*.  trans-48.5131.4177.1-76.10000106.3K414 V418 N419K414-S416 VanDerWaalsContact C-N 3.31Å; K414-S416 PolarHBondContact O-N 2.76Å; S416-V418 CarbonylContact O-C 3.57Å; S416-V418 PolarHBondContact O-N 2.88Å; S416-N419 PolarHBondContact O-N 3.13Å
417K36.9Very low53Low198 Ų198104.6 Ų104.686%0.86154%0.544SS*.THydrogen-bonded Turntrans-48.8-16.5176.9-77.5179.7172.6179.10113P415 N419 R420P415-K417 PolarHBondContact O-N 3.08Å; P415-K417 VanDerWaalsContact O-N 3.16Å; K417-N419 PolarHBondContact O-N 3Å; K417-R420 PolarHBondContact O-N 2.96Å; K417-R420 VanDerWaalsContact O-N 3.1Å
418V37.8Very low50.5Low56 Ų56106.8 Ų106.834%0.33956%0.558SS.*Hα-helixtrans-48.8-36.1164.9-176.70000113.5S416 R420 E421 S422 C424S416-V418 CarbonylContact O-C 3.57Å; S416-V418 PolarHBondContact O-N 2.88Å; V418-R420 VanDerWaalsContact C-N 3.31Å; V418-R420 PolarHBondContact O-N 3.23Å; V418-E421 PolarHBondContact O-N 3.43Å; V418-S422 WeakPolarHBondContact CG1-O 3.36Å; V418-S422 PolarHBondContact O-N 3.33Å; V418-S422 VanDerWaalsContact O-O 3.07Å; V418-C424 HydrophobicContact CG1-CB 3.65Å; V418-C424 VanDerWaalsContact CG1-SG 3.6Å
419N36Very low47.9Very low129 Ų129110 Ų11069%0.6958%0.583SS**Hα-helixtrans-79.9-5.1179.3-85.1-15.3000115S416 K417S416-N419 PolarHBondContact O-N 3.13Å; K417-N419 PolarHBondContact O-N 3Å
420R31.2Very low46Very low231 Ų231110.1 Ų110.187%0.87258%0.583SS**Hα-helixtrans-93.1-32.9166.9-83.5-169.7169.2177-1.5112.5K417 V418K417-R420 PolarHBondContact O-N 2.96Å; K417-R420 VanDerWaalsContact O-N 3.1Å; V418-R420 VanDerWaalsContact C-N 3.31Å; V418-R420 PolarHBondContact O-N 3.23Å
421E34.5Very low44.3Very low181 Ų181111.1 Ų111.185%0.84658%0.581SS**Hα-helixtrans-148.18.5-170.4-69.2-174.6166.500117.3V418V418-E421 PolarHBondContact O-N 3.43Å
422S28.1Very low42.5Very low69 Ų69110.8 Ų110.848%0.48358%0.583SS.*  trans-129.2118.9-177.6-550000113.1V418 C424V418-S422 WeakPolarHBondContact CG1-O 3.36Å; V418-S422 PolarHBondContact O-N 3.33Å; V418-S422 VanDerWaalsContact O-O 3.07Å; S422-C424 PolarHBondContact O-N 2.77Å
423N31Very low40.6Very low152 Ų152113.5 Ų113.581%0.81361%0.611SS**  trans-48.871.5162.5-70.1-12.1000112.5N425N423-N425 PolarHBondContact O-N 2.86Å
424C29.7Very low38.9Very low55 Ų55117.8 Ų117.837%0.37263%0.633SS.*  trans-75.4106.7163.656.40000107.8V418 S422 V426V418-C424 HydrophobicContact CG1-CB 3.65Å; V418-C424 VanDerWaalsContact CG1-SG 3.6Å; S422-C424 PolarHBondContact O-N 2.77Å; C424-V426 PolarHBondContact O-N 3.25Å
425N27.8Very low38.1Very low157 Ų157113.8 Ų113.884%0.8462%0.623SS**  trans-60.654.3-179.6-66.8-35.6000114.3N423N423-N425 PolarHBondContact O-N 2.86Å
426V33.8Very low37.6Very low122 Ų122114.1 Ų114.174%0.73962%0.623SS**SBendtrans-106.275.7161.1-170.80000106.6C424 S428C424-V426 PolarHBondContact O-N 3.25Å; V426-S428 PolarHBondContact O-N 3.26Å
427E30.4Very low38.2Very low164 Ų164116.9 Ų116.977%0.76663%0.627SS**SBendtrans40.132.8169-60.3-171.1161.300116.9D429E427-D429 VanDerWaalsContact C-N 3.31Å; E427-D429 PolarHBondContact O-N 3.2Å
428S37.2Very low39.2Very low77 Ų77110.3 Ų110.354%0.53861%0.606SS.*G310 helixtrans-9015.4-171.555.70000114.5V426 E430V426-S428 PolarHBondContact O-N 3.26Å; S428-E430 PolarHBondContact O-N 3.25Å
429D35.8Very low41Very low169 Ų169109 Ų10990%0.90460%0.596SS**G310 helixtrans-70.9-3.1169.3-80.7-28.6000113.3E427 Y431E427-D429 VanDerWaalsContact C-N 3.31Å; E427-D429 PolarHBondContact O-N 3.2Å; D429-Y431 PolarHBondContact O-N 3.38Å
430E49.5Very low43.2Very low90 Ų90104.9 Ų104.942%0.42158%0.576SS.*G310 helixtrans-78.4-10.1-174.5-69.9-168.9163.300115.5S428S428-E430 PolarHBondContact O-N 3.25Å
431Y49.4Very low45.6Very low48 Ų4899.5 Ų99.519%0.18856%0.56CS.*  trans-128.993.8-170.6-63.3-85.9000113.7R334 K387 D429 A433R334-Y431 VanDerWaalsContact NE-CE1 3.3Å; K387-Y431 HydrophobicContact CB-CD1 3.66Å; K387-Y431 HydrophobicContact CB-CE1 3.99Å; K387-Y431 HydrophobicContact CB-CG 4.22Å; K387-Y431 HydrophobicContact CD-CD1 3.94Å; K387-Y431 HydrophobicContact CD-CG 4.49Å; K387-Y431 HydrophobicContact CG-CD1 3.65Å; K387-Y431 HydrophobicContact CG-CE1 4.11Å; D429-Y431 PolarHBondContact O-N 3.38Å; Y431-A433 PolarHBondContact O-N 3.27Å
432S48.6Very low47.9Very low43 Ų4393.6 Ų93.630%0.30153%0.533SS..  trans-56.5132.3172.3720000112.1R331 K387 T434R331-S432 PolarHBondContact NH1-OG 3.02Å; R331-S432 PolarHBondContact NH2-OG 3.38Å; K387-S432 PolarHBondContact NZ-O 2.85Å; S432-T434 PolarHBondContact O-N 3.28Å
433A41.9Very low50.6Low94 Ų9491 Ų9178%0.77751%0.513SS*.THydrogen-bonded Turntrans-63.6-23.3-179.900000114.2Y431 S435Y431-A433 PolarHBondContact O-N 3.27Å; A433-S435 VanDerWaalsContact C-N 3.27Å; A433-S435 PolarHBondContact O-N 2.93Å
434T39.8Very low53.1Low111 Ų11188.3 Ų88.368%0.68149%0.494SS*.THydrogen-bonded Turntrans-75.617.1-165.153.10000117.4S432 T436S432-T434 PolarHBondContact O-N 3.28Å; T434-T436 PolarHBondContact O-N 2.97Å
435S46.3Very low55.8Low55 Ų5595.3 Ų95.339%0.38551%0.512SS..  trans-92.686.7170.1-1590000109.5A433A433-S435 VanDerWaalsContact C-N 3.27Å; A433-S435 PolarHBondContact O-N 2.93Å
436T43.7Very low58.5Low115 Ų11589 Ų8971%0.70648%0.479SS*.  trans-41.8136.3172.137.90000114.3T434 S438T434-T436 PolarHBondContact O-N 2.97Å; T436-S438 PolarHBondContact O-N 3.38Å; T436-S438 PolarHBondContact O-OG 2.88Å
437E53.6Low60.9Low139 Ų13987.6 Ų87.665%0.6546%0.462SS*.  trans-54.493.7172.8-79.9168.4158.200111.9E439E437-E439 HydrophobicContact CB-CG 4.26Å; E437-E439 PolarHBondContact O-N 3.38Å; E437-E439 VanDerWaalsContact O-N 3.14Å
438S58.1Low63.5Low60 Ų6088.8 Ų88.842%0.4247%0.468SS..  trans-87.157.1167.2-22.70000109.7Y344 T436Y344-S438 WeakPolarHBondContact CD1-O 3.45Å; Y344-S438 WeakPolarHBondContact CE1-O 3.46Å; Y344-S438 VanDerWaalsContact CG-O 3.31Å; Y344-S438 VanDerWaalsContact CZ-CB 3.47Å; Y344-S438 VanDerWaalsContact OH-CB 3.26Å; Y344-S438 WeakPolarHBondContact OH-CB 3.43Å; Y344-S438 PolarHBondContact OH-OG 2.95Å; T436-S438 PolarHBondContact O-N 3.38Å; T436-S438 PolarHBondContact O-OG 2.88Å
