A0A3Q0KQT1_SCHMA Loading...

Family M13 unassigned peptidase (M13 family)

AlphaFold DB , UniProt , Accession A0A3Q0KQT1, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 407 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
1M71.7Confident84.9Confident168 Ų16862.5 Ų62.583%0.82832%0.319SS*.  0-47.60-103-167.9-93.700111.7I3 A4 R5 P17M1-I3 PolarHBondContact O-N 3.28Å; M1-A4 PolarHBondContact O-N 3.22Å; M1-A4 VanDerWaalsContact O-N 3.13Å; M1-R5 PolarHBondContact O-N 3.4Å; M1-P17 HydrophobicContact CG-CB 4.24Å; M1-P17 HydrophobicContact CG-CG 4.42Å
2E80.8Confident85Confident137 Ų13773.4 Ų73.464%0.6436%0.363SS*.Hα-helixtrans-54.7-49.1-177.1-76.5147.6-179.900114.4A4 R5 S6E2-A4 PolarHBondContact O-N 3.37Å; E2-A4 VanDerWaalsContact O-N 3.11Å; E2-R5 VanDerWaalsContact CG-NH1 3.29Å; E2-R5 CarbonylContact O-C 3.56Å; E2-R5 WeakPolarHBondContact O-CA 3.36Å; E2-R5 WeakPolarHBondContact O-CB 3.35Å; E2-R5 PolarHBondContact O-N 3.09Å; E2-S6 PolarHBondContact O-N 3.08Å
3I83.3Confident85Confident30 Ų3077.3 Ų77.315%0.15437%0.371CS..Hα-helixtrans-47.3-44.5175.1-63.3168.6000112.1M1 R5 S6 I7 I84 L87 S88 V91M1-I3 PolarHBondContact O-N 3.28Å; I3-R5 VanDerWaalsContact C-N 3.34Å; I3-R5 PolarHBondContact O-N 3.34Å; I3-S6 PolarHBondContact O-N 3.2Å; I3-I7 HydrophobicContact CG2-CD1 3.68Å; I3-I7 HydrophobicContact CG2-CG1 4.36Å; I3-I7 WeakPolarHBondContact O-CB 3.33Å; I3-I7 WeakPolarHBondContact O-CG1 3.39Å; I3-I7 PolarHBondContact O-N 3.31Å; I3-I84 HydrophobicContact CD1-CG2 3.77Å; I3-L87 HydrophobicContact CG2-CB 3.75Å; I3-L87 HydrophobicContact CG2-CD1 4.32Å; I3-S88 VanDerWaalsContact CD1-OG 3.24Å; I3-S88 WeakPolarHBondContact CD1-OG 3.48Å; I3-V91 HydrophobicContact CG2-CG2 4.33Å
4A85.4Confident85.2Confident5 Ų580.9 Ų80.94%0.04140%0.401CS..Hα-helixtrans-68.4-30.7178.300000112.9M1 E2 S8 V15 P17 L20M1-A4 PolarHBondContact O-N 3.22Å; M1-A4 VanDerWaalsContact O-N 3.13Å; E2-A4 PolarHBondContact O-N 3.37Å; E2-A4 VanDerWaalsContact O-N 3.11Å; A4-S8 WeakPolarHBondContact O-CB 3.15Å; A4-S8 PolarHBondContact O-N 3.39Å; A4-S8 PolarHBondContact O-OG 3.42Å; A4-V15 HydrophobicContact CB-CG1 4.28Å; A4-P17 HydrophobicContact CB-CB 3.92Å; A4-P17 HydrophobicContact CB-CG 3.86Å; A4-L20 HydrophobicContact CB-CD2 4.06Å
5R86.2Confident85.5Confident148 Ų14875.9 Ų75.956%0.55838%0.376SS*.Hα-helixtrans-70.7-46.9172.7-54.6-169-152.4117.30.2111.3M1 E2 I3 S8 S9M1-R5 PolarHBondContact O-N 3.4Å; E2-R5 VanDerWaalsContact CG-NH1 3.29Å; E2-R5 CarbonylContact O-C 3.56Å; E2-R5 WeakPolarHBondContact O-CA 3.36Å; E2-R5 WeakPolarHBondContact O-CB 3.35Å; E2-R5 PolarHBondContact O-N 3.09Å; I3-R5 VanDerWaalsContact C-N 3.34Å; I3-R5 PolarHBondContact O-N 3.34Å; R5-S8 WeakPolarHBondContact O-CB 3.4Å; R5-S8 PolarHBondContact O-N 3.44Å; R5-S8 VanDerWaalsContact O-N 3.14Å; R5-S9 PolarHBondContact O-N 3.5Å
6S86.1Confident85.7Confident26 Ų2674.5 Ų74.518%0.18237%0.37CS..Hα-helixtrans-60.1-47.7177.1-620000111.2E2 I3 S8 S9 I10 V91 E95E2-S6 PolarHBondContact O-N 3.08Å; I3-S6 PolarHBondContact O-N 3.2Å; S6-S8 VanDerWaalsContact C-N 3.31Å; S6-S8 PolarHBondContact O-N 2.9Å; S6-S9 WeakPolarHBondContact O-CB 3.39Å; S6-S9 PolarHBondContact O-N 3.5Å; S6-S9 VanDerWaalsContact O-N 3.07Å; S6-I10 WeakPolarHBondContact O-CD1 3.32Å; S6-I10 VanDerWaalsContact O-CG1 3.31Å; S6-I10 WeakPolarHBondContact O-CG1 3.27Å; S6-I10 PolarHBondContact O-N 3.5Å; S6-V91 VanDerWaalsContact CB-CG1 3.41Å; S6-E95 WeakPolarHBondContact CB-OE1 3.4Å; S6-E95 PolarHBondContact OG-OE1 3.34Å
7I88.8Confident85.6Confident0 Ų073.5 Ų73.50%037%0.37CS..Hα-helixtrans-56.5-45.2173.3-66.1169.2000110.8I3 S9 I10 I11 V15 L20 V30 L34 L87 V91I3-I7 HydrophobicContact CG2-CD1 3.68Å; I3-I7 HydrophobicContact CG2-CG1 4.36Å; I3-I7 WeakPolarHBondContact O-CB 3.33Å; I3-I7 WeakPolarHBondContact O-CG1 3.39Å; I3-I7 PolarHBondContact O-N 3.31Å; I7-S9 PolarHBondContact O-N 3.49Å; I7-I10 PolarHBondContact O-N 2.98Å; I7-I11 HydrophobicContact CG2-CD1 4.07Å; I7-I11 WeakPolarHBondContact O-CG1 3.41Å; I7-I11 PolarHBondContact O-N 3.03Å; I7-V15 HydrophobicContact CB-CG2 4.49Å; I7-V15 HydrophobicContact CG2-CG2 3.81Å; I7-L20 HydrophobicContact CD1-CD2 4.34Å; I7-V30 HydrophobicContact CG2-CG1 3.55Å; I7-L34 HydrophobicContact CD1-CD1 4.15Å; I7-L34 HydrophobicContact CG1-CD1 4.07Å; I7-L34 HydrophobicContact CG1-CD2 4.45Å; I7-L34 HydrophobicContact CG2-CD1 3.85Å; I7-L34 HydrophobicContact CG2-CD2 4.11Å; I7-L34 HydrophobicContact CG2-CG 4.09Å; I7-L87 HydrophobicContact CD1-CD1 4.13Å; I7-L87 HydrophobicContact CD1-CD2 3.99Å; I7-L87 HydrophobicContact CD1-CG 4.47Å; I7-V91 HydrophobicContact CD1-CG2 4.28Å; I7-V91 HydrophobicContact CG1-CG2 3.57Å
8S90Very high85.5Confident26 Ų2674.7 Ų74.718%0.18238%0.383CS..Hα-helixtrans-58.7-36.5178-59.40000112.8A4 R5 S6 K12 R13 V15A4-S8 WeakPolarHBondContact O-CB 3.15Å; A4-S8 PolarHBondContact O-N 3.39Å; A4-S8 PolarHBondContact O-OG 3.42Å; R5-S8 WeakPolarHBondContact O-CB 3.4Å; R5-S8 PolarHBondContact O-N 3.44Å; R5-S8 VanDerWaalsContact O-N 3.14Å; S6-S8 VanDerWaalsContact C-N 3.31Å; S6-S8 PolarHBondContact O-N 2.9Å; S8-K12 WeakPolarHBondContact O-CA 3.45Å; S8-K12 PolarHBondContact O-N 3.3Å; S8-K12 VanDerWaalsContact O-N 3.09Å; S8-R13 WeakPolarHBondContact CA-O 3.46Å; S8-R13 WeakPolarHBondContact CB-O 3.46Å; S8-R13 PolarHBondContact O-N 3.29Å; S8-R13 VanDerWaalsContact O-N 3.12Å; S8-V15 WeakPolarHBondContact OG-CB 3.38Å; S8-V15 PolarHBondContact OG-N 3.48Å
9S87.4Confident85.5Confident92 Ų9274.3 Ų74.364%0.64338%0.38SS*.Hα-helixtrans-68.2-47.7175.8-1680000111.5R5 S6 I7 K12R5-S9 PolarHBondContact O-N 3.5Å; S6-S9 WeakPolarHBondContact O-CB 3.39Å; S6-S9 PolarHBondContact O-N 3.5Å; S6-S9 VanDerWaalsContact O-N 3.07Å; I7-S9 PolarHBondContact O-N 3.49Å; S9-K12 PolarHBondContact O-N 3.12Å
10I86.5Confident85.4Confident32 Ų3270.6 Ų70.616%0.16436%0.361CS..Hα-helixtrans-59.4-53.1-179.4-66.1157.1000111S6 I7 K12 L34 T37 V91 F94S6-I10 WeakPolarHBondContact O-CD1 3.32Å; S6-I10 VanDerWaalsContact O-CG1 3.31Å; S6-I10 WeakPolarHBondContact O-CG1 3.27Å; S6-I10 PolarHBondContact O-N 3.5Å; I7-I10 PolarHBondContact O-N 2.98Å; I10-K12 VanDerWaalsContact C-N 3.29Å; I10-K12 PolarHBondContact O-N 3.47Å; I10-L34 HydrophobicContact CB-CD2 4.26Å; I10-L34 HydrophobicContact CD1-CD2 4.41Å; I10-L34 HydrophobicContact CG2-CD2 3.77Å; I10-T37 HydrophobicContact CG2-CG2 4.26Å; I10-V91 HydrophobicContact CD1-CG2 4.27Å; I10-F94 HydrophobicContact CD1-CB 3.49Å; I10-F94 VanDerWaalsContact CD1-CB 3.49Å; I10-F94 HydrophobicContact CD1-CD2 3.81Å; I10-F94 HydrophobicContact CD1-CG 3.75Å; I10-F94 HydrophobicContact CG1-CB 3.93Å; I10-F94 HydrophobicContact CG1-CD1 4.45Å; I10-F94 HydrophobicContact CG1-CD2 4.43Å; I10-F94 HydrophobicContact CG1-CG 4.06Å; I10-F94 HydrophobicContact CG2-CD1 3.72Å; I10-F94 HydrophobicContact CG2-CD2 3.87Å; I10-F94 HydrophobicContact CG2-CE1 3.64Å; I10-F94 HydrophobicContact CG2-CE2 3.79Å; I10-F94 HydrophobicContact CG2-CG 3.82Å; I10-F94 HydrophobicContact CG2-CZ 3.65Å
11I88.2Confident85.3Confident23 Ų2368.4 Ų68.412%0.11835%0.349CS..THydrogen-bonded Turntrans-85.70.8-17776.3-175000113.4I7 R13 V15 V30 Q33 L34I7-I11 HydrophobicContact CG2-CD1 4.07Å; I7-I11 WeakPolarHBondContact O-CG1 3.41Å; I7-I11 PolarHBondContact O-N 3.03Å; I11-R13 HydrophobicContact CD1-CB 4.39Å; I11-R13 HydrophobicContact CG1-CB 4.02Å; I11-R13 PolarHBondContact O-N 2.99Å; I11-V15 HydrophobicContact CD1-CG2 3.74Å; I11-V30 HydrophobicContact CD1-CG1 4.44Å; I11-Q33 HydrophobicContact CB-CB 4.22Å; I11-Q33 HydrophobicContact CD1-CB 4.17Å; I11-Q33 HydrophobicContact CG2-CB 4.04Å; I11-L34 HydrophobicContact CG2-CD2 3.74Å; I11-L34 HydrophobicContact CG2-CG 3.83Å
12K85.4Confident85.7Confident194 Ų19464.5 Ų64.584%0.84333%0.331SS*.THydrogen-bonded Turntrans52.635.8-178.7-58.3176.5-176.8171.70114S8 S9 I10S8-K12 WeakPolarHBondContact O-CA 3.45Å; S8-K12 PolarHBondContact O-N 3.3Å; S8-K12 VanDerWaalsContact O-N 3.09Å; S9-K12 PolarHBondContact O-N 3.12Å; I10-K12 VanDerWaalsContact C-N 3.29Å; I10-K12 PolarHBondContact O-N 3.47Å
13R85.8Confident85.9Confident124 Ų12463.3 Ų63.347%0.46832%0.324SS..SBendtrans-145.6138.6-178.4-166.5-177.8-179.2-159.3-0.9110.2S8 I11 V15 E29 Q33S8-R13 WeakPolarHBondContact CA-O 3.46Å; S8-R13 WeakPolarHBondContact CB-O 3.46Å; S8-R13 PolarHBondContact O-N 3.29Å; S8-R13 VanDerWaalsContact O-N 3.12Å; I11-R13 HydrophobicContact CD1-CB 4.39Å; I11-R13 HydrophobicContact CG1-CB 4.02Å; I11-R13 PolarHBondContact O-N 2.99Å; R13-V15 PolarHBondContact O-N 3.48Å; R13-E29 IonicContact CZ-OE1 2.64Å; R13-E29 IonicContact NH1-OE1 3.55Å; R13-E29 PolarHBondContact NH1-OE1 3.14Å; R13-E29 IonicContact NH2-OE1 3.93Å; R13-E29 PolarHBondContact NH2-OE1 3.49Å; R13-Q33 VanDerWaalsContact NH1-NE2 3.19Å
14T87.8Confident85.8Confident128 Ų12862.3 Ų62.379%0.78532%0.321SS*.  trans-64119.1-179.2-46.80000111.9
15V89.3Confident85.7Confident6 Ų666.6 Ų66.64%0.03634%0.343CS..  trans-99.2121.3173.4178.50000109.1A4 I7 S8 I11 R13 P17 L20 Y26 V30A4-V15 HydrophobicContact CB-CG1 4.28Å; I7-V15 HydrophobicContact CB-CG2 4.49Å; I7-V15 HydrophobicContact CG2-CG2 3.81Å; S8-V15 WeakPolarHBondContact OG-CB 3.38Å; S8-V15 PolarHBondContact OG-N 3.48Å; I11-V15 HydrophobicContact CD1-CG2 3.74Å; R13-V15 PolarHBondContact O-N 3.48Å; V15-P17 VanDerWaalsContact O-CD 3.26Å; V15-P17 WeakPolarHBondContact O-CD 3.47Å; V15-L20 HydrophobicContact CG1-CB 4.27Å; V15-L20 HydrophobicContact CG1-CD1 3.94Å; V15-L20 HydrophobicContact CG1-CD2 4.07Å; V15-L20 HydrophobicContact CG1-CG 4.32Å; V15-Y26 WeakPolarHBondContact CA-OH 3.46Å; V15-Y26 HydrophobicContact CG1-CE1 4.38Å; V15-V30 HydrophobicContact CG1-CG1 4.42Å; V15-V30 HydrophobicContact CG1-CG2 4.2Å; V15-V30 HydrophobicContact CG2-CG1 4.21Å; V15-V30 HydrophobicContact CG2-CG2 4.26Å
16D88.3Confident85.8Confident53 Ų5362 Ų6228%0.28333%0.326SS..  trans-73.8114176.1-174.2-25.3000110T18 M19 L20 Y26D16-T18 VanDerWaalsContact CG-OG1 3.31Å; D16-T18 PolarHBondContact O-N 3.01Å; D16-T18 WeakPolarHBondContact OD1-CA 3.5Å; D16-T18 WeakPolarHBondContact OD1-CB 3.46Å; D16-T18 PolarHBondContact OD1-N 3.34Å; D16-T18 PolarHBondContact OD1-OG1 2.92Å; D16-T18 PolarHBondContact OD2-OG1 3.17Å; D16-M19 HydrophobicContact CB-CB 4.18Å; D16-M19 HydrophobicContact CB-CG 4.19Å; D16-M19 PolarHBondContact O-N 3.04Å; D16-L20 PolarHBondContact O-N 3.31Å; D16-Y26 HydrophobicContact CB-CE1 4.46Å; D16-Y26 PolarHBondContact N-OH 3.26Å
17P83.8Confident85.9Confident57 Ų5760.8 Ų60.837%0.3732%0.318SS..THydrogen-bonded Turntrans-64.5-21.7-178.8-17.431.1000113.5M1 A4 V15M1-P17 HydrophobicContact CG-CB 4.24Å; M1-P17 HydrophobicContact CG-CG 4.42Å; A4-P17 HydrophobicContact CB-CB 3.92Å; A4-P17 HydrophobicContact CB-CG 3.86Å; V15-P17 VanDerWaalsContact O-CD 3.26Å; V15-P17 WeakPolarHBondContact O-CD 3.47Å
18T84.1Confident85.8Confident96 Ų9661.4 Ų61.459%0.58932%0.321SS*.THydrogen-bonded Turntrans-81.4-29178.872.90000112D16D16-T18 VanDerWaalsContact CG-OG1 3.31Å; D16-T18 PolarHBondContact O-N 3.01Å; D16-T18 WeakPolarHBondContact OD1-CA 3.5Å; D16-T18 WeakPolarHBondContact OD1-CB 3.46Å; D16-T18 PolarHBondContact OD1-N 3.34Å; D16-T18 PolarHBondContact OD1-OG1 2.92Å; D16-T18 PolarHBondContact OD2-OG1 3.17Å
19M85.2Confident85.7Confident66 Ų6663.6 Ų63.633%0.32533%0.328SS..THydrogen-bonded Turntrans-91-27.3178.3-59.8-158-165.100113.4D16 F21 D22 K23 Y26D16-M19 HydrophobicContact CB-CB 4.18Å; D16-M19 HydrophobicContact CB-CG 4.19Å; D16-M19 PolarHBondContact O-N 3.04Å; M19-F21 VanDerWaalsContact C-N 3.26Å; M19-F21 PolarHBondContact O-N 3.47Å; M19-F21 VanDerWaalsContact O-N 3.1Å; M19-D22 PolarHBondContact O-N 3.23Å; M19-K23 HydrophobicContact CB-CD 4.31Å; M19-K23 HydrophobicContact CG-CD 4.31Å; M19-K23 PolarHBondContact O-N 3.37Å; M19-K23 HydrophobicContact SD-CD 3.88Å; M19-K23 PolarHBondContact SD-NZ 3.25Å; M19-Y26 HydrophobicContact CB-CD1 3.63Å; M19-Y26 HydrophobicContact CB-CE1 3.79Å; M19-Y26 HydrophobicContact CB-CG 4.36Å
20L84.4Confident85.8Confident1 Ų159.4 Ų59.41%0.00530%0.299CS..THydrogen-bonded Turntrans-52-36.5-171.1-177.760.2000114.9A4 I7 V15 D16 M27 V30 L87A4-L20 HydrophobicContact CB-CD2 4.06Å; I7-L20 HydrophobicContact CD1-CD2 4.34Å; V15-L20 HydrophobicContact CG1-CB 4.27Å; V15-L20 HydrophobicContact CG1-CD1 3.94Å; V15-L20 HydrophobicContact CG1-CD2 4.07Å; V15-L20 HydrophobicContact CG1-CG 4.32Å; D16-L20 PolarHBondContact O-N 3.31Å; L20-M27 HydrophobicContact CD1-CG 4.46Å; L20-M27 VanDerWaalsContact O-CB 3.25Å; L20-M27 WeakPolarHBondContact O-CB 3.42Å; L20-M27 VanDerWaalsContact O-CG 3.28Å; L20-M27 WeakPolarHBondContact O-CG 3.33Å; L20-V30 HydrophobicContact CD1-CB 4Å; L20-V30 HydrophobicContact CD1-CG1 3.81Å; L20-V30 HydrophobicContact CD1-CG2 4.13Å; L20-L87 HydrophobicContact CD2-CD1 4.31Å
21F83.4Confident85.9Confident24 Ų2458 Ų5811%0.10529%0.292CS..THydrogen-bonded Turntrans-107.7-20.6179.7-60.9-75.6000113.9M19 M27 R80 W83 I84 L87M19-F21 VanDerWaalsContact C-N 3.26Å; M19-F21 PolarHBondContact O-N 3.47Å; M19-F21 VanDerWaalsContact O-N 3.1Å; F21-M27 HydrophobicContact CD1-CE 4.27Å; F21-M27 HydrophobicContact CE1-CE 4.21Å; F21-R80 HydrophobicContact CB-CG 3.95Å; F21-R80 HydrophobicContact CD1-CG 4.36Å; F21-R80 HydrophobicContact CG-CG 4.13Å; F21-W83 HydrophobicContact CD1-CB 4.37Å; F21-W83 HydrophobicContact CE1-CB 4.13Å; F21-I84 HydrophobicContact CE1-CG1 3.97Å; F21-I84 HydrophobicContact CE2-CG1 4.34Å; F21-I84 HydrophobicContact CZ-CG1 3.71Å; F21-L87 HydrophobicContact CE1-CD1 3.8Å; F21-L87 HydrophobicContact CZ-CD1 3.86Å
22D80.5Confident86Confident86 Ų8657.3 Ų57.346%0.4629%0.288SS..THydrogen-bonded Turntrans-93.7-13.3-173.5-67.2-18.4000112.9M19 R80M19-D22 PolarHBondContact O-N 3.23Å; D22-R80 IonicContact OD1-CZ 3.28Å; D22-R80 IonicContact OD1-NE 2.73Å; D22-R80 IonicContact OD1-NH2 2.78Å; D22-R80 PolarHBondContact OD1-NH2 2.78Å; D22-R80 IonicContact OD2-NH2 2.9Å; D22-R80 PolarHBondContact OD2-NH2 3.45Å
23K84.3Confident86.2Confident112 Ų11249.5 Ų49.549%0.48725%0.254SS..  trans-122.2100.8172.4-67.2-175.9-178176.20110.6M19 D25 Y26 M27M19-K23 HydrophobicContact CB-CD 4.31Å; M19-K23 HydrophobicContact CG-CD 4.31Å; M19-K23 PolarHBondContact O-N 3.37Å; M19-K23 HydrophobicContact SD-CD 3.88Å; M19-K23 PolarHBondContact SD-NZ 3.25Å; K23-D25 VanDerWaalsContact C-N 3.31Å; K23-D25 PolarHBondContact O-N 3.5Å; K23-Y26 WeakPolarHBondContact O-CB 3.47Å; K23-Y26 PolarHBondContact O-N 2.98Å; K23-M27 PolarHBondContact O-N 3.19Å
24G81.3Confident86.3Confident9 Ų943.6 Ų43.69%0.09323%0.232CC..Hα-helixtrans-55.1-41.5-179.100000114Y26 M27 D28G24-Y26 VanDerWaalsContact C-N 3.3Å; G24-Y26 PolarHBondContact O-N 3.4Å; G24-M27 WeakPolarHBondContact O-CB 3.24Å; G24-M27 PolarHBondContact O-N 3.37Å; G24-D28 PolarHBondContact O-N 3.05Å
25D83.6Confident86.3Confident96 Ų9637.6 Ų37.651%0.51320%0.195SC..Hα-helixtrans-64.3-33179-59.7-13000112K23 E29 R75K23-D25 VanDerWaalsContact C-N 3.31Å; K23-D25 PolarHBondContact O-N 3.5Å; D25-E29 PolarHBondContact O-N 3.5Å; D25-R75 IonicContact OD1-NE 3.59Å; D25-R75 IonicContact OD1-NH2 3.85Å; D25-R75 IonicContact OD2-CZ 3.61Å; D25-R75 IonicContact OD2-NE 2.88Å; D25-R75 IonicContact OD2-NH2 2.66Å; D25-R75 PolarHBondContact OD2-NH2 3.41Å
26Y87.7Confident86.3Confident51 Ų5137.4 Ų37.420%0.219%0.194CC..Hα-helixtrans-75.7-37174.8-179.5-111.4000111.9V15 D16 M19 K23 G24 D28 E29 V30V15-Y26 WeakPolarHBondContact CA-OH 3.46Å; V15-Y26 HydrophobicContact CG1-CE1 4.38Å; D16-Y26 HydrophobicContact CB-CE1 4.46Å; D16-Y26 PolarHBondContact N-OH 3.26Å; M19-Y26 HydrophobicContact CB-CD1 3.63Å; M19-Y26 HydrophobicContact CB-CE1 3.79Å; M19-Y26 HydrophobicContact CB-CG 4.36Å; K23-Y26 WeakPolarHBondContact O-CB 3.47Å; K23-Y26 PolarHBondContact O-N 2.98Å; G24-Y26 VanDerWaalsContact C-N 3.3Å; G24-Y26 PolarHBondContact O-N 3.4Å; Y26-D28 VanDerWaalsContact C-N 3.34Å; Y26-E29 PolarHBondContact O-N 2.96Å; Y26-V30 HydrophobicContact CD1-CG2 4.49Å; Y26-V30 HydrophobicContact CE1-CG2 4.17Å; Y26-V30 HydrophobicContact CE2-CG2 4.38Å; Y26-V30 WeakPolarHBondContact O-CG2 3.26Å; Y26-V30 PolarHBondContact O-N 3.42Å
27M87.4Confident86.1Confident0 Ų038.1 Ų38.10%020%0.2CC..Hα-helixtrans-60.9-43.7174.3-165.2-176.7-175.600112L20 F21 K23 G24 E29 V30 L31 R78 W83 L87L20-M27 HydrophobicContact CD1-CG 4.46Å; L20-M27 VanDerWaalsContact O-CB 3.25Å; L20-M27 WeakPolarHBondContact O-CB 3.42Å; L20-M27 VanDerWaalsContact O-CG 3.28Å; L20-M27 WeakPolarHBondContact O-CG 3.33Å; F21-M27 HydrophobicContact CD1-CE 4.27Å; F21-M27 HydrophobicContact CE1-CE 4.21Å; K23-M27 PolarHBondContact O-N 3.19Å; G24-M27 WeakPolarHBondContact O-CB 3.24Å; G24-M27 PolarHBondContact O-N 3.37Å; M27-E29 VanDerWaalsContact C-N 3.35Å; M27-V30 PolarHBondContact O-N 3.23Å; M27-L31 HydrophobicContact CE-CD1 4.24Å; M27-L31 HydrophobicContact CG-CD1 4.19Å; M27-L31 WeakPolarHBondContact O-CB 3.45Å; M27-L31 WeakPolarHBondContact O-CG 3.4Å; M27-L31 PolarHBondContact O-N 3.08Å; M27-R78 HydrophobicContact SD-CB 4.01Å; M27-R78 HydrophobicContact SD-CG 3.85Å; M27-W83 HydrophobicContact CE-CB 3.83Å; M27-W83 HydrophobicContact CE-CD2 3.49Å; M27-W83 VanDerWaalsContact CE-CD2 3.49Å; M27-W83 HydrophobicContact CE-CE3 3.36Å; M27-W83 HydrophobicContact CE-CG 3.72Å; M27-W83 HydrophobicContact CE-CZ3 4.06Å; M27-W83 HydrophobicContact SD-CD2 4.19Å; M27-W83 HydrophobicContact SD-CE3 4.46Å; M27-W83 HydrophobicContact SD-CG 4.35Å; M27-L87 HydrophobicContact CE-CD1 3.93Å; M27-L87 HydrophobicContact CE-CG 4.47Å
28D86.7Confident86.2Confident14 Ų1437 Ų378%0.07519%0.191CC..Hα-helixtrans-66.9-34.9178.5-70.7-12.9000111.4G24 Y26 W32 F46 F51 R78G24-D28 PolarHBondContact O-N 3.05Å; Y26-D28 VanDerWaalsContact C-N 3.34Å; D28-W32 VanDerWaalsContact O-CB 3.27Å; D28-W32 WeakPolarHBondContact O-CB 3.32Å; D28-W32 PolarHBondContact O-N 3.11Å; D28-F46 HydrophobicContact CB-CE2 3.94Å; D28-F46 HydrophobicContact CB-CZ 3.94Å; D28-F46 WeakPolarHBondContact O-CE2 3.3Å; D28-F51 HydrophobicContact CB-CE1 4.2Å; D28-F51 HydrophobicContact CB-CZ 4.02Å; D28-R78 IonicContact OD1-CZ 2.66Å; D28-R78 VanDerWaalsContact OD1-CZ 3.28Å; D28-R78 IonicContact OD1-NH1 3.62Å; D28-R78 PolarHBondContact OD1-NH1 3.2Å; D28-R78 IonicContact OD1-NH2 3.15Å; D28-R78 PolarHBondContact OD1-NH2 3.47Å; D28-R78 IonicContact OD2-CZ 2.85Å; D28-R78 IonicContact OD2-NH2 3.69Å; D28-R78 PolarHBondContact OD2-NH2 3.02Å
29E88.1Confident86.2Confident71 Ų7135.4 Ų35.433%0.33218%0.175SC..Hα-helixtrans-63.7-45.8171.4-169.6-175.9157.800111.7R13 D25 Y26 M27 W32 Q33R13-E29 IonicContact CZ-OE1 2.64Å; R13-E29 IonicContact NH1-OE1 3.55Å; R13-E29 PolarHBondContact NH1-OE1 3.14Å; R13-E29 IonicContact NH2-OE1 3.93Å; R13-E29 PolarHBondContact NH2-OE1 3.49Å; D25-E29 PolarHBondContact O-N 3.5Å; Y26-E29 PolarHBondContact O-N 2.96Å; M27-E29 VanDerWaalsContact C-N 3.35Å; E29-W32 WeakPolarHBondContact O-CB 3.46Å; E29-W32 PolarHBondContact O-N 3.21Å; E29-Q33 WeakPolarHBondContact O-CG 3.5Å; E29-Q33 PolarHBondContact O-N 2.72Å
30V89.8Confident86.1Confident5 Ų539.6 Ų39.63%0.0320%0.198CC..Hα-helixtrans-64.5-44.1178.3171.80000111.7I7 I11 V15 L20 Y26 M27 W32 Q33 L34I7-V30 HydrophobicContact CG2-CG1 3.55Å; I11-V30 HydrophobicContact CD1-CG1 4.44Å; V15-V30 HydrophobicContact CG1-CG1 4.42Å; V15-V30 HydrophobicContact CG1-CG2 4.2Å; V15-V30 HydrophobicContact CG2-CG1 4.21Å; V15-V30 HydrophobicContact CG2-CG2 4.26Å; L20-V30 HydrophobicContact CD1-CB 4Å; L20-V30 HydrophobicContact CD1-CG1 3.81Å; L20-V30 HydrophobicContact CD1-CG2 4.13Å; Y26-V30 HydrophobicContact CD1-CG2 4.49Å; Y26-V30 HydrophobicContact CE1-CG2 4.17Å; Y26-V30 HydrophobicContact CE2-CG2 4.38Å; Y26-V30 WeakPolarHBondContact O-CG2 3.26Å; Y26-V30 PolarHBondContact O-N 3.42Å; M27-V30 PolarHBondContact O-N 3.23Å; V30-W32 VanDerWaalsContact C-N 3.33Å; V30-W32 PolarHBondContact O-N 3.26Å; V30-Q33 PolarHBondContact O-N 2.96Å; V30-L34 HydrophobicContact CG1-CD1 4.33Å; V30-L34 PolarHBondContact O-N 2.72Å
31L88.7Confident85.9Confident3 Ų342.5 Ų42.52%0.01621%0.213CC..Hα-helixtrans-63.1-38174.2-76.1168.7000111.8M27 L34 L35 F51 F55 W83 F86 L87M27-L31 HydrophobicContact CE-CD1 4.24Å; M27-L31 HydrophobicContact CG-CD1 4.19Å; M27-L31 WeakPolarHBondContact O-CB 3.45Å; M27-L31 WeakPolarHBondContact O-CG 3.4Å; M27-L31 PolarHBondContact O-N 3.08Å; L31-L34 PolarHBondContact O-N 3.31Å; L31-L35 VanDerWaalsContact O-CG 3.25Å; L31-L35 WeakPolarHBondContact O-CG 3.31Å; L31-L35 PolarHBondContact O-N 3.43Å; L31-F51 HydrophobicContact CB-CE2 3.58Å; L31-F51 HydrophobicContact CB-CZ 4.01Å; L31-F51 HydrophobicContact CD1-CZ 4.14Å; L31-F55 HydrophobicContact CD1-CE2 4.31Å; L31-F55 HydrophobicContact CD2-CE2 4.36Å; L31-W83 HydrophobicContact CD1-CE3 4.44Å; L31-W83 HydrophobicContact CD1-CH2 3.91Å; L31-W83 HydrophobicContact CD1-CZ3 3.63Å; L31-W83 HydrophobicContact CD2-CZ3 4.45Å; L31-F86 HydrophobicContact CD2-CE1 4.15Å; L31-L87 HydrophobicContact CD2-CD2 3.6Å
32W90.4Very high85.7Confident8 Ų846 Ų463%0.0324%0.238CC..Hα-helixtrans-64-42.2174.2173.8-109.4000112.2D28 E29 V30 L34 L35 C36 S44 F46 F51 L54D28-W32 VanDerWaalsContact O-CB 3.27Å; D28-W32 WeakPolarHBondContact O-CB 3.32Å; D28-W32 PolarHBondContact O-N 3.11Å; E29-W32 WeakPolarHBondContact O-CB 3.46Å; E29-W32 PolarHBondContact O-N 3.21Å; V30-W32 VanDerWaalsContact C-N 3.33Å; V30-W32 PolarHBondContact O-N 3.26Å; W32-L34 VanDerWaalsContact C-N 3.34Å; W32-L34 PolarHBondContact O-N 3.03Å; W32-L35 PolarHBondContact O-N 3.13Å; W32-C36 WeakPolarHBondContact O-CB 3.44Å; W32-C36 PolarHBondContact O-N 3.25Å; W32-C36 PolarHBondContact O-SG 3.23Å; W32-S44 PolarHBondContact NE1-O 3.37Å; W32-F46 HydrophobicContact CB-CD2 3.5Å; W32-F46 VanDerWaalsContact CB-CD2 3.5Å; W32-F46 HydrophobicContact CB-CE2 3.84Å; W32-F46 HydrophobicContact CD2-CD2 4.28Å; W32-F46 AromaticContact CG-CD2 3.67Å; W32-F46 HydrophobicContact CG-CD2 3.67Å; W32-F46 HydrophobicContact CG-CE2 4.33Å; W32-F51 HydrophobicContact CB-CD2 4Å; W32-F51 HydrophobicContact CB-CE2 4.42Å; W32-F51 HydrophobicContact CE3-CB 3.76Å; W32-F51 HydrophobicContact CE3-CD2 4.14Å; W32-F51 HydrophobicContact CE3-CG 4.47Å; W32-F51 HydrophobicContact CZ3-CB 4.14Å; W32-L54 HydrophobicContact CZ3-CD1 4.11Å
33Q89.2Confident85.3Confident29 Ų2946 Ų4614%0.13625%0.245CC..Hα-helixtrans-62.8-41.2175.2-67.9-160.6-38.500111.7I11 R13 E29 V30 C36 T37I11-Q33 HydrophobicContact CB-CB 4.22Å; I11-Q33 HydrophobicContact CD1-CB 4.17Å; I11-Q33 HydrophobicContact CG2-CB 4.04Å; R13-Q33 VanDerWaalsContact NH1-NE2 3.19Å; E29-Q33 WeakPolarHBondContact O-CG 3.5Å; E29-Q33 PolarHBondContact O-N 2.72Å; V30-Q33 PolarHBondContact O-N 2.96Å; Q33-C36 WeakPolarHBondContact O-CB 3.37Å; Q33-C36 PolarHBondContact O-N 3.38Å; Q33-T37 PolarHBondContact O-N 3.4Å; Q33-T37 PolarHBondContact O-OG1 3.46Å; Q33-T37 VanDerWaalsContact O-OG1 3.05Å
34L88.9Confident84.7Confident0 Ų044.2 Ų44.20%025%0.247CC..Hα-helixtrans-59.5-47.8172.2-74.5161.8000112.2I7 I10 I11 V30 L31 W32 C36 T37 I38 L87 L90 F94I7-L34 HydrophobicContact CD1-CD1 4.15Å; I7-L34 HydrophobicContact CG1-CD1 4.07Å; I7-L34 HydrophobicContact CG1-CD2 4.45Å; I7-L34 HydrophobicContact CG2-CD1 3.85Å; I7-L34 HydrophobicContact CG2-CD2 4.11Å; I7-L34 HydrophobicContact CG2-CG 4.09Å; I10-L34 HydrophobicContact CB-CD2 4.26Å; I10-L34 HydrophobicContact CD1-CD2 4.41Å; I10-L34 HydrophobicContact CG2-CD2 3.77Å; I11-L34 HydrophobicContact CG2-CD2 3.74Å; I11-L34 HydrophobicContact CG2-CG 3.83Å; V30-L34 HydrophobicContact CG1-CD1 4.33Å; V30-L34 PolarHBondContact O-N 2.72Å; L31-L34 PolarHBondContact O-N 3.31Å; W32-L34 VanDerWaalsContact C-N 3.34Å; W32-L34 PolarHBondContact O-N 3.03Å; L34-C36 VanDerWaalsContact C-N 3.35Å; L34-C36 PolarHBondContact O-N 3.47Å; L34-T37 WeakPolarHBondContact O-CA 3.4Å; L34-T37 WeakPolarHBondContact O-CB 3.45Å; L34-T37 PolarHBondContact O-N 3.02Å; L34-T37 VanDerWaalsContact O-N 3.09Å; L34-I38 WeakPolarHBondContact O-CG1 3.33Å; L34-I38 PolarHBondContact O-N 3.1Å; L34-L87 HydrophobicContact CD1-CD2 4.33Å; L34-L90 HydrophobicContact CB-CD2 4.14Å; L34-L90 HydrophobicContact CD1-CD2 4.05Å; L34-L90 HydrophobicContact CD2-CD2 4.15Å; L34-L90 HydrophobicContact CG-CD2 4.35Å; L34-F94 HydrophobicContact CD2-CD2 4.2Å; L34-F94 HydrophobicContact CD2-CE2 3.72Å; L34-F94 HydrophobicContact CD2-CZ 4.46Å
35L88.3Confident84.5Confident2 Ų250.7 Ų50.71%0.0128%0.28CS..Hα-helixtrans-63.5-38.7178-69.1164.5000112.1L31 W32 T37 I38 Y39 F51 L54 F55 T58L31-L35 VanDerWaalsContact O-CG 3.25Å; L31-L35 WeakPolarHBondContact O-CG 3.31Å; L31-L35 PolarHBondContact O-N 3.43Å; W32-L35 PolarHBondContact O-N 3.13Å; L35-T37 VanDerWaalsContact C-N 3.27Å; L35-T37 PolarHBondContact O-N 3.05Å; L35-I38 PolarHBondContact O-N 3.42Å; L35-Y39 HydrophobicContact CD2-CE2 4.07Å; L35-Y39 VanDerWaalsContact O-CD2 3.29Å; L35-Y39 WeakPolarHBondContact O-CD2 3.35Å; L35-Y39 PolarHBondContact O-N 3.02Å; L35-F51 HydrophobicContact CD1-CD2 3.72Å; L35-F51 HydrophobicContact CD1-CE2 3.91Å; L35-L54 HydrophobicContact CD1-CB 4.37Å; L35-L54 HydrophobicContact CD2-CB 4.27Å; L35-F55 HydrophobicContact CD1-CB 3.94Å; L35-F55 HydrophobicContact CD1-CD2 4.5Å; L35-T58 HydrophobicContact CD2-CG2 4.33Å; L35-T58 WeakPolarHBondContact CD2-OG1 3.38Å
36C87.5Confident84.3Confident3 Ų349.8 Ų49.82%0.0227%0.271CS..Hα-helixtrans-57.5-41.4171.2-81.80000111.6W32 Q33 L34 D40 I41W32-C36 WeakPolarHBondContact O-CB 3.44Å; W32-C36 PolarHBondContact O-N 3.25Å; W32-C36 PolarHBondContact O-SG 3.23Å; Q33-C36 WeakPolarHBondContact O-CB 3.37Å; Q33-C36 PolarHBondContact O-N 3.38Å; L34-C36 VanDerWaalsContact C-N 3.35Å; L34-C36 PolarHBondContact O-N 3.47Å; C36-D40 WeakPolarHBondContact O-CA 3.45Å; C36-D40 PolarHBondContact O-N 3.16Å; C36-D40 VanDerWaalsContact O-N 3.15Å; C36-I41 VanDerWaalsContact CB-O 3.28Å; C36-I41 WeakPolarHBondContact CB-O 3.34Å; C36-I41 PolarHBondContact O-N 2.98Å
37T85.3Confident84Confident67 Ų6750 Ų5041%0.41128%0.277SS..Hα-helixtrans-67.9-39.7174.8-490000112.7I10 Q33 L34 L35 Y39 F94I10-T37 HydrophobicContact CG2-CG2 4.26Å; Q33-T37 PolarHBondContact O-N 3.4Å; Q33-T37 PolarHBondContact O-OG1 3.46Å; Q33-T37 VanDerWaalsContact O-OG1 3.05Å; L34-T37 WeakPolarHBondContact O-CA 3.4Å; L34-T37 WeakPolarHBondContact O-CB 3.45Å; L34-T37 PolarHBondContact O-N 3.02Å; L34-T37 VanDerWaalsContact O-N 3.09Å; L35-T37 VanDerWaalsContact C-N 3.27Å; L35-T37 PolarHBondContact O-N 3.05Å; T37-Y39 PolarHBondContact O-N 3.38Å; T37-F94 HydrophobicContact CG2-CE1 3.76Å; T37-F94 HydrophobicContact CG2-CZ 3.99Å
