A0A077ZCZ7_TRITR Loading...

G-protein coupled receptors family 1 profile domain-containing protein

AlphaFold DB , UniProt , Accession A0A077ZCZ7, Species TRITR (Trichuris trichiura, Whipworm), Gene n/a, Length 342 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
1M45.8Very low44.7Very low221 Ų221112.7 Ų112.7100%1.08961%0.614SS**  0-25.70-71.7-175.4-177.900115.9G3 V4M1-G3 VanDerWaalsContact C-N 3.29Å; M1-G3 PolarHBondContact O-N 2.76Å; M1-V4 PolarHBondContact O-N 2.67Å
2R45.9Very low44.9Very low229 Ų229111 Ų11186%0.86461%0.609SS**Hα-helixtrans-62.5-24.9178.9-73-177.5-173173.72.7115.6
3G42.8Very low45.2Very low48 Ų48112.8 Ų112.850%0.49560%0.601SS.*Hα-helixtrans-72.7-40.2179.500000114M1 K6 V7M1-G3 VanDerWaalsContact C-N 3.29Å; M1-G3 PolarHBondContact O-N 2.76Å; G3-K6 PolarHBondContact O-N 2.7Å; G3-V7 WeakPolarHBondContact O-CG2 3.34Å; G3-V7 PolarHBondContact O-N 2.65Å
4V45.6Very low45.6Very low95 Ų95111.4 Ų111.458%0.57659%0.587SS**Hα-helixtrans-68.7-38.7-178.1-177.90000111M1 K6 V7 F8M1-V4 PolarHBondContact O-N 2.67Å; V4-K6 VanDerWaalsContact C-N 3.34Å; V4-K6 PolarHBondContact O-N 3.17Å; V4-V7 PolarHBondContact O-N 2.84Å; V4-F8 HydrophobicContact CG1-CD2 3.91Å; V4-F8 HydrophobicContact CG1-CE2 4.31Å; V4-F8 WeakPolarHBondContact O-CB 3.38Å; V4-F8 PolarHBondContact O-N 3.22Å
5A44.9Very low46Very low64 Ų64108.1 Ų108.153%0.52957%0.574SS.*Hα-helixtrans-62.9-37.2174.400000112.6A9A5-A9 WeakPolarHBondContact O-CB 3.34Å; A5-A9 PolarHBondContact O-N 3.39Å
6K45.7Very low46.6Very low155 Ų155107.7 Ų107.767%0.67457%0.573SS**Hα-helixtrans-67.9-39.6173.6-96.3-178.8177.5177.70112.3G3 V4 N10G3-K6 PolarHBondContact O-N 2.7Å; V4-K6 VanDerWaalsContact C-N 3.34Å; V4-K6 PolarHBondContact O-N 3.17Å; K6-N10 VanDerWaalsContact O-CB 3.24Å; K6-N10 WeakPolarHBondContact O-CB 3.18Å; K6-N10 VanDerWaalsContact O-CG 3.23Å; K6-N10 PolarHBondContact O-N 3.48Å; K6-N10 PolarHBondContact O-ND2 3.39Å
7V48.9Very low47.4Very low98 Ų98103.5 Ų103.559%0.59455%0.551SS**Hα-helixtrans-67.9-44.8177.2175.20000110.7G3 V4 N10 A11G3-V7 WeakPolarHBondContact O-CG2 3.34Å; G3-V7 PolarHBondContact O-N 2.65Å; V4-V7 PolarHBondContact O-N 2.84Å; V7-N10 PolarHBondContact O-N 3.49Å; V7-A11 VanDerWaalsContact O-CB 3.28Å; V7-A11 WeakPolarHBondContact O-CB 3.49Å; V7-A11 PolarHBondContact O-N 3.23Å
8F41Very low48Very low142 Ų142100 Ų10062%0.62354%0.538SS*.Hα-helixtrans-65.1-44.6175.2-101.5-88.1000112.3V4 N10 A11 V12V4-F8 HydrophobicContact CG1-CD2 3.91Å; V4-F8 HydrophobicContact CG1-CE2 4.31Å; V4-F8 WeakPolarHBondContact O-CB 3.38Å; V4-F8 PolarHBondContact O-N 3.22Å; F8-N10 VanDerWaalsContact C-N 3.28Å; F8-N10 PolarHBondContact O-N 3.42Å; F8-A11 PolarHBondContact O-N 3.43Å; F8-A11 VanDerWaalsContact O-N 3.14Å; F8-V12 WeakPolarHBondContact O-CB 3.49Å; F8-V12 WeakPolarHBondContact O-CG2 3.24Å; F8-V12 PolarHBondContact O-N 3.01Å
9A48Very low48.6Very low47 Ų47100.2 Ų100.239%0.38854%0.538SS..Hα-helixtrans-60.8-38.9175.100000111.6A5 R13A5-A9 WeakPolarHBondContact O-CB 3.34Å; A5-A9 PolarHBondContact O-N 3.39Å; A9-R13 WeakPolarHBondContact O-CB 3.46Å; A9-R13 PolarHBondContact O-N 3.46Å
10N42Very low49.2Very low85 Ų8596.8 Ų96.846%0.45552%0.519SS..Hα-helixtrans-70.7-35.9174.2-77.6-19000112.6K6 V7 F8 K14K6-N10 VanDerWaalsContact O-CB 3.24Å; K6-N10 WeakPolarHBondContact O-CB 3.18Å; K6-N10 VanDerWaalsContact O-CG 3.23Å; K6-N10 PolarHBondContact O-N 3.48Å; K6-N10 PolarHBondContact O-ND2 3.39Å; V7-N10 PolarHBondContact O-N 3.49Å; F8-N10 VanDerWaalsContact C-N 3.28Å; F8-N10 PolarHBondContact O-N 3.42Å; N10-K14 VanDerWaalsContact O-CB 3.31Å; N10-K14 WeakPolarHBondContact O-CB 3.25Å; N10-K14 WeakPolarHBondContact O-CD 3.31Å; N10-K14 WeakPolarHBondContact O-CG 3.03Å; N10-K14 PolarHBondContact O-N 2.92Å; N10-K14 VanDerWaalsContact O-N 3.15Å
11A41.5Very low49.8Very low56 Ų5693 Ų9346%0.46350%0.499SS..Hα-helixtrans-72.6-37179.600000112.7V7 F8 P15V7-A11 VanDerWaalsContact O-CB 3.28Å; V7-A11 WeakPolarHBondContact O-CB 3.49Å; V7-A11 PolarHBondContact O-N 3.23Å; F8-A11 PolarHBondContact O-N 3.43Å; F8-A11 VanDerWaalsContact O-N 3.14Å; A11-P15 WeakPolarHBondContact O-CD 3.35Å
12V46.9Very low50.6Low92 Ų9286.3 Ų86.356%0.55847%0.47SS*.Hα-helixtrans-79.5-29.8177.2176.20000112F8 P15F8-V12 WeakPolarHBondContact O-CB 3.49Å; F8-V12 WeakPolarHBondContact O-CG2 3.24Å; F8-V12 PolarHBondContact O-N 3.01Å; V12-P15 VanDerWaalsContact O-CD 3.29Å; V12-P15 WeakPolarHBondContact O-CD 3.13Å; V12-P15 VanDerWaalsContact O-CG 3.28Å; V12-P15 WeakPolarHBondContact O-CG 3.29Å
13R49Very low51.5Low135 Ų13580.8 Ų80.851%0.50945%0.454SS..Hα-helixtrans-76.2-32.9176.3-168.1177-71.6176.5-3.4113A9 N16 D17A9-R13 WeakPolarHBondContact O-CB 3.46Å; A9-R13 PolarHBondContact O-N 3.46Å; R13-N16 PolarHBondContact O-N 3.09Å; R13-D17 PolarHBondContact O-N 2.69Å
14K50.4Low52.5Low93 Ų9378.8 Ų78.840%0.40443%0.432SS..Hα-helixtrans-58.1-41.8179-86.7172.2-175.8-173.60116.7N10 N16 A18N10-K14 VanDerWaalsContact O-CB 3.31Å; N10-K14 WeakPolarHBondContact O-CB 3.25Å; N10-K14 WeakPolarHBondContact O-CD 3.31Å; N10-K14 WeakPolarHBondContact O-CG 3.03Å; N10-K14 PolarHBondContact O-N 2.92Å; N10-K14 VanDerWaalsContact O-N 3.15Å; K14-N16 VanDerWaalsContact C-N 3.35Å; K14-A18 PolarHBondContact O-N 2.9Å
15P51.8Low53.4Low61 Ų6174.7 Ų74.740%0.39641%0.407SS..Hα-helixtrans-65.8-38.4177.122.3-32.8000111.6A11 V12 D17 A18 I19A11-P15 WeakPolarHBondContact O-CD 3.35Å; V12-P15 VanDerWaalsContact O-CD 3.29Å; V12-P15 WeakPolarHBondContact O-CD 3.13Å; V12-P15 VanDerWaalsContact O-CG 3.28Å; V12-P15 WeakPolarHBondContact O-CG 3.29Å; P15-D17 PolarHBondContact O-N 3.45Å; P15-A18 PolarHBondContact O-N 2.86Å; P15-I19 WeakPolarHBondContact O-CD1 3.19Å; P15-I19 VanDerWaalsContact O-CG1 3.24Å; P15-I19 WeakPolarHBondContact O-CG1 3.49Å; P15-I19 PolarHBondContact O-N 3.48Å
16N56.1Low54.5Low102 Ų10276.4 Ų76.455%0.54541%0.407SS..Hα-helixtrans-64.1-39-179.7-68.2-6.6000112.3R13 K14 I19 L20R13-N16 PolarHBondContact O-N 3.09Å; K14-N16 VanDerWaalsContact C-N 3.35Å; N16-I19 PolarHBondContact O-N 3.49Å; N16-L20 VanDerWaalsContact O-CB 3.32Å; N16-L20 WeakPolarHBondContact O-CB 3.41Å; N16-L20 PolarHBondContact O-N 2.93Å
17D59.6Low55.7Low37 Ų3771 Ų7120%0.19839%0.389CS..Hα-helixtrans-68.2-36.5177.2-71.4-27.9000112.4R13 P15 H21 Y105R13-D17 PolarHBondContact O-N 2.69Å; P15-D17 PolarHBondContact O-N 3.45Å; D17-H21 PolarHBondContact O-N 3.05Å; D17-H21 VanDerWaalsContact O-N 3.17Å; D17-Y105 HydrophobicContact CB-CD1 3.89Å; D17-Y105 HydrophobicContact CB-CE1 4.06Å
18A57.4Low56.7Low40 Ų4066.7 Ų66.733%0.33136%0.362SS..Hα-helixtrans-68.2-44175.300000111.6K14 P15 H21 V22K14-A18 PolarHBondContact O-N 2.9Å; P15-A18 PolarHBondContact O-N 2.86Å; A18-H21 PolarHBondContact O-N 3.45Å; A18-V22 WeakPolarHBondContact O-CG2 3.27Å; A18-V22 PolarHBondContact O-N 3.32Å; A18-V22 VanDerWaalsContact O-N 3.08Å
19I60.5Low58.4Low103 Ų10360.4 Ų60.453%0.52834%0.335SS..Hα-helixtrans-59.8-47.5175.7-68.4164.5000110.2P15 N16 H21 V22 E23P15-I19 WeakPolarHBondContact O-CD1 3.19Å; P15-I19 VanDerWaalsContact O-CG1 3.24Å; P15-I19 WeakPolarHBondContact O-CG1 3.49Å; P15-I19 PolarHBondContact O-N 3.48Å; N16-I19 PolarHBondContact O-N 3.49Å; I19-H21 VanDerWaalsContact C-N 3.27Å; I19-H21 PolarHBondContact O-N 3.31Å; I19-V22 PolarHBondContact O-N 3.47Å; I19-E23 WeakPolarHBondContact O-CB 3.39Å; I19-E23 PolarHBondContact O-N 3.34Å
20L60Low59.9Low32 Ų3260.7 Ų60.717%0.16834%0.337CS..Hα-helixtrans-59.4-37.3179.1-175.569.2000112.3N16 N24 R106N16-L20 VanDerWaalsContact O-CB 3.32Å; N16-L20 WeakPolarHBondContact O-CB 3.41Å; N16-L20 PolarHBondContact O-N 2.93Å; L20-N24 WeakPolarHBondContact O-CB 3.12Å; L20-N24 VanDerWaalsContact O-CG 3.22Å; L20-N24 PolarHBondContact O-N 3.27Å; L20-N24 PolarHBondContact O-ND2 3.22Å; L20-R106 HydrophobicContact CD2-CB 4.26Å; L20-R106 HydrophobicContact CD2-CG 3.7Å
21H61.1Low61.8Low19 Ų1958 Ų589%0.08833%0.329CS..Hα-helixtrans-71.8-39.9177.2-176.5-91.1000112.6D17 A18 I19 E23 N24 T25 R94 Y105 I109D17-H21 PolarHBondContact O-N 3.05Å; D17-H21 VanDerWaalsContact O-N 3.17Å; A18-H21 PolarHBondContact O-N 3.45Å; I19-H21 VanDerWaalsContact C-N 3.27Å; I19-H21 PolarHBondContact O-N 3.31Å; H21-E23 VanDerWaalsContact C-N 3.33Å; H21-N24 PolarHBondContact O-N 2.9Å; H21-T25 WeakPolarHBondContact O-CB 3.44Å; H21-T25 PolarHBondContact O-N 2.78Å; H21-T25 PolarHBondContact O-OG1 3.43Å; H21-R94 PolarHBondContact CE1-NH1 3.47Å; H21-R94 PolarHBondContact CE1-NH2 2.94Å; H21-R94 PolarHBondContact NE2-NH2 3.33Å; H21-Y105 HydrophobicContact CB-CE1 4.46Å; H21-Y105 WeakPolarHBondContact CB-OH 3.33Å; H21-Y105 PolarHBondContact CD2-OH 3.18Å; H21-Y105 VanDerWaalsContact CG-OH 3.28Å; H21-I109 HydrophobicContact CB-CD1 4.39Å
22V63.5Low63.8Low79 Ų7955.3 Ų55.348%0.47931%0.307SS..Hα-helixtrans-59.7-46.4173.2173.50000110A18 I19 N24 T25 L26A18-V22 WeakPolarHBondContact O-CG2 3.27Å; A18-V22 PolarHBondContact O-N 3.32Å; A18-V22 VanDerWaalsContact O-N 3.08Å; I19-V22 PolarHBondContact O-N 3.47Å; V22-N24 PolarHBondContact O-N 3.14Å; V22-T25 PolarHBondContact O-N 3.45Å; V22-L26 VanDerWaalsContact O-CB 3.31Å; V22-L26 WeakPolarHBondContact O-CB 3.39Å; V22-L26 PolarHBondContact O-N 2.92Å
23E64.3Low65.5Low114 Ų11453 Ų5353%0.53330%0.297SS..Hα-helixtrans-62.1-39.4177.5-168.7-177.4170.900112.7I19 H21 L26 S27I19-E23 WeakPolarHBondContact O-CB 3.39Å; I19-E23 PolarHBondContact O-N 3.34Å; H21-E23 VanDerWaalsContact C-N 3.33Å; E23-L26 WeakPolarHBondContact O-CB 3.5Å; E23-L26 PolarHBondContact O-N 2.81Å; E23-S27 PolarHBondContact O-N 3.47Å