439E74.4Confident65.8Low27 Ų2789 Ų8913%0.12646%0.463CS..  trans-65.8136.6170.9-60.2-167.5147.300109.4K395 E437 Y443 K444 K447K395-E439 VanDerWaalsContact NZ-CD 3.34Å; K395-E439 IonicContact NZ-OE1 3.37Å; K395-E439 PolarHBondContact NZ-OE1 3.27Å; E437-E439 HydrophobicContact CB-CG 4.26Å; E437-E439 PolarHBondContact O-N 3.38Å; E437-E439 VanDerWaalsContact O-N 3.14Å; E439-Y443 HydrophobicContact CB-CD1 4.2Å; E439-Y443 HydrophobicContact CG-CD1 4.29Å; E439-Y443 WeakPolarHBondContact OE1-CE1 3.4Å; E439-K444 HydrophobicContact CB-CG 3.93Å; E439-K447 IonicContact OE1-NZ 2.91Å; E439-K447 PolarHBondContact OE1-NZ 3.09Å; E439-K447 IonicContact OE2-NZ 3Å; E439-K447 PolarHBondContact OE2-NZ 3.02Å
440T81.7Confident68.3Low44 Ų4482.3 Ų82.327%0.2743%0.428SS..  trans-66.3144.6173.247.30000109.7G346 E442 Y443 K444G346-T440 WeakPolarHBondContact CA-OG1 3.07Å; G346-T440 PolarHBondContact N-OG1 3.15Å; G346-T440 VanDerWaalsContact N-OG1 3.15Å; T440-E442 PolarHBondContact O-N 2.91Å; T440-E442 VanDerWaalsContact O-N 3.14Å; T440-Y443 PolarHBondContact O-N 3.19Å; T440-Y443 WeakPolarHBondContact OG1-CB 3.38Å; T440-Y443 PolarHBondContact OG1-N 3.32Å; T440-K444 PolarHBondContact O-N 2.72Å; T440-K444 VanDerWaalsContact O-N 3.08Å
441E82.8Confident70.2Confident117 Ų11780.3 Ų80.355%0.54742%0.421SS..Hα-helixtrans-56.3-31.7176.5-69-56.5125.500112.4K444 R445E441-K444 IonicContact OE1-NZ 3.4Å; E441-K444 PolarHBondContact OE1-NZ 3.33Å; E441-R445 WeakPolarHBondContact O-CG 3.48Å; E441-R445 PolarHBondContact O-N 2.76Å
442E81.9Confident72Confident57 Ų5782.1 Ų82.127%0.26644%0.438SS..Hα-helixtrans-67.9-40.6174.1-173.7169.9-164.800113.1K347 K350 T440 R445 L446K347-E442 VanDerWaalsContact CG-CD 3.5Å; K347-E442 VanDerWaalsContact CG-OE1 3.31Å; K347-E442 WeakPolarHBondContact CG-OE1 3.49Å; K347-E442 WeakPolarHBondContact CG-OE2 3.35Å; K347-E442 PolarHBondContact N-OE2 3.49Å; K350-E442 IonicContact NZ-OE1 3.03Å; T440-E442 PolarHBondContact O-N 2.91Å; T440-E442 VanDerWaalsContact O-N 3.14Å; E442-R445 PolarHBondContact O-N 3.32Å; E442-L446 HydrophobicContact CG-CD1 4.41Å; E442-L446 PolarHBondContact O-N 3.13Å
443Y84.6Confident74Confident16 Ų1683.7 Ų83.76%0.06345%0.446CS..Hα-helixtrans-67-42.1177.5175.4-97.2000111L345 V349 K395 E439 T440 R445 L446 K447 V450L345-Y443 HydrophobicContact CB-CD2 4.04Å; L345-Y443 HydrophobicContact CD1-CD2 3.73Å; L345-Y443 HydrophobicContact CD1-CE2 3.53Å; L345-Y443 HydrophobicContact CG-CD2 4.46Å; V349-Y443 HydrophobicContact CB-CD2 4.23Å; V349-Y443 HydrophobicContact CG2-CD2 3.88Å; V349-Y443 HydrophobicContact CG2-CE2 3.95Å; K395-Y443 HydrophobicContact CD-CE1 4.12Å; K395-Y443 WeakPolarHBondContact CD-OH 3.42Å; K395-Y443 HydrophobicContact CG-CE2 4.48Å; K395-Y443 WeakPolarHBondContact CG-OH 3.43Å; K395-Y443 VanDerWaalsContact NZ-CE1 3.29Å; E439-Y443 HydrophobicContact CB-CD1 4.2Å; E439-Y443 HydrophobicContact CG-CD1 4.29Å; E439-Y443 WeakPolarHBondContact OE1-CE1 3.4Å; T440-Y443 PolarHBondContact O-N 3.19Å; T440-Y443 WeakPolarHBondContact OG1-CB 3.38Å; T440-Y443 PolarHBondContact OG1-N 3.32Å; Y443-R445 PolarHBondContact O-N 2.68Å; Y443-L446 PolarHBondContact O-N 2.64Å; Y443-K447 HydrophobicContact CE1-CB 4.16Å; Y443-K447 HydrophobicContact CE1-CD 3.91Å; Y443-K447 HydrophobicContact CE1-CG 3.9Å; Y443-K447 WeakPolarHBondContact O-CB 3.26Å; Y443-K447 PolarHBondContact O-N 3Å; Y443-V450 HydrophobicContact CE2-CG2 4.37Å
444K84.8Confident76.2Confident95 Ų9581 Ų8141%0.41342%0.42SS..Hα-helixtrans-56.8-37.5178.9-69.4-179.9-173166.60112.5E439 T440 E441 L446E439-K444 HydrophobicContact CB-CG 3.93Å; T440-K444 PolarHBondContact O-N 2.72Å; T440-K444 VanDerWaalsContact O-N 3.08Å; E441-K444 IonicContact OE1-NZ 3.4Å; E441-K444 PolarHBondContact OE1-NZ 3.33Å; K444-L446 VanDerWaalsContact C-N 3.32Å; K444-L446 PolarHBondContact O-N 3.35Å
445R85.1Confident78.6Confident201 Ų20176 Ų7676%0.75839%0.391SS*.Hα-helixtrans-68.7-29.3178-70.2174.8-171.8-148.91.4113.7E441 E442 Y443E441-R445 WeakPolarHBondContact O-CG 3.48Å; E441-R445 PolarHBondContact O-N 2.76Å; E442-R445 PolarHBondContact O-N 3.32Å; Y443-R445 PolarHBondContact O-N 2.68Å
446L85.4Confident80.8Confident25 Ų2577.5 Ų77.513%0.13139%0.388CS..Hα-helixtrans-101.7-10.5-175.2-60.7175.7000112.5V349 K350 E442 Y443 K444 E448 D449 V450 W457V349-L446 HydrophobicContact CG1-CB 4.29Å; V349-L446 HydrophobicContact CG1-CD1 3.53Å; K350-L446 HydrophobicContact CG-CD1 4.3Å; E442-L446 HydrophobicContact CG-CD1 4.41Å; E442-L446 PolarHBondContact O-N 3.13Å; Y443-L446 PolarHBondContact O-N 2.64Å; K444-L446 VanDerWaalsContact C-N 3.32Å; K444-L446 PolarHBondContact O-N 3.35Å; L446-E448 VanDerWaalsContact C-N 3.31Å; L446-E448 PolarHBondContact O-N 2.83Å; L446-D449 CarbonylContact O-C 3.46Å; L446-D449 PolarHBondContact O-N 2.74Å; L446-V450 WeakPolarHBondContact O-CG2 3.49Å; L446-V450 PolarHBondContact O-N 3.34Å; L446-W457 HydrophobicContact CB-CG 4.26Å; L446-W457 HydrophobicContact CD1-CG 4.41Å; L446-W457 HydrophobicContact CD2-CD2 4.21Å; L446-W457 HydrophobicContact CD2-CG 4.12Å; L446-W457 HydrophobicContact CG-CG 4.49Å
447K83.6Confident82.9Confident92 Ų9275 Ų7540%0.437%0.365SS..G310 helixtrans-54.5-41.9-170.1-175.6177.4-178168.40113.6E439 Y443 D449 V450E439-K447 IonicContact OE1-NZ 2.91Å; E439-K447 PolarHBondContact OE1-NZ 3.09Å; E439-K447 IonicContact OE2-NZ 3Å; E439-K447 PolarHBondContact OE2-NZ 3.02Å; Y443-K447 HydrophobicContact CE1-CB 4.16Å; Y443-K447 HydrophobicContact CE1-CD 3.91Å; Y443-K447 HydrophobicContact CE1-CG 3.9Å; Y443-K447 WeakPolarHBondContact O-CB 3.26Å; Y443-K447 PolarHBondContact O-N 3Å; K447-D449 VanDerWaalsContact C-N 3.26Å; K447-D449 PolarHBondContact O-N 2.98Å; K447-V450 PolarHBondContact O-N 2.87Å
448E84.8Confident84.4Confident189 Ų18971.1 Ų71.188%0.88335%0.347SS*.G310 helixtrans-68.6-27.5-179.3-64-176.7171.200112.2L446L446-E448 VanDerWaalsContact C-N 3.31Å; L446-E448 PolarHBondContact O-N 2.83Å
449D86.8Confident85.6Confident83 Ų8373.6 Ų73.644%0.44436%0.355SS..G310 helixtrans-99.46.6-178.8-62.7-36.3000113L446 K447 N451 W457L446-D449 CarbonylContact O-C 3.46Å; L446-D449 PolarHBondContact O-N 2.74Å; K447-D449 VanDerWaalsContact C-N 3.26Å; K447-D449 PolarHBondContact O-N 2.98Å; D449-N451 PolarHBondContact O-N 2.88Å; D449-W457 VanDerWaalsContact CB-NE1 3.31Å