38I85.1Confident83.7Confident35 Ų3557 Ų5718%0.17931%0.308CS..Hα-helixtrans-62.1-42.8177.7-66.3179.8000111.7L34 L35 T58 L90 W93 F94L34-I38 WeakPolarHBondContact O-CG1 3.33Å; L34-I38 PolarHBondContact O-N 3.1Å; L35-I38 PolarHBondContact O-N 3.42Å; I38-T58 HydrophobicContact CD1-CG2 3.69Å; I38-L90 HydrophobicContact CD1-CD1 4.28Å; I38-L90 HydrophobicContact CD1-CD2 4.31Å; I38-L90 HydrophobicContact CD1-CG 4.3Å; I38-W93 HydrophobicContact CD1-CZ3 4.36Å; I38-W93 HydrophobicContact CG1-CE3 4.44Å; I38-W93 HydrophobicContact CG1-CH2 4.45Å; I38-W93 HydrophobicContact CG1-CZ3 3.85Å; I38-W93 HydrophobicContact CG2-CH2 4.13Å; I38-W93 HydrophobicContact CG2-CZ3 4.36Å; I38-F94 HydrophobicContact CB-CZ 4.48Å; I38-F94 HydrophobicContact CD1-CE2 4.02Å; I38-F94 HydrophobicContact CD1-CZ 4.23Å; I38-F94 HydrophobicContact CG1-CE1 4.24Å; I38-F94 HydrophobicContact CG1-CE2 3.66Å; I38-F94 HydrophobicContact CG1-CZ 3.36Å
39Y85.2Confident83.2Confident62 Ų6262.1 Ų62.124%0.24334%0.339CS..THydrogen-bonded Turntrans-99.88.6-171.7-66.5-68.4000114.3L35 T37 I41 L54 M57 T58L35-Y39 HydrophobicContact CD2-CE2 4.07Å; L35-Y39 VanDerWaalsContact O-CD2 3.29Å; L35-Y39 WeakPolarHBondContact O-CD2 3.35Å; L35-Y39 PolarHBondContact O-N 3.02Å; T37-Y39 PolarHBondContact O-N 3.38Å; Y39-I41 WeakPolarHBondContact O-CG1 3.47Å; Y39-I41 PolarHBondContact O-N 3.19Å; Y39-L54 HydrophobicContact CD1-CD2 4.5Å; Y39-L54 HydrophobicContact CD2-CB 4.11Å; Y39-L54 HydrophobicContact CD2-CD1 4.05Å; Y39-L54 HydrophobicContact CD2-CD2 3.76Å; Y39-L54 HydrophobicContact CD2-CG 4.18Å; Y39-L54 HydrophobicContact CE2-CB 3.8Å; Y39-L54 HydrophobicContact CE2-CD2 3.82Å; Y39-L54 HydrophobicContact CE2-CG 4.25Å; Y39-L54 HydrophobicContact CG-CD2 4.13Å; Y39-M57 HydrophobicContact CD1-CE 4.28Å; Y39-M57 HydrophobicContact CE1-CE 3.32Å; Y39-M57 WeakPolarHBondContact OH-CE 3.48Å; Y39-T58 VanDerWaalsContact CE2-OG1 3.28Å; Y39-T58 WeakPolarHBondContact CE2-OG1 3.48Å; Y39-T58 PolarHBondContact OH-N 3.03Å; Y39-T58 PolarHBondContact OH-OG1 2.95Å
40D82.8Confident82.9Confident153 Ų15365.7 Ų65.782%0.81835%0.351SS*.THydrogen-bonded Turntrans47.944.7-172.5-162.430.7000113.3C36C36-D40 WeakPolarHBondContact O-CA 3.45Å; C36-D40 PolarHBondContact O-N 3.16Å; C36-D40 VanDerWaalsContact O-N 3.15Å
41I79.7Confident82.7Confident62 Ų6265.6 Ų65.632%0.31835%0.35SS..  trans-99.3134.4179.8-58.5175.5000108.7C36 Y39 S43 L54C36-I41 VanDerWaalsContact CB-O 3.28Å; C36-I41 WeakPolarHBondContact CB-O 3.34Å; C36-I41 PolarHBondContact O-N 2.98Å; Y39-I41 WeakPolarHBondContact O-CG1 3.47Å; Y39-I41 PolarHBondContact O-N 3.19Å; I41-S43 PolarHBondContact O-N 3.08Å; I41-L54 HydrophobicContact CD1-CD1 3.63Å
42P78.4Confident82.3Confident98 Ų9867.7 Ų67.764%0.63636%0.361SS*.  trans-51.7126.4175.5-27.734.7000112.2S44P42-S44 PolarHBondContact O-N 3.47Å; P42-S44 PolarHBondContact O-OG 3.11Å
43S72.6Confident81.9Confident86 Ų8674.7 Ų74.760%0.60139%0.392SS*.  trans-72.550-177.665.50000113.3I41I41-S43 PolarHBondContact O-N 3.08Å
44S72.1Confident81.8Confident75 Ų7574.4 Ų74.452%0.52439%0.391SS..  trans-80.6-177.7176.864.30000111.4W32 P42 F46W32-S44 PolarHBondContact NE1-O 3.37Å; P42-S44 PolarHBondContact O-N 3.47Å; P42-S44 PolarHBondContact O-OG 3.11Å; S44-F46 PolarHBondContact O-N 3.12Å
45N76.2Confident81.6Confident145 Ų14574.4 Ų74.478%0.77539%0.391SS*.SBendtrans-44.9133.2-174.6-66.6-15.8000113.5T47N45-T47 PolarHBondContact O-N 2.96Å; N45-T47 PolarHBondContact O-OG1 3.35Å
46F80.5Confident81.3Confident77 Ų7777.3 Ų77.334%0.33841%0.405SS..  trans-49.4112.9180176.2-98.2000112D28 W32 S44 K48 F51D28-F46 HydrophobicContact CB-CE2 3.94Å; D28-F46 HydrophobicContact CB-CZ 3.94Å; D28-F46 WeakPolarHBondContact O-CE2 3.3Å; W32-F46 HydrophobicContact CB-CD2 3.5Å; W32-F46 VanDerWaalsContact CB-CD2 3.5Å; W32-F46 HydrophobicContact CB-CE2 3.84Å; W32-F46 HydrophobicContact CD2-CD2 4.28Å; W32-F46 AromaticContact CG-CD2 3.67Å; W32-F46 HydrophobicContact CG-CD2 3.67Å; W32-F46 HydrophobicContact CG-CE2 4.33Å; S44-F46 PolarHBondContact O-N 3.12Å; F46-K48 HydrophobicContact CD1-CB 4.49Å; F46-K48 HydrophobicContact CE1-CB 3.76Å; F46-K48 HydrophobicContact CE1-CG 4.08Å; F46-K48 HydrophobicContact CZ-CB 4.37Å; F46-K48 HydrophobicContact CZ-CG 4.42Å; F46-F51 HydrophobicContact CE2-CB 3.89Å; F46-F51 AromaticContact CE2-CD1 3.92Å; F46-F51 HydrophobicContact CE2-CD1 3.92Å; F46-F51 AromaticContact CE2-CD2 3.72Å; F46-F51 HydrophobicContact CE2-CD2 3.72Å; F46-F51 HydrophobicContact CE2-CE1 4.36Å; F46-F51 HydrophobicContact CE2-CE2 4.19Å; F46-F51 AromaticContact CE2-CG 3.55Å; F46-F51 HydrophobicContact CE2-CG 3.55Å; F46-F51 HydrophobicContact CE2-CZ 4.48Å; F46-F51 HydrophobicContact CZ-CB 4.02Å; F46-F51 AromaticContact CZ-CD1 3.69Å; F46-F51 HydrophobicContact CZ-CD1 3.69Å; F46-F51 HydrophobicContact CZ-CD2 4.35Å; F46-F51 HydrophobicContact CZ-CE1 4.2Å; F46-F51 AromaticContact CZ-CG 3.75Å; F46-F51 HydrophobicContact CZ-CG 3.75Å
47T80.7Confident81.2Confident54 Ų5481.1 Ų81.133%0.33142%0.424SS..  trans-110.293-177.3-57.10000110.6N45 V49 Y50 F51N45-T47 PolarHBondContact O-N 2.96Å; N45-T47 PolarHBondContact O-OG1 3.35Å; T47-V49 PolarHBondContact O-N 3.24Å; T47-Y50 HydrophobicContact CG2-CD2 3.46Å; T47-Y50 VanDerWaalsContact CG2-CD2 3.46Å; T47-Y50 HydrophobicContact CG2-CE2 4.05Å; T47-Y50 HydrophobicContact CG2-CG 4.4Å; T47-Y50 PolarHBondContact O-N 3.21Å; T47-F51 PolarHBondContact O-N 3.47Å
48K80.7Confident81.1Confident148 Ų14878.1 Ų78.164%0.64341%0.406SS*.Hα-helixtrans-50.8-33.4-170.9-165.6169.4-174.8168.50115.4F46 L52F46-K48 HydrophobicContact CD1-CB 4.49Å; F46-K48 HydrophobicContact CE1-CB 3.76Å; F46-K48 HydrophobicContact CE1-CG 4.08Å; F46-K48 HydrophobicContact CZ-CB 4.37Å; F46-K48 HydrophobicContact CZ-CG 4.42Å; K48-L52 PolarHBondContact O-N 2.9Å
49V77.5Confident81Confident121 Ų12177 Ų7773%0.73340%0.401SS*.Hα-helixtrans-68.7-45.6178.8179.10000111.6T47T47-V49 PolarHBondContact O-N 3.24Å
50Y81.8Confident80.8Confident147 Ų14779.1 Ų79.158%0.57642%0.421SS*.Hα-helixtrans-71.2-41.9175-68.4-58.3000111.2T47 L52 K53 L54T47-Y50 HydrophobicContact CG2-CD2 3.46Å; T47-Y50 VanDerWaalsContact CG2-CD2 3.46Å; T47-Y50 HydrophobicContact CG2-CE2 4.05Å; T47-Y50 HydrophobicContact CG2-CG 4.4Å; T47-Y50 PolarHBondContact O-N 3.21Å; Y50-L52 VanDerWaalsContact C-N 3.35Å; Y50-L52 PolarHBondContact O-N 3.02Å; Y50-K53 PolarHBondContact O-N 3.16Å; Y50-K53 VanDerWaalsContact O-N 3.13Å; Y50-L54 WeakPolarHBondContact O-CB 3.31Å; Y50-L54 WeakPolarHBondContact O-CG 3.31Å; Y50-L54 PolarHBondContact O-N 3.4Å
51F84.6Confident80.5Confident2 Ų277.3 Ų77.31%0.00941%0.411CS..Hα-helixtrans-48.6-54.9178172.3-109.7000111.9D28 L31 W32 L35 F46 T47 K53 F55 F73D28-F51 HydrophobicContact CB-CE1 4.2Å; D28-F51 HydrophobicContact CB-CZ 4.02Å; L31-F51 HydrophobicContact CB-CE2 3.58Å; L31-F51 HydrophobicContact CB-CZ 4.01Å; L31-F51 HydrophobicContact CD1-CZ 4.14Å; W32-F51 HydrophobicContact CB-CD2 4Å; W32-F51 HydrophobicContact CB-CE2 4.42Å; W32-F51 HydrophobicContact CE3-CB 3.76Å; W32-F51 HydrophobicContact CE3-CD2 4.14Å; W32-F51 HydrophobicContact CE3-CG 4.47Å; W32-F51 HydrophobicContact CZ3-CB 4.14Å; L35-F51 HydrophobicContact CD1-CD2 3.72Å; L35-F51 HydrophobicContact CD1-CE2 3.91Å; F46-F51 HydrophobicContact CE2-CB 3.89Å; F46-F51 AromaticContact CE2-CD1 3.92Å; F46-F51 HydrophobicContact CE2-CD1 3.92Å; F46-F51 AromaticContact CE2-CD2 3.72Å; F46-F51 HydrophobicContact CE2-CD2 3.72Å; F46-F51 HydrophobicContact CE2-CE1 4.36Å; F46-F51 HydrophobicContact CE2-CE2 4.19Å; F46-F51 AromaticContact CE2-CG 3.55Å; F46-F51 HydrophobicContact CE2-CG 3.55Å; F46-F51 HydrophobicContact CE2-CZ 4.48Å; F46-F51 HydrophobicContact CZ-CB 4.02Å; F46-F51 AromaticContact CZ-CD1 3.69Å; F46-F51 HydrophobicContact CZ-CD1 3.69Å; F46-F51 HydrophobicContact CZ-CD2 4.35Å; F46-F51 HydrophobicContact CZ-CE1 4.2Å; F46-F51 AromaticContact CZ-CG 3.75Å; F46-F51 HydrophobicContact CZ-CG 3.75Å; T47-F51 PolarHBondContact O-N 3.47Å; F51-K53 VanDerWaalsContact C-N 3.34Å; F51-K53 PolarHBondContact O-N 2.95Å; F51-F55 WeakPolarHBondContact O-CB 3.47Å; F51-F55 PolarHBondContact O-N 3.48Å; F51-F73 AromaticContact CE1-CD1 3.85Å; F51-F73 HydrophobicContact CE1-CD1 3.85Å; F51-F73 AromaticContact CE1-CE1 3.54Å; F51-F73 HydrophobicContact CE1-CE1 3.54Å; F51-F73 HydrophobicContact CE1-CZ 4.45Å; F51-F73 HydrophobicContact CZ-CD1 4.36Å; F51-F73 AromaticContact CZ-CE1 3.75Å; F51-F73 HydrophobicContact CZ-CE1 3.75Å
52L81.3Confident80.3Confident47 Ų4776 Ų7625%0.24640%0.404CS..Hα-helixtrans-64.5-38.9-177.3-153.197000112.2K48 Y50 M56 L70 F73K48-L52 PolarHBondContact O-N 2.9Å; Y50-L52 VanDerWaalsContact C-N 3.35Å; Y50-L52 PolarHBondContact O-N 3.02Å; L52-M56 WeakPolarHBondContact O-CB 3.44Å; L52-M56 WeakPolarHBondContact O-CG 3.5Å; L52-M56 PolarHBondContact O-N 2.87Å; L52-L70 HydrophobicContact CD1-CD2 3.85Å; L52-L70 HydrophobicContact CD2-CD2 3.61Å; L52-L70 HydrophobicContact CD2-CG 4.21Å; L52-L70 HydrophobicContact CG-CD2 4.4Å; L52-F73 HydrophobicContact CD1-CD2 4.2Å; L52-F73 HydrophobicContact CD1-CE2 4.33Å; L52-F73 HydrophobicContact CD1-CG 4.48Å
53K82.3Confident80.1Confident156 Ų15674.2 Ų74.268%0.67840%0.404SS*.Hα-helixtrans-69.1-48.6-179.5-173.6179.2179-176.30112Y50 F51 M56 M57Y50-K53 PolarHBondContact O-N 3.16Å; Y50-K53 VanDerWaalsContact O-N 3.13Å; F51-K53 VanDerWaalsContact C-N 3.34Å; F51-K53 PolarHBondContact O-N 2.95Å; K53-M56 PolarHBondContact O-N 3.3Å; K53-M57 WeakPolarHBondContact O-CB 3.47Å; K53-M57 PolarHBondContact O-N 3.18Å; K53-M57 VanDerWaalsContact O-N 3.08Å
54L86.1Confident80.4Confident22 Ų2272.3 Ų72.312%0.11538%0.384CS..Hα-helixtrans-63.8-43177.8-66177.9000110.5W32 L35 Y39 I41 Y50 M56 M57 T58W32-L54 HydrophobicContact CZ3-CD1 4.11Å; L35-L54 HydrophobicContact CD1-CB 4.37Å; L35-L54 HydrophobicContact CD2-CB 4.27Å; Y39-L54 HydrophobicContact CD1-CD2 4.5Å; Y39-L54 HydrophobicContact CD2-CB 4.11Å; Y39-L54 HydrophobicContact CD2-CD1 4.05Å; Y39-L54 HydrophobicContact CD2-CD2 3.76Å; Y39-L54 HydrophobicContact CD2-CG 4.18Å; Y39-L54 HydrophobicContact CE2-CB 3.8Å; Y39-L54 HydrophobicContact CE2-CD2 3.82Å; Y39-L54 HydrophobicContact CE2-CG 4.25Å; Y39-L54 HydrophobicContact CG-CD2 4.13Å; I41-L54 HydrophobicContact CD1-CD1 3.63Å; Y50-L54 WeakPolarHBondContact O-CB 3.31Å; Y50-L54 WeakPolarHBondContact O-CG 3.31Å; Y50-L54 PolarHBondContact O-N 3.4Å; L54-M56 PolarHBondContact O-N 2.93Å; L54-M57 HydrophobicContact CD2-CE 4.47Å; L54-M57 PolarHBondContact O-N 2.85Å; L54-T58 PolarHBondContact O-N 3.4Å; L54-T58 PolarHBondContact O-OG1 3.33Å
55F85.4Confident80.1Confident1 Ų173.6 Ų73.60%0.00440%0.399CS..Hα-helixtrans-57.7-48.7175.7-179.3-84.2000112.6L31 L35 F51 M57 T58 A59 F68 F73 W83 F86L31-F55 HydrophobicContact CD1-CE2 4.31Å; L31-F55 HydrophobicContact CD2-CE2 4.36Å; L35-F55 HydrophobicContact CD1-CB 3.94Å; L35-F55 HydrophobicContact CD1-CD2 4.5Å; F51-F55 WeakPolarHBondContact O-CB 3.47Å; F51-F55 PolarHBondContact O-N 3.48Å; F55-M57 VanDerWaalsContact C-N 3.29Å; F55-M57 PolarHBondContact O-N 2.98Å; F55-T58 PolarHBondContact O-N 3.44Å; F55-A59 HydrophobicContact CE1-CB 4.43Å; F55-A59 WeakPolarHBondContact O-CB 3.35Å; F55-A59 PolarHBondContact O-N 2.89Å; F55-F68 HydrophobicContact CE1-CB 3.86Å; F55-F68 HydrophobicContact CE1-CD1 4.03Å; F55-F68 AromaticContact CE1-CD2 3.73Å; F55-F68 HydrophobicContact CE1-CD2 3.73Å; F55-F68 HydrophobicContact CE1-CE2 4.22Å; F55-F68 AromaticContact CE1-CG 3.62Å; F55-F68 HydrophobicContact CE1-CG 3.62Å; F55-F68 AromaticContact CZ-CD1 4Å; F55-F68 HydrophobicContact CZ-CD1 4Å; F55-F68 AromaticContact CZ-CD2 3.86Å; F55-F68 HydrophobicContact CZ-CD2 3.86Å; F55-F68 HydrophobicContact CZ-CE1 4.02Å; F55-F68 AromaticContact CZ-CE2 3.86Å; F55-F68 HydrophobicContact CZ-CE2 3.86Å; F55-F68 AromaticContact CZ-CG 3.93Å; F55-F68 HydrophobicContact CZ-CG 3.93Å; F55-F68 AromaticContact CZ-CZ 3.95Å; F55-F68 HydrophobicContact CZ-CZ 3.95Å; F55-F73 HydrophobicContact CD1-CE2 4.25Å; F55-F73 AromaticContact CD1-CZ 3.66Å; F55-F73 HydrophobicContact CD1-CZ 3.66Å; F55-F73 HydrophobicContact CD2-CZ 4.22Å; F55-F73 HydrophobicContact CE1-CE2 4.13Å; F55-F73 AromaticContact CE1-CZ 3.61Å; F55-F73 HydrophobicContact CE1-CZ 3.61Å; F55-F73 HydrophobicContact CE2-CZ 4.15Å; F55-F73 AromaticContact CG-CZ 3.99Å; F55-F73 HydrophobicContact CG-CZ 3.99Å; F55-F73 AromaticContact CZ-CZ 3.87Å; F55-F73 HydrophobicContact CZ-CZ 3.87Å; F55-W83 AromaticContact CE2-CH2 3.76Å; F55-W83 HydrophobicContact CE2-CH2 3.76Å; F55-W83 AromaticContact CE2-CZ3 3.64Å; F55-W83 HydrophobicContact CE2-CZ3 3.64Å; F55-W83 AromaticContact CZ-CH2 3.58Å; F55-W83 HydrophobicContact CZ-CH2 3.58Å; F55-W83 AromaticContact CZ-CZ3 3.67Å; F55-W83 HydrophobicContact CZ-CZ3 3.67Å; F55-F86 HydrophobicContact CD2-CE1 4.32Å; F55-F86 HydrophobicContact CD2-CZ 4.31Å; F55-F86 HydrophobicContact CE2-CD1 4.18Å; F55-F86 AromaticContact CE2-CE1 3.35Å; F55-F86 HydrophobicContact CE2-CE1 3.35Å; F55-F86 AromaticContact CE2-CZ 3.55Å; F55-F86 HydrophobicContact CE2-CZ 3.55Å; F55-F86 HydrophobicContact CZ-CD1 4.31Å; F55-F86 AromaticContact CZ-CE1 3.77Å; F55-F86 HydrophobicContact CZ-CE1 3.77Å; F55-F86 HydrophobicContact CZ-CE2 4.34Å; F55-F86 AromaticContact CZ-CZ 3.76Å; F55-F86 HydrophobicContact CZ-CZ 3.76Å
56M82.7Confident79.7Confident63 Ų6367.8 Ų67.831%0.3137%0.374SS..Hα-helixtrans-62.1-39.1178.1-68-80.2108.300111.4L52 K53 L54 T60 F68 F73L52-M56 WeakPolarHBondContact O-CB 3.44Å; L52-M56 WeakPolarHBondContact O-CG 3.5Å; L52-M56 PolarHBondContact O-N 2.87Å; K53-M56 PolarHBondContact O-N 3.3Å; L54-M56 PolarHBondContact O-N 2.93Å; M56-T60 WeakPolarHBondContact O-CB 3.44Å; M56-T60 PolarHBondContact O-N 2.86Å; M56-T60 VanDerWaalsContact O-N 3.11Å; M56-T60 PolarHBondContact O-OG1 2.88Å; M56-F68 HydrophobicContact CE-CB 3.48Å; M56-F68 VanDerWaalsContact CE-CB 3.48Å; M56-F68 WeakPolarHBondContact CE-O 3.4Å; M56-F73 HydrophobicContact CE-CE2 4.43Å
57M83.6Confident79Confident82 Ų8271 Ų7140%0.40439%0.394SS..Hα-helixtrans-64.7-52.9177-158.1167.179.800110.5Y39 K53 L54 F55 A59 T60 D61Y39-M57 HydrophobicContact CD1-CE 4.28Å; Y39-M57 HydrophobicContact CE1-CE 3.32Å; Y39-M57 WeakPolarHBondContact OH-CE 3.48Å; K53-M57 WeakPolarHBondContact O-CB 3.47Å; K53-M57 PolarHBondContact O-N 3.18Å; K53-M57 VanDerWaalsContact O-N 3.08Å; L54-M57 HydrophobicContact CD2-CE 4.47Å; L54-M57 PolarHBondContact O-N 2.85Å; F55-M57 VanDerWaalsContact C-N 3.29Å; F55-M57 PolarHBondContact O-N 2.98Å; M57-A59 VanDerWaalsContact C-N 3.35Å; M57-A59 PolarHBondContact O-N 3.29Å; M57-T60 CarbonylContact O-C 3.59Å; M57-T60 WeakPolarHBondContact O-CA 3.43Å; M57-T60 WeakPolarHBondContact O-CB 3.41Å; M57-T60 PolarHBondContact O-N 3.47Å; M57-D61 PolarHBondContact O-N 3.14Å
58T84.7Confident78.6Confident5 Ų569.4 Ų69.43%0.03138%0.383CS..Hα-helixtrans-56.7-43175.8-55.50000112.8L35 I38 Y39 L54 F55 T60 D61 L62 L90L35-T58 HydrophobicContact CD2-CG2 4.33Å; L35-T58 WeakPolarHBondContact CD2-OG1 3.38Å; I38-T58 HydrophobicContact CD1-CG2 3.69Å; Y39-T58 VanDerWaalsContact CE2-OG1 3.28Å; Y39-T58 WeakPolarHBondContact CE2-OG1 3.48Å; Y39-T58 PolarHBondContact OH-N 3.03Å; Y39-T58 PolarHBondContact OH-OG1 2.95Å; L54-T58 PolarHBondContact O-N 3.4Å; L54-T58 PolarHBondContact O-OG1 3.33Å; F55-T58 PolarHBondContact O-N 3.44Å; T58-T60 VanDerWaalsContact C-N 3.25Å; T58-T60 PolarHBondContact O-N 3.18Å; T58-D61 PolarHBondContact O-N 3.09Å; T58-L62 HydrophobicContact CG2-CD1 3.75Å; T58-L62 HydrophobicContact CG2-CG 4.17Å; T58-L62 VanDerWaalsContact O-CB 3.28Å; T58-L62 WeakPolarHBondContact O-CB 3.39Å; T58-L62 WeakPolarHBondContact O-CG 3.47Å; T58-L62 PolarHBondContact O-N 3.35Å; T58-L90 HydrophobicContact CG2-CD1 3.82Å
59A81.8Confident78.1Confident11 Ų1165.7 Ų65.79%0.09137%0.372CS..Hα-helixtrans-64.2-31.3177.300000112.8F55 M57 Y64 F68 F86F55-A59 HydrophobicContact CE1-CB 4.43Å; F55-A59 WeakPolarHBondContact O-CB 3.35Å; F55-A59 PolarHBondContact O-N 2.89Å; M57-A59 VanDerWaalsContact C-N 3.35Å; M57-A59 PolarHBondContact O-N 3.29Å; A59-Y64 PolarHBondContact O-N 3.42Å; A59-Y64 VanDerWaalsContact O-N 3.09Å; A59-F68 HydrophobicContact CB-CD2 4.27Å; A59-F86 HydrophobicContact CB-CE2 3.97Å
60T80.5Confident77.7Confident106 Ų10666.1 Ų66.165%0.6537%0.37SS*.Hα-helixtrans-75.2-47.4175.1-52.80000111M56 M57 T58 L62 G63M56-T60 WeakPolarHBondContact O-CB 3.44Å; M56-T60 PolarHBondContact O-N 2.86Å; M56-T60 VanDerWaalsContact O-N 3.11Å; M56-T60 PolarHBondContact O-OG1 2.88Å; M57-T60 CarbonylContact O-C 3.59Å; M57-T60 WeakPolarHBondContact O-CA 3.43Å; M57-T60 WeakPolarHBondContact O-CB 3.41Å; M57-T60 PolarHBondContact O-N 3.47Å; T58-T60 VanDerWaalsContact C-N 3.25Å; T58-T60 PolarHBondContact O-N 3.18Å; T60-L62 VanDerWaalsContact C-N 3.3Å; T60-L62 PolarHBondContact O-N 3.04Å; T60-G63 PolarHBondContact O-N 3.04Å
61D77.9Confident77.1Confident115 Ų11563.1 Ų63.162%0.61537%0.37SS*.Hα-helixtrans-64.9-33.2-178.9-61.8-25.4000112M57 T58 G63M57-D61 PolarHBondContact O-N 3.14Å; T58-D61 PolarHBondContact O-N 3.09Å; D61-G63 PolarHBondContact O-N 2.93Å
62L76.2Confident76.6Confident34 Ų3464.9 Ų64.918%0.17838%0.38CS..THydrogen-bonded Turntrans-75.2-4.2172.1-69.5175.9000113.9T58 T60 Y64 F86 L90 W93T58-L62 HydrophobicContact CG2-CD1 3.75Å; T58-L62 HydrophobicContact CG2-CG 4.17Å; T58-L62 VanDerWaalsContact O-CB 3.28Å; T58-L62 WeakPolarHBondContact O-CB 3.39Å; T58-L62 WeakPolarHBondContact O-CG 3.47Å; T58-L62 PolarHBondContact O-N 3.35Å; T60-L62 VanDerWaalsContact C-N 3.3Å; T60-L62 PolarHBondContact O-N 3.04Å; L62-Y64 PolarHBondContact O-N 3.48Å; L62-F86 HydrophobicContact CD1-CE2 4.42Å; L62-L90 HydrophobicContact CD1-CB 4.17Å; L62-L90 HydrophobicContact CD1-CD1 4.08Å; L62-L90 HydrophobicContact CD1-CG 4.17Å; L62-W93 HydrophobicContact CD2-CB 3.62Å; L62-W93 HydrophobicContact CD2-CD2 4.31Å; L62-W93 HydrophobicContact CD2-CG 3.45Å; L62-W93 VanDerWaalsContact CD2-CG 3.45Å
63G73.9Confident76Confident61 Ų6163.9 Ų63.963%0.62937%0.374SS*.THydrogen-bonded Turntrans6225.9-176.400000114T60 D61 A65T60-G63 PolarHBondContact O-N 3.04Å; D61-G63 PolarHBondContact O-N 2.93Å; G63-A65 PolarHBondContact O-N 3.41Å; G63-A65 VanDerWaalsContact O-N 3.09Å
64Y77.9Confident75.2Confident47 Ų4759.5 Ų59.518%0.18436%0.363CS..  trans-70.7109-171.9-174.9-102.9000111.4A59 L62 G66 F68 K82 P85 F86 C89A59-Y64 PolarHBondContact O-N 3.42Å; A59-Y64 VanDerWaalsContact O-N 3.09Å; L62-Y64 PolarHBondContact O-N 3.48Å; Y64-G66 WeakPolarHBondContact CD1-O 3.46Å; Y64-G66 PolarHBondContact O-N 3.44Å; Y64-F68 HydrophobicContact CD1-CD2 4.11Å; Y64-F68 AromaticContact CD1-CE2 3.49Å; Y64-F68 HydrophobicContact CD1-CE2 3.49Å; Y64-F68 VanDerWaalsContact CD1-CE2 3.49Å; Y64-F68 HydrophobicContact CD1-CZ 4.4Å; Y64-F68 HydrophobicContact CE1-CD2 4.24Å; Y64-F68 AromaticContact CE1-CE2 3.38Å; Y64-F68 HydrophobicContact CE1-CE2 3.38Å; Y64-F68 AromaticContact CE1-CZ 3.86Å; Y64-F68 HydrophobicContact CE1-CZ 3.86Å; Y64-K82 PolarHBondContact OH-O 3.17Å; Y64-P85 HydrophobicContact CE2-CB 4.36Å; Y64-F86 AromaticContact CD1-CD2 3.86Å; Y64-F86 HydrophobicContact CD1-CD2 3.86Å; Y64-F86 HydrophobicContact CD2-CD2 4.1Å; Y64-F86 HydrophobicContact CE1-CB 4.03Å; Y64-F86 HydrophobicContact CE1-CD2 4.09Å; Y64-F86 HydrophobicContact CE1-CG 4.5Å; Y64-F86 HydrophobicContact CE2-CB 3.98Å; Y64-F86 HydrophobicContact CE2-CD2 4.35Å; Y64-F86 AromaticContact CG-CD2 3.84Å; Y64-F86 HydrophobicContact CG-CD2 3.84Å; Y64-F86 PolarHBondContact OH-N 2.89Å; Y64-C89 HydrophobicContact CD2-CB 4.4Å
65A66.8Low73.8Confident101 Ų10167.5 Ų67.584%0.83539%0.391SS*.  trans-60.2-15.3-174.200000115.2G63 N67G63-A65 PolarHBondContact O-N 3.41Å; G63-A65 VanDerWaalsContact O-N 3.09Å; A65-N67 PolarHBondContact O-N 3.46Å
66G67.3Low72.4Confident24 Ų2474.2 Ų74.225%0.24743%0.428CS..SBendtrans-82.994.2178.700000113.1Y64 F68Y64-G66 WeakPolarHBondContact CD1-O 3.46Å; Y64-G66 PolarHBondContact O-N 3.44Å; G66-F68 VanDerWaalsContact O-CD2 3.3Å; G66-F68 WeakPolarHBondContact O-CD2 3.36Å; G66-F68 PolarHBondContact O-N 3.05Å
67N64.8Low71.5Confident144 Ų14480 Ų8077%0.7745%0.451SS*.  trans-45.3111.2173.7-77.2-25.4000112.6A65 K82A65-N67 PolarHBondContact O-N 3.46Å; N67-K82 PolarHBondContact O-NZ 3.25Å
68F72.9Confident70.9Confident21 Ų2176.7 Ų76.79%0.09243%0.434CS..  trans-89.1126.9172.9-77.3-80.6000111F55 M56 A59 Y64 G66 N72 K82 W83 F86F55-F68 HydrophobicContact CE1-CB 3.86Å; F55-F68 HydrophobicContact CE1-CD1 4.03Å; F55-F68 AromaticContact CE1-CD2 3.73Å; F55-F68 HydrophobicContact CE1-CD2 3.73Å; F55-F68 HydrophobicContact CE1-CE2 4.22Å; F55-F68 AromaticContact CE1-CG 3.62Å; F55-F68 HydrophobicContact CE1-CG 3.62Å; F55-F68 AromaticContact CZ-CD1 4Å; F55-F68 HydrophobicContact CZ-CD1 4Å; F55-F68 AromaticContact CZ-CD2 3.86Å; F55-F68 HydrophobicContact CZ-CD2 3.86Å; F55-F68 HydrophobicContact CZ-CE1 4.02Å; F55-F68 AromaticContact CZ-CE2 3.86Å; F55-F68 HydrophobicContact CZ-CE2 3.86Å; F55-F68 AromaticContact CZ-CG 3.93Å; F55-F68 HydrophobicContact CZ-CG 3.93Å; F55-F68 AromaticContact CZ-CZ 3.95Å; F55-F68 HydrophobicContact CZ-CZ 3.95Å; M56-F68 HydrophobicContact CE-CB 3.48Å; M56-F68 VanDerWaalsContact CE-CB 3.48Å; M56-F68 WeakPolarHBondContact CE-O 3.4Å; A59-F68 HydrophobicContact CB-CD2 4.27Å; Y64-F68 HydrophobicContact CD1-CD2 4.11Å; Y64-F68 AromaticContact CD1-CE2 3.49Å; Y64-F68 HydrophobicContact CD1-CE2 3.49Å; Y64-F68 VanDerWaalsContact CD1-CE2 3.49Å; Y64-F68 HydrophobicContact CD1-CZ 4.4Å; Y64-F68 HydrophobicContact CE1-CD2 4.24Å; Y64-F68 AromaticContact CE1-CE2 3.38Å; Y64-F68 HydrophobicContact CE1-CE2 3.38Å; Y64-F68 AromaticContact CE1-CZ 3.86Å; Y64-F68 HydrophobicContact CE1-CZ 3.86Å; G66-F68 VanDerWaalsContact O-CD2 3.3Å; G66-F68 WeakPolarHBondContact O-CD2 3.36Å; G66-F68 PolarHBondContact O-N 3.05Å; F68-N72 WeakPolarHBondContact CA-OD1 3.48Å; F68-N72 HydrophobicContact CD1-CB 4.13Å; F68-K82 HydrophobicContact CE1-CD 4.38Å; F68-K82 HydrophobicContact CE1-CG 4.35Å; F68-W83 HydrophobicContact CD1-CH2 4.15Å; F68-W83 HydrophobicContact CD1-CZ2 4.14Å; F68-W83 HydrophobicContact CE1-CD2 4.08Å; F68-W83 AromaticContact CE1-CE2 3.89Å; F68-W83 HydrophobicContact CE1-CE3 4.01Å; F68-W83 AromaticContact CE1-CH2 3.67Å; F68-W83 HydrophobicContact CE1-CH2 3.67Å; F68-W83 AromaticContact CE1-CZ2 3.71Å; F68-W83 HydrophobicContact CE1-CZ2 3.71Å; F68-W83 AromaticContact CE1-CZ3 3.82Å; F68-W83 HydrophobicContact CE1-CZ3 3.82Å; F68-W83 HydrophobicContact CZ-CE3 4.18Å; F68-W83 HydrophobicContact CZ-CH2 4.34Å; F68-W83 HydrophobicContact CZ-CZ3 4.06Å; F68-F86 HydrophobicContact CE2-CB 4.12Å; F68-F86 HydrophobicContact CE2-CD1 4.43Å; F68-F86 AromaticContact CE2-CD2 3.49Å; F68-F86 HydrophobicContact CE2-CD2 3.49Å; F68-F86 VanDerWaalsContact CE2-CD2 3.49Å; F68-F86 AromaticContact CE2-CE2 3.97Å; F68-F86 HydrophobicContact CE2-CE2 3.97Å; F68-F86 AromaticContact CE2-CG 3.73Å; F68-F86 HydrophobicContact CE2-CG 3.73Å; F68-F86 HydrophobicContact CZ-CB 3.72Å; F68-F86 HydrophobicContact CZ-CD1 4.14Å; F68-F86 AromaticContact CZ-CD2 3.92Å; F68-F86 HydrophobicContact CZ-CD2 3.92Å; F68-F86 AromaticContact CZ-CG 3.63Å; F68-F86 HydrophobicContact CZ-CG 3.63Å
69T70.7Confident70.4Confident69 Ų6980.7 Ų80.742%0.42346%0.455SS..  trans-109.5161.3174.154.30000110.5S71 N72T69-S71 PolarHBondContact O-N 2.92Å; T69-S71 VanDerWaalsContact O-N 3.11Å; T69-S71 PolarHBondContact OG1-OG 3.42Å; T69-N72 PolarHBondContact N-OD1 3.19Å; T69-N72 WeakPolarHBondContact O-CB 3.23Å; T69-N72 PolarHBondContact O-N 3.46Å; T69-N72 PolarHBondContact OG1-OD1 3.19Å
70L67.9Low70.3Confident131 Ų13186 Ų8669%0.68647%0.473SS*.G310 helixtrans-51.4-33171.1-86.2159.8000113L52 N72 F73L52-L70 HydrophobicContact CD1-CD2 3.85Å; L52-L70 HydrophobicContact CD2-CD2 3.61Å; L52-L70 HydrophobicContact CD2-CG 4.21Å; L52-L70 HydrophobicContact CG-CD2 4.4Å; L70-N72 VanDerWaalsContact C-N 3.26Å; L70-N72 PolarHBondContact O-N 3.39Å; L70-F73 WeakPolarHBondContact O-CB 3.31Å; L70-F73 PolarHBondContact O-N 3.38Å; L70-F73 VanDerWaalsContact O-N 3.09Å
71S70.5Confident70.2Confident83 Ų8391.5 Ų91.558%0.5848%0.482SS*.G310 helixtrans-68.7-15.4175.351.80000114.6T69 F73 S74T69-S71 PolarHBondContact O-N 2.92Å; T69-S71 VanDerWaalsContact O-N 3.11Å; T69-S71 PolarHBondContact OG1-OG 3.42Å; S71-F73 PolarHBondContact O-N 3.03Å; S71-S74 PolarHBondContact O-OG 3.39Å; S71-S74 VanDerWaalsContact O-OG 3.04Å
72N72.9Confident70.3Confident39 Ų3988.3 Ų88.321%0.20946%0.462CS..G310 helixtrans-75.6-6.3169.6-60.6135.7000113.2F68 T69 L70 R78 K82F68-N72 WeakPolarHBondContact CA-OD1 3.48Å; F68-N72 HydrophobicContact CD1-CB 4.13Å; T69-N72 PolarHBondContact N-OD1 3.19Å; T69-N72 WeakPolarHBondContact O-CB 3.23Å; T69-N72 PolarHBondContact O-N 3.46Å; T69-N72 PolarHBondContact OG1-OD1 3.19Å; L70-N72 VanDerWaalsContact C-N 3.26Å; L70-N72 PolarHBondContact O-N 3.39Å; N72-R78 WeakPolarHBondContact O-CD 3.48Å; N72-R78 PolarHBondContact O-NE 2.82Å; N72-K82 PolarHBondContact OD1-NZ 3.5Å
73F70.2Confident70.7Confident27 Ų2786.8 Ų86.812%0.11845%0.454CS..G310 helixtrans-105.66.8177.2-65.3-90.1000113.9F51 L52 F55 M56 L70 S71 R78 W83F51-F73 AromaticContact CE1-CD1 3.85Å; F51-F73 HydrophobicContact CE1-CD1 3.85Å; F51-F73 AromaticContact CE1-CE1 3.54Å; F51-F73 HydrophobicContact CE1-CE1 3.54Å; F51-F73 HydrophobicContact CE1-CZ 4.45Å; F51-F73 HydrophobicContact CZ-CD1 4.36Å; F51-F73 AromaticContact CZ-CE1 3.75Å; F51-F73 HydrophobicContact CZ-CE1 3.75Å; L52-F73 HydrophobicContact CD1-CD2 4.2Å; L52-F73 HydrophobicContact CD1-CE2 4.33Å; L52-F73 HydrophobicContact CD1-CG 4.48Å; F55-F73 HydrophobicContact CD1-CE2 4.25Å; F55-F73 AromaticContact CD1-CZ 3.66Å; F55-F73 HydrophobicContact CD1-CZ 3.66Å; F55-F73 HydrophobicContact CD2-CZ 4.22Å; F55-F73 HydrophobicContact CE1-CE2 4.13Å; F55-F73 AromaticContact CE1-CZ 3.61Å; F55-F73 HydrophobicContact CE1-CZ 3.61Å; F55-F73 HydrophobicContact CE2-CZ 4.15Å; F55-F73 AromaticContact CG-CZ 3.99Å; F55-F73 HydrophobicContact CG-CZ 3.99Å; F55-F73 AromaticContact CZ-CZ 3.87Å; F55-F73 HydrophobicContact CZ-CZ 3.87Å; M56-F73 HydrophobicContact CE-CE2 4.43Å; L70-F73 WeakPolarHBondContact O-CB 3.31Å; L70-F73 PolarHBondContact O-N 3.38Å; L70-F73 VanDerWaalsContact O-N 3.09Å; S71-F73 PolarHBondContact O-N 3.03Å; F73-R78 PolarHBondContact O-NH2 2.84Å; F73-W83 AromaticContact CE1-CH2 3.75Å; F73-W83 HydrophobicContact CE1-CH2 3.75Å; F73-W83 HydrophobicContact CE1-CZ2 4.12Å; F73-W83 AromaticContact CZ-CH2 3.73Å; F73-W83 HydrophobicContact CZ-CH2 3.73Å; F73-W83 HydrophobicContact CZ-CZ2 4.17Å