24N64Low67.3Low5 Ų555 Ų553%0.02731%0.305CS..Hα-helixtrans-72.6-39.7178.2-72.9-42.2000112.9L20 H21 V22 L26 S27 L28 I109 K113L20-N24 WeakPolarHBondContact O-CB 3.12Å; L20-N24 VanDerWaalsContact O-CG 3.22Å; L20-N24 PolarHBondContact O-N 3.27Å; L20-N24 PolarHBondContact O-ND2 3.22Å; H21-N24 PolarHBondContact O-N 2.9Å; V22-N24 PolarHBondContact O-N 3.14Å; N24-L26 VanDerWaalsContact C-N 3.26Å; N24-L26 PolarHBondContact O-N 3.03Å; N24-S27 PolarHBondContact O-N 3.26Å; N24-S27 PolarHBondContact O-OG 2.93Å; N24-L28 PolarHBondContact O-N 3.33Å; N24-L28 VanDerWaalsContact O-N 3.15Å; N24-I109 HydrophobicContact CB-CG2 3.94Å; N24-I109 WeakPolarHBondContact ND2-CG2 3.32Å; N24-K113 WeakPolarHBondContact OD1-CD 3.27Å; N24-K113 PolarHBondContact OD1-NZ 3.14Å
25T65Low69.1Low10 Ų1051.1 Ų51.16%0.06129%0.289CS..Hα-helixtrans-56.3-47.5170.2-43.40000109.3H21 V22 S27 L28 D29 R94H21-T25 WeakPolarHBondContact O-CB 3.44Å; H21-T25 PolarHBondContact O-N 2.78Å; H21-T25 PolarHBondContact O-OG1 3.43Å; V22-T25 PolarHBondContact O-N 3.45Å; T25-S27 VanDerWaalsContact C-N 3.31Å; T25-S27 PolarHBondContact O-N 3.4Å; T25-L28 PolarHBondContact O-N 3.31Å; T25-D29 VanDerWaalsContact O-CB 3.31Å; T25-D29 WeakPolarHBondContact O-CB 3.44Å; T25-D29 PolarHBondContact O-N 3.3Å; T25-R94 PolarHBondContact OG1-NH1 3.33Å; T25-R94 PolarHBondContact OG1-NH2 3.18Å
26L68.7Low70.7Confident100 Ų10049.3 Ų49.352%0.52428%0.276SS..Hα-helixtrans-60.4-37.8178.4-173.668.3000112.6V22 E23 N24 A30V22-L26 VanDerWaalsContact O-CB 3.31Å; V22-L26 WeakPolarHBondContact O-CB 3.39Å; V22-L26 PolarHBondContact O-N 2.92Å; E23-L26 WeakPolarHBondContact O-CB 3.5Å; E23-L26 PolarHBondContact O-N 2.81Å; N24-L26 VanDerWaalsContact C-N 3.26Å; N24-L26 PolarHBondContact O-N 3.03Å; L26-A30 VanDerWaalsContact O-CB 3.23Å; L26-A30 WeakPolarHBondContact O-CB 3.3Å; L26-A30 PolarHBondContact O-N 3.34Å
27S69.7Low72.2Confident42 Ų4247.6 Ų47.629%0.29427%0.269SS..Hα-helixtrans-69.7-37.9178.870.90000113.7E23 N24 T25 A30 G31 K113E23-S27 PolarHBondContact O-N 3.47Å; N24-S27 PolarHBondContact O-N 3.26Å; N24-S27 PolarHBondContact O-OG 2.93Å; T25-S27 VanDerWaalsContact C-N 3.31Å; T25-S27 PolarHBondContact O-N 3.4Å; S27-A30 PolarHBondContact O-N 3.4Å; S27-G31 PolarHBondContact O-N 3.23Å; S27-G31 VanDerWaalsContact O-N 3.13Å; S27-K113 WeakPolarHBondContact OG-CE 2.91Å
28L71.2Confident73.7Confident7 Ų748.4 Ų48.44%0.03728%0.276CS..Hα-helixtrans-74.1-38.6174.9-72.1173000110.9N24 T25 A30 G31 F32 L90 D93 I120N24-L28 PolarHBondContact O-N 3.33Å; N24-L28 VanDerWaalsContact O-N 3.15Å; T25-L28 PolarHBondContact O-N 3.31Å; L28-A30 VanDerWaalsContact C-N 3.27Å; L28-A30 PolarHBondContact O-N 3.02Å; L28-G31 PolarHBondContact O-N 3.41Å; L28-G31 VanDerWaalsContact O-N 3.17Å; L28-F32 PolarHBondContact O-N 3.39Å; L28-L90 HydrophobicContact CB-CD2 3.39Å; L28-L90 HydrophobicContact CB-CG 4.01Å; L28-L90 HydrophobicContact CD1-CD2 4.18Å; L28-L90 HydrophobicContact CG-CD2 4.44Å; L28-D93 HydrophobicContact CD1-CB 4.29Å; L28-I120 HydrophobicContact CD2-CD1 4.35Å
29D76.2Confident75.1Confident10 Ų1047.1 Ų47.15%0.05326%0.263CS..Hα-helixtrans-59.6-39.5171.2-72-16.5000110.8T25 F32 A33 L90 Q263T25-D29 VanDerWaalsContact O-CB 3.31Å; T25-D29 WeakPolarHBondContact O-CB 3.44Å; T25-D29 PolarHBondContact O-N 3.3Å; D29-F32 PolarHBondContact O-N 3.28Å; D29-A33 WeakPolarHBondContact O-CB 3.21Å; D29-A33 PolarHBondContact O-N 3.25Å; D29-L90 WeakPolarHBondContact OD1-CD1 3.28Å; D29-L90 WeakPolarHBondContact OD1-CD2 3.17Å; D29-Q263 PolarHBondContact OD2-NE2 3.33Å
30A79.3Confident76.4Confident53 Ų5343.8 Ų43.844%0.43825%0.254SS..Hα-helixtrans-64.6-39.9174.900000112.1L26 S27 L28 F32 A33 W34L26-A30 VanDerWaalsContact O-CB 3.23Å; L26-A30 WeakPolarHBondContact O-CB 3.3Å; L26-A30 PolarHBondContact O-N 3.34Å; S27-A30 PolarHBondContact O-N 3.4Å; L28-A30 VanDerWaalsContact C-N 3.27Å; L28-A30 PolarHBondContact O-N 3.02Å; A30-F32 VanDerWaalsContact C-N 3.34Å; A30-F32 PolarHBondContact O-N 3.1Å; A30-A33 PolarHBondContact O-N 2.99Å; A30-W34 WeakPolarHBondContact O-CB 3.29Å; A30-W34 PolarHBondContact O-N 2.99Å
31G81.2Confident77.8Confident27 Ų2747.5 Ų47.528%0.27827%0.274SS..Hα-helixtrans-61.6-41.5174.200000112.6S27 L28 W34 S35S27-G31 PolarHBondContact O-N 3.23Å; S27-G31 VanDerWaalsContact O-N 3.13Å; L28-G31 PolarHBondContact O-N 3.41Å; L28-G31 VanDerWaalsContact O-N 3.17Å; G31-W34 PolarHBondContact O-N 2.96Å; G31-S35 PolarHBondContact O-N 3.06Å; G31-S35 PolarHBondContact O-OG 3.22Å
32F83.4Confident79.1Confident1 Ų147 Ų470%0.00427%0.273CS..Hα-helixtrans-65.5-44.8173.4-175-98.8000112.2L28 D29 A30 W34 S35 I36 G83 I87 M252 Y255L28-F32 PolarHBondContact O-N 3.39Å; D29-F32 PolarHBondContact O-N 3.28Å; A30-F32 VanDerWaalsContact C-N 3.34Å; A30-F32 PolarHBondContact O-N 3.1Å; F32-W34 VanDerWaalsContact C-N 3.31Å; F32-W34 PolarHBondContact O-N 3.06Å; F32-S35 WeakPolarHBondContact O-CB 3.37Å; F32-S35 PolarHBondContact O-N 3.41Å; F32-S35 VanDerWaalsContact O-N 3.1Å; F32-I36 HydrophobicContact CD1-CD1 3.66Å; F32-I36 HydrophobicContact CD1-CG1 4.25Å; F32-I36 HydrophobicContact CE1-CD1 3.19Å; F32-I36 HydrophobicContact CE1-CG1 3.72Å; F32-I36 HydrophobicContact CZ-CD1 3.96Å; F32-I36 HydrophobicContact CZ-CG1 4.02Å; F32-I36 PolarHBondContact O-N 3.47Å; F32-G83 WeakPolarHBondContact CD2-O 3.1Å; F32-I87 HydrophobicContact CD2-CD1 4.06Å; F32-I87 HydrophobicContact CD2-CG1 3.56Å; F32-I87 HydrophobicContact CE2-CD1 3.37Å; F32-I87 HydrophobicContact CE2-CG1 3.43Å; F32-I87 VanDerWaalsContact CE2-CG1 3.43Å; F32-I87 HydrophobicContact CG-CG1 4.4Å; F32-I87 HydrophobicContact CZ-CD1 3.77Å; F32-I87 HydrophobicContact CZ-CG1 4.16Å; F32-M252 HydrophobicContact CE2-CE 4.46Å; F32-M252 HydrophobicContact CZ-CE 4.3Å; F32-M252 HydrophobicContact CZ-SD 4.09Å; F32-Y255 AromaticContact CD1-CD1 3.7Å; F32-Y255 HydrophobicContact CD1-CD1 3.7Å; F32-Y255 HydrophobicContact CD1-CD2 4.35Å; F32-Y255 AromaticContact CD1-CE1 3.18Å; F32-Y255 HydrophobicContact CD1-CE1 3.18Å; F32-Y255 AromaticContact CD1-CE2 3.84Å; F32-Y255 HydrophobicContact CD1-CE2 3.84Å; F32-Y255 HydrophobicContact CD1-CG 4.28Å; F32-Y255 AromaticContact CD1-CZ 3.26Å; F32-Y255 AromaticContact CE1-CD1 3.2Å; F32-Y255 HydrophobicContact CE1-CD1 3.2Å; F32-Y255 AromaticContact CE1-CD2 3.44Å; F32-Y255 HydrophobicContact CE1-CD2 3.44Å; F32-Y255 VanDerWaalsContact CE1-CD2 3.44Å; F32-Y255 AromaticContact CE1-CE1 3.15Å; F32-Y255 HydrophobicContact CE1-CE1 3.15Å; F32-Y255 AromaticContact CE1-CE2 3.32Å; F32-Y255 HydrophobicContact CE1-CE2 3.32Å; F32-Y255 AromaticContact CE1-CG 3.37Å; F32-Y255 HydrophobicContact CE1-CG 3.37Å; F32-Y255 AromaticContact CE1-CZ 3.22Å; F32-Y255 HydrophobicContact CG-CE1 4.39Å; F32-Y255 HydrophobicContact CZ-CD1 4.28Å; F32-Y255 AromaticContact CZ-CD2 3.8Å; F32-Y255 HydrophobicContact CZ-CD2 3.8Å; F32-Y255 HydrophobicContact CZ-CE1 4.34Å; F32-Y255 AromaticContact CZ-CE2 3.78Å; F32-Y255 HydrophobicContact CZ-CE2 3.78Å; F32-Y255 HydrophobicContact CZ-CG 4.04Å
33A84.2Confident80.2Confident42 Ų4245.4 Ų45.435%0.34727%0.268SS..Hα-helixtrans-59.3-41.6175.900000111.9D29 A30 S35 I36 V37D29-A33 WeakPolarHBondContact O-CB 3.21Å; D29-A33 PolarHBondContact O-N 3.25Å; A30-A33 PolarHBondContact O-N 2.99Å; A33-S35 VanDerWaalsContact C-N 3.32Å; A33-S35 PolarHBondContact O-N 3.3Å; A33-I36 WeakPolarHBondContact O-CB 3.35Å; A33-I36 PolarHBondContact O-N 3.05Å; A33-V37 WeakPolarHBondContact O-CG2 3.39Å; A33-V37 PolarHBondContact O-N 3.39Å
34W85.8Confident81.3Confident179 Ų17945 Ų4568%0.67827%0.268SS*.Hα-helixtrans-63.3-38.9174.7-126.6-139.5000112.2A30 G31 F32 I36 V37 V38A30-W34 WeakPolarHBondContact O-CB 3.29Å; A30-W34 PolarHBondContact O-N 2.99Å; G31-W34 PolarHBondContact O-N 2.96Å; F32-W34 VanDerWaalsContact C-N 3.31Å; F32-W34 PolarHBondContact O-N 3.06Å; W34-I36 VanDerWaalsContact C-N 3.32Å; W34-I36 PolarHBondContact O-N 3.01Å; W34-V37 HydrophobicContact CE3-CB 4.4Å; W34-V37 HydrophobicContact CE3-CG2 4.29Å; W34-V37 HydrophobicContact CZ3-CG2 4.37Å; W34-V37 PolarHBondContact O-N 3.47Å; W34-V38 WeakPolarHBondContact O-CB 3.23Å; W34-V38 VanDerWaalsContact O-CG2 3.27Å; W34-V38 WeakPolarHBondContact O-CG2 3.48Å; W34-V38 PolarHBondContact O-N 3.23Å
35S87.7Confident82.5Confident10 Ų1046.2 Ų46.27%0.0728%0.281CS..Hα-helixtrans-60.8-42.3174.1-560000111.2G31 F32 A33 N39 S79G31-S35 PolarHBondContact O-N 3.06Å; G31-S35 PolarHBondContact O-OG 3.22Å; F32-S35 WeakPolarHBondContact O-CB 3.37Å; F32-S35 PolarHBondContact O-N 3.41Å; F32-S35 VanDerWaalsContact O-N 3.1Å; A33-S35 VanDerWaalsContact C-N 3.32Å; A33-S35 PolarHBondContact O-N 3.3Å; S35-N39 VanDerWaalsContact O-CB 3.23Å; S35-N39 WeakPolarHBondContact O-CB 3.44Å; S35-N39 PolarHBondContact O-N 2.9Å; S35-S79 WeakPolarHBondContact O-CB 3.11Å
36I85.1Confident83.5Confident23 Ų2346.1 Ų46.112%0.11828%0.282CS..Hα-helixtrans-62.9-46.5174.8-62.7162.6000111.6F32 A33 W34 N39 G40 M252 Y255 P256F32-I36 HydrophobicContact CD1-CD1 3.66Å; F32-I36 HydrophobicContact CD1-CG1 4.25Å; F32-I36 HydrophobicContact CE1-CD1 3.19Å; F32-I36 HydrophobicContact CE1-CG1 3.72Å; F32-I36 HydrophobicContact CZ-CD1 3.96Å; F32-I36 HydrophobicContact CZ-CG1 4.02Å; F32-I36 PolarHBondContact O-N 3.47Å; A33-I36 WeakPolarHBondContact O-CB 3.35Å; A33-I36 PolarHBondContact O-N 3.05Å; W34-I36 VanDerWaalsContact C-N 3.32Å; W34-I36 PolarHBondContact O-N 3.01Å; I36-N39 PolarHBondContact O-N 3.01Å; I36-G40 PolarHBondContact O-N 3.03Å; I36-M252 HydrophobicContact CB-CE 4.44Å; I36-M252 HydrophobicContact CG1-CE 3.7Å; I36-M252 HydrophobicContact CG1-SD 4.48Å; I36-M252 WeakPolarHBondContact CG2-O 3.47Å; I36-Y255 HydrophobicContact CD1-CD1 3.89Å; I36-Y255 HydrophobicContact CD1-CG 4.37Å; I36-P256 HydrophobicContact CD1-CG 4.29Å