450V87.9Confident85.9Confident27 Ų2777 Ų7716%0.16438%0.379CS..BIsolated β-bridgetrans-77.3123.2175.4177.70000109.2V349 Y443 L446 K447 P452V349-V450 HydrophobicContact CG2-CG1 4.48Å; V349-V450 HydrophobicContact CG2-CG2 3.51Å; Y443-V450 HydrophobicContact CE2-CG2 4.37Å; L446-V450 WeakPolarHBondContact O-CG2 3.49Å; L446-V450 PolarHBondContact O-N 3.34Å; K447-V450 PolarHBondContact O-N 2.87Å; V450-P452 VanDerWaalsContact O-CD 3.27Å; V450-P452 WeakPolarHBondContact O-CD 3.48Å
451N89.7Confident85.8Confident49 Ų4982.2 Ų82.226%0.26240%0.4SS..  trans-68.7114.8169.9179.6-22.3000108.8D449 V453 T454 G455 R456 E458D449-N451 PolarHBondContact O-N 2.88Å; N451-V453 PolarHBondContact O-N 2.96Å; N451-V453 WeakPolarHBondContact OD1-CB 3.3Å; N451-V453 PolarHBondContact OD1-N 3.27Å; N451-T454 WeakPolarHBondContact CB-OG1 3.3Å; N451-T454 PolarHBondContact OD1-N 3.38Å; N451-G455 WeakPolarHBondContact O-CA 3.22Å; N451-G455 PolarHBondContact O-N 3.47Å; N451-R456 PolarHBondContact N-O 2.98Å; N451-E458 HydrophobicContact CB-CG 4.39Å; N451-E458 PolarHBondContact ND2-OE2 2.96Å
452P86.9Confident85.8Confident86 Ų8681 Ų8156%0.55840%0.403SS*.THydrogen-bonded Turntrans-67.3-23.6-17527.7-35.2000112.5F399 V450F399-P452 VanDerWaalsContact CB-O 3.3Å; F399-P452 WeakPolarHBondContact CB-O 3.36Å; F399-P452 PolarHBondContact N-O 2.81Å; V450-P452 VanDerWaalsContact O-CD 3.27Å; V450-P452 WeakPolarHBondContact O-CD 3.48Å
453V89.9Confident85.8Confident76 Ų7682.5 Ų82.546%0.46141%0.413SS..THydrogen-bonded Turntrans-73.5-53.9179.6-178.20000110.6F399 G400 N451 G455F399-V453 PolarHBondContact N-O 2.89Å; G400-V453 PolarHBondContact N-O 2.95Å; N451-V453 PolarHBondContact O-N 2.96Å; N451-V453 WeakPolarHBondContact OD1-CB 3.3Å; N451-V453 PolarHBondContact OD1-N 3.27Å; V453-G455 VanDerWaalsContact C-N 3.34Å
454T89.1Confident85.7Confident37 Ų3787.1 Ų87.123%0.22744%0.444CS..THydrogen-bonded Turntrans-81.3-17.1-179.157.70000112.5P353 N451 R456 E458P353-T454 WeakPolarHBondContact CD-O 3.07Å; P353-T454 WeakPolarHBondContact CG-O 3.31Å; N451-T454 WeakPolarHBondContact CB-OG1 3.3Å; N451-T454 PolarHBondContact OD1-N 3.38Å; T454-R456 PolarHBondContact O-N 3.39Å; T454-R456 WeakPolarHBondContact OG1-CG 3.36Å; T454-E458 PolarHBondContact OG1-OE1 2.71Å
455G88.9Confident85.7Confident7 Ų785.7 Ų85.77%0.07244%0.44CS..  trans71.410.3-178.600000114.1N451 V453N451-G455 WeakPolarHBondContact O-CA 3.22Å; N451-G455 PolarHBondContact O-N 3.47Å; V453-G455 VanDerWaalsContact C-N 3.34Å
456R92.1Very high85.7Confident85 Ų8581.8 Ų81.832%0.32143%0.431SS..SBendtrans-118.7154.1179.972.6176179-160.4-0.3112.1V349 R351 L352 N451 T454 E458V349-R456 CarbonylContact O-C 3.5Å; V349-R456 WeakPolarHBondContact O-CA 3.34Å; R351-R456 VanDerWaalsContact O-CB 3.31Å; R351-R456 WeakPolarHBondContact O-CB 3.44Å; L352-R456 HydrophobicContact CD2-CG 4.31Å; N451-R456 PolarHBondContact N-O 2.98Å; T454-R456 PolarHBondContact O-N 3.39Å; T454-R456 WeakPolarHBondContact OG1-CG 3.36Å; R456-E458 HydrophobicContact CG-CG 3.85Å; R456-E458 IonicContact CZ-OE1 3.41Å; R456-E458 VanDerWaalsContact CZ-OE1 3.24Å; R456-E458 IonicContact NE-OE1 2.61Å; R456-E458 PolarHBondContact NE-OE1 3.49Å; R456-E458 IonicContact NH2-OE1 4Å; R456-E458 PolarHBondContact NH2-OE1 3.24Å
457W88.6Confident85.7Confident63 Ų6388.6 Ų88.624%0.23947%0.467CS..BIsolated β-bridgetrans-71.2129166178.679.2000109.6V349 K350 L446 D449 I459V349-W457 PolarHBondContact O-N 3.01Å; K350-W457 HydrophobicContact CG-CE3 4.2Å; L446-W457 HydrophobicContact CB-CG 4.26Å; L446-W457 HydrophobicContact CD1-CG 4.41Å; L446-W457 HydrophobicContact CD2-CD2 4.21Å; L446-W457 HydrophobicContact CD2-CG 4.12Å; L446-W457 HydrophobicContact CG-CG 4.49Å; D449-W457 VanDerWaalsContact CB-NE1 3.31Å; W457-I459 HydrophobicContact CH2-CG1 3.65Å; W457-I459 HydrophobicContact CZ2-CG1 4.47Å; W457-I459 HydrophobicContact CZ3-CG1 3.87Å
458E85.8Confident86Confident58 Ų5886.3 Ų86.327%0.27146%0.458SS..  trans-122.2141.8179.3-61.7-176.6151.500108.9N451 T454 R456 P460N451-E458 HydrophobicContact CB-CG 4.39Å; N451-E458 PolarHBondContact ND2-OE2 2.96Å; T454-E458 PolarHBondContact OG1-OE1 2.71Å; R456-E458 HydrophobicContact CG-CG 3.85Å; R456-E458 IonicContact CZ-OE1 3.41Å; R456-E458 VanDerWaalsContact CZ-OE1 3.24Å; R456-E458 IonicContact NE-OE1 2.61Å; R456-E458 PolarHBondContact NE-OE1 3.49Å; R456-E458 IonicContact NH2-OE1 4Å; R456-E458 PolarHBondContact NH2-OE1 3.24Å; E458-P460 WeakPolarHBondContact O-CD 3.26Å
459I83.2Confident86.3Confident111 Ų11179.8 Ų79.857%0.56943%0.433SS*.  trans-64.8127.8170.7-60.3167.3000106.8W457 Q461W457-I459 HydrophobicContact CH2-CG1 3.65Å; W457-I459 HydrophobicContact CZ2-CG1 4.47Å; W457-I459 HydrophobicContact CZ3-CG1 3.87Å; I459-Q461 PolarHBondContact O-N 2.96Å; I459-Q461 PolarHBondContact O-NE2 3.49Å
460P80.3Confident86.6Confident99 Ų9982.1 Ų82.164%0.64344%0.442SS*.  trans-50.4115.6175.1-28.135.3000110.2E458E458-P460 WeakPolarHBondContact O-CD 3.26Å
461Q79.1Confident86.7Confident153 Ų15388.5 Ų88.572%0.71547%0.47SS*.PPolyproline II helixtrans-80.1145.2176-64.3-59.7-46.800108.9I459 N463I459-Q461 PolarHBondContact O-N 2.96Å; I459-Q461 PolarHBondContact O-NE2 3.49Å; Q461-N463 PolarHBondContact O-N 3.47Å
462P82.5Confident86.8Confident93 Ų9391.1 Ų91.160%0.60448%0.48SS*.PPolyproline II helixtrans-56.8140.2172.724.8-32.6000109.3P464P462-P464 WeakPolarHBondContact O-CD 3.45Å; P462-P464 VanDerWaalsContact O-N 3.16Å
463N82.3Confident87Confident87 Ų8790 Ų9047%0.46547%0.467SS..PPolyproline II helixtrans-65.2119.7-178.8177.1-3.8000108.6Q461 M465 E466Q461-N463 PolarHBondContact O-N 3.47Å; N463-M465 PolarHBondContact O-N 2.87Å; N463-M465 WeakPolarHBondContact OD1-CB 3.34Å; N463-M465 PolarHBondContact OD1-N 3.16Å; N463-E466 HydrophobicContact CB-CG 3.99Å; N463-E466 VanDerWaalsContact O-CB 3.29Å; N463-E466 WeakPolarHBondContact O-CB 3.36Å; N463-E466 PolarHBondContact O-N 3.25Å