74S63.5Low71.2Confident64 Ų6487.1 Ų87.145%0.44844%0.441SS..SBendtrans-65.9164.2173.159.20000111.9S71 D76 R78S71-S74 PolarHBondContact O-OG 3.39Å; S71-S74 VanDerWaalsContact O-OG 3.04Å; S74-D76 PolarHBondContact O-N 3.05Å; S74-R78 PolarHBondContact O-NE 3.14Å
75R57.5Low71.5Confident189 Ų18987.8 Ų87.871%0.71345%0.451SS*.SBendtrans-77.7-17.4-164.2-114.5179.1175.2-175.7-5.8115.1D25D25-R75 IonicContact OD1-NE 3.59Å; D25-R75 IonicContact OD1-NH2 3.85Å; D25-R75 IonicContact OD2-CZ 3.61Å; D25-R75 IonicContact OD2-NE 2.88Å; D25-R75 IonicContact OD2-NH2 2.66Å; D25-R75 PolarHBondContact OD2-NH2 3.41Å
76D56.9Low72.4Confident143 Ų14383 Ų8377%0.76541%0.411SS*.SBendtrans-86.3121-176.1-59.5-54.3000110.8S74 R78S74-D76 PolarHBondContact O-N 3.05Å; D76-R78 PolarHBondContact O-N 3.45Å
77K62.2Low73.4Confident183 Ų18381.9 Ų81.980%0.79640%0.4SS*.  trans13.693.5175.5-69.3-177.1178.2-179.90115.2D79K77-D79 PolarHBondContact O-N 3.45Å
78R72.3Confident74.3Confident13 Ų1377 Ų775%0.04938%0.377CS..  trans-50.3120.4174.3-66.1-72.1178.596.85109.7M27 D28 N72 F73 S74 D76 R80M27-R78 HydrophobicContact SD-CB 4.01Å; M27-R78 HydrophobicContact SD-CG 3.85Å; D28-R78 IonicContact OD1-CZ 2.66Å; D28-R78 VanDerWaalsContact OD1-CZ 3.28Å; D28-R78 IonicContact OD1-NH1 3.62Å; D28-R78 PolarHBondContact OD1-NH1 3.2Å; D28-R78 IonicContact OD1-NH2 3.15Å; D28-R78 PolarHBondContact OD1-NH2 3.47Å; D28-R78 IonicContact OD2-CZ 2.85Å; D28-R78 IonicContact OD2-NH2 3.69Å; D28-R78 PolarHBondContact OD2-NH2 3.02Å; N72-R78 WeakPolarHBondContact O-CD 3.48Å; N72-R78 PolarHBondContact O-NE 2.82Å; F73-R78 PolarHBondContact O-NH2 2.84Å; S74-R78 PolarHBondContact O-NE 3.14Å; D76-R78 PolarHBondContact O-N 3.45Å; R78-R80 PolarHBondContact O-N 3.26Å
79D74.6Confident74.8Confident90 Ų9078 Ų7848%0.48139%0.386SS..  trans-62.1108.5-175.5178.411.5000111.1K77 R81 K82 W83K77-D79 PolarHBondContact O-N 3.45Å; D79-R81 PolarHBondContact O-N 3.3Å; D79-R81 WeakPolarHBondContact OD1-CB 3.41Å; D79-R81 PolarHBondContact OD1-N 3Å; D79-K82 HydrophobicContact CB-CB 4.44Å; D79-K82 PolarHBondContact O-N 2.91Å; D79-W83 PolarHBondContact O-N 3.4Å
80R78.7Confident75.5Confident123 Ų12374.9 Ų74.946%0.46437%0.367SS..Hα-helixtrans-56.2-32.1179.2-64.1-176.7-176.5-170.40.6111.7F21 D22 R78 K82 I84F21-R80 HydrophobicContact CB-CG 3.95Å; F21-R80 HydrophobicContact CD1-CG 4.36Å; F21-R80 HydrophobicContact CG-CG 4.13Å; D22-R80 IonicContact OD1-CZ 3.28Å; D22-R80 IonicContact OD1-NE 2.73Å; D22-R80 IonicContact OD1-NH2 2.78Å; D22-R80 PolarHBondContact OD1-NH2 2.78Å; D22-R80 IonicContact OD2-NH2 2.9Å; D22-R80 PolarHBondContact OD2-NH2 3.45Å; R78-R80 PolarHBondContact O-N 3.26Å; R80-K82 VanDerWaalsContact C-N 3.31Å; R80-K82 PolarHBondContact O-N 3Å; R80-I84 HydrophobicContact CB-CD1 4.01Å; R80-I84 WeakPolarHBondContact O-CB 3.44Å; R80-I84 VanDerWaalsContact O-CG1 3.26Å; R80-I84 WeakPolarHBondContact O-CG1 3.37Å; R80-I84 PolarHBondContact O-N 2.95Å
81R78.6Confident76.2Confident220 Ų22068.9 Ų68.983%0.8334%0.335SS*.Hα-helixtrans-66.8-30178.5-64.1-177.2173.7-173.3-2.2112.9D79 P85D79-R81 PolarHBondContact O-N 3.3Å; D79-R81 WeakPolarHBondContact OD1-CB 3.41Å; D79-R81 PolarHBondContact OD1-N 3Å; R81-P85 WeakPolarHBondContact O-CD 3.4Å; R81-P85 VanDerWaalsContact O-CG 3.31Å; R81-P85 WeakPolarHBondContact O-CG 3.47Å
82K79.3Confident76.6Confident48 Ų4867.6 Ų67.621%0.20933%0.327CS..Hα-helixtrans-89.5-35.6176.4-174.3172.1-174.6171.10113Y64 N67 F68 N72 D79 R80Y64-K82 PolarHBondContact OH-O 3.17Å; N67-K82 PolarHBondContact O-NZ 3.25Å; F68-K82 HydrophobicContact CE1-CD 4.38Å; F68-K82 HydrophobicContact CE1-CG 4.35Å; N72-K82 PolarHBondContact OD1-NZ 3.5Å; D79-K82 HydrophobicContact CB-CB 4.44Å; D79-K82 PolarHBondContact O-N 2.91Å; R80-K82 VanDerWaalsContact C-N 3.31Å; R80-K82 PolarHBondContact O-N 3Å
83W84.8Confident76.9Confident3 Ų370.2 Ų70.21%0.01133%0.334CS..Hα-helixtrans-87.1-28.9-172.7-80.2107.1000114.6F21 M27 L31 F55 F68 F73 D79 F86 L87F21-W83 HydrophobicContact CD1-CB 4.37Å; F21-W83 HydrophobicContact CE1-CB 4.13Å; M27-W83 HydrophobicContact CE-CB 3.83Å; M27-W83 HydrophobicContact CE-CD2 3.49Å; M27-W83 VanDerWaalsContact CE-CD2 3.49Å; M27-W83 HydrophobicContact CE-CE3 3.36Å; M27-W83 HydrophobicContact CE-CG 3.72Å; M27-W83 HydrophobicContact CE-CZ3 4.06Å; M27-W83 HydrophobicContact SD-CD2 4.19Å; M27-W83 HydrophobicContact SD-CE3 4.46Å; M27-W83 HydrophobicContact SD-CG 4.35Å; L31-W83 HydrophobicContact CD1-CE3 4.44Å; L31-W83 HydrophobicContact CD1-CH2 3.91Å; L31-W83 HydrophobicContact CD1-CZ3 3.63Å; L31-W83 HydrophobicContact CD2-CZ3 4.45Å; F55-W83 AromaticContact CE2-CH2 3.76Å; F55-W83 HydrophobicContact CE2-CH2 3.76Å; F55-W83 AromaticContact CE2-CZ3 3.64Å; F55-W83 HydrophobicContact CE2-CZ3 3.64Å; F55-W83 AromaticContact CZ-CH2 3.58Å; F55-W83 HydrophobicContact CZ-CH2 3.58Å; F55-W83 AromaticContact CZ-CZ3 3.67Å; F55-W83 HydrophobicContact CZ-CZ3 3.67Å; F68-W83 HydrophobicContact CD1-CH2 4.15Å; F68-W83 HydrophobicContact CD1-CZ2 4.14Å; F68-W83 HydrophobicContact CE1-CD2 4.08Å; F68-W83 AromaticContact CE1-CE2 3.89Å; F68-W83 HydrophobicContact CE1-CE3 4.01Å; F68-W83 AromaticContact CE1-CH2 3.67Å; F68-W83 HydrophobicContact CE1-CH2 3.67Å; F68-W83 AromaticContact CE1-CZ2 3.71Å; F68-W83 HydrophobicContact CE1-CZ2 3.71Å; F68-W83 AromaticContact CE1-CZ3 3.82Å; F68-W83 HydrophobicContact CE1-CZ3 3.82Å; F68-W83 HydrophobicContact CZ-CE3 4.18Å; F68-W83 HydrophobicContact CZ-CH2 4.34Å; F68-W83 HydrophobicContact CZ-CZ3 4.06Å; F73-W83 AromaticContact CE1-CH2 3.75Å; F73-W83 HydrophobicContact CE1-CH2 3.75Å; F73-W83 HydrophobicContact CE1-CZ2 4.12Å; F73-W83 AromaticContact CZ-CH2 3.73Å; F73-W83 HydrophobicContact CZ-CH2 3.73Å; F73-W83 HydrophobicContact CZ-CZ2 4.17Å; D79-W83 PolarHBondContact O-N 3.4Å; W83-F86 HydrophobicContact CE3-CD1 4.05Å; W83-F86 AromaticContact CZ3-CD1 3.92Å; W83-F86 HydrophobicContact CZ3-CD1 3.92Å; W83-F86 HydrophobicContact CZ3-CE1 4.28Å; W83-L87 WeakPolarHBondContact O-CB 3.37Å; W83-L87 WeakPolarHBondContact O-CG 3.49Å; W83-L87 PolarHBondContact O-N 2.74Å
84I85.8Confident77.2Confident67 Ų6770.8 Ų70.834%0.34434%0.336SS..Hα-helixtrans-63.3-50.5174.3-73.3171.1000111.2I3 F21 R80 F86 L87 S88I3-I84 HydrophobicContact CD1-CG2 3.77Å; F21-I84 HydrophobicContact CE1-CG1 3.97Å; F21-I84 HydrophobicContact CE2-CG1 4.34Å; F21-I84 HydrophobicContact CZ-CG1 3.71Å; R80-I84 HydrophobicContact CB-CD1 4.01Å; R80-I84 WeakPolarHBondContact O-CB 3.44Å; R80-I84 VanDerWaalsContact O-CG1 3.26Å; R80-I84 WeakPolarHBondContact O-CG1 3.37Å; R80-I84 PolarHBondContact O-N 2.95Å; I84-F86 VanDerWaalsContact C-N 3.33Å; I84-F86 PolarHBondContact O-N 2.97Å; I84-L87 PolarHBondContact O-N 3.33Å; I84-S88 WeakPolarHBondContact O-CB 3.46Å; I84-S88 PolarHBondContact O-N 3.01Å; I84-S88 PolarHBondContact O-OG 3.04Å
85P84.1Confident77.7Confident61 Ų6172.9 Ų72.940%0.39634%0.339SS..Hα-helixtrans-61.8-37.4178.9-23.934.7000113.4Y64 R81 S88 C89Y64-P85 HydrophobicContact CE2-CB 4.36Å; R81-P85 WeakPolarHBondContact O-CD 3.4Å; R81-P85 VanDerWaalsContact O-CG 3.31Å; R81-P85 WeakPolarHBondContact O-CG 3.47Å; P85-S88 PolarHBondContact O-N 2.68Å; P85-C89 WeakPolarHBondContact O-CB 3.46Å; P85-C89 PolarHBondContact O-N 3.47Å
86F85.7Confident77.8Confident0 Ų068.1 Ų68.10%033%0.334CS..Hα-helixtrans-65.5-48.4175178.1-101.2000112.4L31 F55 A59 L62 Y64 F68 W83 I84 S88 C89 L90L31-F86 HydrophobicContact CD2-CE1 4.15Å; F55-F86 HydrophobicContact CD2-CE1 4.32Å; F55-F86 HydrophobicContact CD2-CZ 4.31Å; F55-F86 HydrophobicContact CE2-CD1 4.18Å; F55-F86 AromaticContact CE2-CE1 3.35Å; F55-F86 HydrophobicContact CE2-CE1 3.35Å; F55-F86 AromaticContact CE2-CZ 3.55Å; F55-F86 HydrophobicContact CE2-CZ 3.55Å; F55-F86 HydrophobicContact CZ-CD1 4.31Å; F55-F86 AromaticContact CZ-CE1 3.77Å; F55-F86 HydrophobicContact CZ-CE1 3.77Å; F55-F86 HydrophobicContact CZ-CE2 4.34Å; F55-F86 AromaticContact CZ-CZ 3.76Å; F55-F86 HydrophobicContact CZ-CZ 3.76Å; A59-F86 HydrophobicContact CB-CE2 3.97Å; L62-F86 HydrophobicContact CD1-CE2 4.42Å; Y64-F86 AromaticContact CD1-CD2 3.86Å; Y64-F86 HydrophobicContact CD1-CD2 3.86Å; Y64-F86 HydrophobicContact CD2-CD2 4.1Å; Y64-F86 HydrophobicContact CE1-CB 4.03Å; Y64-F86 HydrophobicContact CE1-CD2 4.09Å; Y64-F86 HydrophobicContact CE1-CG 4.5Å; Y64-F86 HydrophobicContact CE2-CB 3.98Å; Y64-F86 HydrophobicContact CE2-CD2 4.35Å; Y64-F86 AromaticContact CG-CD2 3.84Å; Y64-F86 HydrophobicContact CG-CD2 3.84Å; Y64-F86 PolarHBondContact OH-N 2.89Å; F68-F86 HydrophobicContact CE2-CB 4.12Å; F68-F86 HydrophobicContact CE2-CD1 4.43Å; F68-F86 AromaticContact CE2-CD2 3.49Å; F68-F86 HydrophobicContact CE2-CD2 3.49Å; F68-F86 VanDerWaalsContact CE2-CD2 3.49Å; F68-F86 AromaticContact CE2-CE2 3.97Å; F68-F86 HydrophobicContact CE2-CE2 3.97Å; F68-F86 AromaticContact CE2-CG 3.73Å; F68-F86 HydrophobicContact CE2-CG 3.73Å; F68-F86 HydrophobicContact CZ-CB 3.72Å; F68-F86 HydrophobicContact CZ-CD1 4.14Å; F68-F86 AromaticContact CZ-CD2 3.92Å; F68-F86 HydrophobicContact CZ-CD2 3.92Å; F68-F86 AromaticContact CZ-CG 3.63Å; F68-F86 HydrophobicContact CZ-CG 3.63Å; W83-F86 HydrophobicContact CE3-CD1 4.05Å; W83-F86 AromaticContact CZ3-CD1 3.92Å; W83-F86 HydrophobicContact CZ3-CD1 3.92Å; W83-F86 HydrophobicContact CZ3-CE1 4.28Å; I84-F86 VanDerWaalsContact C-N 3.33Å; I84-F86 PolarHBondContact O-N 2.97Å; F86-S88 VanDerWaalsContact C-N 3.29Å; F86-S88 PolarHBondContact O-N 3.13Å; F86-C89 PolarHBondContact O-N 2.86Å; F86-L90 HydrophobicContact CE1-CD1 3.71Å; F86-L90 HydrophobicContact CE2-CD1 4.41Å; F86-L90 HydrophobicContact CZ-CD1 3.53Å; F86-L90 WeakPolarHBondContact O-CB 3.48Å; F86-L90 PolarHBondContact O-N 3.2Å
87L86.9Confident77.7Confident1 Ų162.6 Ų62.61%0.00531%0.308CS..Hα-helixtrans-65.4-33.7176.7-75.5179.7000112I3 I7 L20 F21 M27 L31 L34 W83 I84 V91I3-L87 HydrophobicContact CG2-CB 3.75Å; I3-L87 HydrophobicContact CG2-CD1 4.32Å; I7-L87 HydrophobicContact CD1-CD1 4.13Å; I7-L87 HydrophobicContact CD1-CD2 3.99Å; I7-L87 HydrophobicContact CD1-CG 4.47Å; L20-L87 HydrophobicContact CD2-CD1 4.31Å; F21-L87 HydrophobicContact CE1-CD1 3.8Å; F21-L87 HydrophobicContact CZ-CD1 3.86Å; M27-L87 HydrophobicContact CE-CD1 3.93Å; M27-L87 HydrophobicContact CE-CG 4.47Å; L31-L87 HydrophobicContact CD2-CD2 3.6Å; L34-L87 HydrophobicContact CD1-CD2 4.33Å; W83-L87 WeakPolarHBondContact O-CB 3.37Å; W83-L87 WeakPolarHBondContact O-CG 3.49Å; W83-L87 PolarHBondContact O-N 2.74Å; I84-L87 PolarHBondContact O-N 3.33Å; L87-V91 VanDerWaalsContact O-CB 3.23Å; L87-V91 WeakPolarHBondContact O-CB 3.44Å; L87-V91 VanDerWaalsContact O-CG2 3.23Å; L87-V91 WeakPolarHBondContact O-CG2 3.42Å; L87-V91 PolarHBondContact O-N 3.36Å
88S85.2Confident76.8Confident43 Ų4359.7 Ų59.730%0.30130%0.301SS..Hα-helixtrans-61.6-49.1169.6-79.80000111.4I3 I84 P85 F86 L90 V91 S92I3-S88 VanDerWaalsContact CD1-OG 3.24Å; I3-S88 WeakPolarHBondContact CD1-OG 3.48Å; I84-S88 WeakPolarHBondContact O-CB 3.46Å; I84-S88 PolarHBondContact O-N 3.01Å; I84-S88 PolarHBondContact O-OG 3.04Å; P85-S88 PolarHBondContact O-N 2.68Å; F86-S88 VanDerWaalsContact C-N 3.29Å; F86-S88 PolarHBondContact O-N 3.13Å; S88-L90 VanDerWaalsContact C-N 3.32Å; S88-L90 PolarHBondContact O-N 3.21Å; S88-V91 PolarHBondContact O-N 3.38Å; S88-S92 VanDerWaalsContact O-CB 3.32Å; S88-S92 WeakPolarHBondContact O-CB 3.18Å; S88-S92 PolarHBondContact O-N 2.95Å; S88-S92 PolarHBondContact O-OG 3.28Å; S88-S92 VanDerWaalsContact O-OG 3.07Å
89C83.1Confident75.9Confident42 Ų4263.8 Ų63.828%0.28433%0.327SS..Hα-helixtrans-58.6-43.2176.6177.10000112Y64 P85 F86 S92 W93Y64-C89 HydrophobicContact CD2-CB 4.4Å; P85-C89 WeakPolarHBondContact O-CB 3.46Å; P85-C89 PolarHBondContact O-N 3.47Å; F86-C89 PolarHBondContact O-N 2.86Å; C89-S92 PolarHBondContact O-N 3.31Å; C89-W93 WeakPolarHBondContact O-CB 3.38Å; C89-W93 PolarHBondContact O-N 2.99Å
90L84.2Confident74.8Confident2 Ų266.6 Ų66.61%0.0134%0.338CS..Hα-helixtrans-72.7-35.9-179.3-162.5144000112.4L34 I38 T58 L62 F86 S88 W93 F94L34-L90 HydrophobicContact CB-CD2 4.14Å; L34-L90 HydrophobicContact CD1-CD2 4.05Å; L34-L90 HydrophobicContact CD2-CD2 4.15Å; L34-L90 HydrophobicContact CG-CD2 4.35Å; I38-L90 HydrophobicContact CD1-CD1 4.28Å; I38-L90 HydrophobicContact CD1-CD2 4.31Å; I38-L90 HydrophobicContact CD1-CG 4.3Å; T58-L90 HydrophobicContact CG2-CD1 3.82Å; L62-L90 HydrophobicContact CD1-CB 4.17Å; L62-L90 HydrophobicContact CD1-CD1 4.08Å; L62-L90 HydrophobicContact CD1-CG 4.17Å; F86-L90 HydrophobicContact CE1-CD1 3.71Å; F86-L90 HydrophobicContact CE2-CD1 4.41Å; F86-L90 HydrophobicContact CZ-CD1 3.53Å; F86-L90 WeakPolarHBondContact O-CB 3.48Å; F86-L90 PolarHBondContact O-N 3.2Å; S88-L90 VanDerWaalsContact C-N 3.32Å; S88-L90 PolarHBondContact O-N 3.21Å; L90-W93 PolarHBondContact O-N 3.22Å; L90-F94 HydrophobicContact CD2-CD2 4Å; L90-F94 HydrophobicContact CD2-CE2 3.82Å; L90-F94 WeakPolarHBondContact O-CD2 3.38Å; L90-F94 PolarHBondContact O-N 3Å; L90-F94 VanDerWaalsContact O-N 3.14Å
91V84.1Confident73.4Confident5 Ų565.6 Ų65.63%0.0334%0.34CS..Hα-helixtrans-66.1-47169.6162.70000111I3 S6 I7 I10 L87 S88 W93 F94 E95I3-V91 HydrophobicContact CG2-CG2 4.33Å; S6-V91 VanDerWaalsContact CB-CG1 3.41Å; I7-V91 HydrophobicContact CD1-CG2 4.28Å; I7-V91 HydrophobicContact CG1-CG2 3.57Å; I10-V91 HydrophobicContact CD1-CG2 4.27Å; L87-V91 VanDerWaalsContact O-CB 3.23Å; L87-V91 WeakPolarHBondContact O-CB 3.44Å; L87-V91 VanDerWaalsContact O-CG2 3.23Å; L87-V91 WeakPolarHBondContact O-CG2 3.42Å; L87-V91 PolarHBondContact O-N 3.36Å; S88-V91 PolarHBondContact O-N 3.38Å; V91-W93 PolarHBondContact O-N 3.46Å; V91-F94 CarbonylContact O-C 3.59Å; V91-F94 WeakPolarHBondContact O-CA 3.42Å; V91-F94 WeakPolarHBondContact O-CB 3.46Å; V91-F94 PolarHBondContact O-N 3.34Å; V91-E95 HydrophobicContact CG1-CG 4.11Å; V91-E95 VanDerWaalsContact CG1-OE1 3.3Å; V91-E95 WeakPolarHBondContact CG1-OE1 3.39Å; V91-E95 WeakPolarHBondContact O-CB 3.41Å; V91-E95 WeakPolarHBondContact O-CG 3.22Å; V91-E95 PolarHBondContact O-N 3.02Å
92S78.6Confident72.1Confident57 Ų5759.3 Ų59.340%0.39932%0.323SS..Hα-helixtrans-63.9-29.7176.2-640000112.1S88 C89 E95 C96S88-S92 VanDerWaalsContact O-CB 3.32Å; S88-S92 WeakPolarHBondContact O-CB 3.18Å; S88-S92 PolarHBondContact O-N 2.95Å; S88-S92 PolarHBondContact O-OG 3.28Å; S88-S92 VanDerWaalsContact O-OG 3.07Å; C89-S92 PolarHBondContact O-N 3.31Å; S92-E95 PolarHBondContact O-N 3.14Å; S92-C96 WeakPolarHBondContact O-CA 3.49Å; S92-C96 WeakPolarHBondContact O-CB 3.41Å; S92-C96 PolarHBondContact O-N 3.19Å; S92-C96 PolarHBondContact O-SG 3.1Å
93W79.6Confident71.1Confident94 Ų9462.8 Ų62.836%0.35634%0.34SS..Hα-helixtrans-65-43.3169.1-17788.4000111.5I38 L62 C89 L90 V91 A97I38-W93 HydrophobicContact CD1-CZ3 4.36Å; I38-W93 HydrophobicContact CG1-CE3 4.44Å; I38-W93 HydrophobicContact CG1-CH2 4.45Å; I38-W93 HydrophobicContact CG1-CZ3 3.85Å; I38-W93 HydrophobicContact CG2-CH2 4.13Å; I38-W93 HydrophobicContact CG2-CZ3 4.36Å; L62-W93 HydrophobicContact CD2-CB 3.62Å; L62-W93 HydrophobicContact CD2-CD2 4.31Å; L62-W93 HydrophobicContact CD2-CG 3.45Å; L62-W93 VanDerWaalsContact CD2-CG 3.45Å; C89-W93 WeakPolarHBondContact O-CB 3.38Å; C89-W93 PolarHBondContact O-N 2.99Å; L90-W93 PolarHBondContact O-N 3.22Å; V91-W93 PolarHBondContact O-N 3.46Å; W93-A97 WeakPolarHBondContact O-CA 3.45Å; W93-A97 WeakPolarHBondContact O-CB 3.4Å; W93-A97 PolarHBondContact O-N 3.37Å
94F75.9Confident69.7Low39 Ų3968.4 Ų68.417%0.17137%0.368CS..Hα-helixtrans-67.2-34.5173.3-87.1-69.9000113.8I10 L34 T37 I38 L90 V91I10-F94 HydrophobicContact CD1-CB 3.49Å; I10-F94 VanDerWaalsContact CD1-CB 3.49Å; I10-F94 HydrophobicContact CD1-CD2 3.81Å; I10-F94 HydrophobicContact CD1-CG 3.75Å; I10-F94 HydrophobicContact CG1-CB 3.93Å; I10-F94 HydrophobicContact CG1-CD1 4.45Å; I10-F94 HydrophobicContact CG1-CD2 4.43Å; I10-F94 HydrophobicContact CG1-CG 4.06Å; I10-F94 HydrophobicContact CG2-CD1 3.72Å; I10-F94 HydrophobicContact CG2-CD2 3.87Å; I10-F94 HydrophobicContact CG2-CE1 3.64Å; I10-F94 HydrophobicContact CG2-CE2 3.79Å; I10-F94 HydrophobicContact CG2-CG 3.82Å; I10-F94 HydrophobicContact CG2-CZ 3.65Å; L34-F94 HydrophobicContact CD2-CD2 4.2Å; L34-F94 HydrophobicContact CD2-CE2 3.72Å; L34-F94 HydrophobicContact CD2-CZ 4.46Å; T37-F94 HydrophobicContact CG2-CE1 3.76Å; T37-F94 HydrophobicContact CG2-CZ 3.99Å; I38-F94 HydrophobicContact CB-CZ 4.48Å; I38-F94 HydrophobicContact CD1-CE2 4.02Å; I38-F94 HydrophobicContact CD1-CZ 4.23Å; I38-F94 HydrophobicContact CG1-CE1 4.24Å; I38-F94 HydrophobicContact CG1-CE2 3.66Å; I38-F94 HydrophobicContact CG1-CZ 3.36Å; L90-F94 HydrophobicContact CD2-CD2 4Å; L90-F94 HydrophobicContact CD2-CE2 3.82Å; L90-F94 WeakPolarHBondContact O-CD2 3.38Å; L90-F94 PolarHBondContact O-N 3Å; L90-F94 VanDerWaalsContact O-N 3.14Å; V91-F94 CarbonylContact O-C 3.59Å; V91-F94 WeakPolarHBondContact O-CA 3.42Å; V91-F94 WeakPolarHBondContact O-CB 3.46Å; V91-F94 PolarHBondContact O-N 3.34Å
95E73.2Confident68.4Low107 Ų10768.9 Ų68.950%0.537%0.374SS..Hα-helixtrans-81.9-25.1-179.7-69.4172.7170.300112.5S6 V91 S92S6-E95 WeakPolarHBondContact CB-OE1 3.4Å; S6-E95 PolarHBondContact OG-OE1 3.34Å; V91-E95 HydrophobicContact CG1-CG 4.11Å; V91-E95 VanDerWaalsContact CG1-OE1 3.3Å; V91-E95 WeakPolarHBondContact CG1-OE1 3.39Å; V91-E95 WeakPolarHBondContact O-CB 3.41Å; V91-E95 WeakPolarHBondContact O-CG 3.22Å; V91-E95 PolarHBondContact O-N 3.02Å; S92-E95 PolarHBondContact O-N 3.14Å
96C60.1Low67.5Low90 Ų9070.7 Ų70.761%0.60838%0.38SS*.Hα-helixtrans-99.5-5.1172.9-58.90000113.3S92 D98S92-C96 WeakPolarHBondContact O-CA 3.49Å; S92-C96 WeakPolarHBondContact O-CB 3.41Å; S92-C96 PolarHBondContact O-N 3.19Å; S92-C96 PolarHBondContact O-SG 3.1Å; C96-D98 PolarHBondContact O-N 2.88Å
97A54Low66.5Low26 Ų2675.1 Ų75.122%0.21540%0.401CS..  trans-74.252.6162.100000109.9W93 L102W93-A97 WeakPolarHBondContact O-CA 3.45Å; W93-A97 WeakPolarHBondContact O-CB 3.4Å; W93-A97 PolarHBondContact O-N 3.37Å; A97-L102 HydrophobicContact CB-CD1 4.43Å
98D44.8Very low65.3Low122 Ų12277.7 Ų77.765%0.65242%0.422SS*.  trans-57.1141.9160.4-124.6-31.3000108C96 E100 I101C96-D98 PolarHBondContact O-N 2.88Å; D98-E100 PolarHBondContact O-N 3.25Å; D98-I101 PolarHBondContact O-N 3.39Å
99T53.2Low64.5Low99 Ų9983.4 Ų83.461%0.60744%0.437SS*.THydrogen-bonded Turntrans-56.6-14.3-156.219.10000117.3Q103T99-Q103 WeakPolarHBondContact O-CG 3.5Å; T99-Q103 PolarHBondContact O-N 3.04Å
100E50.2Low64Low150 Ų15087.3 Ų87.370%0.70145%0.451SS*.Hα-helixtrans-68.1-40.6179.4-68.6-175.4140.300113.6D98 L102 Q103 M104D98-E100 PolarHBondContact O-N 3.25Å; E100-L102 PolarHBondContact O-N 3Å; E100-Q103 PolarHBondContact O-N 2.9Å; E100-M104 WeakPolarHBondContact O-CG 3.44Å; E100-M104 PolarHBondContact O-N 3.48Å
101I49.7Very low63.3Low101 Ų10195 Ų9552%0.51848%0.48SS..Hα-helixtrans-69.2-38.7-173.1-63.2179.1000111.3D98 M104 V105D98-I101 PolarHBondContact O-N 3.39Å; I101-M104 PolarHBondContact O-N 3.1Å; I101-V105 WeakPolarHBondContact O-CG2 3.5Å; I101-V105 PolarHBondContact O-N 3.45Å; I101-V105 VanDerWaalsContact O-N 3.15Å
102L52Low62.9Low88 Ų88102.3 Ų102.346%0.46151%0.511SS..Hα-helixtrans-66.8-41.9174.9-80161000111.4A97 E100 M104 V105 D106A97-L102 HydrophobicContact CB-CD1 4.43Å; E100-L102 PolarHBondContact O-N 3Å; L102-M104 PolarHBondContact O-N 2.92Å; L102-V105 PolarHBondContact O-N 3.43Å; L102-D106 PolarHBondContact O-N 2.99Å
103Q57.3Low62.8Low121 Ų121104 Ų10457%0.56552%0.516SS*.Hα-helixtrans-61.5-42.8174.2-76-179.2-14.100112.3T99 E100 V105 D106 E107T99-Q103 WeakPolarHBondContact O-CG 3.5Å; T99-Q103 PolarHBondContact O-N 3.04Å; E100-Q103 PolarHBondContact O-N 2.9Å; Q103-V105 VanDerWaalsContact C-N 3.31Å; Q103-V105 PolarHBondContact O-N 3.42Å; Q103-D106 PolarHBondContact O-N 3.34Å; Q103-E107 WeakPolarHBondContact O-CB 3.39Å; Q103-E107 WeakPolarHBondContact O-CG 3.12Å; Q103-E107 PolarHBondContact O-N 3.32Å
104M55.4Low62.6Low121 Ų121102.6 Ų102.660%0.59652%0.515SS*.Hα-helixtrans-61.7-36175.6-72.6-158.7-55.300113.1E100 I101 L102 A108E100-M104 WeakPolarHBondContact O-CG 3.44Å; E100-M104 PolarHBondContact O-N 3.48Å; I101-M104 PolarHBondContact O-N 3.1Å; L102-M104 PolarHBondContact O-N 2.92Å; M104-A108 WeakPolarHBondContact O-CB 3.49Å; M104-A108 PolarHBondContact O-N 3.25Å
105V58.8Low62.4Low78 Ų78108.5 Ų108.547%0.47354%0.537SS..Hα-helixtrans-70.9-40.5177.9170.50000111.5I101 L102 Q103 A108 R109I101-V105 WeakPolarHBondContact O-CG2 3.5Å; I101-V105 PolarHBondContact O-N 3.45Å; I101-V105 VanDerWaalsContact O-N 3.15Å; L102-V105 PolarHBondContact O-N 3.43Å; Q103-V105 VanDerWaalsContact C-N 3.31Å; Q103-V105 PolarHBondContact O-N 3.42Å; V105-A108 PolarHBondContact O-N 3.33Å; V105-R109 WeakPolarHBondContact O-CB 3.41Å; V105-R109 PolarHBondContact O-N 3.05Å
106D64.7Low62.6Low99 Ų99106 Ų10653%0.52954%0.536SS..Hα-helixtrans-69.1-42.2175.6-80.1-27.6000111.9L102 Q103 A108 R109 E110L102-D106 PolarHBondContact O-N 2.99Å; Q103-D106 PolarHBondContact O-N 3.34Å; D106-A108 PolarHBondContact O-N 3.42Å; D106-R109 WeakPolarHBondContact O-CB 3.48Å; D106-R109 PolarHBondContact O-N 2.97Å; D106-E110 PolarHBondContact O-N 2.66Å
107E65.6Low63.6Low93 Ų93108.2 Ų108.244%0.43554%0.535SS..Hα-helixtrans-60.7-43.2171.9-77.1-168.3-164.300112Q103 R109 E110 R111Q103-E107 WeakPolarHBondContact O-CB 3.39Å; Q103-E107 WeakPolarHBondContact O-CG 3.12Å; Q103-E107 PolarHBondContact O-N 3.32Å; E107-R109 VanDerWaalsContact C-N 3.28Å; E107-R109 PolarHBondContact O-N 3.24Å; E107-E110 PolarHBondContact O-N 2.87Å; E107-R111 WeakPolarHBondContact O-CB 3.5Å; E107-R111 WeakPolarHBondContact O-CG 3.43Å; E107-R111 PolarHBondContact O-N 3.33Å; E107-R111 IonicContact OE2-CZ 3.8Å; E107-R111 IonicContact OE2-NE 3.65Å; E107-R111 IonicContact OE2-NH2 3.55Å; E107-R111 PolarHBondContact OE2-NH2 3.26Å
108A62.2Low64.6Low54 Ų54112 Ų11245%0.44655%0.551SS.*Hα-helixtrans-62.6-36.9176.100000111.9M104 V105 D106 K112M104-A108 WeakPolarHBondContact O-CB 3.49Å; M104-A108 PolarHBondContact O-N 3.25Å; V105-A108 PolarHBondContact O-N 3.33Å; D106-A108 PolarHBondContact O-N 3.42Å; A108-K112 WeakPolarHBondContact O-CB 3.47Å; A108-K112 PolarHBondContact O-N 3.12Å
109R67.4Low66.2Low164 Ų164110.1 Ų110.162%0.61954%0.54SS*.Hα-helixtrans-69.1-39.4175.3-173.4178.8-74.2-165.7-0.3111.7V105 D106 E107 K112 N113V105-R109 WeakPolarHBondContact O-CB 3.41Å; V105-R109 PolarHBondContact O-N 3.05Å; D106-R109 WeakPolarHBondContact O-CB 3.48Å; D106-R109 PolarHBondContact O-N 2.97Å; E107-R109 VanDerWaalsContact C-N 3.28Å; E107-R109 PolarHBondContact O-N 3.24Å; R109-K112 PolarHBondContact O-N 3.46Å; R109-N113 PolarHBondContact O-N 3.08Å; R109-N113 VanDerWaalsContact O-N 3.11Å
110E73.4Confident67.5Low123 Ų123108.6 Ų108.658%0.57553%0.534SS*.Hα-helixtrans-67.3-46.8175.3-163.6-174.7-172.300111.7D106 E107 K112 N113 N114D106-E110 PolarHBondContact O-N 2.66Å; E107-E110 PolarHBondContact O-N 2.87Å; E110-K112 VanDerWaalsContact C-N 3.29Å; E110-K112 PolarHBondContact O-N 3Å; E110-N113 PolarHBondContact O-N 3.47Å; E110-N113 VanDerWaalsContact O-N 3.09Å; E110-N114 PolarHBondContact O-N 3.06Å
111R70Confident69Low164 Ų164106.3 Ų106.362%0.61953%0.526SS*.Hα-helixtrans-55.7-42.5174.4-69.2171.6-156.4-1776.8111.5E107 N114 Y115E107-R111 WeakPolarHBondContact O-CB 3.5Å; E107-R111 WeakPolarHBondContact O-CG 3.43Å; E107-R111 PolarHBondContact O-N 3.33Å; E107-R111 IonicContact OE2-CZ 3.8Å; E107-R111 IonicContact OE2-NE 3.65Å; E107-R111 IonicContact OE2-NH2 3.55Å; E107-R111 PolarHBondContact OE2-NH2 3.26Å; R111-N114 PolarHBondContact O-N 3.32Å; R111-Y115 WeakPolarHBondContact O-CB 3.43Å; R111-Y115 PolarHBondContact O-N 3.43Å
112K74.3Confident70.5Confident159 Ų159105.6 Ų105.669%0.69153%0.526SS*.Hα-helixtrans-61.6-44.1174.6-178178.5177.5178.80112.6A108 R109 E110 Y115 A116A108-K112 WeakPolarHBondContact O-CB 3.47Å; A108-K112 PolarHBondContact O-N 3.12Å; R109-K112 PolarHBondContact O-N 3.46Å; E110-K112 VanDerWaalsContact C-N 3.29Å; E110-K112 PolarHBondContact O-N 3Å; K112-Y115 PolarHBondContact O-N 3.43Å; K112-A116 PolarHBondContact O-N 2.92Å; K112-A116 VanDerWaalsContact O-N 3.11Å
113N76.6Confident71.9Confident93 Ų93107.2 Ų107.250%0.49753%0.531SS..Hα-helixtrans-66.8-36.7177-78.1-19.9000112.2R109 E110 A116 K117R109-N113 PolarHBondContact O-N 3.08Å; R109-N113 VanDerWaalsContact O-N 3.11Å; E110-N113 PolarHBondContact O-N 3.47Å; E110-N113 VanDerWaalsContact O-N 3.09Å; N113-A116 PolarHBondContact O-N 3.13Å; N113-K117 WeakPolarHBondContact O-CG 3.46Å; N113-K117 PolarHBondContact O-N 3.47Å; N113-K117 VanDerWaalsContact O-N 3.16Å
114N75.7Confident73.2Confident64 Ų64105 Ų10534%0.34253%0.529SS..Hα-helixtrans-71.3-35.8176.3-71.6-22.6000112.1E110 R111 K117 L118E110-N114 PolarHBondContact O-N 3.06Å; R111-N114 PolarHBondContact O-N 3.32Å; N114-K117 PolarHBondContact O-N 2.85Å; N114-L118 PolarHBondContact O-N 3.44Å
115Y72.1Confident74.6Confident162 Ų162106.3 Ų106.364%0.63553%0.527SS*.Hα-helixtrans-60.6-43.9170.4-174.5-93.6000112.1R111 K112 K117 L118 L119R111-Y115 WeakPolarHBondContact O-CB 3.43Å; R111-Y115 PolarHBondContact O-N 3.43Å; K112-Y115 PolarHBondContact O-N 3.43Å; Y115-K117 VanDerWaalsContact C-N 3.33Å; Y115-K117 PolarHBondContact O-N 3.06Å; Y115-L118 PolarHBondContact O-N 3.47Å; Y115-L119 PolarHBondContact O-N 2.98Å
116A77.2Confident75.6Confident56 Ų56109 Ų10946%0.46354%0.535SS..Hα-helixtrans-62.6-37.117700000113K112 N113 S120K112-A116 PolarHBondContact O-N 2.92Å; K112-A116 VanDerWaalsContact O-N 3.11Å; N113-A116 PolarHBondContact O-N 3.13Å; A116-S120 PolarHBondContact O-N 3.23Å
117K80.5Confident76.7Confident135 Ų135110.8 Ų110.859%0.58754%0.54SS*.Hα-helixtrans-68.5-37.3173-69.3171.6-174.4166.90112.8N113 N114 Y115 S120 L121N113-K117 WeakPolarHBondContact O-CG 3.46Å; N113-K117 PolarHBondContact O-N 3.47Å; N113-K117 VanDerWaalsContact O-N 3.16Å; N114-K117 PolarHBondContact O-N 2.85Å; Y115-K117 VanDerWaalsContact C-N 3.33Å; Y115-K117 PolarHBondContact O-N 3.06Å; K117-S120 PolarHBondContact O-OG 3.39Å; K117-L121 WeakPolarHBondContact O-CB 3.45Å; K117-L121 PolarHBondContact O-N 3.18Å; K117-L121 VanDerWaalsContact O-N 3.17Å