37V88.5Confident84.4Confident67 Ų6744.7 Ų44.741%0.40628%0.28SS..Hα-helixtrans-61.5-47.8-179171.40000110.8A33 W34 N39 G40 L41A33-V37 WeakPolarHBondContact O-CG2 3.39Å; A33-V37 PolarHBondContact O-N 3.39Å; W34-V37 HydrophobicContact CE3-CB 4.4Å; W34-V37 HydrophobicContact CE3-CG2 4.29Å; W34-V37 HydrophobicContact CZ3-CG2 4.37Å; W34-V37 PolarHBondContact O-N 3.47Å; V37-N39 VanDerWaalsContact C-N 3.3Å; V37-N39 PolarHBondContact O-N 3.21Å; V37-G40 PolarHBondContact O-N 2.02Å; V37-L41 HydrophobicContact CG1-CD1 4.06Å; V37-L41 HydrophobicContact CG1-CG 4.49Å; V37-L41 WeakPolarHBondContact O-CG 3.49Å; V37-L41 PolarHBondContact O-N 3.34Å
38V90.4Very high85.3Confident54 Ų5446.5 Ų46.533%0.32729%0.289SS..Hα-helixtrans-61.6-41.6177.5174.20000110.7W34 L41 A42 C75W34-V38 WeakPolarHBondContact O-CB 3.23Å; W34-V38 VanDerWaalsContact O-CG2 3.27Å; W34-V38 WeakPolarHBondContact O-CG2 3.48Å; W34-V38 PolarHBondContact O-N 3.23Å; V38-L41 PolarHBondContact O-N 3.36Å; V38-A42 VanDerWaalsContact O-CB 3.26Å; V38-A42 WeakPolarHBondContact O-CB 3.41Å; V38-A42 PolarHBondContact O-N 3.13Å; V38-C75 HydrophobicContact CG1-CB 4.13Å
39N88.2Confident86.1Confident12 Ų1247.7 Ų47.76%0.06429%0.293CS..Hα-helixtrans-62.9-43.7176.7-168.827.8000112.1S35 I36 V37 A42 A43 F76 S79S35-N39 VanDerWaalsContact O-CB 3.23Å; S35-N39 WeakPolarHBondContact O-CB 3.44Å; S35-N39 PolarHBondContact O-N 2.9Å; I36-N39 PolarHBondContact O-N 3.01Å; V37-N39 VanDerWaalsContact C-N 3.3Å; V37-N39 PolarHBondContact O-N 3.21Å; N39-A42 WeakPolarHBondContact O-CB 3Å; N39-A42 PolarHBondContact O-N 3.48Å; N39-A43 PolarHBondContact O-N 3.27Å; N39-F76 WeakPolarHBondContact OD1-CD2 3.4Å; N39-F76 WeakPolarHBondContact OD1-CE2 3.25Å; N39-S79 VanDerWaalsContact CA-OG 3.32Å; N39-S79 WeakPolarHBondContact CA-OG 3.37Å; N39-S79 VanDerWaalsContact CB-OG 3.3Å; N39-S79 WeakPolarHBondContact CB-OG 3.3Å; N39-S79 PolarHBondContact N-OG 3.45Å
40G86.4Confident86.6Confident33 Ų3353.8 Ų53.834%0.3432%0.315SS..Hα-helixtrans-62.7-45.3176.500000112.6I36 V37 A42 A43 I44I36-G40 PolarHBondContact O-N 3.03Å; V37-G40 PolarHBondContact O-N 2.02Å; G40-A42 VanDerWaalsContact C-N 3.32Å; G40-A42 PolarHBondContact O-N 2.7Å; G40-A43 PolarHBondContact O-N 3.13Å; G40-I44 WeakPolarHBondContact O-CG1 3Å; G40-I44 PolarHBondContact O-N 3.11Å
41L90Very high87Confident111 Ų11156.1 Ų56.158%0.58132%0.319SS*.Hα-helixtrans-62.8-39.5175.1-71.4174.2000111.9V37 V38 I44 G45V37-L41 HydrophobicContact CG1-CD1 4.06Å; V37-L41 HydrophobicContact CG1-CG 4.49Å; V37-L41 WeakPolarHBondContact O-CG 3.49Å; V37-L41 PolarHBondContact O-N 3.34Å; V38-L41 PolarHBondContact O-N 3.36Å; L41-I44 PolarHBondContact O-N 3.16Å; L41-G45 PolarHBondContact O-N 3.06Å
42A89.4Confident87.4Confident8 Ų858.4 Ų58.47%0.06633%0.328CS..Hα-helixtrans-63.5-41.417500000112.1V38 N39 G40 G45 G46 H72 C75 F76V38-A42 VanDerWaalsContact O-CB 3.26Å; V38-A42 WeakPolarHBondContact O-CB 3.41Å; V38-A42 PolarHBondContact O-N 3.13Å; N39-A42 WeakPolarHBondContact O-CB 3Å; N39-A42 PolarHBondContact O-N 3.48Å; G40-A42 VanDerWaalsContact C-N 3.32Å; G40-A42 PolarHBondContact O-N 2.7Å; A42-G45 PolarHBondContact O-N 3.28Å; A42-G46 PolarHBondContact O-N 3.46Å; A42-H72 WeakPolarHBondContact CB-O 3.31Å; A42-C75 HydrophobicContact CB-CB 3.93Å; A42-F76 HydrophobicContact CB-CB 3.97Å
43A85.6Confident87.7Confident45 Ų4559.4 Ų59.437%0.37233%0.334SS..Hα-helixtrans-63.5-45.5175.400000111.9N39 G40 G45 G46 C47N39-A43 PolarHBondContact O-N 3.27Å; G40-A43 PolarHBondContact O-N 3.13Å; A43-G45 PolarHBondContact O-N 2.83Å; A43-G46 PolarHBondContact O-N 2.94Å; A43-C47 PolarHBondContact O-N 3.42Å; A43-C47 PolarHBondContact O-SG 2.98Å
44I88Confident87.9Confident107 Ų10762.7 Ų62.755%0.54935%0.35SS..Hα-helixtrans-60.3-46.9175.1-66.1166.6000110.3G40 L41 G46 C47 V48G40-I44 WeakPolarHBondContact O-CG1 3Å; G40-I44 PolarHBondContact O-N 3.11Å; L41-I44 PolarHBondContact O-N 3.16Å; I44-G46 VanDerWaalsContact C-N 3.29Å; I44-G46 PolarHBondContact O-N 3.25Å; I44-C47 WeakPolarHBondContact O-CB 3.32Å; I44-C47 PolarHBondContact O-N 2.87Å; I44-C47 VanDerWaalsContact O-N 3.12Å; I44-V48 HydrophobicContact CG2-CG2 4.26Å; I44-V48 WeakPolarHBondContact O-CG2 3.36Å; I44-V48 PolarHBondContact O-N 3.49Å
45G88.3Confident88.1Confident29 Ų2960.8 Ų60.830%0.29935%0.352SS..Hα-helixtrans-59.1-38.7176.800000112.9L41 A42 A43 R49L41-G45 PolarHBondContact O-N 3.06Å; A42-G45 PolarHBondContact O-N 3.28Å; A43-G45 PolarHBondContact O-N 2.83Å; G45-R49 WeakPolarHBondContact O-CB 3.42Å; G45-R49 PolarHBondContact O-N 2.84Å
46G87.1Confident88.2Confident8 Ų864.5 Ų64.58%0.08237%0.374CS..Hα-helixtrans-64.5-42.6172.800000113.1A42 A43 I44 R49 R50 H72A42-G46 PolarHBondContact O-N 3.46Å; A43-G46 PolarHBondContact O-N 2.94Å; I44-G46 VanDerWaalsContact C-N 3.29Å; I44-G46 PolarHBondContact O-N 3.25Å; G46-R49 PolarHBondContact O-N 3.38Å; G46-R50 WeakPolarHBondContact O-CG 3.17Å; G46-R50 PolarHBondContact O-N 3.47Å; G46-R50 VanDerWaalsContact O-N 3.07Å; G46-H72 WeakPolarHBondContact CA-CD2 3.35Å
47C86.6Confident88.2Confident70 Ų7071 Ų7147%0.47340%0.404SS..Hα-helixtrans-63.5-48.8175.4-71.90000112.1A43 I44 R49 R50 I51A43-C47 PolarHBondContact O-N 3.42Å; A43-C47 PolarHBondContact O-SG 2.98Å; I44-C47 WeakPolarHBondContact O-CB 3.32Å; I44-C47 PolarHBondContact O-N 2.87Å; I44-C47 VanDerWaalsContact O-N 3.12Å; C47-R49 VanDerWaalsContact C-N 3.29Å; C47-R49 PolarHBondContact O-N 3.44Å; C47-R50 PolarHBondContact O-N 3.38Å; C47-R50 VanDerWaalsContact O-N 3.13Å; C47-I51 WeakPolarHBondContact O-CG1 3.23Å; C47-I51 PolarHBondContact O-N 3.29Å
48V88.7Confident87.8Confident80 Ų8069.7 Ų69.749%0.48540%0.401SS..Hα-helixtrans-57.6-44.2177.41720000110.5I44 R50 I51 V52I44-V48 HydrophobicContact CG2-CG2 4.26Å; I44-V48 WeakPolarHBondContact O-CG2 3.36Å; I44-V48 PolarHBondContact O-N 3.49Å; V48-R50 PolarHBondContact O-N 3.42Å; V48-I51 PolarHBondContact O-N 3.27Å; V48-V52 HydrophobicContact CG1-CG2 4.37Å; V48-V52 WeakPolarHBondContact O-CG2 3.39Å; V48-V52 PolarHBondContact O-N 2.95Å
49R87.5Confident87.4Confident32 Ų3273.4 Ų73.412%0.12142%0.419CS..Hα-helixtrans-59.7-44.7176.3-176.1-178.4-177.7126.212.7112.4G45 G46 C47 I51 V52 V53 Q69 H72 A145 C147G45-R49 WeakPolarHBondContact O-CB 3.42Å; G45-R49 PolarHBondContact O-N 2.84Å; G46-R49 PolarHBondContact O-N 3.38Å; C47-R49 VanDerWaalsContact C-N 3.29Å; C47-R49 PolarHBondContact O-N 3.44Å; R49-I51 VanDerWaalsContact C-N 3.3Å; R49-I51 PolarHBondContact O-N 3.17Å; R49-V52 PolarHBondContact O-N 3.06Å; R49-V53 HydrophobicContact CG-CG2 4.34Å; R49-V53 WeakPolarHBondContact O-CG2 3.34Å; R49-V53 PolarHBondContact O-N 3.18Å; R49-Q69 PolarHBondContact NH1-O 2.9Å; R49-H72 WeakPolarHBondContact CD-CE1 3.35Å; R49-A145 PolarHBondContact NE-O 2.85Å; R49-A145 PolarHBondContact NH2-O 3.09Å; R49-C147 PolarHBondContact NH2-SG 3Å
50R87Confident87.3Confident139 Ų13980.1 Ų80.153%0.52545%0.447SS..Hα-helixtrans-61.6-40.7178.2-71.9175-170.8178.23.7111.6G46 C47 V48 T54G46-R50 WeakPolarHBondContact O-CG 3.17Å; G46-R50 PolarHBondContact O-N 3.47Å; G46-R50 VanDerWaalsContact O-N 3.07Å; C47-R50 PolarHBondContact O-N 3.38Å; C47-R50 VanDerWaalsContact O-N 3.13Å; V48-R50 PolarHBondContact O-N 3.42Å; R50-T54 WeakPolarHBondContact O-CB 3.5Å; R50-T54 PolarHBondContact O-N 2.96Å; R50-T54 PolarHBondContact O-OG1 3.2Å
51I89.1Confident87.5Confident102 Ų10279.6 Ų79.652%0.52344%0.436SS..Hα-helixtrans-62.1-51.1175.3-66.2167.1000109.9C47 V48 R49 V53 T54 L55C47-I51 WeakPolarHBondContact O-CG1 3.23Å; C47-I51 PolarHBondContact O-N 3.29Å; V48-I51 PolarHBondContact O-N 3.27Å; R49-I51 VanDerWaalsContact C-N 3.3Å; R49-I51 PolarHBondContact O-N 3.17Å; I51-V53 PolarHBondContact O-N 2.72Å; I51-T54 PolarHBondContact O-N 3.16Å; I51-T54 VanDerWaalsContact O-N 3.16Å; I51-L55 HydrophobicContact CG2-CD1 3.82Å; I51-L55 HydrophobicContact CG2-CG 4.35Å; I51-L55 WeakPolarHBondContact O-CG 3.39Å; I51-L55 PolarHBondContact O-N 3.38Å
52V89.8Confident87.3Confident74 Ų7481.3 Ų81.345%0.44844%0.435SS..Hα-helixtrans-58.1-45.8179.7171.20000111.7V48 R49 T54 L55 T56V48-V52 HydrophobicContact CG1-CG2 4.37Å; V48-V52 WeakPolarHBondContact O-CG2 3.39Å; V48-V52 PolarHBondContact O-N 2.95Å; R49-V52 PolarHBondContact O-N 3.06Å; V52-T54 VanDerWaalsContact C-N 3.31Å; V52-T54 PolarHBondContact O-N 3.33Å; V52-L55 PolarHBondContact O-N 2.67Å; V52-T56 HydrophobicContact CG1-CG2 4.27Å; V52-T56 WeakPolarHBondContact O-CG2 3.48Å; V52-T56 PolarHBondContact O-N 3.31Å; V52-T56 PolarHBondContact O-OG1 2.83Å
53V88.5Confident87.1Confident22 Ų2281.6 Ų81.613%0.13343%0.434CS..Hα-helixtrans-64.3-37.2179.1168.40000112.2R49 I51 L55 E57 A145R49-V53 HydrophobicContact CG-CG2 4.34Å; R49-V53 WeakPolarHBondContact O-CG2 3.34Å; R49-V53 PolarHBondContact O-N 3.18Å; I51-V53 PolarHBondContact O-N 2.72Å; V53-L55 VanDerWaalsContact C-N 3.32Å; V53-E57 PolarHBondContact O-N 3.43Å; V53-A145 HydrophobicContact CG1-CB 3.99Å; V53-A145 HydrophobicContact CG2-CB 4.34Å; V53-A145 WeakPolarHBondContact CG2-O 3.34Å
54T88.2Confident87.1Confident111 Ų11187.5 Ų87.568%0.68145%0.447SS*.Hα-helixtrans-66.6-37.7175.8-53.10000110.7R50 I51 V52R50-T54 WeakPolarHBondContact O-CB 3.5Å; R50-T54 PolarHBondContact O-N 2.96Å; R50-T54 PolarHBondContact O-OG1 3.2Å; I51-T54 PolarHBondContact O-N 3.16Å; I51-T54 VanDerWaalsContact O-N 3.16Å; V52-T54 VanDerWaalsContact C-N 3.31Å; V52-T54 PolarHBondContact O-N 3.33Å
55L91.2Very high87Confident139 Ų13986.7 Ų86.773%0.72844%0.441SS*.Hα-helixtrans-75-29.3178.5-68.1173.9000113.7I51 V52 V53I51-L55 HydrophobicContact CG2-CD1 3.82Å; I51-L55 HydrophobicContact CG2-CG 4.35Å; I51-L55 WeakPolarHBondContact O-CG 3.39Å; I51-L55 PolarHBondContact O-N 3.38Å; V52-L55 PolarHBondContact O-N 2.67Å; V53-L55 VanDerWaalsContact C-N 3.32Å
56T88.7Confident87Confident88 Ų8885.3 Ų85.354%0.5443%0.427SS..Hα-helixtrans-93.5-1.2-178.957.90000114.1V52 A58V52-T56 HydrophobicContact CG1-CG2 4.27Å; V52-T56 WeakPolarHBondContact O-CG2 3.48Å; V52-T56 PolarHBondContact O-N 3.31Å; V52-T56 PolarHBondContact O-OG1 2.83Å; T56-A58 PolarHBondContact O-N 2.93Å