464P83.5Confident87Confident113 Ų11392.9 Ų92.973%0.73448%0.475SS*.THydrogen-bonded Turntrans-64-14.6-176.726.2-35.2000113.2P462P462-P464 WeakPolarHBondContact O-CD 3.45Å; P462-P464 VanDerWaalsContact O-N 3.16Å
465M84.6Confident87.1Confident66 Ų6698.9 Ų98.933%0.32550%0.495SS..THydrogen-bonded Turntrans-90.2-1.9176.5-53.4-63.3-82.600112.8N463 N467 M468 K473N463-M465 PolarHBondContact O-N 2.87Å; N463-M465 WeakPolarHBondContact OD1-CB 3.34Å; N463-M465 PolarHBondContact OD1-N 3.16Å; M465-N467 PolarHBondContact O-N 3.3Å; M465-M468 HydrophobicContact CE-CE 4.47Å; M465-M468 HydrophobicContact CE-SD 3.65Å; M465-M468 WeakPolarHBondContact O-CB 3.4Å; M465-M468 PolarHBondContact O-N 3.36Å; M465-M468 HydrophobicContact SD-CE 3.9Å; M465-M468 HydrophobicContact SD-SD 3.86Å; M465-K473 HydrophobicContact CE-CB 3.82Å; M465-K473 HydrophobicContact CE-CD 4.08Å; M465-K473 HydrophobicContact CE-CG 3.53Å
466E85.3Confident87.3Confident119 Ų119102.1 Ų102.156%0.55651%0.51SS*.THydrogen-bonded Turntrans-61.2133.8171.9-84.7169-156.500110N463 M468N463-E466 HydrophobicContact CB-CG 3.99Å; N463-E466 VanDerWaalsContact O-CB 3.29Å; N463-E466 WeakPolarHBondContact O-CB 3.36Å; N463-E466 PolarHBondContact O-N 3.25Å; E466-M468 PolarHBondContact O-N 3.32Å
467N85.6Confident87.1Confident167 Ų167100.5 Ų100.589%0.89352%0.515SS*.THydrogen-bonded Turntrans70.57.5-177-43.1-65.3000116M465M465-N467 PolarHBondContact O-N 3.3Å
468M88.8Confident87Confident44 Ų44102 Ų10222%0.21753%0.525CS..  trans-85.2134.2172.9-167.5175.1-66.400110.9M465 E466 Q472 K473 L476M465-M468 HydrophobicContact CE-CE 4.47Å; M465-M468 HydrophobicContact CE-SD 3.65Å; M465-M468 WeakPolarHBondContact O-CB 3.4Å; M465-M468 PolarHBondContact O-N 3.36Å; M465-M468 HydrophobicContact SD-CE 3.9Å; M465-M468 HydrophobicContact SD-SD 3.86Å; E466-M468 PolarHBondContact O-N 3.32Å; M468-Q472 HydrophobicContact CG-CB 3.28Å; M468-Q472 HydrophobicContact CG-CG 4.29Å; M468-Q472 HydrophobicContact SD-CB 3.89Å; M468-K473 HydrophobicContact CB-CG 4.22Å; M468-K473 HydrophobicContact CG-CG 3.91Å; M468-K473 WeakPolarHBondContact O-CE 3.18Å; M468-K473 HydrophobicContact SD-CB 4.46Å; M468-K473 HydrophobicContact SD-CG 3.83Å; M468-L476 HydrophobicContact CE-CD1 3.44Å; M468-L476 VanDerWaalsContact CE-CD1 3.44Å; M468-L476 HydrophobicContact SD-CD1 3.51Å; M468-L476 VanDerWaalsContact SD-CD1 3.51Å; M468-L476 HydrophobicContact SD-CG 4.49Å
469S91.7Very high87.3Confident52 Ų52101.4 Ų101.436%0.36452%0.524SS..  trans-68.7153.8173.871.90000111.1E471 Q472 K473S469-E471 PolarHBondContact O-N 2.91Å; S469-Q472 WeakPolarHBondContact O-CB 3.32Å; S469-Q472 PolarHBondContact O-N 2.99Å; S469-Q472 VanDerWaalsContact OG-CG 3.31Å; S469-Q472 WeakPolarHBondContact OG-CG 3.49Å; S469-Q472 PolarHBondContact OG-N 3.47Å; S469-K473 WeakPolarHBondContact O-CG 3.4Å; S469-K473 PolarHBondContact O-N 3.5Å
470E91.9Very high87.5Confident133 Ų133101 Ų10162%0.62152%0.523SS*.Hα-helixtrans-56.4-38.2176.8-69.1-58122.600112Q472 K473 E474E470-Q472 VanDerWaalsContact C-N 3.33Å; E470-Q472 PolarHBondContact O-N 3.37Å; E470-K473 PolarHBondContact O-N 3.33Å; E470-K473 VanDerWaalsContact O-N 3.16Å; E470-K473 IonicContact OE1-NZ 2.69Å; E470-K473 PolarHBondContact OE1-NZ 3.38Å; E470-E474 PolarHBondContact O-N 3.19Å
471E91.6Very high87.7Confident161 Ų16199.5 Ų99.575%0.75251%0.511SS*.Hα-helixtrans-59.6-40.9174.3-63.5178.217700112.4S469 Y475S469-E471 PolarHBondContact O-N 2.91Å; E471-Y475 VanDerWaalsContact O-CB 3.31Å; E471-Y475 WeakPolarHBondContact O-CB 3.5Å; E471-Y475 PolarHBondContact O-N 2.88Å
472Q91.1Very high88.1Confident103 Ų10398 Ų9848%0.48150%0.504SS..Hα-helixtrans-68.1-38.2176.2-75.2170.9-23.700111.6M468 S469 E470 Y475 L476M468-Q472 HydrophobicContact CG-CB 3.28Å; M468-Q472 HydrophobicContact CG-CG 4.29Å; M468-Q472 HydrophobicContact SD-CB 3.89Å; S469-Q472 WeakPolarHBondContact O-CB 3.32Å; S469-Q472 PolarHBondContact O-N 2.99Å; S469-Q472 VanDerWaalsContact OG-CG 3.31Å; S469-Q472 WeakPolarHBondContact OG-CG 3.49Å; S469-Q472 PolarHBondContact OG-N 3.47Å; E470-Q472 VanDerWaalsContact C-N 3.33Å; E470-Q472 PolarHBondContact O-N 3.37Å; Q472-Y475 PolarHBondContact O-N 3.49Å; Q472-L476 WeakPolarHBondContact O-CG 3.31Å; Q472-L476 PolarHBondContact O-N 3.28Å
473K90.6Very high88.5Confident64 Ų6499 Ų9928%0.27850%0.499SS..Hα-helixtrans-64.3-45.3176.1-58.4-174.8-173.3160.40111.2M465 M468 S469 E470 L476 A477M465-K473 HydrophobicContact CE-CB 3.82Å; M465-K473 HydrophobicContact CE-CD 4.08Å; M465-K473 HydrophobicContact CE-CG 3.53Å; M468-K473 HydrophobicContact CB-CG 4.22Å; M468-K473 HydrophobicContact CG-CG 3.91Å; M468-K473 WeakPolarHBondContact O-CE 3.18Å; M468-K473 HydrophobicContact SD-CB 4.46Å; M468-K473 HydrophobicContact SD-CG 3.83Å; S469-K473 WeakPolarHBondContact O-CG 3.4Å; S469-K473 PolarHBondContact O-N 3.5Å; E470-K473 PolarHBondContact O-N 3.33Å; E470-K473 VanDerWaalsContact O-N 3.16Å; E470-K473 IonicContact OE1-NZ 2.69Å; E470-K473 PolarHBondContact OE1-NZ 3.38Å; K473-L476 PolarHBondContact O-N 3.33Å; K473-A477 WeakPolarHBondContact O-CB 3.44Å; K473-A477 PolarHBondContact O-N 3.18Å
474E90.1Very high88.6Confident135 Ų13597.3 Ų97.363%0.63149%0.49SS*.Hα-helixtrans-62.8-44.5177.1-173.5175.7-177.600111.2E470 L476 A477 M478E470-E474 PolarHBondContact O-N 3.19Å; E474-L476 PolarHBondContact O-N 3.42Å; E474-A477 PolarHBondContact O-N 3.27Å; E474-M478 WeakPolarHBondContact O-CB 3.01Å; E474-M478 PolarHBondContact O-N 3.27Å
475Y92.2Very high88.6Confident164 Ų16494.3 Ų94.364%0.64347%0.467SS*.Hα-helixtrans-57-48.3175.1177.5-93.1000112.1E471 Q472 M478 D479E471-Y475 VanDerWaalsContact O-CB 3.31Å; E471-Y475 WeakPolarHBondContact O-CB 3.5Å; E471-Y475 PolarHBondContact O-N 2.88Å; Q472-Y475 PolarHBondContact O-N 3.49Å; Y475-M478 PolarHBondContact O-N 2.93Å; Y475-D479 WeakPolarHBondContact O-CB 3.47Å; Y475-D479 PolarHBondContact O-N 3.5Å