118L75.9Confident77.6Confident106 Ų106110.7 Ų110.756%0.55554%0.539SS*.Hα-helixtrans-66.7-40.1175.8-84.3162.5000111.3N114 Y115 L121 V122N114-L118 PolarHBondContact O-N 3.44Å; Y115-L118 PolarHBondContact O-N 3.47Å; L118-L121 WeakPolarHBondContact O-CB 3.32Å; L118-L121 PolarHBondContact O-N 3.43Å; L118-V122 WeakPolarHBondContact O-CG2 3.3Å; L118-V122 PolarHBondContact O-N 3.05Å
119L77.3Confident78.6Confident83 Ų83112.6 Ų112.644%0.43554%0.542SS..Hα-helixtrans-61-47.4178.9-16171.9000111.8Y115 L121 V122 E123Y115-L119 PolarHBondContact O-N 2.98Å; L119-L121 VanDerWaalsContact C-N 3.31Å; L119-L121 PolarHBondContact O-N 3.41Å; L119-V122 PolarHBondContact O-N 3.01Å; L119-E123 WeakPolarHBondContact O-CG 3.05Å; L119-E123 PolarHBondContact O-N 2.92Å
120S81.8Confident79.4Confident66 Ų66109 Ų10946%0.46253%0.532SS..Hα-helixtrans-68.4-28.7177.262.80000113.4A116 K117 S124A116-S120 PolarHBondContact O-N 3.23Å; K117-S120 PolarHBondContact O-OG 3.39Å; S120-S124 WeakPolarHBondContact O-CB 3.15Å; S120-S124 PolarHBondContact O-N 3.39Å
121L82Confident80.1Confident102 Ų102106.8 Ų106.853%0.53453%0.527SS..Hα-helixtrans-67.8-40.3171.6-165.877.8000111.6K117 L118 L119 S124 R125K117-L121 WeakPolarHBondContact O-CB 3.45Å; K117-L121 PolarHBondContact O-N 3.18Å; K117-L121 VanDerWaalsContact O-N 3.17Å; L118-L121 WeakPolarHBondContact O-CB 3.32Å; L118-L121 PolarHBondContact O-N 3.43Å; L119-L121 VanDerWaalsContact C-N 3.31Å; L119-L121 PolarHBondContact O-N 3.41Å; L121-S124 PolarHBondContact O-N 2.87Å; L121-R125 WeakPolarHBondContact O-CG 3.39Å; L121-R125 PolarHBondContact O-N 3.34Å
122V79.6Confident80.8Confident87 Ų87104.2 Ų104.253%0.52752%0.524SS..Hα-helixtrans-64.7-48.5175.8170.20000110.6L118 L119 S124 R125 E126L118-V122 WeakPolarHBondContact O-CG2 3.3Å; L118-V122 PolarHBondContact O-N 3.05Å; L119-V122 PolarHBondContact O-N 3.01Å; V122-S124 VanDerWaalsContact C-N 3.28Å; V122-S124 PolarHBondContact O-N 3.44Å; V122-R125 PolarHBondContact O-N 3.43Å; V122-R125 VanDerWaalsContact O-N 3.12Å; V122-E126 WeakPolarHBondContact O-CB 3.47Å; V122-E126 PolarHBondContact O-N 2.97Å
123E81.9Confident81.3Confident122 Ų122103.9 Ų103.957%0.5752%0.519SS*.Hα-helixtrans-55.4-43.6175.2-71.1175163.700111.8L119 E126 H127L119-E123 WeakPolarHBondContact O-CG 3.05Å; L119-E123 PolarHBondContact O-N 2.92Å; E123-E126 PolarHBondContact O-N 3.19Å; E123-H127 PolarHBondContact O-N 2.95Å; E123-H127 VanDerWaalsContact O-N 3.13Å
124S84.3Confident81.8Confident75 Ų75104 Ų10452%0.52452%0.517SS..Hα-helixtrans-63.9-41.2176.8-178.90000112.9S120 L121 V122 E128S120-S124 WeakPolarHBondContact O-CB 3.15Å; S120-S124 PolarHBondContact O-N 3.39Å; L121-S124 PolarHBondContact O-N 2.87Å; V122-S124 VanDerWaalsContact C-N 3.28Å; V122-S124 PolarHBondContact O-N 3.44Å; S124-E128 PolarHBondContact O-N 2.99Å
125R84.9Confident82.2Confident147 Ų147102.8 Ų102.856%0.55552%0.515SS*.Hα-helixtrans-73.4-33178.5-72.6-59.6-166.2177.73.1113L121 V122 E128 L129L121-R125 WeakPolarHBondContact O-CG 3.39Å; L121-R125 PolarHBondContact O-N 3.34Å; V122-R125 PolarHBondContact O-N 3.43Å; V122-R125 VanDerWaalsContact O-N 3.12Å; R125-E128 VanDerWaalsContact CD-OE2 3.23Å; R125-E128 WeakPolarHBondContact CD-OE2 3.44Å; R125-E128 IonicContact CZ-OE2 3.88Å; R125-E128 IonicContact NE-OE2 2.66Å; R125-E128 IonicContact NH1-OE1 3.6Å; R125-E128 IonicContact NH1-OE2 2.68Å; R125-E128 PolarHBondContact NH1-OE2 3.13Å; R125-E128 PolarHBondContact O-N 3.33Å; R125-L129 WeakPolarHBondContact O-CB 3.46Å; R125-L129 PolarHBondContact O-N 2.64Å
126E80.5Confident82.6Confident135 Ų13599.3 Ų99.363%0.63151%0.505SS*.Hα-helixtrans-66-40.1175-170.8164.9-157.800111.2V122 E123 L129 Q130V122-E126 WeakPolarHBondContact O-CB 3.47Å; V122-E126 PolarHBondContact O-N 2.97Å; E123-E126 PolarHBondContact O-N 3.19Å; E126-L129 PolarHBondContact O-N 2.93Å; E126-Q130 WeakPolarHBondContact O-CB 3.33Å; E126-Q130 PolarHBondContact O-N 3.19Å
127H86.7Confident82.8Confident136 Ų13699.4 Ų99.463%0.6350%0.502SS*.Hα-helixtrans-63.8-40.7173.3-169.865.4000113.1E123 Q130 T131E123-H127 PolarHBondContact O-N 2.95Å; E123-H127 VanDerWaalsContact O-N 3.13Å; H127-Q130 PolarHBondContact O-N 3.41Å; H127-T131 PolarHBondContact O-N 3.48Å; H127-T131 PolarHBondContact O-OG1 3.38Å
128E84.8Confident83Confident91 Ų9199.4 Ų99.443%0.42550%0.502SS..Hα-helixtrans-65.3-44175.4-169.5-179.2-162.400111.8S124 R125 Q130 T131 L132S124-E128 PolarHBondContact O-N 2.99Å; R125-E128 VanDerWaalsContact CD-OE2 3.23Å; R125-E128 WeakPolarHBondContact CD-OE2 3.44Å; R125-E128 IonicContact CZ-OE2 3.88Å; R125-E128 IonicContact NE-OE2 2.66Å; R125-E128 IonicContact NH1-OE1 3.6Å; R125-E128 IonicContact NH1-OE2 2.68Å; R125-E128 PolarHBondContact NH1-OE2 3.13Å; R125-E128 PolarHBondContact O-N 3.33Å; E128-Q130 VanDerWaalsContact C-N 3.34Å; E128-Q130 PolarHBondContact O-N 3.2Å; E128-T131 WeakPolarHBondContact O-CB 3.32Å; E128-T131 PolarHBondContact O-N 2.9Å; E128-L132 WeakPolarHBondContact O-CG 3.45Å; E128-L132 PolarHBondContact O-N 2.93Å
129L84.2Confident83.4Confident95 Ų95103.1 Ų103.150%0.49751%0.509SS..Hα-helixtrans-59.1-42.6174.2-103164000112.4R125 E126 L132 R133R125-L129 WeakPolarHBondContact O-CB 3.46Å; R125-L129 PolarHBondContact O-N 2.64Å; E126-L129 PolarHBondContact O-N 2.93Å; L129-L132 PolarHBondContact O-N 3.41Å; L129-R133 WeakPolarHBondContact O-CG 3.31Å; L129-R133 PolarHBondContact O-N 3.32Å
130Q84.7Confident83.6Confident88 Ų88105.6 Ų105.641%0.41151%0.513SS..Hα-helixtrans-64.1-42.3176.9-176.158.619.200111.5E126 H127 E128 L132 R133 E134E126-Q130 WeakPolarHBondContact O-CB 3.33Å; E126-Q130 PolarHBondContact O-N 3.19Å; H127-Q130 PolarHBondContact O-N 3.41Å; E128-Q130 VanDerWaalsContact C-N 3.34Å; E128-Q130 PolarHBondContact O-N 3.2Å; Q130-L132 VanDerWaalsContact C-N 3.33Å; Q130-L132 PolarHBondContact O-N 2.98Å; Q130-R133 PolarHBondContact O-N 3.12Å; Q130-E134 PolarHBondContact O-N 3.27Å
131T87Confident83.6Confident76 Ų76106.5 Ų106.547%0.46651%0.512SS..Hα-helixtrans-60.3-41.4175.1-54.70000111.8H127 E128 E134 A135H127-T131 PolarHBondContact O-N 3.48Å; H127-T131 PolarHBondContact O-OG1 3.38Å; E128-T131 WeakPolarHBondContact O-CB 3.32Å; E128-T131 PolarHBondContact O-N 2.9Å; T131-E134 PolarHBondContact O-N 3.4Å; T131-A135 PolarHBondContact O-N 3.43Å; T131-A135 VanDerWaalsContact O-N 3.08Å
132L84.5Confident83.8Confident110 Ų110106.3 Ų106.358%0.57651%0.511SS*.Hα-helixtrans-66.6-39.8176.1-71.8171.6000112.6E128 L129 Q130 E134 A135 E136E128-L132 WeakPolarHBondContact O-CG 3.45Å; E128-L132 PolarHBondContact O-N 2.93Å; L129-L132 PolarHBondContact O-N 3.41Å; Q130-L132 VanDerWaalsContact C-N 3.33Å; Q130-L132 PolarHBondContact O-N 2.98Å; L132-E134 VanDerWaalsContact C-N 3.34Å; L132-E134 PolarHBondContact O-N 2.89Å; L132-A135 PolarHBondContact O-N 3.25Å; L132-E136 WeakPolarHBondContact O-CB 3.5Å; L132-E136 PolarHBondContact O-N 3.13Å
133R84.5Confident83.9Confident152 Ų152105.8 Ų105.857%0.57451%0.507SS*.Hα-helixtrans-61.7-40174.6-74.9173.8175.2173.6-0.2112.3L129 Q130 E136 S137L129-R133 WeakPolarHBondContact O-CG 3.31Å; L129-R133 PolarHBondContact O-N 3.32Å; Q130-R133 PolarHBondContact O-N 3.12Å; R133-E136 PolarHBondContact O-N 2.84Å; R133-S137 WeakPolarHBondContact O-CB 3.49Å; R133-S137 PolarHBondContact O-N 3.33Å
134E87.1Confident84Confident97 Ų97106.1 Ų106.145%0.45351%0.507SS..Hα-helixtrans-66.4-39.6174.8-71.8-178.1-160.900112.4Q130 T131 L132 S137 K138Q130-E134 PolarHBondContact O-N 3.27Å; T131-E134 PolarHBondContact O-N 3.4Å; L132-E134 VanDerWaalsContact C-N 3.34Å; L132-E134 PolarHBondContact O-N 2.89Å; E134-S137 PolarHBondContact O-N 2.96Å; E134-K138 WeakPolarHBondContact O-CG 3.42Å; E134-K138 PolarHBondContact O-N 3.32Å
135A83.9Confident84Confident38 Ų38107.9 Ų107.931%0.31451%0.51SS..Hα-helixtrans-65.3-40.9174.300000112.2T131 L132 K138 R139T131-A135 PolarHBondContact O-N 3.43Å; T131-A135 VanDerWaalsContact O-N 3.08Å; L132-A135 PolarHBondContact O-N 3.25Å; A135-K138 PolarHBondContact O-N 3.16Å; A135-R139 WeakPolarHBondContact O-CG 3.33Å; A135-R139 PolarHBondContact O-N 3.17Å
136E81.8Confident83.9Confident88 Ų88105.1 Ų105.141%0.41151%0.506SS..Hα-helixtrans-63.3-43.6174.6-164.8-150.317600111.5L132 R133 K138 R139 R140L132-E136 WeakPolarHBondContact O-CB 3.5Å; L132-E136 PolarHBondContact O-N 3.13Å; R133-E136 PolarHBondContact O-N 2.84Å; E136-K138 PolarHBondContact O-N 3.34Å; E136-R139 PolarHBondContact O-N 2.86Å; E136-R140 VanDerWaalsContact CD-CZ 3.45Å; E136-R140 PolarHBondContact O-N 3.09Å; E136-R140 IonicContact OE1-CZ 2.82Å; E136-R140 IonicContact OE1-NH1 3.01Å; E136-R140 PolarHBondContact OE1-NH1 3.32Å; E136-R140 IonicContact OE1-NH2 3.07Å; E136-R140 PolarHBondContact OE1-NH2 2.92Å; E136-R140 IonicContact OE2-CZ 3.79Å; E136-R140 IonicContact OE2-NH1 2.74Å; E136-R140 IonicContact OE2-NH2 3.61Å; E136-R140 PolarHBondContact OE2-NH2 3.46Å
137S81.3Confident84Confident59 Ų59104.7 Ų104.741%0.41350%0.504SS..Hα-helixtrans-58.7-45.9175.4-173.90000112R133 E134 R139 R140 N141R133-S137 WeakPolarHBondContact O-CB 3.49Å; R133-S137 PolarHBondContact O-N 3.33Å; E134-S137 PolarHBondContact O-N 2.96Å; S137-R139 PolarHBondContact O-N 3.17Å; S137-R140 PolarHBondContact O-N 3.44Å; S137-N141 PolarHBondContact O-N 2.97Å; S137-N141 VanDerWaalsContact O-N 3.14Å
138K84.8Confident83.8Confident135 Ų135104.7 Ų104.759%0.58750%0.502SS*.Hα-helixtrans-59.8-44.1174-71.7166.9-175.3165.60111.8E134 A135 E136 N141 I142E134-K138 WeakPolarHBondContact O-CG 3.42Å; E134-K138 PolarHBondContact O-N 3.32Å; A135-K138 PolarHBondContact O-N 3.16Å; E136-K138 PolarHBondContact O-N 3.34Å; K138-N141 PolarHBondContact O-N 2.98Å; K138-I142 WeakPolarHBondContact O-CG1 3.5Å; K138-I142 PolarHBondContact O-N 3.37Å
139R83.4Confident83.8Confident183 Ų183105.4 Ų105.469%0.69151%0.506SS*.Hα-helixtrans-62.6-42.5175.7-72.2174.7-176.8174.61.9112.4A135 E136 S137 N141 I142 V143A135-R139 WeakPolarHBondContact O-CG 3.33Å; A135-R139 PolarHBondContact O-N 3.17Å; E136-R139 PolarHBondContact O-N 2.86Å; S137-R139 PolarHBondContact O-N 3.17Å; R139-N141 VanDerWaalsContact C-N 3.28Å; R139-N141 PolarHBondContact O-N 3.37Å; R139-I142 PolarHBondContact O-N 3.33Å; R139-V143 WeakPolarHBondContact O-CG2 3.42Å; R139-V143 PolarHBondContact O-N 3.06Å
140R81.1Confident83.7Confident136 Ų136105.4 Ų105.451%0.51351%0.509SS..Hα-helixtrans-60.1-35.3176-91.5-162.2-81.9-104.2-6.3112.9E136 S137 K144E136-R140 VanDerWaalsContact CD-CZ 3.45Å; E136-R140 PolarHBondContact O-N 3.09Å; E136-R140 IonicContact OE1-CZ 2.82Å; E136-R140 IonicContact OE1-NH1 3.01Å; E136-R140 PolarHBondContact OE1-NH1 3.32Å; E136-R140 IonicContact OE1-NH2 3.07Å; E136-R140 PolarHBondContact OE1-NH2 2.92Å; E136-R140 IonicContact OE2-CZ 3.79Å; E136-R140 IonicContact OE2-NH1 2.74Å; E136-R140 IonicContact OE2-NH2 3.61Å; E136-R140 PolarHBondContact OE2-NH2 3.46Å; S137-R140 PolarHBondContact O-N 3.44Å; R140-K144 PolarHBondContact O-N 3.31Å
141N82.8Confident83.6Confident84 Ų84108.6 Ų108.645%0.44952%0.519SS..Hα-helixtrans-69.6-43.5175.4-68-19.6000111.8S137 K138 R139 V143 K144 D145S137-N141 PolarHBondContact O-N 2.97Å; S137-N141 VanDerWaalsContact O-N 3.14Å; K138-N141 PolarHBondContact O-N 2.98Å; R139-N141 VanDerWaalsContact C-N 3.28Å; R139-N141 PolarHBondContact O-N 3.37Å; N141-V143 VanDerWaalsContact C-N 3.29Å; N141-V143 PolarHBondContact O-N 2.93Å; N141-K144 WeakPolarHBondContact O-CB 3.37Å; N141-K144 PolarHBondContact O-N 2.82Å; N141-K144 VanDerWaalsContact O-N 3.13Å; N141-D145 PolarHBondContact O-N 3.23Å
142I85.2Confident83.4Confident99 Ų99108.1 Ų108.151%0.50851%0.513SS..Hα-helixtrans-58.7-40.6174.7-64.3166.1000111.3K138 R139 D145 L146K138-I142 WeakPolarHBondContact O-CG1 3.5Å; K138-I142 PolarHBondContact O-N 3.37Å; R139-I142 PolarHBondContact O-N 3.33Å; I142-D145 PolarHBondContact O-N 3.46Å; I142-L146 HydrophobicContact CG2-CD1 3.96Å; I142-L146 HydrophobicContact CG2-CG 4.43Å; I142-L146 WeakPolarHBondContact O-CG 3.28Å; I142-L146 PolarHBondContact O-N 2.89Å
143V82.9Confident83.2Confident75 Ų75107 Ų10746%0.45551%0.507SS..Hα-helixtrans-61.2-44.6176171.80000111.3R139 N141 D145 L146 E147R139-V143 WeakPolarHBondContact O-CG2 3.42Å; R139-V143 PolarHBondContact O-N 3.06Å; N141-V143 VanDerWaalsContact C-N 3.29Å; N141-V143 PolarHBondContact O-N 2.93Å; V143-D145 PolarHBondContact O-N 3.5Å; V143-L146 PolarHBondContact O-N 2.98Å; V143-E147 HydrophobicContact CG1-CG 4.31Å; V143-E147 WeakPolarHBondContact O-CG 3.23Å; V143-E147 PolarHBondContact O-N 3.49Å
144K83Confident82.9Confident130 Ų130106.5 Ų106.557%0.56551%0.509SS*.Hα-helixtrans-62.4-39.4176.7-72.9176.1176.1179.10113.1R140 N141 E147 K148R140-K144 PolarHBondContact O-N 3.31Å; N141-K144 WeakPolarHBondContact O-CB 3.37Å; N141-K144 PolarHBondContact O-N 2.82Å; N141-K144 VanDerWaalsContact O-N 3.13Å; K144-E147 PolarHBondContact O-N 3.37Å; K144-K148 WeakPolarHBondContact O-CB 3.19Å; K144-K148 PolarHBondContact O-N 3.15Å
145D84.5Confident82.5Confident111 Ų111106.3 Ų106.359%0.59451%0.508SS*.Hα-helixtrans-65.8-40.7176.8-70.1-30.1000111.1N141 I142 V143 K148 E149N141-D145 PolarHBondContact O-N 3.23Å; I142-D145 PolarHBondContact O-N 3.46Å; V143-D145 PolarHBondContact O-N 3.5Å; D145-K148 PolarHBondContact O-N 2.86Å; D145-E149 PolarHBondContact O-N 3.3Å
146L83Confident82.3Confident90 Ų90110.8 Ų110.847%0.47152%0.517SS..Hα-helixtrans-67.9-40174.6-70.5170.6000112.8I142 V143 K148 E149 V150I142-L146 HydrophobicContact CG2-CD1 3.96Å; I142-L146 HydrophobicContact CG2-CG 4.43Å; I142-L146 WeakPolarHBondContact O-CG 3.28Å; I142-L146 PolarHBondContact O-N 2.89Å; V143-L146 PolarHBondContact O-N 2.98Å; L146-K148 VanDerWaalsContact C-N 3.28Å; L146-K148 PolarHBondContact O-N 3.32Å; L146-E149 PolarHBondContact O-N 3.47Å; L146-V150 WeakPolarHBondContact O-CB 3.23Å; L146-V150 VanDerWaalsContact O-CG2 3.3Å; L146-V150 WeakPolarHBondContact O-CG2 3.44Å; L146-V150 PolarHBondContact O-N 2.91Å
147E82.2Confident82Confident125 Ų125113.3 Ų113.358%0.58453%0.527SS*.Hα-helixtrans-58.6-42.1173.6-76.6174.3158.100111.2V143 K144 Y151V143-E147 HydrophobicContact CG1-CG 4.31Å; V143-E147 WeakPolarHBondContact O-CG 3.23Å; V143-E147 PolarHBondContact O-N 3.49Å; K144-E147 PolarHBondContact O-N 3.37Å; E147-Y151 PolarHBondContact O-N 3.46Å
148K83.9Confident81.6Confident136 Ų136114.8 Ų114.859%0.59153%0.53SS*.Hα-helixtrans-66.2-43.8174.7-171.7-178.3177.5-173.90112.1K144 D145 L146 V150 Y151 D152K144-K148 WeakPolarHBondContact O-CB 3.19Å; K144-K148 PolarHBondContact O-N 3.15Å; D145-K148 PolarHBondContact O-N 2.86Å; L146-K148 VanDerWaalsContact C-N 3.28Å; L146-K148 PolarHBondContact O-N 3.32Å; K148-V150 VanDerWaalsContact C-N 3.35Å; K148-V150 PolarHBondContact O-N 3.46Å; K148-Y151 WeakPolarHBondContact O-CB 3.28Å; K148-Y151 PolarHBondContact O-N 3.04Å; K148-D152 PolarHBondContact O-N 3.49Å
149E83.5Confident80.8Confident106 Ų106113.1 Ų113.150%0.49552%0.524SS..Hα-helixtrans-62.7-41.4176.9-169.9179.5-171.900111.9D145 L146 Y151 D152 I153D145-E149 PolarHBondContact O-N 3.3Å; L146-E149 PolarHBondContact O-N 3.47Å; E149-Y151 VanDerWaalsContact C-N 3.33Å; E149-Y151 PolarHBondContact O-N 2.99Å; E149-D152 PolarHBondContact O-N 3.03Å; E149-I153 HydrophobicContact CG-CD1 3.96Å; E149-I153 HydrophobicContact CG-CG1 4.49Å; E149-I153 WeakPolarHBondContact O-CB 3.2Å; E149-I153 VanDerWaalsContact O-CG1 3.26Å; E149-I153 WeakPolarHBondContact O-CG1 3.29Å; E149-I153 PolarHBondContact O-N 3.11Å
150V81.9Confident79.9Confident95 Ų95113.9 Ų113.958%0.57653%0.527SS*.Hα-helixtrans-61.8-41.1174.3168.80000111.2L146 K148 I153 K154L146-V150 WeakPolarHBondContact O-CB 3.23Å; L146-V150 VanDerWaalsContact O-CG2 3.3Å; L146-V150 WeakPolarHBondContact O-CG2 3.44Å; L146-V150 PolarHBondContact O-N 2.91Å; K148-V150 VanDerWaalsContact C-N 3.35Å; K148-V150 PolarHBondContact O-N 3.46Å; V150-I153 PolarHBondContact O-N 3.18Å; V150-K154 WeakPolarHBondContact O-CB 3.36Å; V150-K154 PolarHBondContact O-N 3.33Å
151Y84.1Confident78.6Confident155 Ų155110.9 Ų110.961%0.60853%0.527SS*.Hα-helixtrans-61-49.3174-175.6-90.3000111.7E147 K148 E149 I153 K154 H155E147-Y151 PolarHBondContact O-N 3.46Å; K148-Y151 WeakPolarHBondContact O-CB 3.28Å; K148-Y151 PolarHBondContact O-N 3.04Å; E149-Y151 VanDerWaalsContact C-N 3.33Å; E149-Y151 PolarHBondContact O-N 2.99Å; Y151-I153 VanDerWaalsContact C-N 3.34Å; Y151-I153 PolarHBondContact O-N 3.43Å; Y151-K154 PolarHBondContact O-N 2.91Å; Y151-K154 VanDerWaalsContact O-N 3.16Å; Y151-H155 PolarHBondContact O-N 3.19Å
152D81.9Confident77.3Confident66 Ų66114.9 Ų114.935%0.35354%0.543SS..Hα-helixtrans-64.8-35179.6-70.8-14.7000112.5K148 E149 R156K148-D152 PolarHBondContact O-N 3.49Å; E149-D152 PolarHBondContact O-N 3.03Å; D152-R156 WeakPolarHBondContact O-CB 3.35Å; D152-R156 WeakPolarHBondContact O-CG 3.41Å; D152-R156 PolarHBondContact O-N 3.3Å; D152-R156 PolarHBondContact O-NE 2.84Å
153I80.1Confident75.9Confident88 Ų88118.8 Ų118.845%0.45156%0.556SS.*Hα-helixtrans-66.8-44.3172.7-70.8167.9000110.6E149 V150 Y151 H155 R156 F157E149-I153 HydrophobicContact CG-CD1 3.96Å; E149-I153 HydrophobicContact CG-CG1 4.49Å; E149-I153 WeakPolarHBondContact O-CB 3.2Å; E149-I153 VanDerWaalsContact O-CG1 3.26Å; E149-I153 WeakPolarHBondContact O-CG1 3.29Å; E149-I153 PolarHBondContact O-N 3.11Å; V150-I153 PolarHBondContact O-N 3.18Å; Y151-I153 VanDerWaalsContact C-N 3.34Å; Y151-I153 PolarHBondContact O-N 3.43Å; I153-H155 PolarHBondContact O-N 3.11Å; I153-R156 PolarHBondContact O-N 3.39Å; I153-F157 WeakPolarHBondContact O-CB 3.35Å; I153-F157 PolarHBondContact O-N 3.12Å
154K79.7Confident74.1Confident140 Ų140121.1 Ų121.161%0.60956%0.564SS**Hα-helixtrans-64.5-39.5179.5-168.7174.4-176.9179.40111.9V150 Y151 F157 N158V150-K154 WeakPolarHBondContact O-CB 3.36Å; V150-K154 PolarHBondContact O-N 3.33Å; Y151-K154 PolarHBondContact O-N 2.91Å; Y151-K154 VanDerWaalsContact O-N 3.16Å; K154-F157 PolarHBondContact O-N 3.34Å; K154-N158 PolarHBondContact O-N 3.2Å
155H78.5Confident72Confident94 Ų94120.7 Ų120.744%0.43558%0.577SS.*Hα-helixtrans-60.8-53.8174.1-166.3-77.7000111.7Y151 I153 F157 N158 E159Y151-H155 PolarHBondContact O-N 3.19Å; I153-H155 PolarHBondContact O-N 3.11Å; H155-F157 PolarHBondContact O-N 2.89Å; H155-N158 PolarHBondContact O-N 2.78Å; H155-N158 VanDerWaalsContact O-N 3.11Å; H155-E159 VanDerWaalsContact CE1-CD 3.46Å; H155-E159 IonicContact CE1-OE1 3.35Å; H155-E159 PolarHBondContact CE1-OE1 3.45Å; H155-E159 IonicContact CE1-OE2 3.81Å; H155-E159 VanDerWaalsContact ND1-CD 3.31Å; H155-E159 IonicContact ND1-OE1 3.63Å; H155-E159 IonicContact ND1-OE2 3.24Å; H155-E159 PolarHBondContact ND1-OE2 3.04Å; H155-E159 PolarHBondContact O-N 3.41Å; H155-E159 VanDerWaalsContact O-N 3.08Å
156R78.6Confident70.2Confident131 Ų131121.3 Ų121.349%0.49459%0.59SS.*Hα-helixtrans-64.2-26.8-179.7-71.7175.8-69.7-168.50.1113.6D152 I153 R160D152-R156 WeakPolarHBondContact O-CB 3.35Å; D152-R156 WeakPolarHBondContact O-CG 3.41Å; D152-R156 PolarHBondContact O-N 3.3Å; D152-R156 PolarHBondContact O-NE 2.84Å; I153-R156 PolarHBondContact O-N 3.39Å; R156-R160 WeakPolarHBondContact O-CG 3.17Å; R156-R160 PolarHBondContact O-N 2.97Å
157F75.4Confident68.6Low142 Ų142118.8 Ų118.862%0.62358%0.582SS**Hα-helixtrans-68-47.6172.2178.9-97.3000111.2I153 K154 H155 R160 S161I153-F157 WeakPolarHBondContact O-CB 3.35Å; I153-F157 PolarHBondContact O-N 3.12Å; K154-F157 PolarHBondContact O-N 3.34Å; H155-F157 PolarHBondContact O-N 2.89Å; F157-R160 PolarHBondContact O-N 2.79Å; F157-S161 PolarHBondContact O-N 3.44Å
158N72.6Confident66.9Low90 Ų90121.2 Ų121.248%0.48159%0.594SS.*Hα-helixtrans-62.3-44.7178.8-69.1-5.3000111.8K154 H155 R160 S161K154-N158 PolarHBondContact O-N 3.2Å; H155-N158 PolarHBondContact O-N 2.78Å; H155-N158 VanDerWaalsContact O-N 3.11Å; N158-R160 PolarHBondContact O-N 2.76Å; N158-S161 VanDerWaalsContact O-CB 3.32Å; N158-S161 WeakPolarHBondContact O-CB 3.37Å; N158-S161 PolarHBondContact O-N 2.97Å
159E68.9Low65.5Low99 Ų99123 Ų12346%0.46361%0.61SS.*Hα-helixtrans-60.5-29.2176.4-69.5176.3127.600113.9H155H155-E159 VanDerWaalsContact CE1-CD 3.46Å; H155-E159 IonicContact CE1-OE1 3.35Å; H155-E159 PolarHBondContact CE1-OE1 3.45Å; H155-E159 IonicContact CE1-OE2 3.81Å; H155-E159 VanDerWaalsContact ND1-CD 3.31Å; H155-E159 IonicContact ND1-OE1 3.63Å; H155-E159 IonicContact ND1-OE2 3.24Å; H155-E159 PolarHBondContact ND1-OE2 3.04Å; H155-E159 PolarHBondContact O-N 3.41Å; H155-E159 VanDerWaalsContact O-N 3.08Å
160R63.6Low64.2Low199 Ų199122.6 Ų122.675%0.75161%0.611SS**Hα-helixtrans-82.2-28.2175.4-75.2-179.7174.8-171.5-1.2112.5R156 F157 N158 E162 K163R156-R160 WeakPolarHBondContact O-CG 3.17Å; R156-R160 PolarHBondContact O-N 2.97Å; F157-R160 PolarHBondContact O-N 2.79Å; N158-R160 PolarHBondContact O-N 2.76Å; R160-E162 PolarHBondContact O-N 3.08Å; R160-K163 PolarHBondContact O-N 3.36Å
161S54.8Low63.1Low73 Ų73123.2 Ų123.251%0.5161%0.61SS.*Hα-helixtrans-61.9-29.2178.3-166.30000112.8F157 N158 K163F157-S161 PolarHBondContact O-N 3.44Å; N158-S161 VanDerWaalsContact O-CB 3.32Å; N158-S161 WeakPolarHBondContact O-CB 3.37Å; N158-S161 PolarHBondContact O-N 2.97Å; S161-K163 VanDerWaalsContact C-N 3.35Å; S161-K163 PolarHBondContact O-N 2.92Å
162E55.7Low62Low168 Ų168123.4 Ų123.479%0.78562%0.621SS**THydrogen-bonded Turntrans-79-11.4-178.5-64.9-174.8151.800114.5R160R160-E162 PolarHBondContact O-N 3.08Å
163K54.4Low61.2Low181 Ų181123.9 Ų123.979%0.78763%0.629SS**THydrogen-bonded Turntrans-111.49.2-171.5-63.3-175-178.9176.30114.7R160 S161 S165R160-K163 PolarHBondContact O-N 3.36Å; S161-K163 VanDerWaalsContact C-N 3.35Å; S161-K163 PolarHBondContact O-N 2.92Å; K163-S165 PolarHBondContact O-N 3.39Å
164M44.7Very low60.4Low124 Ų124123.5 Ų123.561%0.61163%0.627SS**  trans-100.352.9-166.3-164.3164.155.900114.2A167M164-A167 HydrophobicContact CG-CB 3.88Å
165S40.8Very low60.1Low122 Ų122121.7 Ų121.785%0.85363%0.628SS**SBendtrans-100.927.6177.7-55.40000114.1K163K163-S165 PolarHBondContact O-N 3.39Å
166S46.3Very low59.8Low123 Ų123121.2 Ų121.286%0.8664%0.635SS**SBendtrans-154.953.8-173.7-167.60000112.5
167A49.7Very low59.5Low37 Ų37117.5 Ų117.531%0.30663%0.63SS.*  trans-140.942.3-158.800000117.2M164M164-A167 HydrophobicContact CG-CB 3.88Å
168E46Very low59.5Low176 Ų176115.2 Ų115.282%0.82263%0.627SS**SBendtrans-74.7-38.7173.4-81.1-176.6134.100113.7L170E168-L170 PolarHBondContact O-N 2.94Å
169N53.3Low59.6Low175 Ų175119.1 Ų119.194%0.93664%0.64SS**THydrogen-bonded Turntrans-76.5-1.5-179.2-76.1-36.4000114.9
170L57Low60Low97 Ų97120.9 Ų120.951%0.50865%0.648SS.*THydrogen-bonded Turntrans-97.2-11.9-177.2-140.4139.6000113E168 L172 S173 L174E168-L170 PolarHBondContact O-N 2.94Å; L170-L172 PolarHBondContact O-N 2.91Å; L170-S173 PolarHBondContact O-OG 3.29Å; L170-L174 HydrophobicContact CD2-CD1 3.83Å; L170-L174 HydrophobicContact CD2-CG 4.11Å
171L58.7Low60.7Low108 Ų108117.5 Ų117.557%0.56564%0.639SS**Hα-helixtrans-65.2-33.7-174.3-78.4162.8000114S173 L174L171-S173 PolarHBondContact O-N 3.21Å; L171-L174 PolarHBondContact O-N 2.83Å
172L61.1Low61.9Low159 Ų159120.4 Ų120.483%0.83264%0.642SS**Hα-helixtrans-72.4-27.6-175.2-80.8163.1000114.3L170L170-L172 PolarHBondContact O-N 2.91Å
173S65.4Low63.1Low76 Ų76114.6 Ų114.653%0.53163%0.627SS.*Hα-helixtrans-84.1-30.1175.9640000112.7L170 L171 V175 S176 S177L170-S173 PolarHBondContact O-OG 3.29Å; L171-S173 PolarHBondContact O-N 3.21Å; S173-V175 PolarHBondContact O-N 3.46Å; S173-S176 PolarHBondContact O-N 2.63Å; S173-S177 PolarHBondContact O-N 3.02Å
174L63.9Low64.3Low79 Ų79111.5 Ų111.541%0.41462%0.616SS.*Hα-helixtrans-63.1-39.7178-82.6164000112.9L170 L171 S176 S177 T178L170-L174 HydrophobicContact CD2-CD1 3.83Å; L170-L174 HydrophobicContact CD2-CG 4.11Å; L171-L174 PolarHBondContact O-N 2.83Å; L174-S176 VanDerWaalsContact C-N 3.3Å; L174-S176 PolarHBondContact O-N 2.8Å; L174-S177 PolarHBondContact O-N 3.47Å; L174-T178 PolarHBondContact O-N 3.34Å; L174-T178 PolarHBondContact O-OG1 3.14Å; L174-T178 VanDerWaalsContact O-OG1 3.08Å
175V72Confident66Low102 Ų102111 Ų11162%0.61861%0.614SS**Hα-helixtrans-58.1-42.4179.7173.80000111.7S173 K179S173-V175 PolarHBondContact O-N 3.46Å; V175-K179 PolarHBondContact O-N 3.35Å; V175-K179 VanDerWaalsContact O-N 3.09Å
176S71.7Confident68Low84 Ų84109 Ų10959%0.58759%0.592SS**Hα-helixtrans-66.1-42.2177.6-60.90000112.3S173 L174 K179 Q180S173-S176 PolarHBondContact O-N 2.63Å; L174-S176 VanDerWaalsContact C-N 3.3Å; L174-S176 PolarHBondContact O-N 2.8Å; S176-K179 PolarHBondContact O-N 3.07Å; S176-Q180 PolarHBondContact O-N 3.19Å
177S73.4Confident69.8Low54 Ų54106.6 Ų106.638%0.37858%0.575SS.*Hα-helixtrans-66.7-41.9177.6-168.60000112.3S173 L174 K179 Q180 K181S173-S177 PolarHBondContact O-N 3.02Å; L174-S177 PolarHBondContact O-N 3.47Å; S177-K179 VanDerWaalsContact C-N 3.32Å; S177-K179 PolarHBondContact O-N 2.95Å; S177-Q180 PolarHBondContact O-N 3.15Å; S177-K181 PolarHBondContact O-N 3.49Å
178T74.7Confident71.5Confident93 Ų93108.3 Ų108.357%0.57159%0.585SS**Hα-helixtrans-62.4-38.6176.2-60.30000111.7L174 K181 K182L174-T178 PolarHBondContact O-N 3.34Å; L174-T178 PolarHBondContact O-OG1 3.14Å; L174-T178 VanDerWaalsContact O-OG1 3.08Å; T178-K181 PolarHBondContact O-N 3.05Å; T178-K182 PolarHBondContact O-N 3.24Å
179K74.9Confident73.4Confident173 Ų173108 Ų10875%0.75258%0.576SS**Hα-helixtrans-65.3-39.2176.8-160.8174.2-175.7-179.70112.2V175 S176 S177 G183V175-K179 PolarHBondContact O-N 3.35Å; V175-K179 VanDerWaalsContact O-N 3.09Å; S176-K179 PolarHBondContact O-N 3.07Å; S177-K179 VanDerWaalsContact C-N 3.32Å; S177-K179 PolarHBondContact O-N 2.95Å; K179-G183 PolarHBondContact O-N 2.91Å
180Q78.2Confident75Confident136 Ų136106 Ų10664%0.63656%0.561SS**Hα-helixtrans-66.4-45.5174.1-173.1-178.78.100112.1S176 S177 K182 G183 Q184S176-Q180 PolarHBondContact O-N 3.19Å; S177-Q180 PolarHBondContact O-N 3.15Å; Q180-K182 VanDerWaalsContact C-N 3.32Å; Q180-K182 PolarHBondContact O-N 2.94Å; Q180-G183 PolarHBondContact O-N 3.31Å; Q180-Q184 PolarHBondContact O-N 3.09Å