57E84.6Confident87Confident160 Ų16086.5 Ų86.575%0.74843%0.431SS*.THydrogen-bonded Turntrans50.828-175.6-59.2-174.9173.200113.5V53 N59V53-E57 PolarHBondContact O-N 3.43Å; E57-N59 PolarHBondContact O-N 3.04Å; E57-N59 VanDerWaalsContact O-N 3.09Å
58A80.9Confident87Confident40 Ų4091.4 Ų91.433%0.33145%0.445SS..  trans-70.5110.1179.900000109.6T56 A145T56-A58 PolarHBondContact O-N 2.93Å; A58-A145 HydrophobicContact CB-CB 3.63Å; A58-A145 WeakPolarHBondContact O-CB 3.28Å
59N81.7Confident86.9Confident131 Ų13192.7 Ų92.770%0.70145%0.445SS*.  trans-85.6-44.4-172.2-73.2-43000113.6E57 A145E57-N59 PolarHBondContact O-N 3.04Å; E57-N59 VanDerWaalsContact O-N 3.09Å; N59-A145 PolarHBondContact O-N 3.43Å
60K87.2Confident86.8Confident153 Ų15391.2 Ų91.267%0.66544%0.439SS*.EExtended strand (participates in β ladder)trans-141139.9-173-64.3-175.6-177.2179.30112.6L142 L143K60-L142 HydrophobicContact CB-CB 4.28Å; K60-L142 HydrophobicContact CB-CD2 4.41Å; K60-L142 HydrophobicContact CD-CB 4.13Å; K60-L142 HydrophobicContact CD-CD1 4.37Å; K60-L143 CarbonylContact C-O 3.53Å; K60-L143 VanDerWaalsContact CA-O 3.24Å; K60-L143 WeakPolarHBondContact CA-O 3.32Å
61I88.8Confident86.9Confident22 Ų2288.5 Ų88.511%0.11344%0.438CS..EExtended strand (participates in β ladder)trans-135151.2175.1-161.4172.3000109.6E65 C66 L143 A145I61-E65 HydrophobicContact CD1-CB 3.81Å; I61-E65 HydrophobicContact CG1-CB 3.75Å; I61-E65 VanDerWaalsContact CG1-OE2 3.25Å; I61-E65 WeakPolarHBondContact CG1-OE2 3.33Å; I61-C66 HydrophobicContact CG2-CB 4.03Å; I61-L143 PolarHBondContact N-O 2.91Å; I61-L143 PolarHBondContact O-N 2.86Å; I61-A145 HydrophobicContact CB-CB 4.41Å; I61-A145 HydrophobicContact CG2-CB 4.48Å
62R86.6Confident86.9Confident148 Ų14885.4 Ų85.456%0.55842%0.422SS*.EExtended strand (participates in β ladder)trans-71.4145.4176.1-64.3-177-163.3-171.25.7110.6R64 E65 C66 L142R62-R64 VanDerWaalsContact C-N 3.28Å; R62-R64 PolarHBondContact O-N 2.92Å; R62-E65 PolarHBondContact O-N 3.43Å; R62-C66 PolarHBondContact O-N 3.13Å; R62-L142 HydrophobicContact CG-CD2 4.02Å
63R85.5Confident86.9Confident13 Ų1382.2 Ų82.25%0.04940%0.402CS..Hα-helixtrans-51.6-39.9178.1-176.9174.2-87.3131.7-0.7114.1C66 L67 Y138 S139 E141 L143 D151 F152R63-C66 VanDerWaalsContact O-CB 3.32Å; R63-C66 WeakPolarHBondContact O-CB 3.38Å; R63-C66 PolarHBondContact O-N 3.43Å; R63-L67 PolarHBondContact O-N 2.9Å; R63-Y138 VanDerWaalsContact NH1-CB 3.28Å; R63-S139 PolarHBondContact NH1-O 3.07Å; R63-E141 PolarHBondContact N-O 3.45Å; R63-E141 IonicContact NH1-OE2 3.94Å; R63-L143 HydrophobicContact CB-CD1 3.78Å; R63-L143 HydrophobicContact CG-CD1 3.89Å; R63-D151 PolarHBondContact NH2-O 3.21Å; R63-F152 HydrophobicContact CG-CD2 4.37Å; R63-F152 HydrophobicContact CG-CE2 4.44Å; R63-F152 PolarHBondContact NE-O 2.9Å
64R84.5Confident87Confident170 Ų17082.1 Ų82.164%0.64240%0.401SS*.Hα-helixtrans-66.7-37.1176.7-77.7-178.4-170.7-165.9-1.1114.4R62 L67 K68 N140R62-R64 VanDerWaalsContact C-N 3.28Å; R62-R64 PolarHBondContact O-N 2.92Å; R64-L67 PolarHBondContact O-N 2.93Å; R64-K68 PolarHBondContact O-N 3.31Å; R64-N140 WeakPolarHBondContact CD-ND2 3.38Å; R64-N140 VanDerWaalsContact CG-OD1 3.31Å; R64-N140 WeakPolarHBondContact CG-OD1 3.27Å; R64-N140 PolarHBondContact NE-ND2 3.41Å
65E87Confident87.2Confident90 Ų9079 Ų7942%0.42138%0.383SS..Hα-helixtrans-71.1-39.1175.3-70.2165.1-176.900110.1I61 R62 L67 K68 Q69I61-E65 HydrophobicContact CD1-CB 3.81Å; I61-E65 HydrophobicContact CG1-CB 3.75Å; I61-E65 VanDerWaalsContact CG1-OE2 3.25Å; I61-E65 WeakPolarHBondContact CG1-OE2 3.33Å; R62-E65 PolarHBondContact O-N 3.43Å; E65-L67 VanDerWaalsContact C-N 3.34Å; E65-L67 PolarHBondContact O-N 3.45Å; E65-K68 PolarHBondContact O-N 3.03Å; E65-Q69 WeakPolarHBondContact O-CG 3.44Å; E65-Q69 PolarHBondContact O-N 2.91Å; E65-Q69 VanDerWaalsContact O-N 3.13Å
66C87.7Confident87.1Confident0 Ų074.6 Ų74.60%036%0.358CS..Hα-helixtrans-56.4-47.3170.5-171.30000111.2I61 R62 R63 K68 Q69 A70 C147 F152I61-C66 HydrophobicContact CG2-CB 4.03Å; R62-C66 PolarHBondContact O-N 3.13Å; R63-C66 VanDerWaalsContact O-CB 3.32Å; R63-C66 WeakPolarHBondContact O-CB 3.38Å; R63-C66 PolarHBondContact O-N 3.43Å; C66-K68 VanDerWaalsContact C-N 3.34Å; C66-K68 PolarHBondContact O-N 2.95Å; C66-Q69 CarbonylContact O-C 3.55Å; C66-Q69 PolarHBondContact O-N 3.49Å; C66-Q69 VanDerWaalsContact O-N 3.11Å; C66-A70 WeakPolarHBondContact O-CA 3.12Å; C66-A70 WeakPolarHBondContact O-CB 3.24Å; C66-A70 PolarHBondContact O-N 3.41Å; C66-C147 WeakPolarHBondContact CA-SG 3.37Å; C66-C147 HydrophobicContact CB-CB 4.44Å; C66-C147 WeakPolarHBondContact CB-SG 3.47Å; C66-C147 VanDerWaalsContact SG-CA 3.52Å; C66-C147 WeakPolarHBondContact SG-CB 3.31Å; C66-C147 CovalentContact SG-SG 2.02Å; C66-C147 PolarHBondContact SG-SG 3.26Å; C66-F152 HydrophobicContact CB-CD2 4.12Å; C66-F152 HydrophobicContact CB-CE2 4.26Å; C66-F152 VanDerWaalsContact SG-CD2 3.51Å
67L86.9Confident87.2Confident33 Ų3370.5 Ų70.517%0.17333%0.333CS..Hα-helixtrans-55.8-44.6177.2174.862.8000113R63 R64 E65 Q69 I74 I132 C135 F152R63-L67 PolarHBondContact O-N 2.9Å; R64-L67 PolarHBondContact O-N 2.93Å; E65-L67 VanDerWaalsContact C-N 3.34Å; E65-L67 PolarHBondContact O-N 3.45Å; L67-Q69 VanDerWaalsContact C-N 3.32Å; L67-Q69 PolarHBondContact O-N 3.24Å; L67-I74 HydrophobicContact CD1-CD1 4.2Å; L67-I132 HydrophobicContact CD1-CD1 3.94Å; L67-C135 HydrophobicContact CD1-CB 4.11Å; L67-C135 HydrophobicContact CD2-CB 4.22Å; L67-F152 HydrophobicContact CB-CE2 3.87Å; L67-F152 HydrophobicContact CB-CZ 3.89Å; L67-F152 HydrophobicContact CD1-CE2 4.46Å; L67-F152 HydrophobicContact CD1-CZ 3.71Å; L67-F152 HydrophobicContact CG-CZ 4.42Å
68K87Confident87.6Confident173 Ų17364.4 Ų64.475%0.75231%0.307SS*.Hα-helixtrans-65.9-34.5178.8-69.9-179179-177.40112.6R64 E65 C66 V71R64-K68 PolarHBondContact O-N 3.31Å; E65-K68 PolarHBondContact O-N 3.03Å; C66-K68 VanDerWaalsContact C-N 3.34Å; C66-K68 PolarHBondContact O-N 2.95Å; K68-V71 WeakPolarHBondContact O-CG2 3.12Å
69Q86.2Confident88.1Confident107 Ų10762.8 Ų62.850%0.529%0.293SS..Hα-helixtrans-92.8-21.2-177.2-62.3175.5-1.800113.1R49 E65 C66 L67 V71R49-Q69 PolarHBondContact NH1-O 2.9Å; E65-Q69 WeakPolarHBondContact O-CG 3.44Å; E65-Q69 PolarHBondContact O-N 2.91Å; E65-Q69 VanDerWaalsContact O-N 3.13Å; C66-Q69 CarbonylContact O-C 3.55Å; C66-Q69 PolarHBondContact O-N 3.49Å; C66-Q69 VanDerWaalsContact O-N 3.11Å; L67-Q69 VanDerWaalsContact C-N 3.32Å; L67-Q69 PolarHBondContact O-N 3.24Å; Q69-V71 PolarHBondContact O-N 3.41Å; Q69-V71 VanDerWaalsContact O-N 3.1Å
70A86.5Confident88.4Confident0 Ų056.8 Ų56.80%026%0.26CS..THydrogen-bonded Turntrans-85.234.9-175.900000112C66 H72 V73 I74 C147 F152C66-A70 WeakPolarHBondContact O-CA 3.12Å; C66-A70 WeakPolarHBondContact O-CB 3.24Å; C66-A70 PolarHBondContact O-N 3.41Å; A70-H72 PolarHBondContact O-N 3.05Å; A70-V73 HydrophobicContact CB-CB 4.32Å; A70-V73 HydrophobicContact CB-CG2 4Å; A70-V73 WeakPolarHBondContact O-CB 3.49Å; A70-V73 PolarHBondContact O-N 3.09Å; A70-I74 PolarHBondContact O-N 3.24Å; A70-C147 HydrophobicContact CB-CB 4.29Å; A70-F152 HydrophobicContact CB-CD1 4.36Å; A70-F152 HydrophobicContact CB-CE1 4Å; A70-F152 HydrophobicContact CB-CZ 4.28Å
71V88.4Confident88.6Confident83 Ų8349.5 Ų49.550%0.50323%0.229SC..Hα-helixtrans-55.8-36.7177-178.30000111K68 Q69 V73 I74 C75K68-V71 WeakPolarHBondContact O-CG2 3.12Å; Q69-V71 PolarHBondContact O-N 3.41Å; Q69-V71 VanDerWaalsContact O-N 3.1Å; V71-V73 VanDerWaalsContact C-N 3.27Å; V71-V73 PolarHBondContact O-N 3.1Å; V71-I74 PolarHBondContact O-N 3.2Å; V71-C75 PolarHBondContact O-N 2.92Å; V71-C75 PolarHBondContact O-SG 3.49Å; V71-C75 VanDerWaalsContact O-SG 3.4Å
72H89.3Confident88.7Confident36 Ų3648.9 Ų48.917%0.16723%0.227CC..Hα-helixtrans-58-36.517568.1-81000112.7A42 G46 R49 A70 F76A42-H72 WeakPolarHBondContact CB-O 3.31Å; G46-H72 WeakPolarHBondContact CA-CD2 3.35Å; R49-H72 WeakPolarHBondContact CD-CE1 3.35Å; A70-H72 PolarHBondContact O-N 3.05Å; H72-F76 VanDerWaalsContact O-CB 3.31Å; H72-F76 WeakPolarHBondContact O-CB 3.4Å; H72-F76 PolarHBondContact O-N 2.92Å
73V88.6Confident88.8Confident7 Ų741.9 Ų41.94%0.04220%0.201CC..Hα-helixtrans-68.1-43.1177.2-179.40000110.9A70 V71 F76 F77 A149 F152 V153A70-V73 HydrophobicContact CB-CB 4.32Å; A70-V73 HydrophobicContact CB-CG2 4Å; A70-V73 WeakPolarHBondContact O-CB 3.49Å; A70-V73 PolarHBondContact O-N 3.09Å; V71-V73 VanDerWaalsContact C-N 3.27Å; V71-V73 PolarHBondContact O-N 3.1Å; V73-F76 WeakPolarHBondContact O-CB 3.5Å; V73-F76 PolarHBondContact O-N 2.96Å; V73-F77 HydrophobicContact CG1-CD2 3.77Å; V73-F77 HydrophobicContact CG1-CE2 3.46Å; V73-F77 VanDerWaalsContact CG1-CE2 3.46Å; V73-F77 VanDerWaalsContact O-CD2 3.26Å; V73-F77 WeakPolarHBondContact O-CD2 3.16Å; V73-F77 PolarHBondContact O-N 3.45Å; V73-F77 VanDerWaalsContact O-N 3.14Å; V73-A149 HydrophobicContact CG1-CB 3.68Å; V73-A149 HydrophobicContact CG2-CB 4.35Å; V73-F152 HydrophobicContact CG1-CD1 4.23Å; V73-F152 HydrophobicContact CG1-CE1 4.41Å; V73-V153 HydrophobicContact CG1-CG2 4.14Å
74I91.3Very high88.9Confident21 Ų2141.4 Ų41.411%0.10820%0.199CC..Hα-helixtrans-62.1-49.9177.2-59.4174.8000109.7L67 A70 V71 F76 F77 V78 F128 V131 I132L67-I74 HydrophobicContact CD1-CD1 4.2Å; A70-I74 PolarHBondContact O-N 3.24Å; V71-I74 PolarHBondContact O-N 3.2Å; I74-F76 VanDerWaalsContact C-N 3.27Å; I74-F76 PolarHBondContact O-N 2.94Å; I74-F77 PolarHBondContact O-N 2.98Å; I74-V78 HydrophobicContact CG2-CG2 4.05Å; I74-V78 WeakPolarHBondContact O-CB 3.34Å; I74-V78 VanDerWaalsContact O-CG2 3.24Å; I74-V78 WeakPolarHBondContact O-CG2 3.38Å; I74-V78 PolarHBondContact O-N 3.25Å; I74-F128 HydrophobicContact CG2-CD2 3.59Å; I74-F128 HydrophobicContact CG2-CE2 3.97Å; I74-V131 HydrophobicContact CG1-CG1 4.01Å; I74-I132 HydrophobicContact CD1-CD1 4.49Å