476L91.6Very high88.8Confident75 Ų7598.7 Ų98.739%0.39349%0.485SS..Hα-helixtrans-67-38.4178.4-71.9180000112.8M468 Q472 K473 E474 M478 L480M468-L476 HydrophobicContact CE-CD1 3.44Å; M468-L476 VanDerWaalsContact CE-CD1 3.44Å; M468-L476 HydrophobicContact SD-CD1 3.51Å; M468-L476 VanDerWaalsContact SD-CD1 3.51Å; M468-L476 HydrophobicContact SD-CG 4.49Å; Q472-L476 WeakPolarHBondContact O-CG 3.31Å; Q472-L476 PolarHBondContact O-N 3.28Å; K473-L476 PolarHBondContact O-N 3.33Å; E474-L476 PolarHBondContact O-N 3.42Å; L476-M478 VanDerWaalsContact C-N 3.29Å; L476-M478 PolarHBondContact O-N 3.43Å; L476-L480 WeakPolarHBondContact O-CB 3.31Å; L476-L480 PolarHBondContact O-N 3.44Å
477A87.7Confident89Confident50 Ų5096.5 Ų96.541%0.41348%0.477SS..Hα-helixtrans-61.7-41.7174.500000110.8K473 E474 L480 V481K473-A477 WeakPolarHBondContact O-CB 3.44Å; K473-A477 PolarHBondContact O-N 3.18Å; E474-A477 PolarHBondContact O-N 3.27Å; A477-L480 PolarHBondContact O-N 3.42Å; A477-V481 WeakPolarHBondContact O-CG2 3.41Å; A477-V481 PolarHBondContact O-N 3.27Å
478M87.9Confident88.9Confident94 Ų9490.8 Ų90.846%0.46344%0.444SS..Hα-helixtrans-73.1-38.1-179.7-150.850.750.400112.7E474 Y475 L476 L480 V481 Q482E474-M478 WeakPolarHBondContact O-CB 3.01Å; E474-M478 PolarHBondContact O-N 3.27Å; Y475-M478 PolarHBondContact O-N 2.93Å; L476-M478 VanDerWaalsContact C-N 3.29Å; L476-M478 PolarHBondContact O-N 3.43Å; M478-L480 VanDerWaalsContact C-N 3.32Å; M478-L480 PolarHBondContact O-N 2.91Å; M478-V481 PolarHBondContact O-N 3.2Å; M478-V481 HydrophobicContact SD-CB 4.48Å; M478-Q482 WeakPolarHBondContact O-CB 3.28Å; M478-Q482 VanDerWaalsContact O-CG 3.31Å; M478-Q482 WeakPolarHBondContact O-CG 3.38Å; M478-Q482 PolarHBondContact O-N 3.09Å
479D91.2Very high88.8Confident47 Ų4798 Ų9825%0.25147%0.469SS..Hα-helixtrans-60.7-40.9170.5177.761.8000111.5Y475 Q482 K483Y475-D479 WeakPolarHBondContact O-CB 3.47Å; Y475-D479 PolarHBondContact O-N 3.5Å; D479-Q482 PolarHBondContact O-N 3.34Å; D479-K483 WeakPolarHBondContact O-CG 3.36Å; D479-K483 PolarHBondContact O-N 2.94Å; D479-K483 WeakPolarHBondContact OD1-CE 3.27Å; D479-K483 IonicContact OD1-NZ 3Å; D479-K483 VanDerWaalsContact OD2-CE 3.25Å; D479-K483 WeakPolarHBondContact OD2-CE 2.84Å; D479-K483 IonicContact OD2-NZ 3.28Å; D479-K483 PolarHBondContact OD2-NZ 3.25Å
480L88.4Confident88.7Confident103 Ų10398.8 Ų98.854%0.53948%0.475SS..Hα-helixtrans-62.9-47174.8179.561.2000111.9L476 A477 M478 Q482 K483 I484L476-L480 WeakPolarHBondContact O-CB 3.31Å; L476-L480 PolarHBondContact O-N 3.44Å; A477-L480 PolarHBondContact O-N 3.42Å; M478-L480 VanDerWaalsContact C-N 3.32Å; M478-L480 PolarHBondContact O-N 2.91Å; L480-Q482 VanDerWaalsContact C-N 3.34Å; L480-Q482 PolarHBondContact O-N 3.48Å; L480-K483 PolarHBondContact O-N 3.5Å; L480-I484 HydrophobicContact CD1-CD1 4.11Å; L480-I484 HydrophobicContact CD1-CG1 4.35Å; L480-I484 HydrophobicContact CG-CD1 4Å; L480-I484 WeakPolarHBondContact O-CG1 3.43Å; L480-I484 PolarHBondContact O-N 3.15Å
481V85Confident88.3Confident66 Ų6695.6 Ų95.640%0.448%0.477SS..Hα-helixtrans-60.2-43.8177.1170.40000110.9A477 M478 K483 I484 D485A477-V481 WeakPolarHBondContact O-CG2 3.41Å; A477-V481 PolarHBondContact O-N 3.27Å; M478-V481 PolarHBondContact O-N 3.2Å; M478-V481 HydrophobicContact SD-CB 4.48Å; V481-K483 VanDerWaalsContact C-N 3.34Å; V481-K483 PolarHBondContact O-N 3.45Å; V481-I484 PolarHBondContact O-N 3.4Å; V481-D485 WeakPolarHBondContact O-CB 3.45Å; V481-D485 PolarHBondContact O-N 3.43Å
482Q87.4Confident88.1Confident121 Ų12194.2 Ų94.257%0.56547%0.474SS*.Hα-helixtrans-62.4-39176.5-73.617715.200112.4M478 D479 L480 K486M478-Q482 WeakPolarHBondContact O-CB 3.28Å; M478-Q482 VanDerWaalsContact O-CG 3.31Å; M478-Q482 WeakPolarHBondContact O-CG 3.38Å; M478-Q482 PolarHBondContact O-N 3.09Å; D479-Q482 PolarHBondContact O-N 3.34Å; L480-Q482 VanDerWaalsContact C-N 3.34Å; L480-Q482 PolarHBondContact O-N 3.48Å; Q482-K486 WeakPolarHBondContact O-CB 3.49Å; Q482-K486 PolarHBondContact O-N 2.89Å
483K89.9Confident87.9Confident115 Ų11592.5 Ų92.550%0.547%0.468SS..Hα-helixtrans-66.3-41.1175-75.5169.1178.9166.20112.1D479 L480 V481 K486 L487D479-K483 WeakPolarHBondContact O-CG 3.36Å; D479-K483 PolarHBondContact O-N 2.94Å; D479-K483 WeakPolarHBondContact OD1-CE 3.27Å; D479-K483 IonicContact OD1-NZ 3Å; D479-K483 VanDerWaalsContact OD2-CE 3.25Å; D479-K483 WeakPolarHBondContact OD2-CE 2.84Å; D479-K483 IonicContact OD2-NZ 3.28Å; D479-K483 PolarHBondContact OD2-NZ 3.25Å; L480-K483 PolarHBondContact O-N 3.5Å; V481-K483 VanDerWaalsContact C-N 3.34Å; V481-K483 PolarHBondContact O-N 3.45Å; K483-K486 PolarHBondContact O-N 3.26Å; K483-L487 WeakPolarHBondContact O-CG 3.41Å; K483-L487 PolarHBondContact O-N 3.48Å
484I84.8Confident87.6Confident51 Ų5195 Ų9526%0.26248%0.481SS..Hα-helixtrans-64.7-48.1175.9-66.5168.9000110.4L480 V481 K486 L487 E488 I493 I510L480-I484 HydrophobicContact CD1-CD1 4.11Å; L480-I484 HydrophobicContact CD1-CG1 4.35Å; L480-I484 HydrophobicContact CG-CD1 4Å; L480-I484 WeakPolarHBondContact O-CG1 3.43Å; L480-I484 PolarHBondContact O-N 3.15Å; V481-I484 PolarHBondContact O-N 3.4Å; I484-K486 VanDerWaalsContact C-N 3.3Å; I484-K486 PolarHBondContact O-N 3.28Å; I484-L487 PolarHBondContact O-N 3.19Å; I484-L487 VanDerWaalsContact O-N 3.08Å; I484-E488 WeakPolarHBondContact O-CB 3.29Å; I484-E488 PolarHBondContact O-N 3.24Å; I484-I493 HydrophobicContact CG2-CD1 4.24Å; I484-I510 HydrophobicContact CB-CD1 4.5Å; I484-I510 HydrophobicContact CG2-CD1 3.75Å
485D83.4Confident87.3Confident50 Ų5089.5 Ų89.527%0.26746%0.457SS..Hα-helixtrans-58-41.1176170.776.7000111.4V481 L487 E488 R489V481-D485 WeakPolarHBondContact O-CB 3.45Å; V481-D485 PolarHBondContact O-N 3.43Å; D485-L487 PolarHBondContact O-N 2.93Å; D485-E488 PolarHBondContact O-N 2.94Å; D485-R489 VanDerWaalsContact CG-NE 3.31Å; D485-R489 WeakPolarHBondContact O-CB 3.42Å; D485-R489 VanDerWaalsContact O-CG 3.29Å; D485-R489 WeakPolarHBondContact O-CG 3.21Å; D485-R489 PolarHBondContact O-N 3.45Å; D485-R489 IonicContact OD1-CZ 3.32Å; D485-R489 IonicContact OD1-NE 3.05Å; D485-R489 PolarHBondContact OD1-NE 3.48Å; D485-R489 IonicContact OD1-NH2 2.71Å; D485-R489 PolarHBondContact OD1-NH2 2.95Å; D485-R489 IonicContact OD2-CZ 2.78Å; D485-R489 IonicContact OD2-NE 3.02Å; D485-R489 PolarHBondContact OD2-NE 3.3Å; D485-R489 IonicContact OD2-NH1 3.42Å; D485-R489 IonicContact OD2-NH2 3.36Å; D485-R489 PolarHBondContact OD2-NH2 3.47Å