181K78.3Confident76.5Confident128 Ų128110.4 Ų110.456%0.55757%0.571SS**Hα-helixtrans-64.1-34.3178.4-74.4-167.7174.7-169.20113S177 T178 G183 Q184 I185S177-K181 PolarHBondContact O-N 3.49Å; T178-K181 PolarHBondContact O-N 3.05Å; K181-G183 VanDerWaalsContact C-N 3.35Å; K181-G183 PolarHBondContact O-N 3.12Å; K181-Q184 PolarHBondContact O-N 3.42Å; K181-I185 WeakPolarHBondContact O-CG1 3.38Å; K181-I185 PolarHBondContact O-N 3.22Å
182K80.5Confident77.8Confident133 Ų133110.4 Ų110.458%0.57857%0.571SS**Hα-helixtrans-58.6-45.6173.6-173.2176.7178-177.60111.8T178 Q180 Q184 I185 E186T178-K182 PolarHBondContact O-N 3.24Å; Q180-K182 VanDerWaalsContact C-N 3.32Å; Q180-K182 PolarHBondContact O-N 2.94Å; K182-Q184 VanDerWaalsContact C-N 3.31Å; K182-Q184 PolarHBondContact O-N 3.33Å; K182-I185 PolarHBondContact O-N 3.05Å; K182-I185 VanDerWaalsContact O-N 3.17Å; K182-E186 WeakPolarHBondContact CE-OE2 3.39Å; K182-E186 PolarHBondContact O-N 3.21Å
183G79.4Confident79.1Confident46 Ų46108.2 Ų108.247%0.47456%0.556SS.*Hα-helixtrans-61.3-36177.100000113.7K179 Q180 K181 S187K179-G183 PolarHBondContact O-N 2.91Å; Q180-G183 PolarHBondContact O-N 3.31Å; K181-G183 VanDerWaalsContact C-N 3.35Å; K181-G183 PolarHBondContact O-N 3.12Å; G183-S187 PolarHBondContact O-N 3.5Å; G183-S187 VanDerWaalsContact O-N 3.14Å
184Q80.8Confident80.3Confident117 Ų117108 Ų10855%0.54755%0.552SS.*Hα-helixtrans-67.8-39.4174.4-69.8-180-33.500112.4Q180 K181 K182 S187 S188Q180-Q184 PolarHBondContact O-N 3.09Å; K181-Q184 PolarHBondContact O-N 3.42Å; K182-Q184 VanDerWaalsContact C-N 3.31Å; K182-Q184 PolarHBondContact O-N 3.33Å; Q184-S187 PolarHBondContact O-N 3.05Å; Q184-S188 WeakPolarHBondContact O-CB 3.34Å; Q184-S188 PolarHBondContact O-N 3.16Å; Q184-S188 PolarHBondContact O-OG 2.97Å; Q184-S188 VanDerWaalsContact O-OG 3.12Å
185I80.1Confident81.4Confident112 Ų112108.8 Ų108.857%0.57456%0.556SS**Hα-helixtrans-63.6-46.5176-68.8165.8000110.9K181 K182 S187 S188 R189K181-I185 WeakPolarHBondContact O-CG1 3.38Å; K181-I185 PolarHBondContact O-N 3.22Å; K182-I185 PolarHBondContact O-N 3.05Å; K182-I185 VanDerWaalsContact O-N 3.17Å; I185-S187 PolarHBondContact O-N 3.13Å; I185-S188 PolarHBondContact O-N 2.65Å; I185-R189 WeakPolarHBondContact O-CB 3.21Å; I185-R189 PolarHBondContact O-N 3.31Å
186E82.8Confident82.2Confident81 Ų81108.7 Ų108.738%0.37955%0.551SS.*Hα-helixtrans-58.8-47.5177.6-118.375.2-113.900111.1K182 S188 R189 E190K182-E186 WeakPolarHBondContact CE-OE2 3.39Å; K182-E186 PolarHBondContact O-N 3.21Å; E186-S188 PolarHBondContact O-N 3.28Å; E186-R189 WeakPolarHBondContact O-CB 3.36Å; E186-R189 PolarHBondContact O-N 3.35Å; E186-R189 VanDerWaalsContact O-N 3.12Å; E186-E190 PolarHBondContact O-N 2.92Å
187S84.6Confident83Confident72 Ų72109.9 Ų109.950%0.50355%0.548SS..Hα-helixtrans-65.1-38.3177.9-179.90000113.5G183 Q184 I185 R189 R191G183-S187 PolarHBondContact O-N 3.5Å; G183-S187 VanDerWaalsContact O-N 3.14Å; Q184-S187 PolarHBondContact O-N 3.05Å; I185-S187 PolarHBondContact O-N 3.13Å; S187-R189 VanDerWaalsContact C-N 3.28Å; S187-R189 PolarHBondContact O-N 3.39Å; S187-R191 WeakPolarHBondContact O-CB 3.45Å; S187-R191 PolarHBondContact O-N 2.82Å; S187-R191 VanDerWaalsContact O-N 3.11Å
188S84.7Confident83.8Confident74 Ų74113 Ų11352%0.51756%0.556SS.*Hα-helixtrans-66.5-31.2172.9-65.90000112.5Q184 I185 E186 L192Q184-S188 WeakPolarHBondContact O-CB 3.34Å; Q184-S188 PolarHBondContact O-N 3.16Å; Q184-S188 PolarHBondContact O-OG 2.97Å; Q184-S188 VanDerWaalsContact O-OG 3.12Å; I185-S188 PolarHBondContact O-N 2.65Å; E186-S188 PolarHBondContact O-N 3.28Å; S188-L192 WeakPolarHBondContact O-CB 3.28Å; S188-L192 PolarHBondContact O-N 3.38Å
189R85.4Confident84.6Confident170 Ų170115.7 Ų115.764%0.64256%0.557SS**Hα-helixtrans-71.6-44.1177.3-167179.7-170.7174.42.9112I185 E186 S187 R191 L192 Q193I185-R189 WeakPolarHBondContact O-CB 3.21Å; I185-R189 PolarHBondContact O-N 3.31Å; E186-R189 WeakPolarHBondContact O-CB 3.36Å; E186-R189 PolarHBondContact O-N 3.35Å; E186-R189 VanDerWaalsContact O-N 3.12Å; S187-R189 VanDerWaalsContact C-N 3.28Å; S187-R189 PolarHBondContact O-N 3.39Å; R189-R191 VanDerWaalsContact C-N 3.33Å; R189-R191 PolarHBondContact O-N 2.96Å; R189-L192 PolarHBondContact O-N 3.26Å; R189-Q193 PolarHBondContact O-N 3.4Å
190E87.8Confident85.2Confident133 Ų133111.5 Ų111.562%0.62154%0.54SS*.Hα-helixtrans-57.5-46.5171.5-71.8175.9163.600111E186 L192 Q193 T194E186-E190 PolarHBondContact O-N 2.92Å; E190-L192 VanDerWaalsContact C-N 3.32Å; E190-L192 PolarHBondContact O-N 3.07Å; E190-Q193 VanDerWaalsContact O-CB 3.27Å; E190-Q193 WeakPolarHBondContact O-CB 3.43Å; E190-Q193 PolarHBondContact O-N 2.77Å; E190-Q193 VanDerWaalsContact O-N 3.1Å; E190-T194 PolarHBondContact O-N 3.44Å; E190-T194 VanDerWaalsContact O-N 3.08Å; E190-T194 PolarHBondContact O-OG1 2.89Å
191R87.6Confident85.8Confident188 Ų188110.5 Ų110.571%0.70954%0.539SS*.Hα-helixtrans-65.2-33.7179.2-166.3171.2-173.6143.93.5113.5S187 R189 L195S187-R191 WeakPolarHBondContact O-CB 3.45Å; S187-R191 PolarHBondContact O-N 2.82Å; S187-R191 VanDerWaalsContact O-N 3.11Å; R189-R191 VanDerWaalsContact C-N 3.33Å; R189-R191 PolarHBondContact O-N 2.96Å; R191-L195 PolarHBondContact O-N 3.22Å
192L86.7Confident86.2Confident109 Ų109107 Ų10757%0.57154%0.535SS*.Hα-helixtrans-66.7-39.3171.4-101.1163.6000112S188 R189 E190 L195 L196S188-L192 WeakPolarHBondContact O-CB 3.28Å; S188-L192 PolarHBondContact O-N 3.38Å; R189-L192 PolarHBondContact O-N 3.26Å; E190-L192 VanDerWaalsContact C-N 3.32Å; E190-L192 PolarHBondContact O-N 3.07Å; L192-L195 PolarHBondContact O-N 3.35Å; L192-L196 WeakPolarHBondContact O-CG 3.43Å; L192-L196 PolarHBondContact O-N 2.87Å
193Q88.6Confident86.6Confident112 Ų112106.3 Ų106.352%0.52353%0.528SS..Hα-helixtrans-59.7-49176.1-165.477.929.100110.8R189 E190 L195 L196 E197R189-Q193 PolarHBondContact O-N 3.4Å; E190-Q193 VanDerWaalsContact O-CB 3.27Å; E190-Q193 WeakPolarHBondContact O-CB 3.43Å; E190-Q193 PolarHBondContact O-N 2.77Å; E190-Q193 VanDerWaalsContact O-N 3.1Å; Q193-L195 PolarHBondContact O-N 3.4Å; Q193-L196 PolarHBondContact O-N 3.35Å; Q193-E197 PolarHBondContact O-N 3.03Å; Q193-E197 VanDerWaalsContact O-N 3.13Å
194T89.2Confident87Confident71 Ų71107.2 Ų107.244%0.43653%0.527SS..Hα-helixtrans-62.1-42.5178.4-42.20000112.3E190 L196 E197 E198E190-T194 PolarHBondContact O-N 3.44Å; E190-T194 VanDerWaalsContact O-N 3.08Å; E190-T194 PolarHBondContact O-OG1 2.89Å; T194-L196 VanDerWaalsContact C-N 3.3Å; T194-L196 PolarHBondContact O-N 3.42Å; T194-E197 PolarHBondContact O-N 2.79Å; T194-E198 WeakPolarHBondContact O-CG 3.47Å; T194-E198 PolarHBondContact O-N 2.92Å
195L87.9Confident87.2Confident96 Ų96107.6 Ų107.650%0.50353%0.529SS..Hα-helixtrans-64.5-32.1177.3-90.5160.4000113.2R191 L192 Q193 Y199R191-L195 PolarHBondContact O-N 3.22Å; L192-L195 PolarHBondContact O-N 3.35Å; Q193-L195 PolarHBondContact O-N 3.4Å; L195-Y199 WeakPolarHBondContact O-CB 3.48Å; L195-Y199 PolarHBondContact O-N 3.42Å
196L87.8Confident87.4Confident100 Ų100109 Ų10952%0.52453%0.533SS..Hα-helixtrans-70.7-39.5174.3-76.6165.3000111.8L192 Q193 T194 Y199 E200L192-L196 WeakPolarHBondContact O-CG 3.43Å; L192-L196 PolarHBondContact O-N 2.87Å; Q193-L196 PolarHBondContact O-N 3.35Å; T194-L196 VanDerWaalsContact C-N 3.3Å; T194-L196 PolarHBondContact O-N 3.42Å; L196-Y199 PolarHBondContact O-N 2.84Å; L196-E200 PolarHBondContact O-N 2.84Å
197E89.6Confident87.6Confident110 Ų110109.7 Ų109.751%0.51454%0.539SS..Hα-helixtrans-66.2-43.6174.4-72174.617400111.9Q193 T194 Y199 E200 N201Q193-E197 PolarHBondContact O-N 3.03Å; Q193-E197 VanDerWaalsContact O-N 3.13Å; T194-E197 PolarHBondContact O-N 2.79Å; E197-Y199 VanDerWaalsContact C-N 3.31Å; E197-Y199 PolarHBondContact O-N 3.37Å; E197-E200 PolarHBondContact O-N 3.45Å; E197-N201 WeakPolarHBondContact O-CB 3.48Å; E197-N201 VanDerWaalsContact O-CG 3.26Å; E197-N201 PolarHBondContact O-N 3.11Å; E197-N201 PolarHBondContact O-ND2 2.93Å
198E90.8Very high87.6Confident119 Ų119111.4 Ų111.456%0.55654%0.539SS*.Hα-helixtrans-58.5-42.4172.6-74.3177.9-174.500111.9T194 A202T194-E198 WeakPolarHBondContact O-CG 3.47Å; T194-E198 PolarHBondContact O-N 2.92Å; E198-A202 WeakPolarHBondContact O-CB 3.37Å; E198-A202 PolarHBondContact O-N 2.99Å
199Y89.8Confident87.6Confident150 Ų150113 Ų11359%0.58854%0.542SS*.Hα-helixtrans-65.4-48.1178.7177-99.1000112.7L195 L196 E197 N201 A202 R203L195-Y199 WeakPolarHBondContact O-CB 3.48Å; L195-Y199 PolarHBondContact O-N 3.42Å; L196-Y199 PolarHBondContact O-N 2.84Å; E197-Y199 VanDerWaalsContact C-N 3.31Å; E197-Y199 PolarHBondContact O-N 3.37Å; Y199-N201 VanDerWaalsContact C-N 3.35Å; Y199-N201 PolarHBondContact O-N 3.14Å; Y199-A202 PolarHBondContact O-N 2.66Å; Y199-R203 VanDerWaalsContact O-CB 3.24Å; Y199-R203 WeakPolarHBondContact O-CB 3.24Å; Y199-R203 PolarHBondContact O-N 3.01Å
200E88.7Confident87.4Confident85 Ų85108.8 Ų108.840%0.39754%0.537SS..Hα-helixtrans-67.9-33.8179.8-77-70.3-167.200112.6L196 E197 R203 S204L196-E200 PolarHBondContact O-N 2.84Å; E197-E200 PolarHBondContact O-N 3.45Å; E200-R203 IonicContact OE1-NH1 3.31Å; E200-R203 PolarHBondContact OE1-NH1 2.92Å; E200-R203 WeakPolarHBondContact OE2-CD 3.45Å; E200-R203 IonicContact OE2-CZ 3.73Å; E200-R203 IonicContact OE2-NH1 2.72Å; E200-R203 PolarHBondContact OE2-NH1 3.28Å; E200-S204 VanDerWaalsContact O-CB 3.31Å; E200-S204 WeakPolarHBondContact O-CB 3.4Å; E200-S204 PolarHBondContact O-N 3.09Å; E200-S204 PolarHBondContact O-OG 3.48Å
201N89.7Confident87.1Confident114 Ų114109 Ų10961%0.6154%0.538SS*.Hα-helixtrans-63.7-48.6172.1-74.7-35.8000111.5E197 Y199 R203 S204 H205E197-N201 WeakPolarHBondContact O-CB 3.48Å; E197-N201 VanDerWaalsContact O-CG 3.26Å; E197-N201 PolarHBondContact O-N 3.11Å; E197-N201 PolarHBondContact O-ND2 2.93Å; Y199-N201 VanDerWaalsContact C-N 3.35Å; Y199-N201 PolarHBondContact O-N 3.14Å; N201-R203 PolarHBondContact O-N 2.98Å; N201-S204 PolarHBondContact O-N 3.46Å; N201-H205 PolarHBondContact O-N 3.42Å; N201-H205 VanDerWaalsContact O-N 3.09Å
202A87.3Confident87Confident56 Ų56104.6 Ų104.646%0.46353%0.527SS..Hα-helixtrans-63.3-40.5177.600000112.3E198 Y199 Q206E198-A202 WeakPolarHBondContact O-CB 3.37Å; E198-A202 PolarHBondContact O-N 2.99Å; Y199-A202 PolarHBondContact O-N 2.66Å; A202-Q206 WeakPolarHBondContact O-CG 3.39Å; A202-Q206 PolarHBondContact O-N 3.06Å
203R88.1Confident86.7Confident118 Ų118103.4 Ų103.445%0.44552%0.521SS..Hα-helixtrans-62.8-43.8175.4176175168-104.1-6.9111.9Y199 E200 N201 Q206 L207Y199-R203 VanDerWaalsContact O-CB 3.24Å; Y199-R203 WeakPolarHBondContact O-CB 3.24Å; Y199-R203 PolarHBondContact O-N 3.01Å; E200-R203 IonicContact OE1-NH1 3.31Å; E200-R203 PolarHBondContact OE1-NH1 2.92Å; E200-R203 WeakPolarHBondContact OE2-CD 3.45Å; E200-R203 IonicContact OE2-CZ 3.73Å; E200-R203 IonicContact OE2-NH1 2.72Å; E200-R203 PolarHBondContact OE2-NH1 3.28Å; N201-R203 PolarHBondContact O-N 2.98Å; R203-Q206 PolarHBondContact O-N 3.29Å; R203-L207 PolarHBondContact O-N 2.84Å
204S88.5Confident86.5Confident65 Ų65102.1 Ų102.146%0.45552%0.522SS..Hα-helixtrans-62.6-45.7178.6-59.90000111.5E200 N201 Q206 L207 E208E200-S204 VanDerWaalsContact O-CB 3.31Å; E200-S204 WeakPolarHBondContact O-CB 3.4Å; E200-S204 PolarHBondContact O-N 3.09Å; E200-S204 PolarHBondContact O-OG 3.48Å; N201-S204 PolarHBondContact O-N 3.46Å; S204-Q206 PolarHBondContact O-N 3.39Å; S204-L207 WeakPolarHBondContact O-CB 3.37Å; S204-L207 PolarHBondContact O-N 3.03Å; S204-E208 PolarHBondContact O-N 2.91Å
205H85.5Confident86.2Confident124 Ų124103.7 Ų103.757%0.57453%0.525SS*.Hα-helixtrans-64.4-35.3175.1-111.717.3000113.3N201 E208 N209N201-H205 PolarHBondContact O-N 3.42Å; N201-H205 VanDerWaalsContact O-N 3.09Å; H205-E208 IonicContact CE1-OE2 3.37Å; H205-E208 IonicContact ND1-OE2 3.24Å; H205-E208 PolarHBondContact ND1-OE2 3.47Å; H205-E208 VanDerWaalsContact ND1-OE2 3.14Å; H205-N209 PolarHBondContact O-N 2.73Å; H205-N209 VanDerWaalsContact O-N 3.14Å; H205-N209 PolarHBondContact O-ND2 3.25Å
206Q84.8Confident86Confident142 Ų142101.6 Ų101.666%0.66452%0.518SS*.Hα-helixtrans-67-38172.8-77.9-174.7-16.100112.1A202 R203 S204 N209 C210A202-Q206 WeakPolarHBondContact O-CG 3.39Å; A202-Q206 PolarHBondContact O-N 3.06Å; R203-Q206 PolarHBondContact O-N 3.29Å; S204-Q206 PolarHBondContact O-N 3.39Å; Q206-N209 PolarHBondContact O-N 3.31Å; Q206-C210 PolarHBondContact O-N 3.17Å; Q206-C210 PolarHBondContact O-SG 3.43Å; Q206-C210 VanDerWaalsContact O-SG 3.41Å
207L85.6Confident85.8Confident95 Ų95101.9 Ų101.950%0.49752%0.519SS..Hα-helixtrans-64.1-47.4177.1-153.577.8000111.3R203 S204 N209 C210 E211R203-L207 PolarHBondContact O-N 2.84Å; S204-L207 WeakPolarHBondContact O-CB 3.37Å; S204-L207 PolarHBondContact O-N 3.03Å; L207-N209 VanDerWaalsContact C-N 3.35Å; L207-N209 PolarHBondContact O-N 3.37Å; L207-C210 CarbonylContact O-C 3.54Å; L207-C210 WeakPolarHBondContact O-CA 3.5Å; L207-C210 WeakPolarHBondContact O-CB 3.48Å; L207-C210 PolarHBondContact O-N 3.23Å; L207-E211 WeakPolarHBondContact O-CG 3.4Å; L207-E211 PolarHBondContact O-N 3.06Å
208E86Confident85.7Confident108 Ų10899.9 Ų99.951%0.50552%0.517SS..Hα-helixtrans-56.5-45.3175.7-175177-161.300111.8S204 H205 C210 E211 M212S204-E208 PolarHBondContact O-N 2.91Å; H205-E208 IonicContact CE1-OE2 3.37Å; H205-E208 IonicContact ND1-OE2 3.24Å; H205-E208 PolarHBondContact ND1-OE2 3.47Å; H205-E208 VanDerWaalsContact ND1-OE2 3.14Å; E208-C210 VanDerWaalsContact C-N 3.31Å; E208-C210 PolarHBondContact O-N 3.21Å; E208-E211 PolarHBondContact O-N 3.29Å; E208-M212 WeakPolarHBondContact O-CG 3.25Å; E208-M212 PolarHBondContact O-N 3.42Å
209N83.4Confident85.5Confident108 Ų108100.9 Ų100.958%0.57852%0.516SS*.Hα-helixtrans-62.9-35.3174.6-77.9-61.2000113H205 Q206 L207 L213H205-N209 PolarHBondContact O-N 2.73Å; H205-N209 VanDerWaalsContact O-N 3.14Å; H205-N209 PolarHBondContact O-ND2 3.25Å; Q206-N209 PolarHBondContact O-N 3.31Å; L207-N209 VanDerWaalsContact C-N 3.35Å; L207-N209 PolarHBondContact O-N 3.37Å; N209-L213 PolarHBondContact O-N 3.47Å
210C80.6Confident85.4Confident82 Ų8297.6 Ų97.655%0.55451%0.511SS*.Hα-helixtrans-71.1-32.2173.9-73.80000113Q206 L207 E208 L213 P214Q206-C210 PolarHBondContact O-N 3.17Å; Q206-C210 PolarHBondContact O-SG 3.43Å; Q206-C210 VanDerWaalsContact O-SG 3.41Å; L207-C210 CarbonylContact O-C 3.54Å; L207-C210 WeakPolarHBondContact O-CA 3.5Å; L207-C210 WeakPolarHBondContact O-CB 3.48Å; L207-C210 PolarHBondContact O-N 3.23Å; E208-C210 VanDerWaalsContact C-N 3.31Å; E208-C210 PolarHBondContact O-N 3.21Å; C210-L213 WeakPolarHBondContact O-CB 3.45Å; C210-P214 WeakPolarHBondContact O-CD 3.34Å
211E82Confident85.4Confident136 Ų13699.8 Ų99.864%0.63652%0.519SS*.Hα-helixtrans-73.9-28.6176.3-72.1176.4175.700112.6L207 E208 P214L207-E211 WeakPolarHBondContact O-CG 3.4Å; L207-E211 PolarHBondContact O-N 3.06Å; E208-E211 PolarHBondContact O-N 3.29Å; E211-P214 WeakPolarHBondContact O-CD 3.41Å
212M85.4Confident85.2Confident96 Ų9698 Ų9847%0.47352%0.515SS..SBendtrans-83.1-10.5175.1-64.5-60.4-66.700114.2E208 E215 S216E208-M212 WeakPolarHBondContact O-CG 3.25Å; E208-M212 PolarHBondContact O-N 3.42Å; M212-E215 PolarHBondContact O-N 3.09Å; M212-S216 PolarHBondContact O-N 2.95Å; M212-S216 PolarHBondContact O-OG 3.28Å
213L81.2Confident85.3Confident85 Ų85101.5 Ų101.545%0.44552%0.522SS..Hα-helixtrans-64.1-42.9-178.8-116.7161.3000113.7N209 C210 E215 S216 I217N209-L213 PolarHBondContact O-N 3.47Å; C210-L213 WeakPolarHBondContact O-CB 3.45Å; L213-E215 PolarHBondContact O-N 2.73Å; L213-S216 WeakPolarHBondContact CA-OG 3.42Å; L213-S216 PolarHBondContact O-N 3.09Å; L213-S216 PolarHBondContact O-OG 2.97Å; L213-I217 HydrophobicContact CD2-CD1 3.82Å; L213-I217 HydrophobicContact CD2-CG1 4.17Å; L213-I217 WeakPolarHBondContact O-CB 3.39Å; L213-I217 VanDerWaalsContact O-CG1 3.31Å; L213-I217 WeakPolarHBondContact O-CG1 3.41Å; L213-I217 PolarHBondContact O-N 2.82Å
214P84.7Confident85.3Confident85 Ų85101.1 Ų101.155%0.55253%0.528SS*.Hα-helixtrans-58.7-40.9174.1-26.636000113.9C210 E211 S218C210-P214 WeakPolarHBondContact O-CD 3.34Å; E211-P214 WeakPolarHBondContact O-CD 3.41Å; P214-S218 VanDerWaalsContact O-CB 3.31Å; P214-S218 WeakPolarHBondContact O-CB 3.46Å; P214-S218 PolarHBondContact O-N 3.29Å
215E83.1Confident85.3Confident104 Ų104102 Ų10249%0.48653%0.527SS..Hα-helixtrans-69.1-38.7177.7-69-160.5157.800112.7M212 L213 S218 R219M212-E215 PolarHBondContact O-N 3.09Å; L213-E215 PolarHBondContact O-N 2.73Å; E215-S218 PolarHBondContact O-N 3.36Å; E215-R219 VanDerWaalsContact CB-NH2 3.32Å; E215-R219 PolarHBondContact O-N 3.32Å; E215-R219 IonicContact OE2-CZ 3.14Å; E215-R219 IonicContact OE2-NH2 3.66Å; E215-R219 PolarHBondContact OE2-NH2 3.42Å
216S83.3Confident85.5Confident52 Ų5299.1 Ų99.136%0.36452%0.522SS..Hα-helixtrans-68.8-40.9178.153.30000111.2M212 L213 S218 R219 V220M212-S216 PolarHBondContact O-N 2.95Å; M212-S216 PolarHBondContact O-OG 3.28Å; L213-S216 WeakPolarHBondContact CA-OG 3.42Å; L213-S216 PolarHBondContact O-N 3.09Å; L213-S216 PolarHBondContact O-OG 2.97Å; S216-S218 PolarHBondContact O-N 2.99Å; S216-R219 PolarHBondContact O-N 2.89Å; S216-V220 WeakPolarHBondContact O-CG2 3.26Å; S216-V220 PolarHBondContact O-N 3.36Å
217I84.3Confident85.7Confident105 Ų10597.2 Ų97.254%0.53852%0.515SS..Hα-helixtrans-59.5-45.2170.1-69.9168.2000111.2L213 R219 V220 K221L213-I217 HydrophobicContact CD2-CD1 3.82Å; L213-I217 HydrophobicContact CD2-CG1 4.17Å; L213-I217 WeakPolarHBondContact O-CB 3.39Å; L213-I217 VanDerWaalsContact O-CG1 3.31Å; L213-I217 WeakPolarHBondContact O-CG1 3.41Å; L213-I217 PolarHBondContact O-N 2.82Å; I217-R219 PolarHBondContact O-N 3.44Å; I217-V220 PolarHBondContact O-N 3.46Å; I217-K221 WeakPolarHBondContact O-CB 3.5Å; I217-K221 PolarHBondContact O-N 3.08Å
218S87.4Confident85.8Confident69 Ų6998.1 Ų98.148%0.48352%0.517SS..Hα-helixtrans-63.1-41.4179.5-163.80000112.3P214 E215 S216 K221 C222P214-S218 VanDerWaalsContact O-CB 3.31Å; P214-S218 WeakPolarHBondContact O-CB 3.46Å; P214-S218 PolarHBondContact O-N 3.29Å; E215-S218 PolarHBondContact O-N 3.36Å; S216-S218 PolarHBondContact O-N 2.99Å; S218-K221 PolarHBondContact O-N 3Å; S218-C222 PolarHBondContact O-N 3.11Å; S218-C222 PolarHBondContact O-SG 2.84Å
219R86.2Confident85.9Confident140 Ų14095.7 Ų95.753%0.52851%0.512SS..Hα-helixtrans-58.9-49.6172.5-95.3177.3-76.3-122.1-7.5112.5E215 S216 I217 K221 C222 Q223E215-R219 VanDerWaalsContact CB-NH2 3.32Å; E215-R219 PolarHBondContact O-N 3.32Å; E215-R219 IonicContact OE2-CZ 3.14Å; E215-R219 IonicContact OE2-NH2 3.66Å; E215-R219 PolarHBondContact OE2-NH2 3.42Å; S216-R219 PolarHBondContact O-N 2.89Å; I217-R219 PolarHBondContact O-N 3.44Å; R219-K221 VanDerWaalsContact C-N 3.26Å; R219-K221 PolarHBondContact O-N 3.43Å; R219-C222 PolarHBondContact O-N 3.44Å; R219-Q223 WeakPolarHBondContact O-CG 3.27Å; R219-Q223 PolarHBondContact O-N 3.13Å; R219-Q223 VanDerWaalsContact O-N 3.1Å
220V87Confident86.1Confident80 Ų8094.1 Ų94.149%0.48550%0.503SS..Hα-helixtrans-61.8-37.6178.51710000110.9S216 I217 Q223 L224S216-V220 WeakPolarHBondContact O-CG2 3.26Å; S216-V220 PolarHBondContact O-N 3.36Å; I217-V220 PolarHBondContact O-N 3.46Å; V220-Q223 PolarHBondContact O-N 2.84Å; V220-L224 HydrophobicContact CG1-CD1 4.32Å; V220-L224 PolarHBondContact O-N 3.35Å
221K88.4Confident86.3Confident131 Ų13195.4 Ų95.457%0.5750%0.502SS*.Hα-helixtrans-65-48.5177.2-164.8176.3-178.9-175.50112.2I217 S218 R219 Q223 L224 D225I217-K221 WeakPolarHBondContact O-CB 3.5Å; I217-K221 PolarHBondContact O-N 3.08Å; S218-K221 PolarHBondContact O-N 3Å; R219-K221 VanDerWaalsContact C-N 3.26Å; R219-K221 PolarHBondContact O-N 3.43Å; K221-Q223 PolarHBondContact O-N 3.22Å; K221-L224 WeakPolarHBondContact O-CA 3.27Å; K221-L224 WeakPolarHBondContact O-CB 3.45Å; K221-L224 PolarHBondContact O-N 3.47Å; K221-D225 PolarHBondContact O-N 3.07Å
222C86.9Confident86.6Confident78 Ų7894.8 Ų94.853%0.52750%0.499SS..Hα-helixtrans-60-32.6175.2-67.80000113.1S218 R219 S226S218-C222 PolarHBondContact O-N 3.11Å; S218-C222 PolarHBondContact O-SG 2.84Å; R219-C222 PolarHBondContact O-N 3.44Å; C222-S226 PolarHBondContact O-N 2.88Å; C222-S226 VanDerWaalsContact O-N 3.1Å
223Q89.2Confident86.7Confident129 Ų12997.7 Ų97.760%0.60351%0.505SS*.Hα-helixtrans-68.5-40.3173.3-72178.8-44.300112.1R219 V220 K221 S226 I227R219-Q223 WeakPolarHBondContact O-CG 3.27Å; R219-Q223 PolarHBondContact O-N 3.13Å; R219-Q223 VanDerWaalsContact O-N 3.1Å; V220-Q223 PolarHBondContact O-N 2.84Å; K221-Q223 PolarHBondContact O-N 3.22Å; Q223-S226 PolarHBondContact O-N 3.49Å; Q223-I227 VanDerWaalsContact O-CG1 3.31Å; Q223-I227 WeakPolarHBondContact O-CG1 3.41Å; Q223-I227 PolarHBondContact O-N 2.89Å
224L88.3Confident86.7Confident109 Ų10999.2 Ų99.257%0.57151%0.513SS*.Hα-helixtrans-62.2-47.9173.1-103.6151.2000111.9V220 K221 S226 I227 E228V220-L224 HydrophobicContact CG1-CD1 4.32Å; V220-L224 PolarHBondContact O-N 3.35Å; K221-L224 WeakPolarHBondContact O-CA 3.27Å; K221-L224 WeakPolarHBondContact O-CB 3.45Å; K221-L224 PolarHBondContact O-N 3.47Å; L224-S226 VanDerWaalsContact C-N 3.26Å; L224-S226 PolarHBondContact O-N 2.9Å; L224-I227 PolarHBondContact O-N 3.29Å; L224-I227 VanDerWaalsContact O-N 3.13Å; L224-E228 PolarHBondContact O-N 3.33Å
225D88.7Confident86.7Confident83 Ų83101.4 Ų101.444%0.44451%0.514SS..Hα-helixtrans-59.7-37.1178.1-58.6-21.8000111.3K221 S229K221-D225 PolarHBondContact O-N 3.07Å; D225-S229 PolarHBondContact O-N 2.97Å; D225-S229 VanDerWaalsContact O-N 3.12Å
226S89.9Confident86.8Confident65 Ų65103.1 Ų103.146%0.45552%0.522SS..Hα-helixtrans-65.6-46.3173.8-168.20000112.3C222 Q223 L224 E228 S229 D230C222-S226 PolarHBondContact O-N 2.88Å; C222-S226 VanDerWaalsContact O-N 3.1Å; Q223-S226 PolarHBondContact O-N 3.49Å; L224-S226 VanDerWaalsContact C-N 3.26Å; L224-S226 PolarHBondContact O-N 2.9Å; S226-E228 VanDerWaalsContact C-N 3.32Å; S226-E228 PolarHBondContact O-N 3.28Å; S226-S229 WeakPolarHBondContact O-CB 3.38Å; S226-S229 PolarHBondContact O-N 3.02Å; S226-D230 PolarHBondContact O-N 3.06Å
227I87.5Confident86.7Confident101 Ų101103 Ų10352%0.51852%0.524SS..Hα-helixtrans-63.5-39.8179.1-69165.5000110.7Q223 L224 D230 M231Q223-I227 VanDerWaalsContact O-CG1 3.31Å; Q223-I227 WeakPolarHBondContact O-CG1 3.41Å; Q223-I227 PolarHBondContact O-N 2.89Å; L224-I227 PolarHBondContact O-N 3.29Å; L224-I227 VanDerWaalsContact O-N 3.13Å; I227-D230 PolarHBondContact O-N 2.98Å; I227-M231 HydrophobicContact CG2-CG 4.46Å; I227-M231 WeakPolarHBondContact O-CG 3.43Å; I227-M231 PolarHBondContact O-N 3.43Å
228E87.6Confident86.5Confident115 Ų115104.5 Ų104.554%0.53753%0.527SS..Hα-helixtrans-62-43.6175.6-174.3169.6-16600111.6L224 S226 D230 M231 H232L224-E228 PolarHBondContact O-N 3.33Å; S226-E228 VanDerWaalsContact C-N 3.32Å; S226-E228 PolarHBondContact O-N 3.28Å; E228-D230 PolarHBondContact O-N 3.44Å; E228-M231 PolarHBondContact O-N 2.98Å; E228-H232 PolarHBondContact O-N 2.65Å
229S88.6Confident86.3Confident57 Ų57105.6 Ų105.640%0.39953%0.527SS..Hα-helixtrans-61-41.9174.9-170.10000112.9D225 S226 H232 R233D225-S229 PolarHBondContact O-N 2.97Å; D225-S229 VanDerWaalsContact O-N 3.12Å; S226-S229 WeakPolarHBondContact O-CB 3.38Å; S226-S229 PolarHBondContact O-N 3.02Å; S229-H232 PolarHBondContact O-N 2.96Å; S229-R233 PolarHBondContact O-N 3.06Å; S229-R233 VanDerWaalsContact O-N 3.13Å
230D86.9Confident86Confident75 Ų75105.3 Ų105.340%0.40153%0.532SS..Hα-helixtrans-70.5-37.1178-70.1-32.8000112S226 I227 E228 H232 R233 L234S226-D230 PolarHBondContact O-N 3.06Å; I227-D230 PolarHBondContact O-N 2.98Å; E228-D230 PolarHBondContact O-N 3.44Å; D230-H232 VanDerWaalsContact C-N 3.35Å; D230-H232 PolarHBondContact O-N 2.73Å; D230-R233 PolarHBondContact O-N 2.89Å; D230-R233 IonicContact OD1-NH1 3.58Å; D230-L234 WeakPolarHBondContact O-CB 3.49Å; D230-L234 PolarHBondContact O-N 3.29Å
231M86.2Confident85.5Confident108 Ų108106.2 Ų106.253%0.53253%0.533SS..Hα-helixtrans-63.1-38.4172.2-73.1-16482.500112.4I227 E228 L234 F235I227-M231 HydrophobicContact CG2-CG 4.46Å; I227-M231 WeakPolarHBondContact O-CG 3.43Å; I227-M231 PolarHBondContact O-N 3.43Å; E228-M231 PolarHBondContact O-N 2.98Å; M231-L234 PolarHBondContact O-N 3.35Å; M231-F235 PolarHBondContact O-N 3.48Å
232H88.4Confident85.1Confident123 Ų123102.9 Ų102.957%0.56952%0.524SS*.Hα-helixtrans-63.1-45.2174.2-80.76.9000112.3E228 S229 D230 L234 F235 E236E228-H232 PolarHBondContact O-N 2.65Å; S229-H232 PolarHBondContact O-N 2.96Å; D230-H232 VanDerWaalsContact C-N 3.35Å; D230-H232 PolarHBondContact O-N 2.73Å; H232-L234 VanDerWaalsContact C-N 3.32Å; H232-L234 PolarHBondContact O-N 3.22Å; H232-F235 PolarHBondContact O-N 2.92Å; H232-E236 PolarHBondContact O-N 3.47Å
233R86Confident84.8Confident158 Ų158103.6 Ų103.660%0.59652%0.522SS*.Hα-helixtrans-60.4-41.1174.1-72.7176.2175.7160.1-2112.5S229 D230 F235 E236 A237S229-R233 PolarHBondContact O-N 3.06Å; S229-R233 VanDerWaalsContact O-N 3.13Å; D230-R233 PolarHBondContact O-N 2.89Å; D230-R233 IonicContact OD1-NH1 3.58Å; R233-F235 VanDerWaalsContact C-N 3.33Å; R233-F235 PolarHBondContact O-N 3.12Å; R233-E236 PolarHBondContact O-N 2.98Å; R233-A237 WeakPolarHBondContact O-CB 3.14Å; R233-A237 PolarHBondContact O-N 2.97Å
234L81.9Confident84.2Confident117 Ų117106.3 Ų106.361%0.61353%0.527SS*.Hα-helixtrans-60.7-42.8175.5-109.8161.9000111.5D230 M231 H232 A237 F238D230-L234 WeakPolarHBondContact O-CB 3.49Å; D230-L234 PolarHBondContact O-N 3.29Å; M231-L234 PolarHBondContact O-N 3.35Å; H232-L234 VanDerWaalsContact C-N 3.32Å; H232-L234 PolarHBondContact O-N 3.22Å; L234-A237 PolarHBondContact O-N 3.42Å; L234-F238 WeakPolarHBondContact O-CB 3.3Å; L234-F238 PolarHBondContact O-N 2.99Å
235F85Confident83.5Confident130 Ų130105.7 Ų105.757%0.5752%0.524SS*.Hα-helixtrans-65.3-41.9175.7-101.6-77.1000113.2M231 H232 R233 F238 N239M231-F235 PolarHBondContact O-N 3.48Å; H232-F235 PolarHBondContact O-N 2.92Å; R233-F235 VanDerWaalsContact C-N 3.33Å; R233-F235 PolarHBondContact O-N 3.12Å; F235-F238 PolarHBondContact O-N 3.13Å; F235-N239 WeakPolarHBondContact O-CB 3.26Å; F235-N239 VanDerWaalsContact O-CG 3.3Å; F235-N239 PolarHBondContact O-N 3.25Å; F235-N239 PolarHBondContact O-ND2 2.98Å