75C91.6Very high89.3Confident46 Ų4633.3 Ų33.331%0.31117%0.169SC..Hα-helixtrans-59-39177.9-700000112.1V38 A42 V71 S79V38-C75 HydrophobicContact CG1-CB 4.13Å; A42-C75 HydrophobicContact CB-CB 3.93Å; V71-C75 PolarHBondContact O-N 2.92Å; V71-C75 PolarHBondContact O-SG 3.49Å; V71-C75 VanDerWaalsContact O-SG 3.4Å; C75-S79 WeakPolarHBondContact O-CB 3.26Å; C75-S79 PolarHBondContact O-N 3.37Å; C75-S79 PolarHBondContact O-OG 3.31Å
76F90.4Very high89.4Confident45 Ų4529 Ų2920%0.19715%0.149CC..Hα-helixtrans-59.2-55.4176.7-177.5-92.2000111.5N39 A42 H72 V73 I74 S79 E80N39-F76 WeakPolarHBondContact OD1-CD2 3.4Å; N39-F76 WeakPolarHBondContact OD1-CE2 3.25Å; A42-F76 HydrophobicContact CB-CB 3.97Å; H72-F76 VanDerWaalsContact O-CB 3.31Å; H72-F76 WeakPolarHBondContact O-CB 3.4Å; H72-F76 PolarHBondContact O-N 2.92Å; V73-F76 WeakPolarHBondContact O-CB 3.5Å; V73-F76 PolarHBondContact O-N 2.96Å; I74-F76 VanDerWaalsContact C-N 3.27Å; I74-F76 PolarHBondContact O-N 2.94Å; F76-S79 PolarHBondContact O-N 2.89Å; F76-S79 PolarHBondContact O-OG 2.99Å; F76-E80 WeakPolarHBondContact O-CB 3.3Å; F76-E80 PolarHBondContact O-N 3.12Å
77F91Very high89.3Confident2 Ų229.2 Ų29.21%0.00915%0.15CC..Hα-helixtrans-69.5-39.2-178.2-69-59000113.3V73 I74 E80 T81 T127 V131 A149 V153 F157 Y158 H161V73-F77 HydrophobicContact CG1-CD2 3.77Å; V73-F77 HydrophobicContact CG1-CE2 3.46Å; V73-F77 VanDerWaalsContact CG1-CE2 3.46Å; V73-F77 VanDerWaalsContact O-CD2 3.26Å; V73-F77 WeakPolarHBondContact O-CD2 3.16Å; V73-F77 PolarHBondContact O-N 3.45Å; V73-F77 VanDerWaalsContact O-N 3.14Å; I74-F77 PolarHBondContact O-N 2.98Å; F77-E80 WeakPolarHBondContact O-CB 3.39Å; F77-E80 PolarHBondContact O-N 2.84Å; F77-T81 PolarHBondContact O-N 3.43Å; F77-T81 PolarHBondContact O-OG1 3.13Å; F77-T127 HydrophobicContact CB-CG2 3.85Å; F77-V131 HydrophobicContact CD2-CG2 4.48Å; F77-A149 HydrophobicContact CE2-CB 4.02Å; F77-A149 HydrophobicContact CZ-CB 4.11Å; F77-V153 HydrophobicContact CE2-CG2 4.27Å; F77-F157 HydrophobicContact CB-CZ 4.03Å; F77-F157 AromaticContact CD1-CE1 3.85Å; F77-F157 HydrophobicContact CD1-CE1 3.85Å; F77-F157 HydrophobicContact CD1-CZ 4.08Å; F77-F157 AromaticContact CD2-CE1 3.63Å; F77-F157 HydrophobicContact CD2-CE1 3.63Å; F77-F157 AromaticContact CD2-CZ 3.73Å; F77-F157 HydrophobicContact CD2-CZ 3.73Å; F77-F157 AromaticContact CE1-CE1 3.81Å; F77-F157 HydrophobicContact CE1-CE1 3.81Å; F77-F157 HydrophobicContact CE1-CZ 4.49Å; F77-F157 HydrophobicContact CE2-CD1 4.44Å; F77-F157 AromaticContact CE2-CE1 3.57Å; F77-F157 HydrophobicContact CE2-CE1 3.57Å; F77-F157 HydrophobicContact CE2-CZ 4.16Å; F77-F157 AromaticContact CG-CE1 3.78Å; F77-F157 HydrophobicContact CG-CE1 3.78Å; F77-F157 AromaticContact CG-CZ 3.68Å; F77-F157 HydrophobicContact CG-CZ 3.68Å; F77-F157 HydrophobicContact CZ-CD1 4.48Å; F77-F157 AromaticContact CZ-CE1 3.67Å; F77-F157 HydrophobicContact CZ-CE1 3.67Å; F77-Y158 HydrophobicContact CE1-CD1 4.44Å; F77-Y158 AromaticContact CE1-CE1 3.83Å; F77-Y158 HydrophobicContact CE1-CE1 3.83Å; F77-Y158 HydrophobicContact CZ-CD1 4.43Å; F77-Y158 AromaticContact CZ-CE1 3.59Å; F77-Y158 HydrophobicContact CZ-CE1 3.59Å; F77-Y158 AromaticContact CZ-CZ 3.68Å; F77-H161 AromaticContact CD1-CD2 3.89Å; F77-H161 AromaticContact CD1-NE2 3.5Å
78V93Very high89.4Confident33 Ų3329.4 Ų29.420%0.215%0.149CC..Hα-helixtrans-63.1-45.2177.7171.10000110.5I74 E80 T81 A82 T127 F128I74-V78 HydrophobicContact CG2-CG2 4.05Å; I74-V78 WeakPolarHBondContact O-CB 3.34Å; I74-V78 VanDerWaalsContact O-CG2 3.24Å; I74-V78 WeakPolarHBondContact O-CG2 3.38Å; I74-V78 PolarHBondContact O-N 3.25Å; V78-E80 VanDerWaalsContact C-N 3.33Å; V78-E80 PolarHBondContact O-N 3.39Å; V78-T81 PolarHBondContact O-N 3.49Å; V78-A82 VanDerWaalsContact O-CB 3.27Å; V78-A82 WeakPolarHBondContact O-CB 3.4Å; V78-A82 PolarHBondContact O-N 3.46Å; V78-T127 HydrophobicContact CG2-CG2 4.29Å; V78-F128 HydrophobicContact CG2-CB 4.05Å
79S91.3Very high89.6Confident5 Ų521.2 Ų21.24%0.03511%0.114CC..Hα-helixtrans-68.2-31.8177.863.70000113S35 N39 C75 F76 G83S35-S79 WeakPolarHBondContact O-CB 3.11Å; N39-S79 VanDerWaalsContact CA-OG 3.32Å; N39-S79 WeakPolarHBondContact CA-OG 3.37Å; N39-S79 VanDerWaalsContact CB-OG 3.3Å; N39-S79 WeakPolarHBondContact CB-OG 3.3Å; N39-S79 PolarHBondContact N-OG 3.45Å; C75-S79 WeakPolarHBondContact O-CB 3.26Å; C75-S79 PolarHBondContact O-N 3.37Å; C75-S79 PolarHBondContact O-OG 3.31Å; F76-S79 PolarHBondContact O-N 2.89Å; F76-S79 PolarHBondContact O-OG 2.99Å; S79-G83 PolarHBondContact O-N 2.86Å
80E86.9Confident89.5Confident5 Ų516.6 Ų16.62%0.0239%0.092CC..Hα-helixtrans-63-48.6172.8179.3176.5-140.200111.8F76 F77 V78 G83 T84 H161 R248F76-E80 WeakPolarHBondContact O-CB 3.3Å; F76-E80 PolarHBondContact O-N 3.12Å; F77-E80 WeakPolarHBondContact O-CB 3.39Å; F77-E80 PolarHBondContact O-N 2.84Å; V78-E80 VanDerWaalsContact C-N 3.33Å; V78-E80 PolarHBondContact O-N 3.39Å; E80-G83 PolarHBondContact O-N 3.39Å; E80-T84 PolarHBondContact O-N 2.86Å; E80-T84 PolarHBondContact O-OG1 3.47Å; E80-H161 IonicContact OE2-CD2 3.8Å; E80-H161 IonicContact OE2-CE1 3.16Å; E80-H161 IonicContact OE2-NE2 2.71Å; E80-H161 PolarHBondContact OE2-NE2 3.02Å; E80-R248 VanDerWaalsContact OE1-CD 3.28Å; E80-R248 WeakPolarHBondContact OE1-CD 3.12Å; E80-R248 IonicContact OE1-CZ 3.69Å; E80-R248 IonicContact OE1-NE 2.64Å; E80-R248 PolarHBondContact OE1-NE 3.48Å; E80-R248 IonicContact OE1-NH1 2.97Å; E80-R248 PolarHBondContact OE1-NH1 3.29Å
81T91.5Very high89.5Confident0 Ų016.7 Ų16.70%09%0.093CC..Hα-helixtrans-65.8-43.3176.4-620000111.3F77 V78 G83 T84 A85 S123 T127 H161 F164 N165F77-T81 PolarHBondContact O-N 3.43Å; F77-T81 PolarHBondContact O-OG1 3.13Å; V78-T81 PolarHBondContact O-N 3.49Å; T81-G83 VanDerWaalsContact C-N 3.3Å; T81-G83 PolarHBondContact O-N 3.44Å; T81-T84 PolarHBondContact O-N 3Å; T81-A85 WeakPolarHBondContact O-CB 3.46Å; T81-A85 PolarHBondContact O-N 3.25Å; T81-S123 WeakPolarHBondContact CG2-O 3.24Å; T81-T127 VanDerWaalsContact CB-OG1 3.23Å; T81-T127 WeakPolarHBondContact CB-OG1 3.38Å; T81-T127 WeakPolarHBondContact CG2-OG1 3.47Å; T81-T127 PolarHBondContact OG1-OG1 2.93Å; T81-H161 PolarHBondContact OG1-CE1 3.49Å; T81-F164 HydrophobicContact CG2-CD1 4.25Å; T81-F164 HydrophobicContact CG2-CE1 3.73Å; T81-N165 WeakPolarHBondContact CA-OD1 3.46Å; T81-N165 PolarHBondContact OG1-ND2 2.83Å; T81-N165 VanDerWaalsContact OG1-ND2 3.13Å
82A91.9Very high89.5Confident9 Ų914.5 Ų14.57%0.0748%0.078CC..Hα-helixtrans-58.8-41.9176.300000111.8V78 A85 S86 I120 S124V78-A82 VanDerWaalsContact O-CB 3.27Å; V78-A82 WeakPolarHBondContact O-CB 3.4Å; V78-A82 PolarHBondContact O-N 3.46Å; A82-A85 PolarHBondContact O-N 3.01Å; A82-S86 VanDerWaalsContact O-CB 3.26Å; A82-S86 WeakPolarHBondContact O-CB 3.42Å; A82-S86 PolarHBondContact O-N 3.19Å; A82-S86 PolarHBondContact O-OG 2.64Å; A82-I120 HydrophobicContact CB-CG2 4.21Å; A82-S124 WeakPolarHBondContact CB-OG 3.12Å
83G88.5Confident89.4Confident1 Ų112.9 Ų12.91%0.017%0.071CC..Hα-helixtrans-61.1-50174.900000111.6F32 S79 E80 T81 A85 S86 I87F32-G83 WeakPolarHBondContact CD2-O 3.1Å; S79-G83 PolarHBondContact O-N 2.86Å; E80-G83 PolarHBondContact O-N 3.39Å; T81-G83 VanDerWaalsContact C-N 3.3Å; T81-G83 PolarHBondContact O-N 3.44Å; G83-A85 PolarHBondContact O-N 3.39Å; G83-S86 WeakPolarHBondContact O-CB 3.39Å; G83-S86 PolarHBondContact O-N 3.2Å; G83-I87 WeakPolarHBondContact O-CG1 3.49Å; G83-I87 PolarHBondContact O-N 2.71Å
84T88.1Confident89.1Confident3 Ų313.1 Ų13.12%0.0187%0.071CC..Hα-helixtrans-59.6-45.8178.4-47.40000111.8E80 T81 S86 I87 F88 N165 I168 Q220E80-T84 PolarHBondContact O-N 2.86Å; E80-T84 PolarHBondContact O-OG1 3.47Å; T81-T84 PolarHBondContact O-N 3Å; T84-S86 VanDerWaalsContact C-N 3.34Å; T84-S86 PolarHBondContact O-N 3.36Å; T84-I87 PolarHBondContact O-N 3.12Å; T84-F88 PolarHBondContact O-N 2.94Å; T84-N165 PolarHBondContact OG1-OD1 2.91Å; T84-I168 HydrophobicContact CG2-CB 4.04Å; T84-I168 HydrophobicContact CG2-CG2 3.79Å; T84-Q220 PolarHBondContact OG1-NE2 2.68Å
85A91.1Very high88.9Confident0 Ų013.6 Ų13.60%07%0.073CC..Hα-helixtrans-67.2-33177.300000112.8T81 A82 G83 F88 S89 I120 S123T81-A85 WeakPolarHBondContact O-CB 3.46Å; T81-A85 PolarHBondContact O-N 3.25Å; A82-A85 PolarHBondContact O-N 3.01Å; G83-A85 PolarHBondContact O-N 3.39Å; A85-F88 PolarHBondContact O-N 3.24Å; A85-S89 WeakPolarHBondContact O-CB 3.37Å; A85-S89 PolarHBondContact O-N 2.8Å; A85-S89 PolarHBondContact O-OG 3.47Å; A85-I120 HydrophobicContact CB-CG1 4.06Å; A85-S123 VanDerWaalsContact CB-OG 3.32Å; A85-S123 WeakPolarHBondContact CB-OG 2.83Å
86S89.2Confident88.5Confident0 Ų012.6 Ų12.60%07%0.066CC..Hα-helixtrans-66.4-44.3175.9-62.30000111A82 G83 T84 S89 L90 I120A82-S86 VanDerWaalsContact O-CB 3.26Å; A82-S86 WeakPolarHBondContact O-CB 3.42Å; A82-S86 PolarHBondContact O-N 3.19Å; A82-S86 PolarHBondContact O-OG 2.64Å; G83-S86 WeakPolarHBondContact O-CB 3.39Å; G83-S86 PolarHBondContact O-N 3.2Å; T84-S86 VanDerWaalsContact C-N 3.34Å; T84-S86 PolarHBondContact O-N 3.36Å; S86-S89 PolarHBondContact O-N 3.18Å; S86-L90 WeakPolarHBondContact O-CG 3.45Å; S86-L90 PolarHBondContact O-N 3.21Å; S86-I120 WeakPolarHBondContact OG-CD1 3.5Å
87I86.3Confident88Confident5 Ų510.9 Ų10.93%0.0266%0.06CC..Hα-helixtrans-63.5-44.1176.2-62.7-179.7000110.8F32 G83 T84 S89 L90 C91 T172 L213 T216F32-I87 HydrophobicContact CD2-CD1 4.06Å; F32-I87 HydrophobicContact CD2-CG1 3.56Å; F32-I87 HydrophobicContact CE2-CD1 3.37Å; F32-I87 HydrophobicContact CE2-CG1 3.43Å; F32-I87 VanDerWaalsContact CE2-CG1 3.43Å; F32-I87 HydrophobicContact CG-CG1 4.4Å; F32-I87 HydrophobicContact CZ-CD1 3.77Å; F32-I87 HydrophobicContact CZ-CG1 4.16Å; G83-I87 WeakPolarHBondContact O-CG1 3.49Å; G83-I87 PolarHBondContact O-N 2.71Å; T84-I87 PolarHBondContact O-N 3.12Å; I87-S89 VanDerWaalsContact C-N 3.31Å; I87-S89 PolarHBondContact O-N 3.39Å; I87-L90 WeakPolarHBondContact O-CB 3.44Å; I87-L90 PolarHBondContact O-N 2.91Å; I87-C91 PolarHBondContact O-N 3.35Å; I87-T172 HydrophobicContact CG2-CG2 3.94Å; I87-L213 HydrophobicContact CG2-CD2 3.4Å; I87-T216 HydrophobicContact CD1-CG2 3.23Å; I87-T216 HydrophobicContact CG2-CG2 4.4Å