486K88.5Confident86.9Confident159 Ų15983.4 Ų83.469%0.69144%0.443SS*.Hα-helixtrans-63.5-39.3174.8-174.2-179.6178.9-178.10112.8Q482 K483 I484 S490Q482-K486 WeakPolarHBondContact O-CB 3.49Å; Q482-K486 PolarHBondContact O-N 2.89Å; K483-K486 PolarHBondContact O-N 3.26Å; I484-K486 VanDerWaalsContact C-N 3.3Å; I484-K486 PolarHBondContact O-N 3.28Å; K486-S490 WeakPolarHBondContact O-CB 3.35Å; K486-S490 PolarHBondContact O-N 2.99Å; K486-S490 VanDerWaalsContact O-N 3.16Å; K486-S490 PolarHBondContact O-OG 3.29Å; K486-S490 VanDerWaalsContact O-OG 3.13Å
487L88.9Confident86.6Confident73 Ų7380.6 Ų80.638%0.38243%0.429SS..Hα-helixtrans-71.6-37177.5-71.5171.7000111.7K483 I484 D485 S490 G491 L492 I493K483-L487 WeakPolarHBondContact O-CG 3.41Å; K483-L487 PolarHBondContact O-N 3.48Å; I484-L487 PolarHBondContact O-N 3.19Å; I484-L487 VanDerWaalsContact O-N 3.08Å; D485-L487 PolarHBondContact O-N 2.93Å; L487-S490 WeakPolarHBondContact CA-OG 3.36Å; L487-S490 PolarHBondContact O-N 3.37Å; L487-S490 PolarHBondContact O-OG 2.92Å; L487-G491 PolarHBondContact O-N 3.45Å; L487-L492 HydrophobicContact CD2-CD1 4.11Å; L487-L492 PolarHBondContact O-N 3.15Å; L487-I493 HydrophobicContact CB-CD1 3.49Å; L487-I493 VanDerWaalsContact CB-CD1 3.49Å; L487-I493 HydrophobicContact CB-CG1 3.66Å; L487-I493 HydrophobicContact CB-CG2 4.41Å; L487-I493 HydrophobicContact CD1-CD1 4.12Å; L487-I493 HydrophobicContact CG-CD1 4.47Å; L487-I493 PolarHBondContact O-N 3.48Å
488E84.4Confident86.4Confident46 Ų4682 Ų8222%0.21543%0.429CS..Hα-helixtrans-66.1-48.8175.3-176.2176.9-167.700111.2I484 D485 S490 G491 I493I484-E488 WeakPolarHBondContact O-CB 3.29Å; I484-E488 PolarHBondContact O-N 3.24Å; D485-E488 PolarHBondContact O-N 2.94Å; E488-S490 PolarHBondContact O-N 3.36Å; E488-G491 WeakPolarHBondContact O-CA 3.35Å; E488-G491 PolarHBondContact O-N 3.16Å; E488-I493 WeakPolarHBondContact CA-O 3.42Å; E488-I493 HydrophobicContact CB-CG1 4.5Å
489R85.7Confident86.2Confident196 Ų19678 Ų7874%0.7441%0.412SS*.Hα-helixtrans-62.7-28.8177.2-72.1-179.3-167.1-170.98.5113.9D485 G491D485-R489 VanDerWaalsContact CG-NE 3.31Å; D485-R489 WeakPolarHBondContact O-CB 3.42Å; D485-R489 VanDerWaalsContact O-CG 3.29Å; D485-R489 WeakPolarHBondContact O-CG 3.21Å; D485-R489 PolarHBondContact O-N 3.45Å; D485-R489 IonicContact OD1-CZ 3.32Å; D485-R489 IonicContact OD1-NE 3.05Å; D485-R489 PolarHBondContact OD1-NE 3.48Å; D485-R489 IonicContact OD1-NH2 2.71Å; D485-R489 PolarHBondContact OD1-NH2 2.95Å; D485-R489 IonicContact OD2-CZ 2.78Å; D485-R489 IonicContact OD2-NE 3.02Å; D485-R489 PolarHBondContact OD2-NE 3.3Å; D485-R489 IonicContact OD2-NH1 3.42Å; D485-R489 IonicContact OD2-NH2 3.36Å; D485-R489 PolarHBondContact OD2-NH2 3.47Å; R489-G491 PolarHBondContact O-N 2.86Å
490S89.8Confident85.6Confident69 Ų6985.7 Ų85.748%0.48345%0.446SS..THydrogen-bonded Turntrans-77.5-7.4174.962.40000113K486 L487 E488 L492K486-S490 WeakPolarHBondContact O-CB 3.35Å; K486-S490 PolarHBondContact O-N 2.99Å; K486-S490 VanDerWaalsContact O-N 3.16Å; K486-S490 PolarHBondContact O-OG 3.29Å; K486-S490 VanDerWaalsContact O-OG 3.13Å; L487-S490 WeakPolarHBondContact CA-OG 3.36Å; L487-S490 PolarHBondContact O-N 3.37Å; L487-S490 PolarHBondContact O-OG 2.92Å; E488-S490 PolarHBondContact O-N 3.36Å; S490-L492 PolarHBondContact O-N 3.03Å
491G85.2Confident85.1Confident65 Ų6585.5 Ų85.567%0.6745%0.446SS*.THydrogen-bonded Turntrans73.59.4-177.600000113.7L487 E488 R489L487-G491 PolarHBondContact O-N 3.45Å; E488-G491 WeakPolarHBondContact O-CA 3.35Å; E488-G491 PolarHBondContact O-N 3.16Å; R489-G491 PolarHBondContact O-N 2.86Å
492L86.9Confident85Confident133 Ų13382.5 Ų82.570%0.69643%0.428SS*.SBendtrans-75.8-33.6179.7-71.5176.7000112.2L487 S490L487-L492 HydrophobicContact CD2-CD1 4.11Å; L487-L492 PolarHBondContact O-N 3.15Å; S490-L492 PolarHBondContact O-N 3.03Å
493I85.6Confident84.8Confident66 Ų6683.7 Ų83.734%0.33843%0.427SS..  trans-128.1147.5175.471.6178.3000109.8I484 L487 E488I484-I493 HydrophobicContact CG2-CD1 4.24Å; L487-I493 HydrophobicContact CB-CD1 3.49Å; L487-I493 VanDerWaalsContact CB-CD1 3.49Å; L487-I493 HydrophobicContact CB-CG1 3.66Å; L487-I493 HydrophobicContact CB-CG2 4.41Å; L487-I493 HydrophobicContact CD1-CD1 4.12Å; L487-I493 HydrophobicContact CG-CD1 4.47Å; L487-I493 PolarHBondContact O-N 3.48Å; E488-I493 WeakPolarHBondContact CA-O 3.42Å; E488-I493 HydrophobicContact CB-CG1 4.5Å
494Q86.1Confident84.5Confident118 Ų11882 Ų8255%0.55143%0.426SS*.  trans-123.4105.7167.1-176.169.363.400107.1G496 P506Q494-G496 PolarHBondContact O-N 3.11Å; Q494-P506 HydrophobicContact CG-CB 3.96Å; Q494-P506 HydrophobicContact CG-CG 4.35Å
495P83Confident84.6Confident19 Ų1984.3 Ų84.312%0.12343%0.431CS..  trans-59.5139.3175.9-20.231.8000110.3V507 L513P495-V507 HydrophobicContact CB-CG2 3.86Å; P495-V507 PolarHBondContact O-N 3.29Å; P495-V507 VanDerWaalsContact O-N 3.07Å; P495-L513 HydrophobicContact CB-CD1 4.09Å
496G83.9Confident84.7Confident35 Ų3585.8 Ų85.836%0.36144%0.444SS..EExtended strand (participates in β ladder)trans-127.1149.4-179.400000111.6Q494 R505Q494-G496 PolarHBondContact O-N 3.11Å; G496-R505 CarbonylContact C-O 3.59Å; G496-R505 WeakPolarHBondContact CA-O 3.46Å
497T85.1Confident84.5Confident16 Ų1678.5 Ų78.510%0.09841%0.413CS..EExtended strand (participates in β ladder)trans-118.8165.9168.7-170.40000109.7R505 V507T497-R505 HydrophobicContact CG2-CG 3.85Å; T497-R505 PolarHBondContact N-O 3.19Å; T497-R505 PolarHBondContact O-N 2.83Å; T497-V507 HydrophobicContact CG2-CG1 3.93Å
498I83.9Confident84Confident81 Ų8183.4 Ų83.442%0.41543%0.434SS..EExtended strand (participates in β ladder)trans-83.5122.8179-61.8159.5000108.2L412L412-I498 HydrophobicContact CB-CD1 3.9Å; L412-I498 HydrophobicContact CB-CG1 4Å; L412-I498 HydrophobicContact CB-CG2 4.2Å