236E85.9Confident82.9Confident140 Ų140106.5 Ų106.565%0.65453%0.527SS*.Hα-helixtrans-61-46.1174.3-73.6-174144.700111.7H232 R233 F238 N239 H240H232-E236 PolarHBondContact O-N 3.47Å; R233-E236 PolarHBondContact O-N 2.98Å; E236-F238 VanDerWaalsContact C-N 3.33Å; E236-F238 PolarHBondContact O-N 3.39Å; E236-N239 PolarHBondContact O-N 3.36Å; E236-H240 PolarHBondContact O-N 3.04Å
237A80.4Confident82.2Confident51 Ų51106.7 Ų106.742%0.42153%0.526SS..Hα-helixtrans-61.1-41.4175.800000112.1R233 L234 H240 I241R233-A237 WeakPolarHBondContact O-CB 3.14Å; R233-A237 PolarHBondContact O-N 2.97Å; L234-A237 PolarHBondContact O-N 3.42Å; A237-H240 PolarHBondContact O-N 3.22Å; A237-I241 WeakPolarHBondContact O-CG1 3.31Å; A237-I241 PolarHBondContact O-N 3.02Å
238F79.9Confident81.4Confident135 Ų135107 Ų10759%0.59253%0.528SS*.Hα-helixtrans-64.7-44.4178.1-145.5-82.5000111.9L234 F235 E236 H240 I241 V242L234-F238 WeakPolarHBondContact O-CB 3.3Å; L234-F238 PolarHBondContact O-N 2.99Å; F235-F238 PolarHBondContact O-N 3.13Å; E236-F238 VanDerWaalsContact C-N 3.33Å; E236-F238 PolarHBondContact O-N 3.39Å; F238-H240 VanDerWaalsContact C-N 3.32Å; F238-H240 PolarHBondContact O-N 2.94Å; F238-I241 PolarHBondContact O-N 3.18Å; F238-V242 HydrophobicContact CD1-CG2 4.17Å; F238-V242 HydrophobicContact CE1-CG2 4.42Å; F238-V242 WeakPolarHBondContact O-CG2 3.21Å; F238-V242 PolarHBondContact O-N 3.1Å
239N83.1Confident80.7Confident92 Ų92107.7 Ų107.749%0.49253%0.531SS..Hα-helixtrans-60-42.8174.1-71.8-25.1000111.2F235 E236 I241 V242 D243F235-N239 WeakPolarHBondContact O-CB 3.26Å; F235-N239 VanDerWaalsContact O-CG 3.3Å; F235-N239 PolarHBondContact O-N 3.25Å; F235-N239 PolarHBondContact O-ND2 2.98Å; E236-N239 PolarHBondContact O-N 3.36Å; N239-I241 VanDerWaalsContact C-N 3.29Å; N239-I241 PolarHBondContact O-N 3.32Å; N239-V242 WeakPolarHBondContact O-CB 3.5Å; N239-V242 PolarHBondContact O-N 2.9Å; N239-V242 VanDerWaalsContact O-N 3.12Å; N239-D243 PolarHBondContact O-N 2.78Å
240H79.9Confident80Confident134 Ų134107.9 Ų107.962%0.6253%0.532SS*.Hα-helixtrans-62.2-33.7176.5-117.1-33.9000113.5E236 A237 F238 R244E236-H240 PolarHBondContact O-N 3.04Å; A237-H240 PolarHBondContact O-N 3.22Å; F238-H240 VanDerWaalsContact C-N 3.32Å; F238-H240 PolarHBondContact O-N 2.94Å; H240-R244 WeakPolarHBondContact O-CG 3.1Å; H240-R244 PolarHBondContact O-N 3.01Å
241I77.7Confident79.3Confident100 Ų100110.8 Ų110.851%0.51354%0.539SS..Hα-helixtrans-70.3-42.2173.3-69163.1000110.6A237 F238 N239 R244 N245A237-I241 WeakPolarHBondContact O-CG1 3.31Å; A237-I241 PolarHBondContact O-N 3.02Å; F238-I241 PolarHBondContact O-N 3.18Å; N239-I241 VanDerWaalsContact C-N 3.29Å; N239-I241 PolarHBondContact O-N 3.32Å; I241-R244 PolarHBondContact O-N 2.8Å; I241-N245 PolarHBondContact O-N 3.06Å
242V79.6Confident78.6Confident61 Ų61111.6 Ų111.637%0.3754%0.541SS..Hα-helixtrans-60-46.8176.11710000111F238 N239 R244 N245 I246F238-V242 HydrophobicContact CD1-CG2 4.17Å; F238-V242 HydrophobicContact CE1-CG2 4.42Å; F238-V242 WeakPolarHBondContact O-CG2 3.21Å; F238-V242 PolarHBondContact O-N 3.1Å; N239-V242 WeakPolarHBondContact O-CB 3.5Å; N239-V242 PolarHBondContact O-N 2.9Å; N239-V242 VanDerWaalsContact O-N 3.12Å; V242-R244 VanDerWaalsContact C-N 3.33Å; V242-R244 PolarHBondContact O-N 2.65Å; V242-N245 WeakPolarHBondContact O-CB 3.11Å; V242-N245 PolarHBondContact O-N 3.36Å; V242-N245 VanDerWaalsContact O-N 3.08Å; V242-I246 HydrophobicContact CG1-CD1 3.98Å; V242-I246 WeakPolarHBondContact O-CG1 3.28Å; V242-I246 PolarHBondContact O-N 3.02Å
243D80.2Confident77.8Confident92 Ų92109.8 Ų109.849%0.49254%0.541SS..Hα-helixtrans-60.7-40.2176.9-73.9-21.2000112.3N239 N245 I246 T247N239-D243 PolarHBondContact O-N 2.78Å; D243-N245 VanDerWaalsContact C-N 3.35Å; D243-I246 PolarHBondContact O-N 3.2Å; D243-T247 WeakPolarHBondContact O-CB 3.25Å; D243-T247 PolarHBondContact O-N 3.31Å; D243-T247 PolarHBondContact O-OG1 3.5Å
244R76.2Confident77.1Confident187 Ų187105.9 Ų105.971%0.70653%0.532SS*.Hα-helixtrans-65.3-36.2173.5-75.3-179.274.21470.2112.4H240 I241 V242 T247 L248H240-R244 WeakPolarHBondContact O-CG 3.1Å; H240-R244 PolarHBondContact O-N 3.01Å; I241-R244 PolarHBondContact O-N 2.8Å; V242-R244 VanDerWaalsContact C-N 3.33Å; V242-R244 PolarHBondContact O-N 2.65Å; R244-T247 WeakPolarHBondContact O-CB 3.41Å; R244-T247 PolarHBondContact O-N 3.06Å; R244-L248 WeakPolarHBondContact O-CG 3.5Å; R244-L248 PolarHBondContact O-N 3.19Å
245N74.2Confident76.5Confident95 Ų95104.9 Ų104.951%0.50853%0.527SS..Hα-helixtrans-68-41.9175.4-102.1-24000112.4I241 V242 D243 T247 L248 Q249I241-N245 PolarHBondContact O-N 3.06Å; V242-N245 WeakPolarHBondContact O-CB 3.11Å; V242-N245 PolarHBondContact O-N 3.36Å; V242-N245 VanDerWaalsContact O-N 3.08Å; D243-N245 VanDerWaalsContact C-N 3.35Å; N245-T247 VanDerWaalsContact C-N 3.27Å; N245-T247 PolarHBondContact O-N 3.17Å; N245-L248 PolarHBondContact O-N 2.94Å; N245-L248 VanDerWaalsContact O-N 3.16Å; N245-Q249 PolarHBondContact O-N 3.33Å
246I76.3Confident76Confident100 Ų100104.4 Ų104.451%0.51353%0.527SS..Hα-helixtrans-59.7-41.7172.6-66.4167.2000110.1V242 D243 L248 Q249 S250V242-I246 HydrophobicContact CG1-CD1 3.98Å; V242-I246 WeakPolarHBondContact O-CG1 3.28Å; V242-I246 PolarHBondContact O-N 3.02Å; D243-I246 PolarHBondContact O-N 3.2Å; I246-L248 PolarHBondContact O-N 3.01Å; I246-Q249 PolarHBondContact O-N 3.32Å; I246-S250 PolarHBondContact O-N 2.85Å
247T74.5Confident75.5Confident70 Ų70101.2 Ų101.243%0.42952%0.519SS..Hα-helixtrans-63.3-41.2175.5-50.40000111.5D243 R244 N245 S250 Y251D243-T247 WeakPolarHBondContact O-CB 3.25Å; D243-T247 PolarHBondContact O-N 3.31Å; D243-T247 PolarHBondContact O-OG1 3.5Å; R244-T247 WeakPolarHBondContact O-CB 3.41Å; R244-T247 PolarHBondContact O-N 3.06Å; N245-T247 VanDerWaalsContact C-N 3.27Å; N245-T247 PolarHBondContact O-N 3.17Å; T247-S250 PolarHBondContact O-N 2.88Å; T247-S250 PolarHBondContact O-OG 3.03Å; T247-Y251 HydrophobicContact CG2-CE2 4.06Å; T247-Y251 WeakPolarHBondContact O-CD2 3.34Å
248L71.1Confident75.2Confident106 Ų106105.1 Ų105.156%0.55553%0.529SS*.Hα-helixtrans-63.5-40.3176-78.5164.5000112.6R244 N245 I246 S250 Y251 E252R244-L248 WeakPolarHBondContact O-CG 3.5Å; R244-L248 PolarHBondContact O-N 3.19Å; N245-L248 PolarHBondContact O-N 2.94Å; N245-L248 VanDerWaalsContact O-N 3.16Å; I246-L248 PolarHBondContact O-N 3.01Å; L248-S250 VanDerWaalsContact C-N 3.26Å; L248-S250 PolarHBondContact O-N 2.99Å; L248-Y251 PolarHBondContact O-N 2.88Å; L248-E252 PolarHBondContact O-N 3.19Å; L248-E252 VanDerWaalsContact O-N 3.13Å
249Q72.4Confident74.8Confident130 Ų130103.1 Ų103.161%0.60752%0.524SS*.Hα-helixtrans-60.2-32.3173.8-83.4-175.4-3700113.2N245 I246 Y251 E252 C253N245-Q249 PolarHBondContact O-N 3.33Å; I246-Q249 PolarHBondContact O-N 3.32Å; Q249-Y251 VanDerWaalsContact C-N 3.3Å; Q249-Y251 PolarHBondContact O-N 3.43Å; Q249-E252 PolarHBondContact O-N 2.95Å; Q249-C253 PolarHBondContact O-N 2.92Å
250S74.6Confident74.6Confident61 Ų61103.4 Ų103.443%0.42752%0.521SS..Hα-helixtrans-65.5-31.8173.974.80000113.3I246 T247 L248 C253 L254I246-S250 PolarHBondContact O-N 2.85Å; T247-S250 PolarHBondContact O-N 2.88Å; T247-S250 PolarHBondContact O-OG 3.03Å; L248-S250 VanDerWaalsContact C-N 3.26Å; L248-S250 PolarHBondContact O-N 2.99Å; S250-C253 WeakPolarHBondContact O-CB 3.46Å; S250-C253 PolarHBondContact O-N 2.7Å; S250-L254 PolarHBondContact O-N 3.23Å
251Y71.6Confident74.6Confident137 Ų13799.9 Ų99.954%0.53751%0.51SS..Hα-helixtrans-75.2-32.7174.3-65.4-59.5000112.4T247 L248 Q249 C253 L254 L255T247-Y251 HydrophobicContact CG2-CE2 4.06Å; T247-Y251 WeakPolarHBondContact O-CD2 3.34Å; L248-Y251 PolarHBondContact O-N 2.88Å; Q249-Y251 VanDerWaalsContact C-N 3.3Å; Q249-Y251 PolarHBondContact O-N 3.43Å; Y251-C253 VanDerWaalsContact C-N 3.27Å; Y251-C253 PolarHBondContact O-N 3.17Å; Y251-L254 HydrophobicContact CD1-CD1 4.08Å; Y251-L254 PolarHBondContact O-N 2.94Å; Y251-L255 WeakPolarHBondContact O-CG 3.49Å; Y251-L255 PolarHBondContact O-N 3.11Å
252E72.1Confident74.5Confident124 Ų12497.8 Ų97.858%0.57951%0.507SS*.Hα-helixtrans-61.9-38.8171-164.1167.6-141.700111L248 Q249 L255 E256L248-E252 PolarHBondContact O-N 3.19Å; L248-E252 VanDerWaalsContact O-N 3.13Å; Q249-E252 PolarHBondContact O-N 2.95Å; E252-L255 WeakPolarHBondContact O-CB 3.48Å; E252-L255 PolarHBondContact O-N 2.86Å; E252-E256 PolarHBondContact O-N 2.96Å; E252-E256 VanDerWaalsContact O-N 3.12Å
253C71.2Confident74.4Confident85 Ų8599.5 Ų99.557%0.57451%0.513SS*.Hα-helixtrans-64.6-39.3173.5-153.50000112.8Q249 S250 Y251 E256 S257Q249-C253 PolarHBondContact O-N 2.92Å; S250-C253 WeakPolarHBondContact O-CB 3.46Å; S250-C253 PolarHBondContact O-N 2.7Å; Y251-C253 VanDerWaalsContact C-N 3.27Å; Y251-C253 PolarHBondContact O-N 3.17Å; C253-E256 PolarHBondContact O-N 2.78Å; C253-S257 VanDerWaalsContact O-CB 3.27Å; C253-S257 WeakPolarHBondContact O-CB 3.33Å; C253-S257 PolarHBondContact O-N 3.37Å; C253-S257 PolarHBondContact O-OG 3.09Å
254L70.4Confident74.5Confident77 Ų7799.3 Ų99.340%0.40351%0.512SS..Hα-helixtrans-64.5-39.3172.5-85.6160.6000112.7S250 Y251 E256 E258 L259S250-L254 PolarHBondContact O-N 3.23Å; Y251-L254 HydrophobicContact CD1-CD1 4.08Å; Y251-L254 PolarHBondContact O-N 2.94Å; L254-E256 PolarHBondContact O-N 3.17Å; L254-E258 HydrophobicContact CD2-CG 4.18Å; L254-E258 PolarHBondContact O-N 3.32Å; L254-L259 PolarHBondContact O-N 2.71Å
255L71.2Confident74.8Confident96 Ų9697 Ų9750%0.50351%0.509SS..Iπ-helixtrans-61.6-42176.5-77.3166.1000112.1Y251 E252 L259 K260Y251-L255 WeakPolarHBondContact O-CG 3.49Å; Y251-L255 PolarHBondContact O-N 3.11Å; E252-L255 WeakPolarHBondContact O-CB 3.48Å; E252-L255 PolarHBondContact O-N 2.86Å; L255-L259 HydrophobicContact CD2-CB 4.38Å; L255-L259 HydrophobicContact CD2-CD2 3.6Å; L255-K260 WeakPolarHBondContact O-CB 3.37Å; L255-K260 PolarHBondContact O-N 3.22Å
256E74.3Confident75Confident120 Ų12094.2 Ų94.256%0.56150%0.502SS*.Iπ-helixtrans-81.1-33.1178.4-72-148.1109.100114.6E252 C253 L254 K260 P261E252-E256 PolarHBondContact O-N 2.96Å; E252-E256 VanDerWaalsContact O-N 3.12Å; C253-E256 PolarHBondContact O-N 2.78Å; L254-E256 PolarHBondContact O-N 3.17Å; E256-K260 IonicContact OE1-NZ 3.44Å; E256-K260 PolarHBondContact OE1-NZ 3.36Å; E256-P261 WeakPolarHBondContact O-CD 3.39Å
257S74.8Confident75.3Confident72 Ų7295.8 Ų95.850%0.50350%0.503SS..Iπ-helixtrans-86.8-34.1-17659.70000114.5C253 P261C253-S257 VanDerWaalsContact O-CB 3.27Å; C253-S257 WeakPolarHBondContact O-CB 3.33Å; C253-S257 PolarHBondContact O-N 3.37Å; C253-S257 PolarHBondContact O-OG 3.09Å; S257-P261 WeakPolarHBondContact O-CG 3.16Å
258E74.1Confident75.8Confident133 Ų13396.2 Ų96.262%0.62151%0.505SS*.Iπ-helixtrans-110.2-53.1-178.1-63.5-167.6176.400112.5L254 A262L254-E258 HydrophobicContact CD2-CG 4.18Å; L254-E258 PolarHBondContact O-N 3.32Å; E258-A262 WeakPolarHBondContact O-CB 3.36Å; E258-A262 PolarHBondContact O-N 2.88Å
259L71.7Confident76.5Confident94 Ų9495.7 Ų95.749%0.49251%0.506SS..Iπ-helixtrans-70.1-41.7-170.5-161.876.5000112.3L254 L255 A262 M263L254-L259 PolarHBondContact O-N 2.71Å; L255-L259 HydrophobicContact CD2-CB 4.38Å; L255-L259 HydrophobicContact CD2-CD2 3.6Å; L259-A262 PolarHBondContact O-N 3.23Å; L259-M263 WeakPolarHBondContact O-CG 3.47Å; L259-M263 PolarHBondContact O-N 2.87Å
260K79Confident77.1Confident97 Ų9794.9 Ų94.942%0.42250%0.504SS..Hα-helixtrans-64.6-49.5-178.4-178178.7-175.1-1790112.6L255 E256 A262 M263 D264L255-K260 WeakPolarHBondContact O-CB 3.37Å; L255-K260 PolarHBondContact O-N 3.22Å; E256-K260 IonicContact OE1-NZ 3.44Å; E256-K260 PolarHBondContact OE1-NZ 3.36Å; K260-A262 VanDerWaalsContact C-N 3.29Å; K260-A262 PolarHBondContact O-N 3.25Å; K260-M263 PolarHBondContact O-N 3.41Å; K260-D264 PolarHBondContact O-N 3.45Å
261P79.7Confident77.7Confident60 Ų6097.1 Ų97.139%0.3951%0.511SS..Hα-helixtrans-59.7-34.8171.4-26.937000114.1E256 S257 D264 Q265E256-P261 WeakPolarHBondContact O-CD 3.39Å; S257-P261 WeakPolarHBondContact O-CG 3.16Å; P261-D264 PolarHBondContact O-N 3.05Å; P261-Q265 PolarHBondContact O-N 3.28Å
262A75.4Confident78.6Confident56 Ų5697 Ų9746%0.46351%0.513SS..Hα-helixtrans-67.2-40.3175.800000112.2E258 L259 K260 Q265 G266E258-A262 WeakPolarHBondContact O-CB 3.36Å; E258-A262 PolarHBondContact O-N 2.88Å; L259-A262 PolarHBondContact O-N 3.23Å; K260-A262 VanDerWaalsContact C-N 3.29Å; K260-A262 PolarHBondContact O-N 3.25Å; A262-Q265 PolarHBondContact O-N 3.46Å; A262-G266 PolarHBondContact O-N 2.95Å
263M77.8Confident79.2Confident97 Ų9796.2 Ų96.248%0.47851%0.512SS..Hα-helixtrans-65.2-43.1172-69-157-47.500112L259 K260 Q265 G266 Y267L259-M263 WeakPolarHBondContact O-CG 3.47Å; L259-M263 PolarHBondContact O-N 2.87Å; K260-M263 PolarHBondContact O-N 3.41Å; M263-Q265 VanDerWaalsContact C-N 3.31Å; M263-Q265 PolarHBondContact O-N 2.94Å; M263-G266 CarbonylContact O-C 3.53Å; M263-G266 WeakPolarHBondContact O-CA 3.39Å; M263-G266 PolarHBondContact O-N 3.1Å; M263-Y267 HydrophobicContact CB-CE2 4.41Å; M263-Y267 WeakPolarHBondContact O-CD2 3.21Å; M263-Y267 PolarHBondContact O-N 3.38Å
264D82.9Confident80.1Confident88 Ų8896.9 Ų96.947%0.47151%0.507SS..Hα-helixtrans-61.1-40177.8-68.8-23.1000111.2K260 P261 Y267 V268K260-D264 PolarHBondContact O-N 3.45Å; P261-D264 PolarHBondContact O-N 3.05Å; D264-Y267 PolarHBondContact O-N 3.06Å; D264-V268 WeakPolarHBondContact O-CG2 3.49Å; D264-V268 PolarHBondContact O-N 2.97Å; D264-V268 VanDerWaalsContact O-N 3.1Å
265Q80.8Confident81.1Confident140 Ų14096.8 Ų96.865%0.65451%0.512SS*.Hα-helixtrans-64.5-38.8169.4-78.3-176.7-10.400112.7P261 A262 M263 Y267 V268 V269P261-Q265 PolarHBondContact O-N 3.28Å; A262-Q265 PolarHBondContact O-N 3.46Å; M263-Q265 VanDerWaalsContact C-N 3.31Å; M263-Q265 PolarHBondContact O-N 2.94Å; Q265-Y267 VanDerWaalsContact C-N 3.34Å; Q265-Y267 PolarHBondContact O-N 3.36Å; Q265-V268 PolarHBondContact O-N 3.27Å; Q265-V269 WeakPolarHBondContact O-CG2 3.44Å; Q265-V269 PolarHBondContact O-N 3.26Å
266G79.7Confident82Confident35 Ų3596.2 Ų96.236%0.36152%0.516SS..Hα-helixtrans-57.4-43.4172.900000112.8A262 M263 V269 M270A262-G266 PolarHBondContact O-N 2.95Å; M263-G266 CarbonylContact O-C 3.53Å; M263-G266 WeakPolarHBondContact O-CA 3.39Å; M263-G266 PolarHBondContact O-N 3.1Å; G266-V269 PolarHBondContact O-N 2.75Å; G266-M270 PolarHBondContact O-N 3.46Å
267Y81.9Confident82.6Confident134 Ų13494.5 Ų94.553%0.52551%0.508SS..Hα-helixtrans-63.6-44.4174.2-71.8-62.2000112.1M263 D264 Q265 V269 M270 D271M263-Y267 HydrophobicContact CB-CE2 4.41Å; M263-Y267 WeakPolarHBondContact O-CD2 3.21Å; M263-Y267 PolarHBondContact O-N 3.38Å; D264-Y267 PolarHBondContact O-N 3.06Å; Q265-Y267 VanDerWaalsContact C-N 3.34Å; Q265-Y267 PolarHBondContact O-N 3.36Å; Y267-V269 PolarHBondContact O-N 3.37Å; Y267-M270 HydrophobicContact CD1-CE 4.26Å; Y267-M270 HydrophobicContact CE1-CE 4.42Å; Y267-M270 PolarHBondContact O-N 2.77Å; Y267-D271 PolarHBondContact O-N 2.91Å
268V86Confident83.3Confident79 Ų7996.8 Ų96.848%0.47951%0.508SS..Hα-helixtrans-61-32.2175172.40000112.4D264 Q265 K272D264-V268 WeakPolarHBondContact O-CG2 3.49Å; D264-V268 PolarHBondContact O-N 2.97Å; D264-V268 VanDerWaalsContact O-N 3.1Å; Q265-V268 PolarHBondContact O-N 3.27Å; V268-K272 WeakPolarHBondContact O-CG 3.48Å; V268-K272 PolarHBondContact O-N 2.9Å
269V84.6Confident84.2Confident95 Ų9595 Ų9558%0.57650%0.5SS*.Hα-helixtrans-72.4-39.1173.5172.40000111.4Q265 G266 Y267 K272 L273Q265-V269 WeakPolarHBondContact O-CG2 3.44Å; Q265-V269 PolarHBondContact O-N 3.26Å; G266-V269 PolarHBondContact O-N 2.75Å; Y267-V269 PolarHBondContact O-N 3.37Å; V269-K272 PolarHBondContact O-N 3.04Å; V269-L273 PolarHBondContact O-N 3.35Å
270M85.2Confident85Confident113 Ų11396.9 Ų96.956%0.55751%0.506SS*.Hα-helixtrans-64.2-42.5173.9-71.1-138.4-6000112.7G266 Y267 K272 L273 E274G266-M270 PolarHBondContact O-N 3.46Å; Y267-M270 HydrophobicContact CD1-CE 4.26Å; Y267-M270 HydrophobicContact CE1-CE 4.42Å; Y267-M270 PolarHBondContact O-N 2.77Å; M270-K272 VanDerWaalsContact C-N 3.27Å; M270-K272 PolarHBondContact O-N 3.36Å; M270-L273 WeakPolarHBondContact O-CB 3.37Å; M270-L273 PolarHBondContact O-N 3.35Å; M270-E274 PolarHBondContact O-N 3.11Å
271D88.1Confident85.5Confident107 Ų10798.7 Ų98.757%0.57251%0.514SS*.Hα-helixtrans-60.7-38.4176.2-71.7-10.9000111.6Y267 S275Y267-D271 PolarHBondContact O-N 2.91Å; D271-S275 WeakPolarHBondContact O-CB 3.42Å; D271-S275 PolarHBondContact O-N 3.39Å
272K89.1Confident86.1Confident135 Ų13598.1 Ų98.159%0.58751%0.512SS*.Hα-helixtrans-65.5-41.5172.5-75.6175.1-178.61770112.1V268 V269 M270 S275 C276V268-K272 WeakPolarHBondContact O-CG 3.48Å; V268-K272 PolarHBondContact O-N 2.9Å; V269-K272 PolarHBondContact O-N 3.04Å; M270-K272 VanDerWaalsContact C-N 3.27Å; M270-K272 PolarHBondContact O-N 3.36Å; K272-S275 WeakPolarHBondContact O-CB 3.4Å; K272-S275 PolarHBondContact O-N 3.07Å; K272-C276 PolarHBondContact O-N 3.26Å; K272-C276 PolarHBondContact O-SG 2.89Å; K272-C276 VanDerWaalsContact O-SG 3.39Å
273L85.9Confident86.9Confident107 Ų10798.8 Ų98.856%0.5651%0.507SS*.Hα-helixtrans-60.9-47.3176.5-170.176.4000111V269 M270 S275 C276 E277V269-L273 PolarHBondContact O-N 3.35Å; M270-L273 WeakPolarHBondContact O-CB 3.37Å; M270-L273 PolarHBondContact O-N 3.35Å; L273-S275 VanDerWaalsContact C-N 3.31Å; L273-S275 PolarHBondContact O-N 2.89Å; L273-C276 WeakPolarHBondContact O-CA 3.49Å; L273-C276 WeakPolarHBondContact O-CB 3.5Å; L273-C276 PolarHBondContact O-N 3.48Å; L273-C276 VanDerWaalsContact O-N 3.11Å; L273-E277 PolarHBondContact O-N 3.04Å
274E89.4Confident87.5Confident99 Ų9998.6 Ų98.646%0.46351%0.505SS..Hα-helixtrans-64.5-36.1179.2-152.7-151.8158.200111.9M270 E277 K278M270-E274 PolarHBondContact O-N 3.11Å; E274-E277 PolarHBondContact O-N 3.24Å; E274-K278 WeakPolarHBondContact O-CD 3.39Å; E274-K278 WeakPolarHBondContact O-CG 3.36Å; E274-K278 PolarHBondContact O-N 3.37Å; E274-K278 WeakPolarHBondContact OE1-CE 3.46Å; E274-K278 IonicContact OE1-NZ 3.94Å; E274-K278 PolarHBondContact OE1-NZ 3.19Å; E274-K278 IonicContact OE2-NZ 3.98Å; E274-K278 PolarHBondContact OE2-NZ 3.4Å
275S90.9Very high87.9Confident75 Ų7597.4 Ų97.452%0.52450%0.504SS..Hα-helixtrans-63.7-43.3171.2-171.10000112D271 K272 L273 K278 Q279D271-S275 WeakPolarHBondContact O-CB 3.42Å; D271-S275 PolarHBondContact O-N 3.39Å; K272-S275 WeakPolarHBondContact O-CB 3.4Å; K272-S275 PolarHBondContact O-N 3.07Å; L273-S275 VanDerWaalsContact C-N 3.31Å; L273-S275 PolarHBondContact O-N 2.89Å; S275-K278 PolarHBondContact O-N 3.41Å; S275-Q279 WeakPolarHBondContact O-CB 3.33Å; S275-Q279 PolarHBondContact O-N 2.95Å
276C89.8Confident88.4Confident84 Ų8496.1 Ų96.157%0.56850%0.496SS*.Hα-helixtrans-61.8-43.9174-75.60000112.3K272 L273 K278 Q279 E280K272-C276 PolarHBondContact O-N 3.26Å; K272-C276 PolarHBondContact O-SG 2.89Å; K272-C276 VanDerWaalsContact O-SG 3.39Å; L273-C276 WeakPolarHBondContact O-CA 3.49Å; L273-C276 WeakPolarHBondContact O-CB 3.5Å; L273-C276 PolarHBondContact O-N 3.48Å; L273-C276 VanDerWaalsContact O-N 3.11Å; C276-K278 VanDerWaalsContact C-N 3.34Å; C276-K278 PolarHBondContact O-N 2.79Å; C276-Q279 CarbonylContact O-C 3.58Å; C276-Q279 PolarHBondContact O-N 3.44Å; C276-E280 WeakPolarHBondContact O-CB 3.37Å; C276-E280 PolarHBondContact O-N 3.06Å
277E88.2Confident89Confident85 Ų8598.6 Ų98.640%0.39750%0.5SS..Hα-helixtrans-61.8-39.9175.3-73.4-167-170.400112.7L273 E274 Q279 E280 K281L273-E277 PolarHBondContact O-N 3.04Å; E274-E277 PolarHBondContact O-N 3.24Å; E277-Q279 VanDerWaalsContact C-N 3.33Å; E277-E280 PolarHBondContact O-N 2.82Å; E277-K281 WeakPolarHBondContact O-CG 3.13Å; E277-K281 PolarHBondContact O-N 2.8Å; E277-K281 IonicContact OE2-NZ 2.71Å; E277-K281 PolarHBondContact OE2-NZ 2.66Å
278K89.9Confident89.4Confident119 Ų11996.1 Ų96.152%0.51750%0.496SS..Hα-helixtrans-63.9-40.7175.2-75162.7178.1162.20110.8E274 S275 C276 S282E274-K278 WeakPolarHBondContact O-CD 3.39Å; E274-K278 WeakPolarHBondContact O-CG 3.36Å; E274-K278 PolarHBondContact O-N 3.37Å; E274-K278 WeakPolarHBondContact OE1-CE 3.46Å; E274-K278 IonicContact OE1-NZ 3.94Å; E274-K278 PolarHBondContact OE1-NZ 3.19Å; E274-K278 IonicContact OE2-NZ 3.98Å; E274-K278 PolarHBondContact OE2-NZ 3.4Å; S275-K278 PolarHBondContact O-N 3.41Å; C276-K278 VanDerWaalsContact C-N 3.34Å; C276-K278 PolarHBondContact O-N 2.79Å; K278-S282 WeakPolarHBondContact O-CB 3.37Å; K278-S282 PolarHBondContact O-N 2.94Å
279Q91.4Very high89.7Confident95 Ų9596.5 Ų96.544%0.44450%0.498SS..Hα-helixtrans-69-38175.8-17258.65700112.5S275 C276 E277 S282 N283S275-Q279 WeakPolarHBondContact O-CB 3.33Å; S275-Q279 PolarHBondContact O-N 2.95Å; C276-Q279 CarbonylContact O-C 3.58Å; C276-Q279 PolarHBondContact O-N 3.44Å; E277-Q279 VanDerWaalsContact C-N 3.33Å; Q279-S282 PolarHBondContact O-N 3.33Å; Q279-N283 PolarHBondContact NE2-OD1 3.46Å; Q279-N283 WeakPolarHBondContact O-CB 3.45Å; Q279-N283 VanDerWaalsContact O-CG 3.25Å; Q279-N283 PolarHBondContact O-N 3.01Å
280E88.9Confident90.1Very high134 Ų13497 Ų9763%0.62650%0.497SS*.Hα-helixtrans-60.5-51.2174.2-175.7-176.5-178.600110.6C276 E277 S282 N283 Q284C276-E280 WeakPolarHBondContact O-CB 3.37Å; C276-E280 PolarHBondContact O-N 3.06Å; E277-E280 PolarHBondContact O-N 2.82Å; E280-S282 VanDerWaalsContact C-N 3.27Å; E280-S282 PolarHBondContact O-N 2.98Å; E280-N283 CarbonylContact O-C 3.59Å; E280-N283 PolarHBondContact O-N 3.31Å; E280-Q284 PolarHBondContact O-N 3.29Å
281K90.9Very high90.4Very high136 Ų13694.5 Ų94.559%0.59149%0.489SS*.Hα-helixtrans-58.7-36.8175.5-71.7164.3-175.5154.40112.3E277 S285E277-K281 WeakPolarHBondContact O-CG 3.13Å; E277-K281 PolarHBondContact O-N 2.8Å; E277-K281 IonicContact OE2-NZ 2.71Å; E277-K281 PolarHBondContact OE2-NZ 2.66Å; K281-S285 PolarHBondContact O-N 3.36Å; K281-S285 PolarHBondContact O-OG 2.95Å
282S92.1Very high90.6Very high47 Ų4792.9 Ų92.933%0.32948%0.483SS..Hα-helixtrans-69.9-32.5173.9-175.80000113.5K278 Q279 E280 S285 K286K278-S282 WeakPolarHBondContact O-CB 3.37Å; K278-S282 PolarHBondContact O-N 2.94Å; Q279-S282 PolarHBondContact O-N 3.33Å; E280-S282 VanDerWaalsContact C-N 3.27Å; E280-S282 PolarHBondContact O-N 2.98Å; S282-S285 PolarHBondContact O-OG 3.18Å; S282-S285 VanDerWaalsContact O-OG 3.14Å; S282-K286 WeakPolarHBondContact O-CG 3.4Å; S282-K286 PolarHBondContact O-N 2.88Å
283N91.4Very high90.7Very high70 Ų7090 Ų9037%0.37447%0.473SS..Hα-helixtrans-77.6-38.3176.1-71.7-12.4000111.3Q279 E280 K286 I287Q279-N283 PolarHBondContact NE2-OD1 3.46Å; Q279-N283 WeakPolarHBondContact O-CB 3.45Å; Q279-N283 VanDerWaalsContact O-CG 3.25Å; Q279-N283 PolarHBondContact O-N 3.01Å; E280-N283 CarbonylContact O-C 3.59Å; E280-N283 PolarHBondContact O-N 3.31Å; N283-K286 WeakPolarHBondContact O-CB 3.5Å; N283-K286 PolarHBondContact O-N 2.71Å; N283-I287 WeakPolarHBondContact O-CG1 3.38Å; N283-I287 PolarHBondContact O-N 3.23Å
284Q91.5Very high91Very high93 Ų9390.5 Ų90.544%0.43548%0.476SS..Hα-helixtrans-60.2-46.1174.9-173.957.748.700111.2E280 K286 I287 D288E280-Q284 PolarHBondContact O-N 3.29Å; Q284-K286 VanDerWaalsContact C-N 3.29Å; Q284-K286 PolarHBondContact O-N 2.86Å; Q284-I287 CarbonylContact O-C 3.59Å; Q284-I287 WeakPolarHBondContact O-CA 3.46Å; Q284-I287 WeakPolarHBondContact O-CB 3.47Å; Q284-I287 PolarHBondContact O-N 3.14Å; Q284-D288 PolarHBondContact NE2-OD1 2.82Å; Q284-D288 PolarHBondContact O-N 3.06Å
285S89.4Confident91.1Very high63 Ų6394.2 Ų94.244%0.44149%0.486SS..Hα-helixtrans-63.7-32.5177.564.60000113.3K281 S282 D288 V289K281-S285 PolarHBondContact O-N 3.36Å; K281-S285 PolarHBondContact O-OG 2.95Å; S282-S285 PolarHBondContact O-OG 3.18Å; S282-S285 VanDerWaalsContact O-OG 3.14Å; S285-D288 PolarHBondContact O-N 2.91Å; S285-V289 WeakPolarHBondContact O-CG2 3.27Å; S285-V289 PolarHBondContact O-N 3.02Å; S285-V289 VanDerWaalsContact O-N 3.11Å
286K92.2Very high91.2Very high114 Ų11494.6 Ų94.650%0.49648%0.482SS..Hα-helixtrans-66.9-39.6170-68.6169-169.61670112.3S282 N283 Q284 D288 V289 L290S282-K286 WeakPolarHBondContact O-CG 3.4Å; S282-K286 PolarHBondContact O-N 2.88Å; N283-K286 WeakPolarHBondContact O-CB 3.5Å; N283-K286 PolarHBondContact O-N 2.71Å; Q284-K286 VanDerWaalsContact C-N 3.29Å; Q284-K286 PolarHBondContact O-N 2.86Å; K286-D288 VanDerWaalsContact C-N 3.33Å; K286-V289 PolarHBondContact O-N 3.31Å; K286-L290 WeakPolarHBondContact O-CB 3.5Å; K286-L290 WeakPolarHBondContact O-CG 3.35Å; K286-L290 PolarHBondContact O-N 3.26Å
287I92.3Very high91.3Very high87 Ų8796.9 Ų96.945%0.44649%0.486SS..Hα-helixtrans-63.8-40.6175.1-70.3166.3000110.4N283 Q284 L290 T291N283-I287 WeakPolarHBondContact O-CG1 3.38Å; N283-I287 PolarHBondContact O-N 3.23Å; Q284-I287 CarbonylContact O-C 3.59Å; Q284-I287 WeakPolarHBondContact O-CA 3.46Å; Q284-I287 WeakPolarHBondContact O-CB 3.47Å; Q284-I287 PolarHBondContact O-N 3.14Å; I287-L290 PolarHBondContact O-N 3.43Å; I287-T291 VanDerWaalsContact O-CB 3.27Å; I287-T291 WeakPolarHBondContact O-CB 3.36Å; I287-T291 PolarHBondContact O-N 3.45Å; I287-T291 PolarHBondContact O-OG1 2.86Å
288D91Very high91.5Very high82 Ų8296.8 Ų96.844%0.43949%0.488SS..Hα-helixtrans-65.1-40.3178.4-60.8-25.7000111.7Q284 S285 K286 T291 T292Q284-D288 PolarHBondContact NE2-OD1 2.82Å; Q284-D288 PolarHBondContact O-N 3.06Å; S285-D288 PolarHBondContact O-N 2.91Å; K286-D288 VanDerWaalsContact C-N 3.33Å; D288-T291 PolarHBondContact O-N 2.96Å; D288-T292 WeakPolarHBondContact O-CB 3.43Å; D288-T292 PolarHBondContact O-N 3.44Å; D288-T292 PolarHBondContact O-OG1 2.97Å
289V92Very high91.5Very high86 Ų8695.5 Ų95.552%0.52149%0.486SS..Hα-helixtrans-62.7-52.3172173.40000110.8S285 K286 T291 T292 D293S285-V289 WeakPolarHBondContact O-CG2 3.27Å; S285-V289 PolarHBondContact O-N 3.02Å; S285-V289 VanDerWaalsContact O-N 3.11Å; K286-V289 PolarHBondContact O-N 3.31Å; V289-T291 VanDerWaalsContact C-N 3.25Å; V289-T291 PolarHBondContact O-N 2.98Å; V289-T292 CarbonylContact O-C 3.59Å; V289-T292 WeakPolarHBondContact O-CA 3.39Å; V289-T292 WeakPolarHBondContact O-CB 3.35Å; V289-T292 PolarHBondContact O-N 3.48Å; V289-D293 PolarHBondContact O-N 3.47Å
290L92.6Very high91.5Very high106 Ų10694.3 Ų94.356%0.55549%0.488SS*.Hα-helixtrans-60.5-34.2179-72.2171000112.9K286 I287 T292 D293 L294K286-L290 WeakPolarHBondContact O-CB 3.5Å; K286-L290 WeakPolarHBondContact O-CG 3.35Å; K286-L290 PolarHBondContact O-N 3.26Å; I287-L290 PolarHBondContact O-N 3.43Å; L290-T292 VanDerWaalsContact C-N 3.34Å; L290-D293 PolarHBondContact O-N 3.5Å; L290-L294 WeakPolarHBondContact O-CB 3.39Å; L290-L294 WeakPolarHBondContact O-CG 3.46Å; L290-L294 PolarHBondContact O-N 3.4Å