88F89.7Confident87.5Confident37 Ų3710.9 Ų10.916%0.1626%0.06CC..Hα-helixtrans-57.5-45.4173.7175.8-91.9000111.8T84 A85 L90 C91 L92 L119 I168 T172 L175T84-F88 PolarHBondContact O-N 2.94Å; A85-F88 PolarHBondContact O-N 3.24Å; F88-L90 VanDerWaalsContact C-N 3.33Å; F88-L90 PolarHBondContact O-N 3.25Å; F88-C91 WeakPolarHBondContact O-CB 2.97Å; F88-C91 PolarHBondContact O-N 2.86Å; F88-L92 HydrophobicContact CE1-CB 4.48Å; F88-L92 HydrophobicContact CE1-CD2 4.17Å; F88-L92 WeakPolarHBondContact O-CB 3.33Å; F88-L92 PolarHBondContact O-N 3.29Å; F88-L119 HydrophobicContact CD1-CD2 3.31Å; F88-L119 HydrophobicContact CE1-CD2 3.52Å; F88-L119 HydrophobicContact CG-CD2 4.45Å; F88-I168 HydrophobicContact CB-CG2 3.68Å; F88-I168 HydrophobicContact CD2-CG2 4.31Å; F88-I168 HydrophobicContact CG-CG2 4.08Å; F88-T172 WeakPolarHBondContact CB-OG1 3.35Å; F88-T172 WeakPolarHBondContact CD2-OG1 3.45Å; F88-L175 HydrophobicContact CD2-CD1 3.98Å; F88-L175 HydrophobicContact CE2-CD1 3.29Å; F88-L175 HydrophobicContact CE2-CG 4.44Å; F88-L175 HydrophobicContact CZ-CD1 3.68Å
89S89.9Confident87Confident1 Ų115.9 Ų15.91%0.0078%0.076CC..Hα-helixtrans-63.6-38.8179.4-60.60000112.1A85 S86 I87 L92 D93 G116A85-S89 WeakPolarHBondContact O-CB 3.37Å; A85-S89 PolarHBondContact O-N 2.8Å; A85-S89 PolarHBondContact O-OG 3.47Å; S86-S89 PolarHBondContact O-N 3.18Å; I87-S89 VanDerWaalsContact C-N 3.31Å; I87-S89 PolarHBondContact O-N 3.39Å; S89-L92 PolarHBondContact O-N 3.34Å; S89-D93 WeakPolarHBondContact O-CB 3.3Å; S89-D93 PolarHBondContact O-N 2.99Å; S89-G116 WeakPolarHBondContact OG-CA 3.01Å
90L85.7Confident86.1Confident9 Ų921.7 Ų21.75%0.04710%0.1CC..Hα-helixtrans-61.4-47172.4-74.9168.8000111.3L28 D29 S86 I87 F88 L92 D93 R94L28-L90 HydrophobicContact CB-CD2 3.39Å; L28-L90 HydrophobicContact CB-CG 4.01Å; L28-L90 HydrophobicContact CD1-CD2 4.18Å; L28-L90 HydrophobicContact CG-CD2 4.44Å; D29-L90 WeakPolarHBondContact OD1-CD1 3.28Å; D29-L90 WeakPolarHBondContact OD1-CD2 3.17Å; S86-L90 WeakPolarHBondContact O-CG 3.45Å; S86-L90 PolarHBondContact O-N 3.21Å; I87-L90 WeakPolarHBondContact O-CB 3.44Å; I87-L90 PolarHBondContact O-N 2.91Å; F88-L90 VanDerWaalsContact C-N 3.33Å; F88-L90 PolarHBondContact O-N 3.25Å; L90-L92 PolarHBondContact O-N 3.5Å; L90-D93 PolarHBondContact O-N 3.41Å; L90-R94 WeakPolarHBondContact O-CG 3.34Å; L90-R94 PolarHBondContact O-N 3.28Å
91C86.8Confident85.1Confident3 Ų325.6 Ų25.62%0.0213%0.126CC..Hα-helixtrans-60.6-44175.2-78.90000112.6I87 F88 D93 R94 F95 T172 L213I87-C91 PolarHBondContact O-N 3.35Å; F88-C91 WeakPolarHBondContact O-CB 2.97Å; F88-C91 PolarHBondContact O-N 2.86Å; C91-D93 VanDerWaalsContact C-N 3.32Å; C91-D93 PolarHBondContact O-N 3.5Å; C91-R94 PolarHBondContact O-N 2.74Å; C91-F95 WeakPolarHBondContact O-CB 3.46Å; C91-F95 PolarHBondContact O-N 3.31Å; C91-T172 HydrophobicContact CB-CG2 4.04Å; C91-T172 WeakPolarHBondContact SG-CG2 3.43Å; C91-L213 WeakPolarHBondContact SG-CD1 3.5Å; C91-L213 WeakPolarHBondContact SG-CD2 3.29Å
92L88.4Confident83.5Confident36 Ų3629 Ų2919%0.18815%0.147CC..Hα-helixtrans-63.3-40.6179.3-178.363.9000111.5F88 S89 L90 F95 C96 L175F88-L92 HydrophobicContact CE1-CB 4.48Å; F88-L92 HydrophobicContact CE1-CD2 4.17Å; F88-L92 WeakPolarHBondContact O-CB 3.33Å; F88-L92 PolarHBondContact O-N 3.29Å; S89-L92 PolarHBondContact O-N 3.34Å; L90-L92 PolarHBondContact O-N 3.5Å; L92-F95 PolarHBondContact O-N 3.4Å; L92-C96 WeakPolarHBondContact O-CB 3.4Å; L92-C96 PolarHBondContact O-N 3.21Å; L92-C96 PolarHBondContact O-SG 3.14Å; L92-L175 HydrophobicContact CB-CD1 4.4Å; L92-L175 HydrophobicContact CD1-CD1 4.24Å
93D85.5Confident81.7Confident3 Ų336 Ų362%0.01618%0.178CC..Hα-helixtrans-62.4-46.5175.6-179.873.7000111.8L28 S89 L90 C91 F95 C96 A97 I112L28-D93 HydrophobicContact CD1-CB 4.29Å; S89-D93 WeakPolarHBondContact O-CB 3.3Å; S89-D93 PolarHBondContact O-N 2.99Å; L90-D93 PolarHBondContact O-N 3.41Å; C91-D93 VanDerWaalsContact C-N 3.32Å; C91-D93 PolarHBondContact O-N 3.5Å; D93-F95 PolarHBondContact O-N 2.92Å; D93-C96 PolarHBondContact O-N 3.11Å; D93-A97 VanDerWaalsContact O-CB 3.29Å; D93-A97 WeakPolarHBondContact O-CB 3.43Å; D93-A97 PolarHBondContact O-N 2.95Å; D93-I112 HydrophobicContact CB-CG2 3.83Å
94R82.8Confident80.5Confident11 Ų1139.4 Ų39.44%0.04220%0.2CC..Hα-helixtrans-61.4-45.6174.5-65.6-54.799.3142.26.2112.5H21 T25 L90 C91 C96 A97 I98 L209H21-R94 PolarHBondContact CE1-NH1 3.47Å; H21-R94 PolarHBondContact CE1-NH2 2.94Å; H21-R94 PolarHBondContact NE2-NH2 3.33Å; T25-R94 PolarHBondContact OG1-NH1 3.33Å; T25-R94 PolarHBondContact OG1-NH2 3.18Å; L90-R94 WeakPolarHBondContact O-CG 3.34Å; L90-R94 PolarHBondContact O-N 3.28Å; C91-R94 PolarHBondContact O-N 2.74Å; R94-C96 PolarHBondContact O-N 3.13Å; R94-A97 PolarHBondContact O-N 3.09Å; R94-I98 WeakPolarHBondContact O-CG1 3.38Å; R94-I98 PolarHBondContact O-N 2.92Å; R94-I98 VanDerWaalsContact O-N 3.1Å; R94-L209 HydrophobicContact CG-CD1 4.29Å
95F86.5Confident79.5Confident31 Ų3141.2 Ų41.214%0.13621%0.206CC..Hα-helixtrans-57.8-49.8178175.4-98.1000110.8C91 L92 D93 A97 I98 W99 L175 L178 T179 I182C91-F95 WeakPolarHBondContact O-CB 3.46Å; C91-F95 PolarHBondContact O-N 3.31Å; L92-F95 PolarHBondContact O-N 3.4Å; D93-F95 PolarHBondContact O-N 2.92Å; F95-A97 PolarHBondContact O-N 2.72Å; F95-I98 PolarHBondContact O-N 3.12Å; F95-W99 HydrophobicContact CE1-CB 4.42Å; F95-W99 HydrophobicContact CE1-CD2 4.39Å; F95-W99 HydrophobicContact CE1-CE3 4.13Å; F95-W99 HydrophobicContact CE1-CG 4.49Å; F95-W99 AromaticContact CE2-CE3 3.63Å; F95-W99 HydrophobicContact CE2-CE3 3.63Å; F95-W99 HydrophobicContact CE2-CZ3 4.12Å; F95-W99 AromaticContact CZ-CD2 3.95Å; F95-W99 HydrophobicContact CZ-CD2 3.95Å; F95-W99 AromaticContact CZ-CE3 3.28Å; F95-W99 HydrophobicContact CZ-CE3 3.28Å; F95-W99 HydrophobicContact CZ-CG 4.45Å; F95-W99 AromaticContact CZ-CZ3 3.8Å; F95-W99 HydrophobicContact CZ-CZ3 3.8Å; F95-W99 VanDerWaalsContact O-CB 3.3Å; F95-W99 WeakPolarHBondContact O-CB 3.49Å; F95-W99 PolarHBondContact O-N 2.92Å; F95-L175 HydrophobicContact CD1-CD2 4.3Å; F95-L175 HydrophobicContact CD2-CD2 4.49Å; F95-L175 HydrophobicContact CG-CD2 4.25Å; F95-L178 HydrophobicContact CD2-CB 4.28Å; F95-L178 HydrophobicContact CE2-CB 3.83Å; F95-L178 HydrophobicContact CE2-CD1 4.45Å; F95-T179 WeakPolarHBondContact CB-OG1 3.47Å; F95-T179 WeakPolarHBondContact CD2-OG1 3.33Å; F95-I182 HydrophobicContact CD2-CD1 3.96Å; F95-I182 HydrophobicContact CE2-CD1 3.49Å; F95-I182 VanDerWaalsContact CE2-CD1 3.49Å; F95-I182 HydrophobicContact CZ-CD1 4.35Å
96C84.8Confident78.5Confident26 Ų2648.9 Ų48.918%0.17624%0.235CC..Hα-helixtrans-64.1-41.4179.7-70.80000112.7L92 D93 R94 I98 Q108 I112L92-C96 WeakPolarHBondContact O-CB 3.4Å; L92-C96 PolarHBondContact O-N 3.21Å; L92-C96 PolarHBondContact O-SG 3.14Å; D93-C96 PolarHBondContact O-N 3.11Å; R94-C96 PolarHBondContact O-N 3.13Å; C96-I98 PolarHBondContact O-N 3.39Å; C96-Q108 PolarHBondContact O-NE2 3.44Å; C96-I112 HydrophobicContact CB-CD1 3.3Å; C96-I112 HydrophobicContact CB-CG1 4.22Å
97A80Confident77.9Confident9 Ų953.5 Ų53.57%0.07426%0.259CS..Hα-helixtrans-60.2-35.5178.100000111.9D93 R94 F95 Q202D93-A97 VanDerWaalsContact O-CB 3.29Å; D93-A97 WeakPolarHBondContact O-CB 3.43Å; D93-A97 PolarHBondContact O-N 2.95Å; R94-A97 PolarHBondContact O-N 3.09Å; F95-A97 PolarHBondContact O-N 2.72Å; A97-Q202 PolarHBondContact O-OE1 2.83Å
98I80.7Confident77.5Confident2 Ų255.4 Ų55.41%0.0127%0.268CS..Hα-helixtrans-87.5-39.4-179.1-67.4163.2000112.1R94 F95 C96 T179 I182 I183 K186 F199R94-I98 WeakPolarHBondContact O-CG1 3.38Å; R94-I98 PolarHBondContact O-N 2.92Å; R94-I98 VanDerWaalsContact O-N 3.1Å; F95-I98 PolarHBondContact O-N 3.12Å; C96-I98 PolarHBondContact O-N 3.39Å; I98-T179 HydrophobicContact CD1-CG2 3.56Å; I98-I182 HydrophobicContact CG2-CB 4.29Å; I98-I182 HydrophobicContact CG2-CG2 3.64Å; I98-I183 HydrophobicContact CD1-CD1 3.84Å; I98-I183 HydrophobicContact CD1-CG1 3.91Å; I98-I183 HydrophobicContact CG2-CG1 4.27Å; I98-K186 PolarHBondContact O-NZ 2.86Å; I98-F199 HydrophobicContact CG2-CE2 4.17Å
99W80.7Confident76.9Confident138 Ų13853.9 Ų53.952%0.52326%0.262SS..Hα-helixtrans-58.6-59.1-173.1-177.8-90.7000111.9F95 I182 K186F95-W99 HydrophobicContact CE1-CB 4.42Å; F95-W99 HydrophobicContact CE1-CD2 4.39Å; F95-W99 HydrophobicContact CE1-CE3 4.13Å; F95-W99 HydrophobicContact CE1-CG 4.49Å; F95-W99 AromaticContact CE2-CE3 3.63Å; F95-W99 HydrophobicContact CE2-CE3 3.63Å; F95-W99 HydrophobicContact CE2-CZ3 4.12Å; F95-W99 AromaticContact CZ-CD2 3.95Å; F95-W99 HydrophobicContact CZ-CD2 3.95Å; F95-W99 AromaticContact CZ-CE3 3.28Å; F95-W99 HydrophobicContact CZ-CE3 3.28Å; F95-W99 HydrophobicContact CZ-CG 4.45Å; F95-W99 AromaticContact CZ-CZ3 3.8Å; F95-W99 HydrophobicContact CZ-CZ3 3.8Å; F95-W99 VanDerWaalsContact O-CB 3.3Å; F95-W99 WeakPolarHBondContact O-CB 3.49Å; F95-W99 PolarHBondContact O-N 2.92Å; W99-I182 HydrophobicContact CD2-CD1 4.39Å; W99-I182 HydrophobicContact CE3-CD1 3.27Å; W99-I182 HydrophobicContact CE3-CG1 4.06Å; W99-I182 HydrophobicContact CZ3-CD1 3.68Å; W99-I182 HydrophobicContact CZ3-CG1 4.15Å; W99-K186 PolarHBondContact O-NZ 3.49Å; W99-K186 VanDerWaalsContact O-NZ 3.07Å
100K73.6Confident76.5Confident126 Ų12657.5 Ų57.555%0.54828%0.281SS..  trans-134.2101177.6-83.6-179.8179.4-175.10109.2T102 Q108K100-T102 PolarHBondContact O-N 2.92Å; K100-T102 PolarHBondContact O-OG1 3.02Å; K100-Q108 PolarHBondContact O-NE2 2.96Å; K100-Q108 PolarHBondContact O-OE1 3.47Å