499G82.7Confident83.5Confident9 Ų986.4 Ų86.49%0.09345%0.447CS..  trans-72.2166.917300000112.5D501 G502 R503G499-D501 PolarHBondContact O-N 2.98Å; G499-G502 PolarHBondContact O-N 3.38Å; G499-R503 PolarHBondContact N-O 3.07Å
500E79Confident82.8Confident209 Ų20979.2 Ų79.298%0.97742%0.423SS*.THydrogen-bonded Turntrans-60.4-26.9173.9-63.2-178.917100112.6G502E500-G502 PolarHBondContact O-N 3.45Å
501D78.8Confident81.9Confident99 Ų9980.3 Ų80.353%0.52942%0.423SS..THydrogen-bonded Turntrans-75.7-4.6174.869-16.4000113.4A410 G499 R503A410-D501 WeakPolarHBondContact CB-O 3.23Å; G499-D501 PolarHBondContact O-N 2.98Å; D501-R503 VanDerWaalsContact C-N 3.29Å; D501-R503 PolarHBondContact O-N 3.37Å; D501-R503 WeakPolarHBondContact OD1-CB 3.45Å; D501-R503 PolarHBondContact OD1-N 2.86Å; D501-R503 WeakPolarHBondContact OD2-CB 3.33Å; D501-R503 WeakPolarHBondContact OD2-CD 3.35Å; D501-R503 WeakPolarHBondContact OD2-CG 3.39Å
502G81.6Confident81.3Confident2 Ų278.7 Ų78.72%0.02140%0.398CS..SBendtrans79.15.1-177.100000114.9A410 L412 G413 G499 E500A410-G502 CarbonylContact C-O 3.44Å; A410-G502 WeakPolarHBondContact CA-O 3.48Å; L412-G502 PolarHBondContact N-O 3Å; G413-G502 VanDerWaalsContact CA-CA 3.49Å; G499-G502 PolarHBondContact O-N 3.38Å; E500-G502 PolarHBondContact O-N 3.45Å
503R83.1Confident80.4Confident146 Ų14675.7 Ų75.755%0.55138%0.383SS*.SBendtrans-91.1158.3175.2-62.5-174.3172.7-176-3.1111.1A410 G499 D501 R505A410-R503 HydrophobicContact CB-CG 3.43Å; A410-R503 VanDerWaalsContact CB-CG 3.43Å; G499-R503 PolarHBondContact N-O 3.07Å; D501-R503 VanDerWaalsContact C-N 3.29Å; D501-R503 PolarHBondContact O-N 3.37Å; D501-R503 WeakPolarHBondContact OD1-CB 3.45Å; D501-R503 PolarHBondContact OD1-N 2.86Å; D501-R503 WeakPolarHBondContact OD2-CB 3.33Å; D501-R503 WeakPolarHBondContact OD2-CD 3.35Å; D501-R503 WeakPolarHBondContact OD2-CG 3.39Å; R503-R505 PolarHBondContact O-N 3.24Å
504V84.8Confident79.6Confident80 Ų8077.1 Ų77.149%0.48539%0.39SS..EExtended strand (participates in β ladder)trans-77.2123.5172.4-176.10000108.8A407 L412A407-V504 HydrophobicContact CB-CG2 4.01Å; L412-V504 HydrophobicContact CD1-CG2 3.85Å
505R86.1Confident78.5Confident99 Ų9977.1 Ų77.137%0.37439%0.39SS..EExtended strand (participates in β ladder)trans-113.9145.3171.866.7174-17581.2-3.5110.2G496 T497 R503 V507 E512G496-R505 CarbonylContact C-O 3.59Å; G496-R505 WeakPolarHBondContact CA-O 3.46Å; T497-R505 HydrophobicContact CG2-CG 3.85Å; T497-R505 PolarHBondContact N-O 3.19Å; T497-R505 PolarHBondContact O-N 2.83Å; R503-R505 PolarHBondContact O-N 3.24Å; R505-V507 PolarHBondContact O-N 2.64Å; R505-E512 IonicContact CZ-OE2 3.14Å; R505-E512 VanDerWaalsContact CZ-OE2 3.32Å; R505-E512 IonicContact NH1-OE2 3.91Å; R505-E512 PolarHBondContact NH1-OE2 2.97Å; R505-E512 IonicContact NH2-OE2 2.89Å; R505-E512 PolarHBondContact NH2-OE2 3.02Å
506P86.1Confident77.3Confident82 Ų8278.7 Ų78.753%0.53240%0.399SS..EExtended strand (participates in β ladder)trans-55.9140.5168.3-23.334.2000110.8Q494Q494-P506 HydrophobicContact CG-CB 3.96Å; Q494-P506 HydrophobicContact CG-CG 4.35Å
507V83.2Confident75.9Confident6 Ų683.7 Ų83.74%0.03641%0.411CS..  trans-72.3141.9165.9-60.30000108.9P495 T497 R505 E512 L513P495-V507 HydrophobicContact CB-CG2 3.86Å; P495-V507 PolarHBondContact O-N 3.29Å; P495-V507 VanDerWaalsContact O-N 3.07Å; T497-V507 HydrophobicContact CG2-CG1 3.93Å; R505-V507 PolarHBondContact O-N 2.64Å; V507-E512 HydrophobicContact CB-CB 4.34Å; V507-E512 HydrophobicContact CG1-CB 4.25Å; V507-L513 HydrophobicContact CG1-CD2 3.7Å; V507-L513 HydrophobicContact CG1-CG 4.11Å
508Q79Confident74.3Confident175 Ų17588 Ų8882%0.81843%0.43SS*.SBendtrans-81.8-30.8173.6-54.1179.2100110.4E512Q508-E512 WeakPolarHBondContact CA-OE1 3.42Å; Q508-E512 WeakPolarHBondContact CB-OE1 3.5Å; Q508-E512 PolarHBondContact N-OE1 3.4Å
509H74.9Confident73Confident109 Ų10989.5 Ų89.551%0.50544%0.435SS..SBendtrans-142.4140.5176.1-163.9-88000110.8L511 E512H509-L511 VanDerWaalsContact CE1-CD1 3.43Å; H509-L511 WeakPolarHBondContact CE1-CD1 3.39Å; H509-L511 VanDerWaalsContact CE1-CG 3.47Å; H509-L511 WeakPolarHBondContact CE1-CG 3.39Å; H509-L511 WeakPolarHBondContact ND1-CB 3.26Å; H509-L511 VanDerWaalsContact ND1-CG 3.33Å; H509-L511 WeakPolarHBondContact ND1-CG 3.35Å; H509-L511 PolarHBondContact ND1-N 3.17Å; H509-L511 PolarHBondContact O-N 3.03Å; H509-E512 PolarHBondContact N-OE1 3.45Å; H509-E512 WeakPolarHBondContact O-CB 3.36Å; H509-E512 PolarHBondContact O-N 3.24Å
510I70.9Confident71.6Confident46 Ų4692.5 Ų92.524%0.23645%0.449CS..THydrogen-bonded Turntrans-57.7-23.9-177-159.2159.6000113.8I484 E512 L513I484-I510 HydrophobicContact CB-CD1 4.5Å; I484-I510 HydrophobicContact CG2-CD1 3.75Å; I510-E512 PolarHBondContact O-N 3.12Å; I510-L513 HydrophobicContact CG1-CD1 4.04Å; I510-L513 WeakPolarHBondContact O-CB 2.85Å; I510-L513 PolarHBondContact O-N 3.48Å
511L70.8Confident70Confident91 Ų9187.9 Ų87.948%0.47643%0.427SS..THydrogen-bonded Turntrans-65.2-22.3175.2-67.3173.8000113.7H509 L513 I514 Q515H509-L511 VanDerWaalsContact CE1-CD1 3.43Å; H509-L511 WeakPolarHBondContact CE1-CD1 3.39Å; H509-L511 VanDerWaalsContact CE1-CG 3.47Å; H509-L511 WeakPolarHBondContact CE1-CG 3.39Å; H509-L511 WeakPolarHBondContact ND1-CB 3.26Å; H509-L511 VanDerWaalsContact ND1-CG 3.33Å; H509-L511 WeakPolarHBondContact ND1-CG 3.35Å; H509-L511 PolarHBondContact ND1-N 3.17Å; H509-L511 PolarHBondContact O-N 3.03Å; L511-L513 PolarHBondContact O-N 3.47Å; L511-I514 HydrophobicContact CD2-CD1 3.93Å; L511-I514 PolarHBondContact O-N 3.49Å; L511-Q515 PolarHBondContact O-N 3.27Å
512E71.2Confident68.4Low32 Ų3289.8 Ų89.815%0.1543%0.431CS..Hα-helixtrans-60.2-30.8173.7-72179.2-127.900111.9R505 V507 Q508 H509 I510 I514 Q515 T516R505-E512 IonicContact CZ-OE2 3.14Å; R505-E512 VanDerWaalsContact CZ-OE2 3.32Å; R505-E512 IonicContact NH1-OE2 3.91Å; R505-E512 PolarHBondContact NH1-OE2 2.97Å; R505-E512 IonicContact NH2-OE2 2.89Å; R505-E512 PolarHBondContact NH2-OE2 3.02Å; V507-E512 HydrophobicContact CB-CB 4.34Å; V507-E512 HydrophobicContact CG1-CB 4.25Å; Q508-E512 WeakPolarHBondContact CA-OE1 3.42Å; Q508-E512 WeakPolarHBondContact CB-OE1 3.5Å; Q508-E512 PolarHBondContact N-OE1 3.4Å; H509-E512 PolarHBondContact N-OE1 3.45Å; H509-E512 WeakPolarHBondContact O-CB 3.36Å; H509-E512 PolarHBondContact O-N 3.24Å; I510-E512 PolarHBondContact O-N 3.12Å; E512-I514 PolarHBondContact O-N 2.98Å; E512-Q515 PolarHBondContact O-N 3.4Å; E512-T516 PolarHBondContact O-N 3.31Å; E512-T516 PolarHBondContact O-OG1 2.97Å