291T92.5Very high91.7Very high61 Ų6192.1 Ų92.137%0.37448%0.48SS..Hα-helixtrans-67.7-36.2174.7-59.50000111.4I287 D288 V289 R295I287-T291 VanDerWaalsContact O-CB 3.27Å; I287-T291 WeakPolarHBondContact O-CB 3.36Å; I287-T291 PolarHBondContact O-N 3.45Å; I287-T291 PolarHBondContact O-OG1 2.86Å; D288-T291 PolarHBondContact O-N 2.96Å; V289-T291 VanDerWaalsContact C-N 3.25Å; V289-T291 PolarHBondContact O-N 2.98Å; T291-R295 WeakPolarHBondContact O-CG 3.25Å; T291-R295 PolarHBondContact O-N 3.34Å; T291-R295 VanDerWaalsContact O-N 3.14Å
292T91.4Very high91.7Very high73 Ų7388.9 Ų88.945%0.44847%0.469SS..Hα-helixtrans-69.8-43.9174.6-55.70000111D288 V289 L290 L294 R295 N296D288-T292 WeakPolarHBondContact O-CB 3.43Å; D288-T292 PolarHBondContact O-N 3.44Å; D288-T292 PolarHBondContact O-OG1 2.97Å; V289-T292 CarbonylContact O-C 3.59Å; V289-T292 WeakPolarHBondContact O-CA 3.39Å; V289-T292 WeakPolarHBondContact O-CB 3.35Å; V289-T292 PolarHBondContact O-N 3.48Å; L290-T292 VanDerWaalsContact C-N 3.34Å; T292-L294 PolarHBondContact O-N 3.21Å; T292-R295 WeakPolarHBondContact O-CB 3.49Å; T292-R295 PolarHBondContact O-N 2.96Å; T292-N296 VanDerWaalsContact O-CG 3.3Å; T292-N296 PolarHBondContact O-N 3.11Å; T292-N296 PolarHBondContact O-ND2 2.98Å
293D91.7Very high91.7Very high74 Ų7491.8 Ų91.840%0.39648%0.478SS..Hα-helixtrans-62.5-41.7175.7-70.5-23.1000112.1V289 L290 R295 N296 M297V289-D293 PolarHBondContact O-N 3.47Å; L290-D293 PolarHBondContact O-N 3.5Å; D293-R295 PolarHBondContact O-N 2.81Å; D293-N296 PolarHBondContact O-N 3.03Å; D293-M297 WeakPolarHBondContact O-CG 3.41Å; D293-M297 PolarHBondContact O-N 2.95Å
294L91.5Very high91.7Very high117 Ų11791 Ų9161%0.61348%0.481SS*.Hα-helixtrans-61.8-39.8173.8-81.9169.2000112.6L290 T292 M297 D298L290-L294 WeakPolarHBondContact O-CB 3.39Å; L290-L294 WeakPolarHBondContact O-CG 3.46Å; L290-L294 PolarHBondContact O-N 3.4Å; T292-L294 PolarHBondContact O-N 3.21Å; L294-M297 PolarHBondContact O-N 3.14Å; L294-D298 PolarHBondContact O-N 3.47Å
295R92.4Very high91.7Very high178 Ų17891.5 Ų91.567%0.67248%0.482SS*.Hα-helixtrans-63.7-42.8173.2-77.8177.7175.3170.10.5111.7T291 T292 D293 M297 D298 I299T291-R295 WeakPolarHBondContact O-CG 3.25Å; T291-R295 PolarHBondContact O-N 3.34Å; T291-R295 VanDerWaalsContact O-N 3.14Å; T292-R295 WeakPolarHBondContact O-CB 3.49Å; T292-R295 PolarHBondContact O-N 2.96Å; D293-R295 PolarHBondContact O-N 2.81Å; R295-M297 VanDerWaalsContact C-N 3.35Å; R295-D298 PolarHBondContact O-N 2.92Å; R295-I299 WeakPolarHBondContact O-CG1 3.5Å; R295-I299 PolarHBondContact O-N 3.35Å
296N92.1Very high91.7Very high83 Ų8393.8 Ų93.844%0.44449%0.486SS..Hα-helixtrans-63-41.5176.4-67-25.5000111.4T292 D293 I299 S300T292-N296 VanDerWaalsContact O-CG 3.3Å; T292-N296 PolarHBondContact O-N 3.11Å; T292-N296 PolarHBondContact O-ND2 2.98Å; D293-N296 PolarHBondContact O-N 3.03Å; N296-I299 PolarHBondContact O-N 3.43Å; N296-S300 PolarHBondContact O-N 3.01Å; N296-S300 PolarHBondContact O-OG 2.85Å
297M92.2Very high91.7Very high132 Ų13293.2 Ų93.265%0.6548%0.484SS*.Hα-helixtrans-63.1-39.5174.1-73.2-171.5-177.600112.8D293 L294 R295 S300 L301D293-M297 WeakPolarHBondContact O-CG 3.41Å; D293-M297 PolarHBondContact O-N 2.95Å; L294-M297 PolarHBondContact O-N 3.14Å; R295-M297 VanDerWaalsContact C-N 3.35Å; M297-S300 PolarHBondContact O-N 3.28Å; M297-L301 VanDerWaalsContact O-CB 3.25Å; M297-L301 WeakPolarHBondContact O-CB 3.42Å; M297-L301 PolarHBondContact O-N 3.04Å
298D91.7Very high91.6Very high82 Ų8293.3 Ų93.344%0.43949%0.485SS..Hα-helixtrans-68.4-36.4176.4-168.362.4000112.1L294 R295 L301 N302L294-D298 PolarHBondContact O-N 3.47Å; R295-D298 PolarHBondContact O-N 2.92Å; D298-L301 PolarHBondContact O-N 3.31Å; D298-N302 WeakPolarHBondContact O-CB 3.47Å; D298-N302 PolarHBondContact O-N 2.85Å; D298-N302 PolarHBondContact O-ND2 3.38Å; D298-N302 PolarHBondContact OD2-ND2 2.93Å
299I91.4Very high91.7Very high93 Ų9393.3 Ų93.348%0.47749%0.488SS..Hα-helixtrans-57.9-55170.7-67.9164.6000110R295 N296 L301 N302 E303R295-I299 WeakPolarHBondContact O-CG1 3.5Å; R295-I299 PolarHBondContact O-N 3.35Å; N296-I299 PolarHBondContact O-N 3.43Å; I299-L301 VanDerWaalsContact C-N 3.29Å; I299-L301 PolarHBondContact O-N 3.01Å; I299-N302 PolarHBondContact O-N 2.85Å; I299-E303 WeakPolarHBondContact O-CG 3.3Å; I299-E303 PolarHBondContact O-N 3.34Å
300S90.8Very high91.6Very high69 Ų6993.4 Ų93.448%0.48348%0.483SS..Hα-helixtrans-62.8-32.4178.8-62.30000113.5N296 M297 A304N296-S300 PolarHBondContact O-N 3.01Å; N296-S300 PolarHBondContact O-OG 2.85Å; M297-S300 PolarHBondContact O-N 3.28Å; S300-A304 WeakPolarHBondContact O-CB 3.34Å; S300-A304 PolarHBondContact O-N 3.48Å
301L92.1Very high91.5Very high88 Ų8896 Ų9646%0.46149%0.486SS..Hα-helixtrans-65.9-39.5172.9176.562.7000111.5M297 D298 I299 A304 K305M297-L301 VanDerWaalsContact O-CB 3.25Å; M297-L301 WeakPolarHBondContact O-CB 3.42Å; M297-L301 PolarHBondContact O-N 3.04Å; D298-L301 PolarHBondContact O-N 3.31Å; I299-L301 VanDerWaalsContact C-N 3.29Å; I299-L301 PolarHBondContact O-N 3.01Å; L301-A304 PolarHBondContact O-N 3.1Å; L301-K305 VanDerWaalsContact O-CG 3.3Å; L301-K305 WeakPolarHBondContact O-CG 3.47Å; L301-K305 PolarHBondContact O-N 2.98Å
302N92Very high91.4Very high68 Ų68101.3 Ų101.336%0.36450%0.5SS..Hα-helixtrans-72.2-36.6178-68.3-37.4000111.9D298 I299 K305 Q306D298-N302 WeakPolarHBondContact O-CB 3.47Å; D298-N302 PolarHBondContact O-N 2.85Å; D298-N302 PolarHBondContact O-ND2 3.38Å; D298-N302 PolarHBondContact OD2-ND2 2.93Å; I299-N302 PolarHBondContact O-N 2.85Å; N302-K305 PolarHBondContact O-N 3.13Å; N302-K305 PolarHBondContact OD1-NZ 3.43Å; N302-Q306 PolarHBondContact O-N 2.93Å
303E92Very high91.4Very high108 Ų108100.4 Ų100.451%0.50550%0.496SS..Hα-helixtrans-59.3-47.4167.9-68.2173.1157.100111.5I299 K305 Q306 H307I299-E303 WeakPolarHBondContact O-CG 3.3Å; I299-E303 PolarHBondContact O-N 3.34Å; E303-K305 PolarHBondContact O-N 3.23Å; E303-Q306 WeakPolarHBondContact O-CB 3.41Å; E303-Q306 PolarHBondContact O-N 3.01Å; E303-Q306 VanDerWaalsContact O-N 3.13Å; E303-H307 PolarHBondContact O-CD2 3.22Å; E303-H307 PolarHBondContact O-N 2.94Å
304A90.4Very high91.3Very high55 Ų55101 Ų10146%0.45550%0.496SS..Hα-helixtrans-62.7-39.3177.100000112.9S300 L301 Q306 L308S300-A304 WeakPolarHBondContact O-CB 3.34Å; S300-A304 PolarHBondContact O-N 3.48Å; L301-A304 PolarHBondContact O-N 3.1Å; A304-Q306 VanDerWaalsContact C-N 3.35Å; A304-L308 WeakPolarHBondContact O-CB 3.44Å; A304-L308 PolarHBondContact O-N 3.01Å
305K91.8Very high91.2Very high102 Ų102101 Ų10144%0.44350%0.497SS..Hα-helixtrans-60.6-43.4171.7-74.2169.2-166.5154.20111.2L301 N302 E303 L308 V309L301-K305 VanDerWaalsContact O-CG 3.3Å; L301-K305 WeakPolarHBondContact O-CG 3.47Å; L301-K305 PolarHBondContact O-N 2.98Å; N302-K305 PolarHBondContact O-N 3.13Å; N302-K305 PolarHBondContact OD1-NZ 3.43Å; E303-K305 PolarHBondContact O-N 3.23Å; K305-L308 PolarHBondContact O-N 3.38Å; K305-V309 WeakPolarHBondContact O-CG2 3.34Å; K305-V309 PolarHBondContact O-N 3.24Å
306Q89.7Confident91.1Very high111 Ų11196.8 Ų96.852%0.51949%0.491SS..Hα-helixtrans-63.1-48179.6-172.965.1600111.3N302 E303 A304 L308 V309 E310N302-Q306 PolarHBondContact O-N 2.93Å; E303-Q306 WeakPolarHBondContact O-CB 3.41Å; E303-Q306 PolarHBondContact O-N 3.01Å; E303-Q306 VanDerWaalsContact O-N 3.13Å; A304-Q306 VanDerWaalsContact C-N 3.35Å; Q306-L308 VanDerWaalsContact C-N 3.28Å; Q306-L308 PolarHBondContact O-N 3.38Å; Q306-V309 WeakPolarHBondContact O-CB 3.39Å; Q306-V309 PolarHBondContact O-N 3.5Å; Q306-V309 VanDerWaalsContact O-N 3.1Å; Q306-E310 WeakPolarHBondContact O-CG 3.35Å; Q306-E310 PolarHBondContact O-N 3.44Å
307H91.6Very high90.9Very high102 Ų102100.4 Ų100.447%0.47250%0.498SS..Hα-helixtrans-59.2-37.2173.5-71.1-45.2000112.8E303 V309 E310 Y311E303-H307 PolarHBondContact O-CD2 3.22Å; E303-H307 PolarHBondContact O-N 2.94Å; H307-V309 VanDerWaalsContact C-N 3.35Å; H307-V309 PolarHBondContact O-N 2.92Å; H307-E310 IonicContact ND1-OE2 3.78Å; H307-E310 PolarHBondContact ND1-OE2 3.32Å; H307-E310 VanDerWaalsContact ND1-OE2 3.15Å; H307-E310 WeakPolarHBondContact O-CB 3.45Å; H307-E310 PolarHBondContact O-N 2.96Å; H307-Y311 WeakPolarHBondContact O-CD2 3.48Å; H307-Y311 PolarHBondContact O-N 2.96Å
308L91.6Very high90.8Very high89 Ų89101.2 Ų101.247%0.46650%0.498SS..Hα-helixtrans-66.5-35176.1-173143.7000112.5A304 K305 Q306 R312A304-L308 WeakPolarHBondContact O-CB 3.44Å; A304-L308 PolarHBondContact O-N 3.01Å; K305-L308 PolarHBondContact O-N 3.38Å; Q306-L308 VanDerWaalsContact C-N 3.28Å; Q306-L308 PolarHBondContact O-N 3.38Å; L308-R312 WeakPolarHBondContact O-CB 3.14Å; L308-R312 WeakPolarHBondContact O-CG 3.48Å; L308-R312 PolarHBondContact O-N 2.89Å
309V91.8Very high90.7Very high83 Ų83104 Ų10450%0.50351%0.506SS..Hα-helixtrans-66.1-42.9170.9172.30000111K305 Q306 H307 R312 S313K305-V309 WeakPolarHBondContact O-CG2 3.34Å; K305-V309 PolarHBondContact O-N 3.24Å; Q306-V309 WeakPolarHBondContact O-CB 3.39Å; Q306-V309 PolarHBondContact O-N 3.5Å; Q306-V309 VanDerWaalsContact O-N 3.1Å; H307-V309 VanDerWaalsContact C-N 3.35Å; H307-V309 PolarHBondContact O-N 2.92Å; V309-R312 PolarHBondContact O-N 3.34Å; V309-S313 WeakPolarHBondContact O-CB 3.44Å; V309-S313 PolarHBondContact O-N 3.44Å
310E90.2Very high90.5Very high87 Ų87103.7 Ų103.741%0.40751%0.508SS..Hα-helixtrans-61.2-47.4175.4-69.2176.7157.800112.1Q306 H307 R312 S313 Q314Q306-E310 WeakPolarHBondContact O-CG 3.35Å; Q306-E310 PolarHBondContact O-N 3.44Å; H307-E310 IonicContact ND1-OE2 3.78Å; H307-E310 PolarHBondContact ND1-OE2 3.32Å; H307-E310 VanDerWaalsContact ND1-OE2 3.15Å; H307-E310 WeakPolarHBondContact O-CB 3.45Å; H307-E310 PolarHBondContact O-N 2.96Å; E310-R312 VanDerWaalsContact C-N 3.34Å; E310-R312 PolarHBondContact O-N 2.85Å; E310-S313 WeakPolarHBondContact O-CB 3.47Å; E310-S313 PolarHBondContact O-N 2.97Å; E310-S313 VanDerWaalsContact O-N 3.15Å; E310-Q314 WeakPolarHBondContact O-CG 3.48Å; E310-Q314 PolarHBondContact O-N 3.15Å
311Y90.5Very high90.4Very high160 Ų160105.4 Ų105.463%0.62751%0.511SS*.Hα-helixtrans-60.8-41.1175.7-79.6-58.6000112.2H307 Q314 L315H307-Y311 WeakPolarHBondContact O-CD2 3.48Å; H307-Y311 PolarHBondContact O-N 2.96Å; Y311-Q314 PolarHBondContact O-N 3.44Å; Y311-L315 WeakPolarHBondContact O-CB 3.34Å; Y311-L315 PolarHBondContact O-N 3.03Å
312R90.6Very high90.1Very high174 Ų174107 Ų10766%0.65752%0.52SS*.Hα-helixtrans-60.8-44.5172.6-77.3176.8174.1-179.80.3111.5L308 V309 E310 Q314 L315 V316L308-R312 WeakPolarHBondContact O-CB 3.14Å; L308-R312 WeakPolarHBondContact O-CG 3.48Å; L308-R312 PolarHBondContact O-N 2.89Å; V309-R312 PolarHBondContact O-N 3.34Å; E310-R312 VanDerWaalsContact C-N 3.34Å; E310-R312 PolarHBondContact O-N 2.85Å; R312-Q314 PolarHBondContact O-N 3.25Å; R312-L315 PolarHBondContact O-N 3.32Å; R312-V316 WeakPolarHBondContact O-CG2 3.4Å; R312-V316 PolarHBondContact O-N 2.83Å
313S90.9Very high89.9Confident53 Ų53108 Ų10837%0.37153%0.526SS..Hα-helixtrans-61-42.2175.3171.10000112.7V309 E310 R317V309-S313 WeakPolarHBondContact O-CB 3.44Å; V309-S313 PolarHBondContact O-N 3.44Å; E310-S313 WeakPolarHBondContact O-CB 3.47Å; E310-S313 PolarHBondContact O-N 2.97Å; E310-S313 VanDerWaalsContact O-N 3.15Å; S313-R317 WeakPolarHBondContact O-CG 3.38Å; S313-R317 PolarHBondContact O-N 3.35Å; S313-R317 PolarHBondContact O-NE 3.03Å; S313-R317 PolarHBondContact OG-NE 2.9Å; S313-R317 PolarHBondContact OG-NH2 3.15Å
314Q90Very high89.7Confident86 Ų86106.6 Ų106.640%0.40252%0.524SS..Hα-helixtrans-64.4-40.7174.1-69.5-179.626.300112E310 Y311 R312 R317 K318E310-Q314 WeakPolarHBondContact O-CG 3.48Å; E310-Q314 PolarHBondContact O-N 3.15Å; Y311-Q314 PolarHBondContact O-N 3.44Å; R312-Q314 PolarHBondContact O-N 3.25Å; Q314-R317 PolarHBondContact O-N 3.42Å; Q314-K318 WeakPolarHBondContact O-CG 3.38Å; Q314-K318 PolarHBondContact O-N 3.13Å
315L89.7Confident89.5Confident118 Ų118110.5 Ų110.562%0.61853%0.531SS*.Hα-helixtrans-68.7-39.4-179.8-166.5147.1000111.6Y311 R312 K318 K319Y311-L315 WeakPolarHBondContact O-CB 3.34Å; Y311-L315 PolarHBondContact O-N 3.03Å; R312-L315 PolarHBondContact O-N 3.32Å; L315-K318 PolarHBondContact O-N 3.01Å; L315-K319 WeakPolarHBondContact O-CB 3.48Å; L315-K319 PolarHBondContact O-N 2.9Å
316V90.6Very high89.3Confident90 Ų90111.4 Ų111.455%0.54554%0.535SS..Hα-helixtrans-60.5-48170.1171.40000110.7R312 K318 K319 V320R312-V316 WeakPolarHBondContact O-CG2 3.4Å; R312-V316 PolarHBondContact O-N 2.83Å; V316-K318 PolarHBondContact O-N 3.38Å; V316-K319 PolarHBondContact O-N 3.43Å; V316-K319 VanDerWaalsContact O-N 3.13Å; V316-V320 WeakPolarHBondContact O-CG2 3.48Å; V316-V320 PolarHBondContact O-N 2.87Å
317R88Confident89.1Confident159 Ų159113.5 Ų113.560%0.654%0.542SS*.Hα-helixtrans-57.9-44.2175.9-79.1-178.7-86.1177.3-7.3112.4S313 Q314 V320 L321S313-R317 WeakPolarHBondContact O-CG 3.38Å; S313-R317 PolarHBondContact O-N 3.35Å; S313-R317 PolarHBondContact O-NE 3.03Å; S313-R317 PolarHBondContact OG-NE 2.9Å; S313-R317 PolarHBondContact OG-NH2 3.15Å; Q314-R317 PolarHBondContact O-N 3.42Å; R317-V320 PolarHBondContact O-N 2.99Å; R317-L321 WeakPolarHBondContact O-CB 3.45Å; R317-L321 PolarHBondContact O-N 2.88Å
318K88.4Confident88.8Confident149 Ų149112.3 Ų112.365%0.64854%0.542SS*.Hα-helixtrans-62.8-40.3174.1-76.3-179.5177.9176.90112.3Q314 L315 V316 L321 L322Q314-K318 WeakPolarHBondContact O-CG 3.38Å; Q314-K318 PolarHBondContact O-N 3.13Å; L315-K318 PolarHBondContact O-N 3.01Å; V316-K318 PolarHBondContact O-N 3.38Å; K318-L321 PolarHBondContact O-N 3.32Å; K318-L322 WeakPolarHBondContact O-CB 3.44Å; K318-L322 PolarHBondContact O-N 3.15Å
319K89.5Confident88.4Confident141 Ų141117 Ų11761%0.61355%0.554SS**Hα-helixtrans-65.8-40.8177.4-170176.3-177.1178.90112.2L315 V316 L322 N323L315-K319 WeakPolarHBondContact O-CB 3.48Å; L315-K319 PolarHBondContact O-N 2.9Å; V316-K319 PolarHBondContact O-N 3.43Å; V316-K319 VanDerWaalsContact O-N 3.13Å; K319-L322 PolarHBondContact O-N 2.91Å; K319-N323 PolarHBondContact O-N 3.41Å
320V88.3Confident88.2Confident86 Ų86117.7 Ų117.752%0.52155%0.551SS.*Hα-helixtrans-61.7-49.3172.5172.70000110.3V316 R317 L322 N323 T324V316-V320 WeakPolarHBondContact O-CG2 3.48Å; V316-V320 PolarHBondContact O-N 2.87Å; R317-V320 PolarHBondContact O-N 2.99Å; V320-L322 VanDerWaalsContact C-N 3.29Å; V320-L322 PolarHBondContact O-N 3.33Å; V320-N323 PolarHBondContact O-N 3.37Å; V320-N323 VanDerWaalsContact O-N 3.14Å; V320-T324 PolarHBondContact O-N 3.14Å; V320-T324 PolarHBondContact O-OG1 2.86Å
321L88.8Confident87.9Confident104 Ų104116 Ų11655%0.54555%0.552SS.*Hα-helixtrans-59-39.4178.1-170.471.1000112.5R317 K318 T324 K325R317-L321 WeakPolarHBondContact O-CB 3.45Å; R317-L321 PolarHBondContact O-N 2.88Å; K318-L321 PolarHBondContact O-N 3.32Å; L321-T324 PolarHBondContact O-N 3.17Å; L321-K325 WeakPolarHBondContact O-CG 2.77Å; L321-K325 PolarHBondContact O-N 3.06Å
322L86.1Confident87.7Confident121 Ų121112.4 Ų112.463%0.63454%0.544SS*.Hα-helixtrans-64.5-44.6175.6-161.689.7000111.6K318 K319 V320 K325 K326K318-L322 WeakPolarHBondContact O-CB 3.44Å; K318-L322 PolarHBondContact O-N 3.15Å; K319-L322 PolarHBondContact O-N 2.91Å; V320-L322 VanDerWaalsContact C-N 3.29Å; V320-L322 PolarHBondContact O-N 3.33Å; L322-K325 PolarHBondContact O-N 3.34Å; L322-K326 WeakPolarHBondContact O-CB 3.44Å; L322-K326 PolarHBondContact O-N 2.91Å
323N87.5Confident87.5Confident91 Ų91109.3 Ų109.349%0.48754%0.539SS..Hα-helixtrans-62.8-40.3175.5-87.5-1.8000112.2K319 V320 K326 K327K319-N323 PolarHBondContact O-N 3.41Å; V320-N323 PolarHBondContact O-N 3.37Å; V320-N323 VanDerWaalsContact O-N 3.14Å; N323-K326 PolarHBondContact O-N 2.93Å; N323-K327 PolarHBondContact O-N 3.43Å
324T86.9Confident87.2Confident78 Ų78109.4 Ų109.448%0.47954%0.543SS..Hα-helixtrans-61.7-50.1174.1-55.60000110.6V320 L321 K326 K327 T328V320-T324 PolarHBondContact O-N 3.14Å; V320-T324 PolarHBondContact O-OG1 2.86Å; L321-T324 PolarHBondContact O-N 3.17Å; T324-K326 VanDerWaalsContact C-N 3.28Å; T324-K326 PolarHBondContact O-N 3.44Å; T324-K327 PolarHBondContact O-N 3.33Å; T324-K327 VanDerWaalsContact O-N 3.17Å; T324-T328 PolarHBondContact O-N 2.97Å; T324-T328 PolarHBondContact O-OG1 2.97Å; T324-T328 VanDerWaalsContact O-OG1 3.06Å
325K87.3Confident86.9Confident137 Ų137110.3 Ų110.360%0.59655%0.551SS**Hα-helixtrans-59.6-35.9176.1-75.1-172.6176.6-170.70113.1L321 L322 R329L321-K325 WeakPolarHBondContact O-CG 2.77Å; L321-K325 PolarHBondContact O-N 3.06Å; L322-K325 PolarHBondContact O-N 3.34Å; K325-R329 PolarHBondContact O-N 3.38Å
326K87.6Confident86.6Confident120 Ų120111.6 Ų111.652%0.52255%0.551SS.*Hα-helixtrans-63.2-51.1174179.2176.2166.9176.70110.7L322 N323 T324 T328 R329 E330L322-K326 WeakPolarHBondContact O-CB 3.44Å; L322-K326 PolarHBondContact O-N 2.91Å; N323-K326 PolarHBondContact O-N 2.93Å; T324-K326 VanDerWaalsContact C-N 3.28Å; T324-K326 PolarHBondContact O-N 3.44Å; K326-T328 VanDerWaalsContact C-N 3.33Å; K326-T328 PolarHBondContact O-N 3Å; K326-R329 PolarHBondContact O-N 2.9Å; K326-R329 VanDerWaalsContact O-N 3.15Å; K326-E330 WeakPolarHBondContact CE-OE1 3.47Å; K326-E330 HydrophobicContact CG-CG 4.45Å; K326-E330 IonicContact NZ-OE1 2.87Å; K326-E330 WeakPolarHBondContact O-CG 3.41Å; K326-E330 PolarHBondContact O-N 2.92Å
327K86.1Confident86.4Confident156 Ų156110.6 Ų110.668%0.67855%0.545SS*.Hα-helixtrans-59-40.3176.6-75.3-172173.6-169.60112.9N323 T324 E330 A331N323-K327 PolarHBondContact O-N 3.43Å; T324-K327 PolarHBondContact O-N 3.33Å; T324-K327 VanDerWaalsContact O-N 3.17Å; K327-E330 PolarHBondContact O-N 3.46Å; K327-A331 PolarHBondContact O-N 3.07Å
328T84.6Confident86.2Confident77 Ų77110 Ų11047%0.47255%0.547SS..Hα-helixtrans-60.7-47.2174.6-51.10000111.1T324 K326 E330 A331 D332T324-T328 PolarHBondContact O-N 2.97Å; T324-T328 PolarHBondContact O-OG1 2.97Å; T324-T328 VanDerWaalsContact O-OG1 3.06Å; K326-T328 VanDerWaalsContact C-N 3.33Å; K326-T328 PolarHBondContact O-N 3Å; T328-E330 PolarHBondContact O-N 3.24Å; T328-A331 PolarHBondContact O-N 2.88Å; T328-D332 PolarHBondContact O-N 3.15Å
329R82.8Confident85.9Confident188 Ų188108.3 Ų108.371%0.70954%0.542SS*.Hα-helixtrans-62.7-38.1175.6-81-175.1169-174.2-4.1113.3K325 K326 A331 D332 I333K325-R329 PolarHBondContact O-N 3.38Å; K326-R329 PolarHBondContact O-N 2.9Å; K326-R329 VanDerWaalsContact O-N 3.15Å; R329-A331 VanDerWaalsContact C-N 3.34Å; R329-D332 PolarHBondContact O-N 3.31Å; R329-I333 WeakPolarHBondContact O-CB 3.46Å; R329-I333 WeakPolarHBondContact O-CD1 3.47Å; R329-I333 WeakPolarHBondContact O-CG1 3.21Å; R329-I333 PolarHBondContact O-N 3.35Å
330E87.1Confident85.7Confident96 Ų96106.1 Ų106.145%0.44954%0.536SS..Hα-helixtrans-64.4-39.5176.1-72.3168.8155.800111.3K326 K327 T328 A334K326-E330 WeakPolarHBondContact CE-OE1 3.47Å; K326-E330 HydrophobicContact CG-CG 4.45Å; K326-E330 IonicContact NZ-OE1 2.87Å; K326-E330 WeakPolarHBondContact O-CG 3.41Å; K326-E330 PolarHBondContact O-N 2.92Å; K327-E330 PolarHBondContact O-N 3.46Å; T328-E330 PolarHBondContact O-N 3.24Å; E330-A334 WeakPolarHBondContact O-CB 3.45Å; E330-A334 PolarHBondContact O-N 2.97Å
331A85.2Confident85.6Confident51 Ų51107.2 Ų107.242%0.42154%0.536SS..Hα-helixtrans-67.3-43173.100000112.7K327 T328 R329 I333 A334 N335K327-A331 PolarHBondContact O-N 3.07Å; T328-A331 PolarHBondContact O-N 2.88Å; R329-A331 VanDerWaalsContact C-N 3.34Å; A331-I333 VanDerWaalsContact C-N 3.33Å; A331-I333 PolarHBondContact O-N 3.1Å; A331-A334 PolarHBondContact O-N 3.28Å; A331-N335 WeakPolarHBondContact O-CB 3.49Å; A331-N335 PolarHBondContact O-N 3.4Å
332D85.5Confident85.4Confident86 Ų86105.5 Ų105.546%0.4653%0.533SS..Hα-helixtrans-60.5-42.1175.2-70.6-23.9000111.6T328 R329 N335 K336T328-D332 PolarHBondContact O-N 3.15Å; R329-D332 PolarHBondContact O-N 3.31Å; D332-N335 PolarHBondContact O-N 3.16Å; D332-K336 WeakPolarHBondContact O-CG 3.44Å; D332-K336 PolarHBondContact O-N 3.41Å
333I86.2Confident85.2Confident109 Ų109105.2 Ų105.256%0.55953%0.527SS*.Hα-helixtrans-62.6-49.5175.1-71.1164.6000110R329 A331 N335 K336 T337R329-I333 WeakPolarHBondContact O-CB 3.46Å; R329-I333 WeakPolarHBondContact O-CD1 3.47Å; R329-I333 WeakPolarHBondContact O-CG1 3.21Å; R329-I333 PolarHBondContact O-N 3.35Å; A331-I333 VanDerWaalsContact C-N 3.33Å; A331-I333 PolarHBondContact O-N 3.1Å; I333-N335 VanDerWaalsContact C-N 3.3Å; I333-N335 PolarHBondContact O-N 3.46Å; I333-K336 PolarHBondContact O-N 2.83Å; I333-K336 VanDerWaalsContact O-N 3.16Å; I333-T337 PolarHBondContact O-N 2.92Å; I333-T337 PolarHBondContact O-OG1 3.48Å; I333-T337 VanDerWaalsContact O-OG1 3.1Å
334A84.6Confident85.1Confident54 Ų54104 Ų10445%0.44652%0.519SS..Hα-helixtrans-60.1-38.8179.500000112.8E330 A331 T337 K338E330-A334 WeakPolarHBondContact O-CB 3.45Å; E330-A334 PolarHBondContact O-N 2.97Å; A331-A334 PolarHBondContact O-N 3.28Å; A334-T337 PolarHBondContact O-N 3.25Å; A334-K338 PolarHBondContact O-N 3.41Å; A334-K338 VanDerWaalsContact O-N 3.12Å
335N83.6Confident84.9Confident105 Ų105103.7 Ų103.756%0.56152%0.52SS*.Hα-helixtrans-64.2-47.4173.7-75.8-18.6000111.6A331 D332 I333 T337 K338 E339A331-N335 WeakPolarHBondContact O-CB 3.49Å; A331-N335 PolarHBondContact O-N 3.4Å; D332-N335 PolarHBondContact O-N 3.16Å; I333-N335 VanDerWaalsContact C-N 3.3Å; I333-N335 PolarHBondContact O-N 3.46Å; N335-T337 VanDerWaalsContact C-N 3.31Å; N335-T337 PolarHBondContact O-N 3.12Å; N335-K338 PolarHBondContact O-N 3.01Å; N335-E339 WeakPolarHBondContact O-CB 3.43Å; N335-E339 PolarHBondContact O-N 3.35Å
336K83.8Confident84.7Confident146 Ų146102.3 Ų102.364%0.63552%0.516SS*.Hα-helixtrans-65-31.7176.6-73.3-165.6175.9-157.90113.4D332 I333 E339 N340D332-K336 WeakPolarHBondContact O-CG 3.44Å; D332-K336 PolarHBondContact O-N 3.41Å; I333-K336 PolarHBondContact O-N 2.83Å; I333-K336 VanDerWaalsContact O-N 3.16Å; K336-E339 PolarHBondContact O-N 3.31Å; K336-N340 WeakPolarHBondContact O-CB 3.47Å; K336-N340 PolarHBondContact O-N 3.22Å
337T85.8Confident84.4Confident68 Ų68104.7 Ų104.742%0.41752%0.522SS..Hα-helixtrans-64.2-47.6172.8-61.90000110.7I333 A334 N335 E339 N340 E341I333-T337 PolarHBondContact O-N 2.92Å; I333-T337 PolarHBondContact O-OG1 3.48Å; I333-T337 VanDerWaalsContact O-OG1 3.1Å; A334-T337 PolarHBondContact O-N 3.25Å; N335-T337 VanDerWaalsContact C-N 3.31Å; N335-T337 PolarHBondContact O-N 3.12Å; T337-E339 VanDerWaalsContact C-N 3.34Å; T337-E339 PolarHBondContact O-N 2.95Å; T337-N340 PolarHBondContact O-N 2.98Å; T337-E341 WeakPolarHBondContact O-CG 3.49Å; T337-E341 PolarHBondContact O-N 2.93Å
338K84.7Confident84.3Confident148 Ų148103.1 Ų103.164%0.64352%0.517SS*.Hα-helixtrans-59.6-42.2174-80.1-175.1171-175.50113A334 N335 N340 E341 S342A334-K338 PolarHBondContact O-N 3.41Å; A334-K338 VanDerWaalsContact O-N 3.12Å; N335-K338 PolarHBondContact O-N 3.01Å; K338-N340 VanDerWaalsContact C-N 3.31Å; K338-N340 PolarHBondContact O-N 2.81Å; K338-E341 PolarHBondContact O-N 3.4Å; K338-S342 PolarHBondContact O-N 3.47Å
339E82.1Confident84.3Confident113 Ų113104.9 Ų104.953%0.52852%0.52SS..Hα-helixtrans-62.1-40.3177.4-163.1173.8-137.100111N335 K336 T337 S342 F343N335-E339 WeakPolarHBondContact O-CB 3.43Å; N335-E339 PolarHBondContact O-N 3.35Å; K336-E339 PolarHBondContact O-N 3.31Å; T337-E339 VanDerWaalsContact C-N 3.34Å; T337-E339 PolarHBondContact O-N 2.95Å; E339-S342 WeakPolarHBondContact O-CB 3.34Å; E339-S342 PolarHBondContact O-N 3.14Å; E339-F343 HydrophobicContact CG-CE2 3.88Å; E339-F343 HydrophobicContact CG-CZ 4.45Å; E339-F343 WeakPolarHBondContact O-CD2 3.39Å; E339-F343 PolarHBondContact O-N 2.88Å
340N85.7Confident84.2Confident94 Ų94100.5 Ų100.550%0.50351%0.51SS..Hα-helixtrans-70.3-37.2174.5-169.959000113.4K336 T337 K338 S342 F343 I344K336-N340 WeakPolarHBondContact O-CB 3.47Å; K336-N340 PolarHBondContact O-N 3.22Å; T337-N340 PolarHBondContact O-N 2.98Å; K338-N340 VanDerWaalsContact C-N 3.31Å; K338-N340 PolarHBondContact O-N 2.81Å; N340-S342 VanDerWaalsContact C-N 3.31Å; N340-F343 PolarHBondContact O-N 3.44Å; N340-I344 VanDerWaalsContact O-CG1 3.29Å; N340-I344 WeakPolarHBondContact O-CG1 3.15Å; N340-I344 PolarHBondContact O-N 3.44Å
341E86.6Confident84Confident109 Ų109103.7 Ų103.751%0.50952%0.522SS..Hα-helixtrans-63.1-37.8172.2-73.5169.5174.700111.8T337 K338 I344 S345T337-E341 WeakPolarHBondContact O-CG 3.49Å; T337-E341 PolarHBondContact O-N 2.93Å; K338-E341 PolarHBondContact O-N 3.4Å; E341-I344 PolarHBondContact O-N 3.47Å; E341-S345 WeakPolarHBondContact O-CB 3.34Å; E341-S345 PolarHBondContact O-N 2.95Å; E341-S345 PolarHBondContact O-OG 3.06Å
342S83.3Confident83.9Confident69 Ų69105 Ų10548%0.48353%0.525SS..Hα-helixtrans-59.2-52.3170.6179.20000111.3K338 E339 N340 I344 S345 E346K338-S342 PolarHBondContact O-N 3.47Å; E339-S342 WeakPolarHBondContact O-CB 3.34Å; E339-S342 PolarHBondContact O-N 3.14Å; N340-S342 VanDerWaalsContact C-N 3.31Å; S342-I344 VanDerWaalsContact C-N 3.32Å; S342-I344 PolarHBondContact O-N 2.93Å; S342-S345 WeakPolarHBondContact O-CB 3.49Å; S342-S345 PolarHBondContact O-N 3.25Å; S342-S345 VanDerWaalsContact O-N 3.14Å; S342-E346 PolarHBondContact O-N 2.9Å
343F82.6Confident83.7Confident115 Ų115107.5 Ų107.550%0.50453%0.528SS..Hα-helixtrans-61.4-35.9177.4-69.3-50.6000113.4E339 N340 R347E339-F343 HydrophobicContact CG-CE2 3.88Å; E339-F343 HydrophobicContact CG-CZ 4.45Å; E339-F343 WeakPolarHBondContact O-CD2 3.39Å; E339-F343 PolarHBondContact O-N 2.88Å; N340-F343 PolarHBondContact O-N 3.44Å; F343-R347 WeakPolarHBondContact O-CB 3.29Å; F343-R347 PolarHBondContact O-N 2.97Å
344I84.9Confident83.5Confident65 Ų65108.7 Ų108.733%0.33353%0.534SS..Hα-helixtrans-64-43.5174.9-71.7165.4000110.7N340 E341 S342 R347 Q348N340-I344 VanDerWaalsContact O-CG1 3.29Å; N340-I344 WeakPolarHBondContact O-CG1 3.15Å; N340-I344 PolarHBondContact O-N 3.44Å; E341-I344 PolarHBondContact O-N 3.47Å; S342-I344 VanDerWaalsContact C-N 3.32Å; S342-I344 PolarHBondContact O-N 2.93Å; I344-R347 PolarHBondContact O-N 3.35Å; I344-Q348 PolarHBondContact O-N 3.32Å