101P66.4Low76.5Confident87 Ų8764.4 Ų64.457%0.56531%0.306SS*.  trans-71.775.5163.429.7-31.7000108.2
102T57.6Low76.4Confident73 Ų7365 Ų6545%0.44831%0.309SS..  trans-89.6131.6179.211.20000110.2K100 P104 Y105 Q108K100-T102 PolarHBondContact O-N 2.92Å; K100-T102 PolarHBondContact O-OG1 3.02Å; T102-P104 CarbonylContact O-C 3.39Å; T102-Y105 WeakPolarHBondContact O-CA 3.45Å; T102-Y105 PolarHBondContact O-N 2.92Å; T102-Y105 VanDerWaalsContact O-N 3.13Å; T102-Q108 PolarHBondContact OG1-OE1 3Å
103H54.4Low76.2Confident156 Ų15665.8 Ų65.872%0.72231%0.311SS*.SBendtrans-74.5131.1166.5-169.3-68.2000108.6
104P62.3Low76.4Confident71 Ų7172.7 Ų72.746%0.46134%0.341SS..  cis-89.4109.57.532.3-30.8000113.2T102 R106 L107 Q108T102-P104 CarbonylContact O-C 3.39Å; P104-R106 PolarHBondContact O-N 3.49Å; P104-R106 VanDerWaalsContact O-N 3.17Å; P104-L107 HydrophobicContact CG-CB 4.02Å; P104-L107 HydrophobicContact CG-CD2 4.49Å; P104-L107 PolarHBondContact O-N 2.91Å; P104-Q108 PolarHBondContact O-N 3.28Å
105Y68.1Low76.8Confident42 Ų4276.3 Ų76.317%0.16536%0.36CS..Hα-helixtrans-50.8-40.5179.3176.5-112.3000113.1D17 H21 T102 L107 Q108 I109D17-Y105 HydrophobicContact CB-CD1 3.89Å; D17-Y105 HydrophobicContact CB-CE1 4.06Å; H21-Y105 HydrophobicContact CB-CE1 4.46Å; H21-Y105 WeakPolarHBondContact CB-OH 3.33Å; H21-Y105 PolarHBondContact CD2-OH 3.18Å; H21-Y105 VanDerWaalsContact CG-OH 3.28Å; T102-Y105 WeakPolarHBondContact O-CA 3.45Å; T102-Y105 PolarHBondContact O-N 2.92Å; T102-Y105 VanDerWaalsContact O-N 3.13Å; Y105-L107 PolarHBondContact O-N 3.45Å; Y105-Q108 PolarHBondContact O-N 2.81Å; Y105-I109 HydrophobicContact CD1-CD1 3.51Å; Y105-I109 HydrophobicContact CD1-CG1 4.46Å; Y105-I109 HydrophobicContact CD2-CD1 4.22Å; Y105-I109 HydrophobicContact CD2-CG1 4.4Å; Y105-I109 HydrophobicContact CE1-CD1 3.12Å; Y105-I109 HydrophobicContact CE1-CG1 4.22Å; Y105-I109 HydrophobicContact CE2-CD1 3.88Å; Y105-I109 HydrophobicContact CE2-CG1 4.14Å; Y105-I109 HydrophobicContact CG-CD1 4.06Å; Y105-I109 WeakPolarHBondContact O-CG1 3.38Å; Y105-I109 PolarHBondContact O-N 2.92Å
106R69.7Low76.9Confident160 Ų16075 Ų7560%0.60436%0.355SS*.Hα-helixtrans-57-43177.5-178.5170.7-179.2-154.70.2113.4L20 P104 L110L20-R106 HydrophobicContact CD2-CB 4.26Å; L20-R106 HydrophobicContact CD2-CG 3.7Å; P104-R106 PolarHBondContact O-N 3.49Å; P104-R106 VanDerWaalsContact O-N 3.17Å; R106-L110 HydrophobicContact CG-CD1 4.18Å; R106-L110 VanDerWaalsContact O-CG 3.31Å; R106-L110 WeakPolarHBondContact O-CG 3.31Å; R106-L110 PolarHBondContact O-N 3.29Å; R106-L110 VanDerWaalsContact O-N 3.09Å
107L76.2Confident77.2Confident97 Ų9777.6 Ų77.651%0.50837%0.366SS..Hα-helixtrans-71.2-36.3-177.8-166.368.9000111P104 Y105 R111P104-L107 HydrophobicContact CG-CB 4.02Å; P104-L107 HydrophobicContact CG-CD2 4.49Å; P104-L107 PolarHBondContact O-N 2.91Å; Y105-L107 PolarHBondContact O-N 3.45Å; L107-R111 VanDerWaalsContact O-CB 3.29Å; L107-R111 WeakPolarHBondContact O-CB 3.49Å; L107-R111 PolarHBondContact O-N 3.15Å
108Q78Confident77.8Confident46 Ų4682.9 Ų82.922%0.21539%0.391CS..Hα-helixtrans-63.8-47.3175.8-174.71773.600111C96 K100 T102 P104 Y105 R111 I112C96-Q108 PolarHBondContact O-NE2 3.44Å; K100-Q108 PolarHBondContact O-NE2 2.96Å; K100-Q108 PolarHBondContact O-OE1 3.47Å; T102-Q108 PolarHBondContact OG1-OE1 3Å; P104-Q108 PolarHBondContact O-N 3.28Å; Y105-Q108 PolarHBondContact O-N 2.81Å; Q108-R111 WeakPolarHBondContact O-CB 3.33Å; Q108-R111 PolarHBondContact O-N 2.88Å; Q108-I112 HydrophobicContact CG-CD1 3.79Å; Q108-I112 WeakPolarHBondContact O-CD1 3.45Å; Q108-I112 VanDerWaalsContact O-CG1 3.26Å; Q108-I112 WeakPolarHBondContact O-CG1 3.23Å; Q108-I112 PolarHBondContact O-N 3.41Å
109I77.3Confident78.4Confident5 Ų585.3 Ų85.33%0.02640%0.404CS..Hα-helixtrans-62.1-47178-61.8163.9000111.4H21 N24 Y105 R111 I112 K113H21-I109 HydrophobicContact CB-CD1 4.39Å; N24-I109 HydrophobicContact CB-CG2 3.94Å; N24-I109 WeakPolarHBondContact ND2-CG2 3.32Å; Y105-I109 HydrophobicContact CD1-CD1 3.51Å; Y105-I109 HydrophobicContact CD1-CG1 4.46Å; Y105-I109 HydrophobicContact CD2-CD1 4.22Å; Y105-I109 HydrophobicContact CD2-CG1 4.4Å; Y105-I109 HydrophobicContact CE1-CD1 3.12Å; Y105-I109 HydrophobicContact CE1-CG1 4.22Å; Y105-I109 HydrophobicContact CE2-CD1 3.88Å; Y105-I109 HydrophobicContact CE2-CG1 4.14Å; Y105-I109 HydrophobicContact CG-CD1 4.06Å; Y105-I109 WeakPolarHBondContact O-CG1 3.38Å; Y105-I109 PolarHBondContact O-N 2.92Å; I109-R111 VanDerWaalsContact C-N 3.25Å; I109-R111 PolarHBondContact O-N 3.37Å; I109-I112 PolarHBondContact O-N 3.49Å; I109-K113 WeakPolarHBondContact O-CB 3.24Å; I109-K113 PolarHBondContact O-N 3.14Å
110L81.6Confident78.9Confident77 Ų7780 Ų8040%0.40339%0.385SS..Hα-helixtrans-60.4-38.5178.9-71.4173.9000111.7R106 K114R106-L110 HydrophobicContact CG-CD1 4.18Å; R106-L110 VanDerWaalsContact O-CG 3.31Å; R106-L110 WeakPolarHBondContact O-CG 3.31Å; R106-L110 PolarHBondContact O-N 3.29Å; R106-L110 VanDerWaalsContact O-N 3.09Å; L110-K114 WeakPolarHBondContact O-CB 3.22Å; L110-K114 PolarHBondContact O-N 2.78Å
111R84.4Confident79.8Confident154 Ų15477.1 Ų77.158%0.58138%0.381SS*.Hα-helixtrans-64.6-47.4175.5-172.9-175.3-61.8172-0.6111.4L107 Q108 I109 K113 K114 I115L107-R111 VanDerWaalsContact O-CB 3.29Å; L107-R111 WeakPolarHBondContact O-CB 3.49Å; L107-R111 PolarHBondContact O-N 3.15Å; Q108-R111 WeakPolarHBondContact O-CB 3.33Å; Q108-R111 PolarHBondContact O-N 2.88Å; I109-R111 VanDerWaalsContact C-N 3.25Å; I109-R111 PolarHBondContact O-N 3.37Å; R111-K113 VanDerWaalsContact C-N 3.35Å; R111-K114 PolarHBondContact O-N 2.98Å; R111-I115 HydrophobicContact CG-CD1 3.92Å; R111-I115 VanDerWaalsContact O-CG1 3.25Å; R111-I115 WeakPolarHBondContact O-CG1 3.43Å; R111-I115 PolarHBondContact O-N 3.05Å
112I85.4Confident81.2Confident16 Ų1678.5 Ų78.58%0.08238%0.383CS..Hα-helixtrans-63.5-43179.1-66.1158.3000110.7D93 C96 Q108 I109 K114 I115 G116D93-I112 HydrophobicContact CB-CG2 3.83Å; C96-I112 HydrophobicContact CB-CD1 3.3Å; C96-I112 HydrophobicContact CB-CG1 4.22Å; Q108-I112 HydrophobicContact CG-CD1 3.79Å; Q108-I112 WeakPolarHBondContact O-CD1 3.45Å; Q108-I112 VanDerWaalsContact O-CG1 3.26Å; Q108-I112 WeakPolarHBondContact O-CG1 3.23Å; Q108-I112 PolarHBondContact O-N 3.41Å; I109-I112 PolarHBondContact O-N 3.49Å; I112-K114 VanDerWaalsContact C-N 3.35Å; I112-K114 PolarHBondContact O-N 3.45Å; I112-I115 PolarHBondContact O-N 2.78Å; I112-G116 PolarHBondContact O-N 3.25Å
113K85.1Confident82.9Confident52 Ų5275.2 Ų75.223%0.22636%0.363CS..Hα-helixtrans-57.3-48.4174-178.9-178.7-168.9165.60111.4N24 S27 I109 R111 I115 G116 I117N24-K113 WeakPolarHBondContact OD1-CD 3.27Å; N24-K113 PolarHBondContact OD1-NZ 3.14Å; S27-K113 WeakPolarHBondContact OG-CE 2.91Å; I109-K113 WeakPolarHBondContact O-CB 3.24Å; I109-K113 PolarHBondContact O-N 3.14Å; R111-K113 VanDerWaalsContact C-N 3.35Å; K113-I115 VanDerWaalsContact C-N 3.32Å; K113-I115 PolarHBondContact O-N 2.89Å; K113-G116 PolarHBondContact O-N 2.91Å; K113-I117 HydrophobicContact CD-CD1 4.48Å; K113-I117 HydrophobicContact CG-CD1 3.83Å; K113-I117 HydrophobicContact CG-CG1 4.45Å; K113-I117 WeakPolarHBondContact O-CG1 3.33Å; K113-I117 PolarHBondContact O-N 3.46Å
114K88.8Confident84.7Confident148 Ų14868.8 Ų68.864%0.64334%0.335SS*.Hα-helixtrans-59.9-44.8177.2-173.2177.4-179.9179.90110.7L110 R111 I112 M118L110-K114 WeakPolarHBondContact O-CB 3.22Å; L110-K114 PolarHBondContact O-N 2.78Å; R111-K114 PolarHBondContact O-N 2.98Å; I112-K114 VanDerWaalsContact C-N 3.35Å; I112-K114 PolarHBondContact O-N 3.45Å; K114-M118 HydrophobicContact CG-CG 4.34Å; K114-M118 WeakPolarHBondContact O-CB 3.48Å; K114-M118 WeakPolarHBondContact O-CG 3.28Å; K114-M118 PolarHBondContact O-N 3.43Å
115I90.4Very high86.3Confident87 Ų8769.7 Ų69.745%0.44634%0.336SS..Hα-helixtrans-61.1-45.7176.6-68.8165.7000110.8R111 I112 K113 M118 L119R111-I115 HydrophobicContact CG-CD1 3.92Å; R111-I115 VanDerWaalsContact O-CG1 3.25Å; R111-I115 WeakPolarHBondContact O-CG1 3.43Å; R111-I115 PolarHBondContact O-N 3.05Å; I112-I115 PolarHBondContact O-N 2.78Å; K113-I115 VanDerWaalsContact C-N 3.32Å; K113-I115 PolarHBondContact O-N 2.89Å; I115-M118 PolarHBondContact O-N 3.5Å; I115-L119 VanDerWaalsContact O-CB 3.31Å; I115-L119 WeakPolarHBondContact O-CB 3.12Å; I115-L119 PolarHBondContact O-N 2.88Å
116G90.1Very high87.6Confident2 Ų271.3 Ų71.32%0.02134%0.344CS..Hα-helixtrans-62.2-48178.700000112.5S89 I112 K113 M118 L119 I120S89-G116 WeakPolarHBondContact OG-CA 3.01Å; I112-G116 PolarHBondContact O-N 3.25Å; K113-G116 PolarHBondContact O-N 2.91Å; G116-M118 PolarHBondContact O-N 3.32Å; G116-L119 PolarHBondContact O-N 3.42Å; G116-I120 WeakPolarHBondContact O-CD1 3.23Å; G116-I120 VanDerWaalsContact O-CG1 3.24Å; G116-I120 WeakPolarHBondContact O-CG1 3.46Å; G116-I120 PolarHBondContact O-N 3.19Å
117I90.9Very high88.8Confident81 Ų8163.7 Ų63.742%0.41532%0.315SS..Hα-helixtrans-60.6-45.6175.5-67.2169.6000110.6K113 L119 I120 S121K113-I117 HydrophobicContact CD-CD1 4.48Å; K113-I117 HydrophobicContact CG-CD1 3.83Å; K113-I117 HydrophobicContact CG-CG1 4.45Å; K113-I117 WeakPolarHBondContact O-CG1 3.33Å; K113-I117 PolarHBondContact O-N 3.46Å; I117-L119 VanDerWaalsContact C-N 3.31Å; I117-L119 PolarHBondContact O-N 3.17Å; I117-I120 PolarHBondContact O-N 3.48Å; I117-S121 WeakPolarHBondContact O-CB 3.36Å; I117-S121 PolarHBondContact O-N 3.38Å; I117-S121 PolarHBondContact O-OG 2.98Å; I117-S121 VanDerWaalsContact O-OG 3.05Å