513L69.8Low66.6Low70 Ų7092 Ų9237%0.36645%0.446SS..Hα-helixtrans-66.7-28.5177-60.1174.5000112.1P495 V507 I510 L511P495-L513 HydrophobicContact CB-CD1 4.09Å; V507-L513 HydrophobicContact CG1-CD2 3.7Å; V507-L513 HydrophobicContact CG1-CG 4.11Å; I510-L513 HydrophobicContact CG1-CD1 4.04Å; I510-L513 WeakPolarHBondContact O-CB 2.85Å; I510-L513 PolarHBondContact O-N 3.48Å; L511-L513 PolarHBondContact O-N 3.47Å
514I67.9Low64.5Low95 Ų9590.7 Ų90.749%0.48745%0.45SS..Hα-helixtrans-80.6-44.9178.8-56.9179.2000110.2L511 E512 T516 K517 E518L511-I514 HydrophobicContact CD2-CD1 3.93Å; L511-I514 PolarHBondContact O-N 3.49Å; E512-I514 PolarHBondContact O-N 2.98Å; I514-T516 VanDerWaalsContact C-N 3.28Å; I514-T516 PolarHBondContact O-N 3.12Å; I514-K517 WeakPolarHBondContact O-CB 3.43Å; I514-K517 PolarHBondContact O-N 3.33Å; I514-E518 PolarHBondContact O-N 3.41Å
515Q62.6Low62.3Low118 Ų11894 Ų9455%0.55146%0.46SS*.Hα-helixtrans-59.4-39.2-179.1-69.31772.100112.4L511 E512 K517 E518 E519L511-Q515 PolarHBondContact O-N 3.27Å; E512-Q515 PolarHBondContact O-N 3.4Å; Q515-K517 PolarHBondContact O-N 3.06Å; Q515-E518 PolarHBondContact O-N 3.4Å; Q515-E518 VanDerWaalsContact O-N 3.15Å; Q515-E519 PolarHBondContact O-N 3.01Å
516T57.6Low60Low52 Ų5293.6 Ų93.632%0.31947%0.473SS..Hα-helixtrans-58.4-36.3177.3-47.40000111.7E512 I514 E519 D520E512-T516 PolarHBondContact O-N 3.31Å; E512-T516 PolarHBondContact O-OG1 2.97Å; I514-T516 VanDerWaalsContact C-N 3.28Å; I514-T516 PolarHBondContact O-N 3.12Å; T516-E519 PolarHBondContact O-N 2.93Å; T516-D520 PolarHBondContact O-N 3.5Å; T516-D520 VanDerWaalsContact O-N 3.16Å
517K54.3Low57.7Low141 Ų14195.3 Ų95.361%0.61348%0.482SS*.Hα-helixtrans-68.2-37.8178.7-168.6-178.4178.9-176.50112.5I514 Q515 D520 Q521I514-K517 WeakPolarHBondContact O-CB 3.43Å; I514-K517 PolarHBondContact O-N 3.33Å; Q515-K517 PolarHBondContact O-N 3.06Å; K517-D520 PolarHBondContact O-N 3.3Å; K517-Q521 WeakPolarHBondContact O-CG 2.85Å; K517-Q521 PolarHBondContact O-N 3.04Å; K517-Q521 VanDerWaalsContact O-N 3.1Å
518E53.1Low55.3Low105 Ų105104.7 Ų104.749%0.49153%0.532SS..Hα-helixtrans-68.2-36.2177.8-65.6-175.9179.400112I514 Q515 K522I514-E518 PolarHBondContact O-N 3.41Å; Q515-E518 PolarHBondContact O-N 3.4Å; Q515-E518 VanDerWaalsContact O-N 3.15Å; E518-K522 WeakPolarHBondContact O-CG 3.22Å; E518-K522 PolarHBondContact O-N 3.47Å; E518-K522 VanDerWaalsContact O-N 3.14Å
519E55.4Low54.1Low113 Ų113101.2 Ų101.253%0.52852%0.517SS..Hα-helixtrans-66.9-41.1174.6-68.7-172.2177.300112.4K414 Q515 T516 K522 S523K414-E519 IonicContact NZ-OE2 3.9Å; Q515-E519 PolarHBondContact O-N 3.01Å; T516-E519 PolarHBondContact O-N 2.93Å; E519-K522 PolarHBondContact O-N 3.29Å; E519-S523 WeakPolarHBondContact O-CB 3.36Å; E519-S523 PolarHBondContact O-N 3.45Å
520D53.7Low53Low72 Ų72100.8 Ų100.839%0.38552%0.518SS..Hα-helixtrans-66.9-39178.3-74-19.4000111.7T516 K517 S523 N524T516-D520 PolarHBondContact O-N 3.5Å; T516-D520 VanDerWaalsContact O-N 3.16Å; K517-D520 PolarHBondContact O-N 3.3Å; D520-S523 PolarHBondContact O-N 3.03Å; D520-S523 PolarHBondContact O-OG 2.68Å; D520-N524 PolarHBondContact O-N 2.81Å; D520-N524 VanDerWaalsContact O-N 3.08Å
521Q46.3Very low52Low112 Ų112103.8 Ų103.852%0.52353%0.534SS..Hα-helixtrans-61.7-46.2173.5-76.1-178-20.700112K517 S523 N524 E525K517-Q521 WeakPolarHBondContact O-CG 2.85Å; K517-Q521 PolarHBondContact O-N 3.04Å; K517-Q521 VanDerWaalsContact O-N 3.1Å; Q521-S523 VanDerWaalsContact C-N 3.28Å; Q521-S523 PolarHBondContact O-N 3.07Å; Q521-N524 PolarHBondContact O-N 2.75Å; Q521-E525 WeakPolarHBondContact O-CG 3.31Å; Q521-E525 PolarHBondContact O-N 3.17Å; Q521-E525 VanDerWaalsContact O-N 3.1Å
522K44.7Very low50.9Low139 Ų139104.6 Ų104.660%0.60454%0.537SS*.Hα-helixtrans-62.4-34175.8-73.8173.6-178167.70112.8E518 E519 S526E518-K522 WeakPolarHBondContact O-CG 3.22Å; E518-K522 PolarHBondContact O-N 3.47Å; E518-K522 VanDerWaalsContact O-N 3.14Å; E519-K522 PolarHBondContact O-N 3.29Å; K522-S526 PolarHBondContact O-N 3.46Å; K522-S526 PolarHBondContact O-OG 3.4Å
523S43.9Very low49.7Very low49 Ų49109.1 Ų109.134%0.34356%0.561SS.*Hα-helixtrans-72.6-34178.976.90000113.4E519 D520 Q521 S526 V527E519-S523 WeakPolarHBondContact O-CB 3.36Å; E519-S523 PolarHBondContact O-N 3.45Å; D520-S523 PolarHBondContact O-N 3.03Å; D520-S523 PolarHBondContact O-OG 2.68Å; Q521-S523 VanDerWaalsContact C-N 3.28Å; Q521-S523 PolarHBondContact O-N 3.07Å; S523-S526 PolarHBondContact O-OG 3.02Å; S523-V527 WeakPolarHBondContact O-CG2 3.36Å
524N38.4Very low48.3Very low118 Ų118111.7 Ų111.763%0.63157%0.574SS**Hα-helixtrans-74-31.7173.9-77.9-25.5000112.1D520 Q521D520-N524 PolarHBondContact O-N 2.81Å; D520-N524 VanDerWaalsContact O-N 3.08Å; Q521-N524 PolarHBondContact O-N 2.75Å
525E37.7Very low46.9Very low149 Ų149112.9 Ų112.970%0.69658%0.581SS**Hα-helixtrans-74.1-22.6175.5-73.6-179.917500113.7Q521Q521-E525 WeakPolarHBondContact O-CG 3.31Å; Q521-E525 PolarHBondContact O-N 3.17Å; Q521-E525 VanDerWaalsContact O-N 3.1Å
526S39.7Very low45.7Very low91 Ų91112.5 Ų112.564%0.63658%0.583SS**THydrogen-bonded Turntrans-93.23.5179.341.40000114.5K522 S523K522-S526 PolarHBondContact O-N 3.46Å; K522-S526 PolarHBondContact O-OG 3.4Å; S523-S526 PolarHBondContact O-OG 3.02Å
527V37.7Very low44.8Very low119 Ų119117.6 Ų117.672%0.72161%0.605SS**  trans-109.5-9.1175.1177.90000112.6S523S523-V527 WeakPolarHBondContact O-CG2 3.36Å
528N32.3Very low43.9Very low203 Ų203115.5 Ų115.5100%1.08660%0.604SS**  trans-91.70161.3-74.3-21.1000110

Retrieved 528 of 528 residues in 158.3 ms (Link to these results)

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