345S83.2Confident83.4Confident71 Ų71109.6 Ų109.650%0.49754%0.538SS..Hα-helixtrans-66.3-45.2179.6-55.90000111.8E341 S342 R347 Q348 H349E341-S345 WeakPolarHBondContact O-CB 3.34Å; E341-S345 PolarHBondContact O-N 2.95Å; E341-S345 PolarHBondContact O-OG 3.06Å; S342-S345 WeakPolarHBondContact O-CB 3.49Å; S342-S345 PolarHBondContact O-N 3.25Å; S342-S345 VanDerWaalsContact O-N 3.14Å; S345-R347 PolarHBondContact O-N 2.94Å; S345-Q348 WeakPolarHBondContact O-CB 3.48Å; S345-Q348 PolarHBondContact O-N 3.49Å; S345-H349 PolarHBondContact O-N 2.99Å
346E82Confident83.3Confident108 Ų108109.7 Ų109.751%0.50554%0.535SS..Hα-helixtrans-61.3-43.4175.1-175.9175.4-153.400111.5S342 Q348 H349 L350S342-E346 PolarHBondContact O-N 2.9Å; E346-Q348 VanDerWaalsContact C-N 3.33Å; E346-Q348 PolarHBondContact O-N 2.96Å; E346-H349 PolarHBondContact O-N 3.28Å; E346-L350 HydrophobicContact CG-CD1 4.29Å; E346-L350 WeakPolarHBondContact O-CG 3.39Å; E346-L350 PolarHBondContact O-N 3.12Å
347R82.4Confident83.1Confident170 Ų170105.8 Ų105.864%0.64252%0.523SS*.Hα-helixtrans-62.3-37.3174.5-174.4-176.366.1166.3-0.2112.4F343 I344 S345 K351F343-R347 WeakPolarHBondContact O-CB 3.29Å; F343-R347 PolarHBondContact O-N 2.97Å; I344-R347 PolarHBondContact O-N 3.35Å; S345-R347 PolarHBondContact O-N 2.94Å; R347-K351 WeakPolarHBondContact O-CB 3.21Å; R347-K351 PolarHBondContact O-N 3.42Å
348Q83.8Confident82.8Confident123 Ų123105.4 Ų105.458%0.57553%0.527SS*.Hα-helixtrans-65.1-47.2173.1-91.2175.6-59.400111.4I344 S345 E346 L350 K351 T352I344-Q348 PolarHBondContact O-N 3.32Å; S345-Q348 WeakPolarHBondContact O-CB 3.48Å; S345-Q348 PolarHBondContact O-N 3.49Å; E346-Q348 VanDerWaalsContact C-N 3.33Å; E346-Q348 PolarHBondContact O-N 2.96Å; Q348-L350 PolarHBondContact O-N 3.21Å; Q348-K351 WeakPolarHBondContact O-CB 3.48Å; Q348-K351 PolarHBondContact O-N 3.07Å; Q348-K351 VanDerWaalsContact O-N 3.12Å; Q348-T352 PolarHBondContact O-N 3.2Å; Q348-T352 PolarHBondContact O-OG1 2.89Å
349H85.1Confident82.7Confident115 Ų115105.3 Ų105.353%0.53253%0.529SS..Hα-helixtrans-58-45.8176.7174.6-92.5000112.5S345 E346 K351 T352 R353S345-H349 PolarHBondContact O-N 2.99Å; E346-H349 PolarHBondContact O-N 3.28Å; H349-K351 VanDerWaalsContact C-N 3.31Å; H349-K351 PolarHBondContact O-N 3.44Å; H349-T352 PolarHBondContact O-N 3.05Å; H349-R353 PolarHBondContact O-N 3.04Å
350L80.5Confident82.5Confident95 Ų95105.8 Ų105.850%0.49753%0.531SS..Hα-helixtrans-62.2-37175.1-71.9171.7000112.5E346 Q348 R353 L354E346-L350 HydrophobicContact CG-CD1 4.29Å; E346-L350 WeakPolarHBondContact O-CG 3.39Å; E346-L350 PolarHBondContact O-N 3.12Å; Q348-L350 PolarHBondContact O-N 3.21Å; L350-R353 PolarHBondContact O-N 3.28Å; L350-L354 WeakPolarHBondContact O-CB 3.4Å; L350-L354 PolarHBondContact O-N 3.4Å
351K82.5Confident82.1Confident163 Ų163105.8 Ų105.871%0.70953%0.531SS*.Hα-helixtrans-67.7-37.7176.6-168.8177.4-179.6-176.70112.3R347 Q348 H349 L354 S355R347-K351 WeakPolarHBondContact O-CB 3.21Å; R347-K351 PolarHBondContact O-N 3.42Å; Q348-K351 WeakPolarHBondContact O-CB 3.48Å; Q348-K351 PolarHBondContact O-N 3.07Å; Q348-K351 VanDerWaalsContact O-N 3.12Å; H349-K351 VanDerWaalsContact C-N 3.31Å; H349-K351 PolarHBondContact O-N 3.44Å; K351-L354 PolarHBondContact O-N 3.42Å; K351-S355 PolarHBondContact O-N 2.96Å
352T82.7Confident81.8Confident78 Ų78104 Ų10448%0.47953%0.531SS..Hα-helixtrans-63.1-51.1173.3-53.60000110.8Q348 H349 L354 S355 E356Q348-T352 PolarHBondContact O-N 3.2Å; Q348-T352 PolarHBondContact O-OG1 2.89Å; H349-T352 PolarHBondContact O-N 3.05Å; T352-L354 VanDerWaalsContact C-N 3.28Å; T352-L354 PolarHBondContact O-N 3.5Å; T352-S355 WeakPolarHBondContact O-CA 3.28Å; T352-S355 VanDerWaalsContact O-CB 3.28Å; T352-S355 WeakPolarHBondContact O-CB 3.45Å; T352-S355 PolarHBondContact O-N 3.4Å; T352-E356 PolarHBondContact O-N 2.89Å
353R81.8Confident81.6Confident140 Ų140103.6 Ų103.653%0.52853%0.528SS..Hα-helixtrans-55.6-40.4176.3-79.7-172.660.9-166.4-4.4113.3H349 L350 S355 E356 T357H349-R353 PolarHBondContact O-N 3.04Å; L350-R353 PolarHBondContact O-N 3.28Å; R353-S355 VanDerWaalsContact C-N 3.27Å; R353-S355 PolarHBondContact O-N 3.25Å; R353-E356 WeakPolarHBondContact CA-OE2 3.5Å; R353-E356 PolarHBondContact O-N 3.35Å; R353-T357 PolarHBondContact O-N 3.01Å; R353-T357 PolarHBondContact O-OG1 3.09Å
354L81.9Confident81.4Confident133 Ų133102.2 Ų102.270%0.69653%0.525SS*.Hα-helixtrans-62.2-36.5176.8-162.581.2000111.9L350 K351 T352 A358L350-L354 WeakPolarHBondContact O-CB 3.4Å; L350-L354 PolarHBondContact O-N 3.4Å; K351-L354 PolarHBondContact O-N 3.42Å; T352-L354 VanDerWaalsContact C-N 3.28Å; T352-L354 PolarHBondContact O-N 3.5Å; L354-A358 WeakPolarHBondContact O-CB 3.48Å; L354-A358 PolarHBondContact O-N 3.06Å
355S82.1Confident81.1Confident74 Ų74103 Ų10352%0.51753%0.532SS..Hα-helixtrans-69.1-40.3176-163.90000112K351 T352 R353 A358 Q359K351-S355 PolarHBondContact O-N 2.96Å; T352-S355 WeakPolarHBondContact O-CA 3.28Å; T352-S355 VanDerWaalsContact O-CB 3.28Å; T352-S355 WeakPolarHBondContact O-CB 3.45Å; T352-S355 PolarHBondContact O-N 3.4Å; R353-S355 VanDerWaalsContact C-N 3.27Å; R353-S355 PolarHBondContact O-N 3.25Å; S355-A358 PolarHBondContact O-N 3.26Å; S355-Q359 PolarHBondContact O-N 3.49Å
356E82.8Confident80.9Confident107 Ų107105.9 Ų105.950%0.554%0.538SS..Hα-helixtrans-61.8-50.7176.3-67.4165.4167.100110.7T352 R353 A358 Q359 E360T352-E356 PolarHBondContact O-N 2.89Å; R353-E356 WeakPolarHBondContact CA-OE2 3.5Å; R353-E356 PolarHBondContact O-N 3.35Å; E356-A358 VanDerWaalsContact C-N 3.3Å; E356-A358 PolarHBondContact O-N 3.16Å; E356-Q359 WeakPolarHBondContact O-CB 3.36Å; E356-Q359 PolarHBondContact O-N 3.12Å; E356-E360 PolarHBondContact O-N 3.02Å
357T79.1Confident80.6Confident63 Ų63106.8 Ų106.839%0.38754%0.542SS..Hα-helixtrans-64.2-33177.8-52.20000112.7R353 Q359 N361R353-T357 PolarHBondContact O-N 3.01Å; R353-T357 PolarHBondContact O-OG1 3.09Å; T357-Q359 VanDerWaalsContact C-N 3.32Å; T357-N361 WeakPolarHBondContact O-CB 3.47Å; T357-N361 PolarHBondContact O-N 3.33Å; T357-N361 PolarHBondContact O-ND2 3.27Å
358A79.8Confident80.3Confident60 Ų60103.1 Ų103.150%0.49653%0.534SS..Hα-helixtrans-65.4-36.6172.700000112.2L354 S355 E356 S362L354-A358 WeakPolarHBondContact O-CB 3.48Å; L354-A358 PolarHBondContact O-N 3.06Å; S355-A358 PolarHBondContact O-N 3.26Å; E356-A358 VanDerWaalsContact C-N 3.3Å; E356-A358 PolarHBondContact O-N 3.16Å; A358-S362 PolarHBondContact O-N 3.05Å; A358-S362 VanDerWaalsContact O-N 3.12Å
359Q81.7Confident80.1Confident146 Ų146101.3 Ų101.368%0.68253%0.528SS*.Hα-helixtrans-74.3-39177.5-169.6168.5-8.200112.3S355 E356 T357 S362 S363S355-Q359 PolarHBondContact O-N 3.49Å; E356-Q359 WeakPolarHBondContact O-CB 3.36Å; E356-Q359 PolarHBondContact O-N 3.12Å; T357-Q359 VanDerWaalsContact C-N 3.32Å; Q359-S362 WeakPolarHBondContact O-CB 3.44Å; Q359-S362 PolarHBondContact O-N 3.06Å; Q359-S363 PolarHBondContact O-N 3.02Å; Q359-S363 VanDerWaalsContact O-N 3.09Å
360E79.3Confident79.8Confident124 Ų124100.5 Ų100.558%0.57953%0.528SS*.Hα-helixtrans-58.2-47.7169.9-72.6-179140.300111.5E356 S362 S363 I364E356-E360 PolarHBondContact O-N 3.02Å; E360-S362 VanDerWaalsContact C-N 3.3Å; E360-S362 PolarHBondContact O-N 3.06Å; E360-S363 WeakPolarHBondContact O-CB 3.42Å; E360-S363 PolarHBondContact O-N 3.35Å; E360-S363 VanDerWaalsContact O-N 3.13Å; E360-I364 WeakPolarHBondContact O-CG1 3.41Å; E360-I364 PolarHBondContact O-N 2.98Å
361N77.1Confident79.4Confident93 Ų93100.2 Ų100.250%0.49752%0.524SS..Hα-helixtrans-59.2-39.5176.4-78.4-25.2000112.3T357 S363 I364 V365T357-N361 WeakPolarHBondContact O-CB 3.47Å; T357-N361 PolarHBondContact O-N 3.33Å; T357-N361 PolarHBondContact O-ND2 3.27Å; N361-S363 PolarHBondContact O-N 3.5Å; N361-I364 PolarHBondContact O-N 3.13Å; N361-V365 WeakPolarHBondContact O-CG2 3.36Å; N361-V365 PolarHBondContact O-N 3.36Å
362S80Confident79.1Confident72 Ų7298 Ų9850%0.50352%0.516SS..Hα-helixtrans-61.8-42.5175.2-166.20000112.2A358 Q359 E360 V365 E366A358-S362 PolarHBondContact O-N 3.05Å; A358-S362 VanDerWaalsContact O-N 3.12Å; Q359-S362 WeakPolarHBondContact O-CB 3.44Å; Q359-S362 PolarHBondContact O-N 3.06Å; E360-S362 VanDerWaalsContact C-N 3.3Å; E360-S362 PolarHBondContact O-N 3.06Å; S362-V365 PolarHBondContact O-N 3.49Å; S362-E366 PolarHBondContact O-N 3.24Å
363S78.1Confident78.8Confident60 Ų60100.4 Ų100.442%0.4252%0.522SS..Hα-helixtrans-65.1-39.3177.5-1770000112.3Q359 E360 N361 E366 Q367Q359-S363 PolarHBondContact O-N 3.02Å; Q359-S363 VanDerWaalsContact O-N 3.09Å; E360-S363 WeakPolarHBondContact O-CB 3.42Å; E360-S363 PolarHBondContact O-N 3.35Å; E360-S363 VanDerWaalsContact O-N 3.13Å; N361-S363 PolarHBondContact O-N 3.5Å; S363-E366 PolarHBondContact O-N 3.37Å; S363-Q367 PolarHBondContact O-N 3.34Å
364I78.3Confident78.4Confident86 Ų86100.5 Ų100.544%0.44152%0.522SS..Hα-helixtrans-65.1-41.4175.7-67.1166.4000110.9E360 N361 E366 Q367 I368E360-I364 WeakPolarHBondContact O-CG1 3.41Å; E360-I364 PolarHBondContact O-N 2.98Å; N361-I364 PolarHBondContact O-N 3.13Å; I364-E366 PolarHBondContact O-N 3.02Å; I364-Q367 PolarHBondContact O-N 3.38Å; I364-I368 HydrophobicContact CG2-CD1 4Å; I364-I368 WeakPolarHBondContact O-CG1 3.2Å; I364-I368 PolarHBondContact O-N 3.48Å
365V79.2Confident77.9Confident82 Ų8299.4 Ų99.450%0.49752%0.516SS..Hα-helixtrans-63.7-39.2175.9170.60000111.7N361 S362 I368 N369N361-V365 WeakPolarHBondContact O-CG2 3.36Å; N361-V365 PolarHBondContact O-N 3.36Å; S362-V365 PolarHBondContact O-N 3.49Å; V365-I368 PolarHBondContact O-N 3.35Å; V365-N369 PolarHBondContact O-N 3Å; V365-N369 VanDerWaalsContact O-N 3.12Å
366E78.8Confident77.5Confident131 Ų131102.7 Ų102.761%0.61252%0.523SS*.Hα-helixtrans-63.5-41.3172.3-78.9-171.1138.700112.7S362 S363 I364 I368 N369 L370S362-E366 PolarHBondContact O-N 3.24Å; S363-E366 PolarHBondContact O-N 3.37Å; I364-E366 PolarHBondContact O-N 3.02Å; E366-I368 PolarHBondContact O-N 3.04Å; E366-N369 PolarHBondContact O-N 3.3Å; E366-L370 PolarHBondContact O-N 3.41Å
367Q76.3Confident77.1Confident127 Ų127101.5 Ų101.559%0.59352%0.524SS*.Hα-helixtrans-62.2-40.5175.4-75.1-174.4-4.700112.6S363 I364 L370 E371S363-Q367 PolarHBondContact O-N 3.34Å; I364-Q367 PolarHBondContact O-N 3.38Å; Q367-L370 PolarHBondContact O-N 3.03Å; Q367-E371 PolarHBondContact O-N 2.98Å
368I76.5Confident76.6Confident94 Ų94103.5 Ų103.548%0.48253%0.531SS..Hα-helixtrans-62.3-47176.7-69.4166.5000110.7I364 V365 E366 L370 E371 E372I364-I368 HydrophobicContact CG2-CD1 4Å; I364-I368 WeakPolarHBondContact O-CG1 3.2Å; I364-I368 PolarHBondContact O-N 3.48Å; V365-I368 PolarHBondContact O-N 3.35Å; E366-I368 PolarHBondContact O-N 3.04Å; I368-L370 VanDerWaalsContact C-N 3.29Å; I368-L370 PolarHBondContact O-N 3.19Å; I368-E371 PolarHBondContact O-N 2.66Å; I368-E372 PolarHBondContact O-N 2.8Å
369N78.2Confident76Confident84 Ų84104 Ų10445%0.44953%0.531SS..Hα-helixtrans-60.3-37.4176.5-75.6-23000112.5V365 E366 E372 Q373V365-N369 PolarHBondContact O-N 3Å; V365-N369 VanDerWaalsContact O-N 3.12Å; E366-N369 PolarHBondContact O-N 3.3Å; N369-E372 PolarHBondContact O-N 3.12Å; N369-Q373 WeakPolarHBondContact O-CG 3.45Å; N369-Q373 PolarHBondContact O-N 3.06Å; N369-Q373 VanDerWaalsContact O-N 3.11Å
370L79.4Confident75.4Confident98 Ų98105 Ų10551%0.51353%0.533SS..Hα-helixtrans-65.7-39.8175.8-99.5155.9000112.6E366 Q367 I368 Q373 R374E366-L370 PolarHBondContact O-N 3.41Å; Q367-L370 PolarHBondContact O-N 3.03Å; I368-L370 VanDerWaalsContact C-N 3.29Å; I368-L370 PolarHBondContact O-N 3.19Å; L370-Q373 PolarHBondContact O-N 3.46Å; L370-R374 WeakPolarHBondContact O-CG 3.35Å; L370-R374 PolarHBondContact O-N 3.1Å; L370-R374 VanDerWaalsContact O-N 3.1Å
371E72.8Confident74.8Confident89 Ų89103.9 Ų103.942%0.41653%0.531SS..Hα-helixtrans-73.8-33175-74-58.4156.300113.1Q367 I368 Q373 R374 L375Q367-E371 PolarHBondContact O-N 2.98Å; I368-E371 PolarHBondContact O-N 2.66Å; E371-Q373 VanDerWaalsContact C-N 3.33Å; E371-Q373 PolarHBondContact O-N 3.11Å; E371-R374 VanDerWaalsContact CD-CD 3.49Å; E371-R374 WeakPolarHBondContact O-CB 3.39Å; E371-R374 PolarHBondContact O-N 3.49Å; E371-R374 WeakPolarHBondContact OE1-CD 3.49Å; E371-R374 IonicContact OE1-CZ 3.58Å; E371-R374 IonicContact OE1-NE 3.93Å; E371-R374 IonicContact OE1-NH1 3.6Å; E371-R374 PolarHBondContact OE1-NH1 3.1Å; E371-R374 WeakPolarHBondContact OE2-CD 3.44Å; E371-L375 WeakPolarHBondContact O-CB 3.43Å; E371-L375 WeakPolarHBondContact O-CG 3.36Å; E371-L375 PolarHBondContact O-N 3.49Å
372E75.4Confident74.2Confident117 Ų117105 Ų10555%0.54753%0.533SS..Hα-helixtrans-61.7-40.1170.1-77.1-164.2142.900112.1I368 N369 L375 Q376I368-E372 PolarHBondContact O-N 2.8Å; N369-E372 PolarHBondContact O-N 3.12Å; E372-L375 PolarHBondContact O-N 3.21Å; E372-Q376 PolarHBondContact O-N 2.91Å
373Q76.4Confident73.7Confident128 Ų128105.2 Ų105.260%0.59853%0.531SS*.Hα-helixtrans-65-38173.4-72.7-176.86.200112.5N369 L370 E371 Q376 T377N369-Q373 WeakPolarHBondContact O-CG 3.45Å; N369-Q373 PolarHBondContact O-N 3.06Å; N369-Q373 VanDerWaalsContact O-N 3.11Å; L370-Q373 PolarHBondContact O-N 3.46Å; E371-Q373 VanDerWaalsContact C-N 3.33Å; E371-Q373 PolarHBondContact O-N 3.11Å; Q373-Q376 PolarHBondContact O-N 3.46Å; Q373-T377 PolarHBondContact O-N 3.49Å; Q373-T377 PolarHBondContact O-OG1 3.36Å
374R73.9Confident73.1Confident142 Ų142107.9 Ų107.954%0.53654%0.537SS..Hα-helixtrans-62.9-44.6172.5-74.9171169.6-173.4-1.8111.4L370 E371 Q376 T377 I378L370-R374 WeakPolarHBondContact O-CG 3.35Å; L370-R374 PolarHBondContact O-N 3.1Å; L370-R374 VanDerWaalsContact O-N 3.1Å; E371-R374 VanDerWaalsContact CD-CD 3.49Å; E371-R374 WeakPolarHBondContact O-CB 3.39Å; E371-R374 PolarHBondContact O-N 3.49Å; E371-R374 WeakPolarHBondContact OE1-CD 3.49Å; E371-R374 IonicContact OE1-CZ 3.58Å; E371-R374 IonicContact OE1-NE 3.93Å; E371-R374 IonicContact OE1-NH1 3.6Å; E371-R374 PolarHBondContact OE1-NH1 3.1Å; E371-R374 WeakPolarHBondContact OE2-CD 3.44Å; R374-Q376 PolarHBondContact O-N 3.33Å; R374-T377 WeakPolarHBondContact O-CB 3.37Å; R374-T377 PolarHBondContact O-N 2.85Å; R374-T377 VanDerWaalsContact O-N 3.1Å; R374-I378 WeakPolarHBondContact O-CG1 3.48Å; R374-I378 PolarHBondContact O-N 2.87Å
375L70.8Confident72.6Confident110 Ų110107.9 Ų107.958%0.57654%0.54SS*.Hα-helixtrans-62.5-40.8176.4-76.7166.8000112.6E371 E372 T377 I378 S379E371-L375 WeakPolarHBondContact O-CB 3.43Å; E371-L375 WeakPolarHBondContact O-CG 3.36Å; E371-L375 PolarHBondContact O-N 3.49Å; E372-L375 PolarHBondContact O-N 3.21Å; L375-T377 VanDerWaalsContact C-N 3.29Å; L375-T377 PolarHBondContact O-N 3.39Å; L375-I378 PolarHBondContact O-N 3.41Å; L375-S379 WeakPolarHBondContact O-CB 3.34Å; L375-S379 PolarHBondContact O-N 3.06Å
376Q73.4Confident71.8Confident143 Ų143109.8 Ų109.867%0.66854%0.544SS*.Hα-helixtrans-61.7-36.9171.5-76.1-169.2-0.800112.6E372 Q373 R374 S379 K380E372-Q376 PolarHBondContact O-N 2.91Å; Q373-Q376 PolarHBondContact O-N 3.46Å; R374-Q376 PolarHBondContact O-N 3.33Å; Q376-S379 PolarHBondContact O-N 2.94Å; Q376-K380 PolarHBondContact O-N 3.05Å
377T73.8Confident71.2Confident82 Ų82108.9 Ų108.950%0.50354%0.54SS..Hα-helixtrans-69-42.7177.7-51.60000111.3Q373 R374 L375 S379 K380 N381Q373-T377 PolarHBondContact O-N 3.49Å; Q373-T377 PolarHBondContact O-OG1 3.36Å; R374-T377 WeakPolarHBondContact O-CB 3.37Å; R374-T377 PolarHBondContact O-N 2.85Å; R374-T377 VanDerWaalsContact O-N 3.1Å; L375-T377 VanDerWaalsContact C-N 3.29Å; L375-T377 PolarHBondContact O-N 3.39Å; T377-S379 VanDerWaalsContact C-N 3.34Å; T377-K380 PolarHBondContact O-N 3.45Å; T377-N381 PolarHBondContact O-N 2.87Å
378I69.9Low70.6Confident105 Ų105107.7 Ų107.754%0.53854%0.537SS..Hα-helixtrans-63.2-40.9174.1-67.6166.2000110.7R374 L375 N381 H382R374-I378 WeakPolarHBondContact O-CG1 3.48Å; R374-I378 PolarHBondContact O-N 2.87Å; L375-I378 PolarHBondContact O-N 3.41Å; I378-N381 PolarHBondContact O-N 2.96Å; I378-H382 PolarHBondContact O-N 3.16Å
379S65.8Low70Confident72 Ų72108.1 Ų108.150%0.50354%0.54SS..Hα-helixtrans-60.4-45.1176.1-1780000112.3L375 Q376 T377 N381 H382 V383L375-S379 WeakPolarHBondContact O-CB 3.34Å; L375-S379 PolarHBondContact O-N 3.06Å; Q376-S379 PolarHBondContact O-N 2.94Å; T377-S379 VanDerWaalsContact C-N 3.34Å; S379-N381 PolarHBondContact O-N 3.42Å; S379-H382 WeakPolarHBondContact O-CB 3.35Å; S379-H382 PolarHBondContact O-N 2.86Å; S379-H382 VanDerWaalsContact O-N 3.16Å; S379-V383 PolarHBondContact O-N 3.21Å; S379-V383 VanDerWaalsContact O-N 3.16Å
380K70.2Confident69.5Low167 Ų167111 Ų11173%0.72655%0.549SS*.Hα-helixtrans-59.9-43.2172.3-82.1-177.2173.8177.50112.8Q376 T377 H382 V383 H384Q376-K380 PolarHBondContact O-N 3.05Å; T377-K380 PolarHBondContact O-N 3.45Å; K380-H382 VanDerWaalsContact C-N 3.27Å; K380-H382 PolarHBondContact O-N 3.46Å; K380-V383 PolarHBondContact O-N 3.23Å; K380-H384 PolarHBondContact O-N 3.32Å
381N66.3Low68.9Low99 Ų99109.2 Ų109.253%0.52955%0.545SS..Hα-helixtrans-64.4-33.9176.5-69.9-11.9000111.7T377 I378 S379 H384 V385T377-N381 PolarHBondContact O-N 2.87Å; I378-N381 PolarHBondContact O-N 2.96Å; S379-N381 PolarHBondContact O-N 3.42Å; N381-H384 PolarHBondContact O-N 3.16Å; N381-V385 WeakPolarHBondContact O-CG2 3.49Å; N381-V385 PolarHBondContact O-N 3.42Å
382H65.1Low68.2Low117 Ų117110.2 Ų110.254%0.54255%0.552SS.*Hα-helixtrans-66.8-42.3178.3-164.4-3.2000112.2I378 S379 K380 H384 V385 E386I378-H382 PolarHBondContact O-N 3.16Å; S379-H382 WeakPolarHBondContact O-CB 3.35Å; S379-H382 PolarHBondContact O-N 2.86Å; S379-H382 VanDerWaalsContact O-N 3.16Å; K380-H382 VanDerWaalsContact C-N 3.27Å; K380-H382 PolarHBondContact O-N 3.46Å; H382-H384 VanDerWaalsContact C-N 3.29Å; H382-H384 PolarHBondContact O-N 3Å; H382-V385 PolarHBondContact O-N 3.42Å; H382-E386 PolarHBondContact O-N 3.15Å
383V69.8Low67.5Low77 Ų77109.5 Ų109.547%0.46755%0.552SS.*Hα-helixtrans-58.9-42.6173.1175.70000110.8S379 K380 V385 E386 E387S379-V383 PolarHBondContact O-N 3.21Å; S379-V383 VanDerWaalsContact O-N 3.16Å; K380-V383 PolarHBondContact O-N 3.23Å; V383-V385 VanDerWaalsContact C-N 3.32Å; V383-V385 PolarHBondContact O-N 3.19Å; V383-E386 PolarHBondContact O-N 2.93Å; V383-E386 VanDerWaalsContact O-N 3.15Å; V383-E387 PolarHBondContact O-N 3.43Å
384H64.6Low66.7Low115 Ų115108.8 Ų108.853%0.53255%0.548SS..Hα-helixtrans-69.1-30.2178.9-15146.8000113K380 N381 H382 E387 L388K380-H384 PolarHBondContact O-N 3.32Å; N381-H384 PolarHBondContact O-N 3.16Å; H382-H384 VanDerWaalsContact C-N 3.29Å; H382-H384 PolarHBondContact O-N 3Å; H384-E387 IonicContact CE1-OE2 2.77Å; H384-E387 IonicContact CG-OE2 3.57Å; H384-E387 IonicContact ND1-OE2 2.93Å; H384-E387 PolarHBondContact ND1-OE2 2.87Å; H384-L388 WeakPolarHBondContact O-CB 3.5Å; H384-L388 PolarHBondContact O-N 3.04Å
385V67.1Low66.1Low86 Ų86107 Ų10752%0.52155%0.548SS..Hα-helixtrans-69.6-36.2170.2169.10000111.5N381 H382 V383 L388 N389N381-V385 WeakPolarHBondContact O-CG2 3.49Å; N381-V385 PolarHBondContact O-N 3.42Å; H382-V385 PolarHBondContact O-N 3.42Å; V383-V385 VanDerWaalsContact C-N 3.32Å; V383-V385 PolarHBondContact O-N 3.19Å; V385-L388 PolarHBondContact O-N 3.3Å; V385-N389 VanDerWaalsContact O-CB 3.27Å; V385-N389 WeakPolarHBondContact O-CB 3.44Å; V385-N389 PolarHBondContact O-N 3.01Å
386E63.5Low65.3Low123 Ų123104.3 Ų104.358%0.57554%0.538SS*.Hα-helixtrans-66-40.4172.8-71.9-164.8139.100112.3H382 V383 N389 K390H382-E386 PolarHBondContact O-N 3.15Å; V383-E386 PolarHBondContact O-N 2.93Å; V383-E386 VanDerWaalsContact O-N 3.15Å; E386-N389 PolarHBondContact O-N 3.19Å; E386-K390 WeakPolarHBondContact O-CB 3.3Å; E386-K390 PolarHBondContact O-N 3.01Å
387E65.8Low64.3Low111 Ų111103.4 Ų103.452%0.51953%0.534SS..Hα-helixtrans-59.9-48.5172.8-70178142.900111.5V383 H384 N389 K390 S391V383-E387 PolarHBondContact O-N 3.43Å; H384-E387 IonicContact CE1-OE2 2.77Å; H384-E387 IonicContact CG-OE2 3.57Å; H384-E387 IonicContact ND1-OE2 2.93Å; H384-E387 PolarHBondContact ND1-OE2 2.87Å; E387-N389 VanDerWaalsContact C-N 3.33Å; E387-N389 PolarHBondContact O-N 2.91Å; E387-K390 WeakPolarHBondContact O-CB 3.45Å; E387-K390 PolarHBondContact O-N 3.4Å; E387-S391 PolarHBondContact O-N 3.5Å; E387-S391 PolarHBondContact O-OG 2.94Å
388L63.6Low63.4Low102 Ų102107 Ų10753%0.53455%0.547SS..Hα-helixtrans-58.9-41.5174.2-90162000112.7H384 V385 K390 S391 L392H384-L388 WeakPolarHBondContact O-CB 3.5Å; H384-L388 PolarHBondContact O-N 3.04Å; V385-L388 PolarHBondContact O-N 3.3Å; L388-K390 VanDerWaalsContact C-N 3.32Å; L388-K390 PolarHBondContact O-N 3.47Å; L388-S391 PolarHBondContact O-N 2.95Å; L388-L392 WeakPolarHBondContact O-CB 3.27Å; L388-L392 PolarHBondContact O-N 3.43Å
389N64.9Low62.7Low104 Ų104107.2 Ų107.256%0.55655%0.554SS**Hα-helixtrans-66.5-35.5178.1-164.631.9000111.5V385 E386 E387 L392 L393V385-N389 VanDerWaalsContact O-CB 3.27Å; V385-N389 WeakPolarHBondContact O-CB 3.44Å; V385-N389 PolarHBondContact O-N 3.01Å; E386-N389 PolarHBondContact O-N 3.19Å; E387-N389 VanDerWaalsContact C-N 3.33Å; E387-N389 PolarHBondContact O-N 2.91Å; N389-L392 PolarHBondContact O-N 2.91Å; N389-L393 PolarHBondContact O-N 3.42Å
390K67Low62Low144 Ų144112.1 Ų112.163%0.62657%0.566SS**Hα-helixtrans-66.8-43.5174.8-161.5178.1-176.3-176.80111.9E386 E387 L388 L393 E394E386-K390 WeakPolarHBondContact O-CB 3.3Å; E386-K390 PolarHBondContact O-N 3.01Å; E387-K390 WeakPolarHBondContact O-CB 3.45Å; E387-K390 PolarHBondContact O-N 3.4Å; L388-K390 VanDerWaalsContact C-N 3.32Å; L388-K390 PolarHBondContact O-N 3.47Å; K390-L393 WeakPolarHBondContact O-CB 3.37Å; K390-L393 PolarHBondContact O-N 3.41Å; K390-E394 PolarHBondContact O-N 3.4Å
391S66.3Low60.7Low61 Ų61109.6 Ų109.643%0.42757%0.565SS.*Hα-helixtrans-65.8-35.9173.1-61.70000112.8E387 L388 L393 E394 I395E387-S391 PolarHBondContact O-N 3.5Å; E387-S391 PolarHBondContact O-OG 2.94Å; L388-S391 PolarHBondContact O-N 2.95Å; S391-L393 VanDerWaalsContact C-N 3.32Å; S391-E394 PolarHBondContact O-N 3.06Å; S391-I395 VanDerWaalsContact O-CG1 3.3Å; S391-I395 WeakPolarHBondContact O-CG1 3.43Å; S391-I395 PolarHBondContact O-N 3.19Å
392L58.4Low59.3Low109 Ų109114.9 Ų114.957%0.57158%0.583SS**Hα-helixtrans-62.9-37.6170.9-97.8158.6000112.1L388 N389 I395 S396L388-L392 WeakPolarHBondContact O-CB 3.27Å; L388-L392 PolarHBondContact O-N 3.43Å; N389-L392 PolarHBondContact O-N 2.91Å; L392-I395 PolarHBondContact O-N 3.3Å; L392-S396 PolarHBondContact O-N 2.94Å
393L61.4Low57.8Low102 Ų102113.7 Ų113.753%0.53459%0.594SS.*Hα-helixtrans-64.8-45.5175.9-156.176.2000111.3N389 K390 S391 I395 S396 Q397N389-L393 PolarHBondContact O-N 3.42Å; K390-L393 WeakPolarHBondContact O-CB 3.37Å; K390-L393 PolarHBondContact O-N 3.41Å; S391-L393 VanDerWaalsContact C-N 3.32Å; L393-I395 PolarHBondContact O-N 3.48Å; L393-S396 PolarHBondContact O-N 3.45Å; L393-S396 PolarHBondContact O-OG 3.21Å; L393-Q397 WeakPolarHBondContact O-CG 3.43Å; L393-Q397 PolarHBondContact O-N 3.39Å
394E59.6Low56.5Low114 Ų114115.5 Ų115.553%0.53361%0.607SS.*Hα-helixtrans-61.4-41.8175.6-71.3174.716800112.2K390 S391 S396 Q397 M398K390-E394 PolarHBondContact O-N 3.4Å; S391-E394 PolarHBondContact O-N 3.06Å; E394-S396 PolarHBondContact O-N 3.45Å; E394-Q397 PolarHBondContact O-N 3.48Å; E394-M398 PolarHBondContact O-N 3.12Å; E394-M398 VanDerWaalsContact O-N 3.12Å
395I59.8Low55.5Low104 Ų104119.2 Ų119.253%0.53362%0.622SS.*Hα-helixtrans-62.6-41.9173.7-68.8165.9000111.1S391 L392 L393 Q397 M398 V399S391-I395 VanDerWaalsContact O-CG1 3.3Å; S391-I395 WeakPolarHBondContact O-CG1 3.43Å; S391-I395 PolarHBondContact O-N 3.19Å; L392-I395 PolarHBondContact O-N 3.3Å; L393-I395 PolarHBondContact O-N 3.48Å; I395-Q397 VanDerWaalsContact C-N 3.3Å; I395-Q397 PolarHBondContact O-N 3.04Å; I395-M398 PolarHBondContact O-N 3.39Å; I395-V399 HydrophobicContact CG2-CG2 4.46Å; I395-V399 WeakPolarHBondContact O-CG2 3.49Å; I395-V399 PolarHBondContact O-N 3.18Å; I395-V399 VanDerWaalsContact O-N 3.09Å
396S53.9Low54.2Low53 Ų53120.2 Ų120.237%0.37163%0.63SS.*Hα-helixtrans-64.2-34.6178.175.30000112.7L392 L393 E394 V399 F400L392-S396 PolarHBondContact O-N 2.94Å; L393-S396 PolarHBondContact O-N 3.45Å; L393-S396 PolarHBondContact O-OG 3.21Å; E394-S396 PolarHBondContact O-N 3.45Å; S396-V399 PolarHBondContact O-N 2.68Å; S396-F400 PolarHBondContact O-N 3.09Å
397Q54.3Low53.2Low124 Ų124124.3 Ų124.358%0.57966%0.664SS**Hα-helixtrans-68.9-34.4174.6-71.5177.7-5.300112.7L393 E394 I395 T401L393-Q397 WeakPolarHBondContact O-CG 3.43Å; L393-Q397 PolarHBondContact O-N 3.39Å; E394-Q397 PolarHBondContact O-N 3.48Å; I395-Q397 VanDerWaalsContact C-N 3.3Å; I395-Q397 PolarHBondContact O-N 3.04Å; Q397-T401 PolarHBondContact O-OG1 3.23Å
398M54Low52.6Low157 Ų157125 Ų12577%0.77367%0.671SS**Hα-helixtrans-72.1-31.5174.6-71.9-169.674.300113.6E394 I395E394-M398 PolarHBondContact O-N 3.12Å; E394-M398 VanDerWaalsContact O-N 3.12Å; I395-M398 PolarHBondContact O-N 3.39Å
399V55.7Low52Low111 Ų111126.2 Ų126.267%0.67368%0.679SS**Hα-helixtrans-77.3-26.2-178.2172.30000112.7I395 S396I395-V399 HydrophobicContact CG2-CG2 4.46Å; I395-V399 WeakPolarHBondContact O-CG2 3.49Å; I395-V399 PolarHBondContact O-N 3.18Å; I395-V399 VanDerWaalsContact O-N 3.09Å; S396-V399 PolarHBondContact O-N 2.68Å
400F51Low51.3Low174 Ų174127.4 Ų127.476%0.76369%0.685SS**THydrogen-bonded Turntrans-92.53-175.1-89.9-81.1000116.4S396 K402S396-F400 PolarHBondContact O-N 3.09Å; F400-K402 PolarHBondContact O-N 3.49Å
401T43.3Very low50.4Low115 Ų115126.5 Ų126.571%0.70669%0.689SS**  trans-104.268.6-174.838.50000114.6Q397Q397-T401 PolarHBondContact O-OG1 3.23Å
402K36.4Very low49.4Very low209 Ų209130.6 Ų130.691%0.90971%0.705SS**SBendtrans-154.554.5157.3-124.6-178.3-171.4-176.80116.3F400F400-K402 PolarHBondContact O-N 3.49Å
403A32.6Very low48.8Very low93 Ų93132 Ų13277%0.76971%0.714SS**  trans-167.7148.5156.100000111.9
404P43.3Very low47.9Very low115 Ų115134.1 Ų134.175%0.74773%0.727SS**  trans-96.3177.8169.738.9-34.9000111.7
405F44.2Very low47Very low192 Ų192135.7 Ų135.784%0.84274%0.742SS**  cis45120.6-20.6-82.6-92.5000124.3
406P39.6Very low45.9Very low108 Ų108138.3 Ų138.370%0.70176%0.76SS**  trans-115.6-168132.138.5-27.8000111.9
407T42.6Very low45.2Very low209 Ų209146.1 Ų146.1100%1.28280%0.795SS**  trans72.30-171.632.30000117.7

Retrieved 407 of 407 residues in 493.2 ms (Link to these results)

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