118M92.6Very high89.6Confident120 Ų12063.3 Ų63.359%0.59131%0.31SS*.Hα-helixtrans-62.3-39.6178-69.8-67.6-77.500111.5K114 I115 G116 L122K114-M118 HydrophobicContact CG-CG 4.34Å; K114-M118 WeakPolarHBondContact O-CB 3.48Å; K114-M118 WeakPolarHBondContact O-CG 3.28Å; K114-M118 PolarHBondContact O-N 3.43Å; I115-M118 PolarHBondContact O-N 3.5Å; G116-M118 PolarHBondContact O-N 3.32Å; M118-L122 WeakPolarHBondContact O-CB 3.38Å; M118-L122 PolarHBondContact O-N 2.83Å
119L92.1Very high90.4Very high54 Ų5464.8 Ų64.828%0.28332%0.318SS..Hα-helixtrans-65.8-45.2177.1-177.667.1000111.8F88 I115 G116 I117 L122 S123F88-L119 HydrophobicContact CD1-CD2 3.31Å; F88-L119 HydrophobicContact CE1-CD2 3.52Å; F88-L119 HydrophobicContact CG-CD2 4.45Å; I115-L119 VanDerWaalsContact O-CB 3.31Å; I115-L119 WeakPolarHBondContact O-CB 3.12Å; I115-L119 PolarHBondContact O-N 2.88Å; G116-L119 PolarHBondContact O-N 3.42Å; I117-L119 VanDerWaalsContact C-N 3.31Å; I117-L119 PolarHBondContact O-N 3.17Å; L119-L122 PolarHBondContact O-N 3.13Å; L119-S123 VanDerWaalsContact O-CB 3.22Å; L119-S123 WeakPolarHBondContact O-CB 3.39Å; L119-S123 PolarHBondContact O-N 3.03Å; L119-S123 PolarHBondContact O-OG 3.33Å
120I92.4Very high91.2Very high26 Ų2665.4 Ų65.413%0.13332%0.321CS..Hα-helixtrans-61.5-48.3176.4-65.4160.6000109.9L28 A82 A85 S86 G116 I117 S123 S124L28-I120 HydrophobicContact CD2-CD1 4.35Å; A82-I120 HydrophobicContact CB-CG2 4.21Å; A85-I120 HydrophobicContact CB-CG1 4.06Å; S86-I120 WeakPolarHBondContact OG-CD1 3.5Å; G116-I120 WeakPolarHBondContact O-CD1 3.23Å; G116-I120 VanDerWaalsContact O-CG1 3.24Å; G116-I120 WeakPolarHBondContact O-CG1 3.46Å; G116-I120 PolarHBondContact O-N 3.19Å; I117-I120 PolarHBondContact O-N 3.48Å; I120-S123 PolarHBondContact O-OG 2.72Å; I120-S124 VanDerWaalsContact O-CB 3.24Å; I120-S124 WeakPolarHBondContact O-CB 3.26Å; I120-S124 PolarHBondContact O-N 3.46Å; I120-S124 PolarHBondContact O-OG 2.79Å
121S92.9Very high91.7Very high65 Ų6561.7 Ų61.746%0.45530%0.302SS..Hα-helixtrans-63.5-44.6179.2-64.30000112.3I117 S124 L125I117-S121 WeakPolarHBondContact O-CB 3.36Å; I117-S121 PolarHBondContact O-N 3.38Å; I117-S121 PolarHBondContact O-OG 2.98Å; I117-S121 VanDerWaalsContact O-OG 3.05Å; S121-S124 PolarHBondContact O-N 2.93Å; S121-L125 VanDerWaalsContact O-CB 3.26Å; S121-L125 WeakPolarHBondContact O-CB 3.04Å; S121-L125 PolarHBondContact O-N 2.89Å
122L94.9Very high92Very high117 Ų11756.9 Ų56.961%0.61329%0.287SS*.Hα-helixtrans-68.8-40.6-178.6-174.562.7000111.9M118 L119 L125 F126M118-L122 WeakPolarHBondContact O-CB 3.38Å; M118-L122 PolarHBondContact O-N 2.83Å; L119-L122 PolarHBondContact O-N 3.13Å; L122-L125 PolarHBondContact O-N 3.43Å; L122-F126 VanDerWaalsContact O-CB 3.27Å; L122-F126 WeakPolarHBondContact O-CB 3.47Å; L122-F126 PolarHBondContact O-N 3.27Å
123S93.2Very high92.3Very high4 Ų460.2 Ų60.23%0.02830%0.304CS..Hα-helixtrans-68.7-37.2176.659.90000112.5T81 A85 L119 I120 F126 T127T81-S123 WeakPolarHBondContact CG2-O 3.24Å; A85-S123 VanDerWaalsContact CB-OG 3.32Å; A85-S123 WeakPolarHBondContact CB-OG 2.83Å; L119-S123 VanDerWaalsContact O-CB 3.22Å; L119-S123 WeakPolarHBondContact O-CB 3.39Å; L119-S123 PolarHBondContact O-N 3.03Å; L119-S123 PolarHBondContact O-OG 3.33Å; I120-S123 PolarHBondContact O-OG 2.72Å; S123-F126 PolarHBondContact O-N 3.39Å; S123-T127 PolarHBondContact O-N 3.48Å; S123-T127 PolarHBondContact O-OG1 3.33Å
124S93.6Very high92.4Very high21 Ų2158.3 Ų58.315%0.14730%0.297CS..Hα-helixtrans-63.7-47.2172.1-60.60000111.4A82 I120 S121 T127 F128A82-S124 WeakPolarHBondContact CB-OG 3.12Å; I120-S124 VanDerWaalsContact O-CB 3.24Å; I120-S124 WeakPolarHBondContact O-CB 3.26Å; I120-S124 PolarHBondContact O-N 3.46Å; I120-S124 PolarHBondContact O-OG 2.79Å; S121-S124 PolarHBondContact O-N 2.93Å; S124-T127 PolarHBondContact O-N 3.42Å; S124-F128 WeakPolarHBondContact O-CB 3.25Å; S124-F128 PolarHBondContact O-N 3.37Å
125L95.2Very high92.3Very high89 Ų8951.6 Ų51.647%0.46627%0.269SS..Hα-helixtrans-63.5-42.2176.9-178.763.8000111.5S121 L122 T127 F128 I129S121-L125 VanDerWaalsContact O-CB 3.26Å; S121-L125 WeakPolarHBondContact O-CB 3.04Å; S121-L125 PolarHBondContact O-N 2.89Å; L122-L125 PolarHBondContact O-N 3.43Å; L125-T127 VanDerWaalsContact C-N 3.33Å; L125-T127 PolarHBondContact O-N 2.99Å; L125-F128 PolarHBondContact O-N 2.76Å; L125-I129 HydrophobicContact CD1-CD1 4Å; L125-I129 HydrophobicContact CD1-CG1 4.21Å; L125-I129 HydrophobicContact CD2-CD1 4.43Å; L125-I129 HydrophobicContact CG-CD1 3.8Å; L125-I129 HydrophobicContact CG-CG1 4.39Å; L125-I129 WeakPolarHBondContact O-CB 3.37Å; L125-I129 VanDerWaalsContact O-CG1 3.28Å; L125-I129 WeakPolarHBondContact O-CG1 3.33Å; L125-I129 PolarHBondContact O-N 2.9Å
126F95.4Very high92.1Very high76 Ų7651.6 Ų51.633%0.33327%0.273SS..Hα-helixtrans-56.6-48173.9169.4-103.3000111.2L122 S123 F128 I129 L130 I160 F164L122-F126 VanDerWaalsContact O-CB 3.27Å; L122-F126 WeakPolarHBondContact O-CB 3.47Å; L122-F126 PolarHBondContact O-N 3.27Å; S123-F126 PolarHBondContact O-N 3.39Å; F126-F128 PolarHBondContact O-N 2.95Å; F126-I129 PolarHBondContact O-N 3.43Å; F126-L130 HydrophobicContact CE1-CD2 4.32Å; F126-L130 HydrophobicContact CZ-CD2 4.36Å; F126-L130 VanDerWaalsContact O-CB 3.24Å; F126-L130 WeakPolarHBondContact O-CB 3.3Å; F126-L130 PolarHBondContact O-N 3.06Å; F126-I160 HydrophobicContact CZ-CG2 4.12Å; F126-F164 HydrophobicContact CD1-CD1 4.14Å; F126-F164 HydrophobicContact CD1-CE1 4.04Å; F126-F164 HydrophobicContact CD1-CE2 4.46Å; F126-F164 HydrophobicContact CD1-CG 4.38Å; F126-F164 HydrophobicContact CD1-CZ 4.19Å; F126-F164 HydrophobicContact CE1-CB 4.33Å; F126-F164 HydrophobicContact CE1-CD1 4.07Å; F126-F164 HydrophobicContact CE1-CD2 4.14Å; F126-F164 HydrophobicContact CE1-CE1 4.39Å; F126-F164 HydrophobicContact CE1-CE2 4.47Å; F126-F164 AromaticContact CE1-CG 3.92Å; F126-F164 HydrophobicContact CE1-CG 3.92Å
127T94Very high91.9Very high0 Ų056.3 Ų56.30%031%0.305CS..Hα-helixtrans-63.5-43.7178.5-55.90000111.4F77 V78 T81 S123 S124 L125 L130 V131F77-T127 HydrophobicContact CB-CG2 3.85Å; V78-T127 HydrophobicContact CG2-CG2 4.29Å; T81-T127 VanDerWaalsContact CB-OG1 3.23Å; T81-T127 WeakPolarHBondContact CB-OG1 3.38Å; T81-T127 WeakPolarHBondContact CG2-OG1 3.47Å; T81-T127 PolarHBondContact OG1-OG1 2.93Å; S123-T127 PolarHBondContact O-N 3.48Å; S123-T127 PolarHBondContact O-OG1 3.33Å; S124-T127 PolarHBondContact O-N 3.42Å; L125-T127 VanDerWaalsContact C-N 3.33Å; L125-T127 PolarHBondContact O-N 2.99Å; T127-L130 PolarHBondContact O-N 3.41Å; T127-V131 WeakPolarHBondContact O-CG2 3.32Å; T127-V131 PolarHBondContact O-N 3.23Å
128F94.5Very high91.5Very high90 Ų9056.5 Ų56.540%0.39530%0.301SS..Hα-helixtrans-57.9-52.5175.9177.2-98.1000111.4I74 V78 S124 L125 F126 L130 V131 I132I74-F128 HydrophobicContact CG2-CD2 3.59Å; I74-F128 HydrophobicContact CG2-CE2 3.97Å; V78-F128 HydrophobicContact CG2-CB 4.05Å; S124-F128 WeakPolarHBondContact O-CB 3.25Å; S124-F128 PolarHBondContact O-N 3.37Å; L125-F128 PolarHBondContact O-N 2.76Å; F126-F128 PolarHBondContact O-N 2.95Å; F128-L130 VanDerWaalsContact C-N 3.3Å; F128-L130 PolarHBondContact O-N 3.48Å; F128-V131 PolarHBondContact O-N 3.39Å; F128-I132 HydrophobicContact CD1-CG1 4.41Å; F128-I132 HydrophobicContact CE1-CG1 4.03Å; F128-I132 HydrophobicContact CE2-CD1 4.48Å; F128-I132 HydrophobicContact CE2-CG1 4.47Å; F128-I132 HydrophobicContact CZ-CD1 4.27Å; F128-I132 HydrophobicContact CZ-CG1 4.06Å; F128-I132 WeakPolarHBondContact O-CG1 3.44Å; F128-I132 PolarHBondContact O-N 3.39Å
129I94.6Very high90.8Very high77 Ų7753.5 Ų53.540%0.39529%0.292SS..Hα-helixtrans-59.4-42.9178.1-69.3170.6000110.6L125 F126 V131 I132 I133L125-I129 HydrophobicContact CD1-CD1 4Å; L125-I129 HydrophobicContact CD1-CG1 4.21Å; L125-I129 HydrophobicContact CD2-CD1 4.43Å; L125-I129 HydrophobicContact CG-CD1 3.8Å; L125-I129 HydrophobicContact CG-CG1 4.39Å; L125-I129 WeakPolarHBondContact O-CB 3.37Å; L125-I129 VanDerWaalsContact O-CG1 3.28Å; L125-I129 WeakPolarHBondContact O-CG1 3.33Å; L125-I129 PolarHBondContact O-N 2.9Å; F126-I129 PolarHBondContact O-N 3.43Å; I129-V131 VanDerWaalsContact C-N 3.35Å; I129-V131 PolarHBondContact O-N 2.84Å; I129-I132 PolarHBondContact O-N 3.49Å; I129-I132 VanDerWaalsContact O-N 3.17Å; I129-I133 HydrophobicContact CG2-CD1 3.49Å; I129-I133 VanDerWaalsContact CG2-CD1 3.49Å; I129-I133 HydrophobicContact CG2-CG1 4.06Å; I129-I133 WeakPolarHBondContact O-CB 3.16Å; I129-I133 WeakPolarHBondContact O-CG1 3.23Å; I129-I133 PolarHBondContact O-N 2.87Å
130L93.4Very high90.4Very high17 Ų1754.7 Ų54.79%0.08930%0.298CS..Hα-helixtrans-60.7-42.9179.5-172.370.5000111.7F126 T127 F128 C134 F157 I160 H161F126-L130 HydrophobicContact CE1-CD2 4.32Å; F126-L130 HydrophobicContact CZ-CD2 4.36Å; F126-L130 VanDerWaalsContact O-CB 3.24Å; F126-L130 WeakPolarHBondContact O-CB 3.3Å; F126-L130 PolarHBondContact O-N 3.06Å; T127-L130 PolarHBondContact O-N 3.41Å; F128-L130 VanDerWaalsContact C-N 3.3Å; F128-L130 PolarHBondContact O-N 3.48Å; L130-C134 WeakPolarHBondContact O-CB 3.26Å; L130-C134 PolarHBondContact O-N 2.97Å; L130-C134 PolarHBondContact O-SG 2.9Å; L130-F157 HydrophobicContact CB-CD2 4.47Å; L130-F157 HydrophobicContact CB-CE2 4.33Å; L130-F157 HydrophobicContact CD2-CD2 3.79Å; L130-F157 HydrophobicContact CD2-CE2 3.82Å; L130-F157 HydrophobicContact CG-CD2 3.79Å; L130-F157 HydrophobicContact CG-CE2 4.03Å; L130-I160 HydrophobicContact CD1-CD1 4.17Å; L130-I160 HydrophobicContact CD1-CG2 4.05Å; L130-I160 HydrophobicContact CD2-CB 4.04Å; L130-I160 HydrophobicContact CD2-CG2 3.65Å; L130-H161 HydrophobicContact CD2-CB 4.38Å
131V91.3Very high90Very high0 Ų058.5 Ų58.50%032%0.315CS..Hα-helixtrans-61-48.1173.9176.40000110.4I74 F77 T127 F128 I129 C134 C135 V153 F157I74-V131 HydrophobicContact CG1-CG1 4.01Å; F77-V131 HydrophobicContact CD2-CG2 4.48Å; T127-V131 WeakPolarHBondContact O-CG2 3.32Å; T127-V131 PolarHBondContact O-N 3.23Å; F128-V131 PolarHBondContact O-N 3.39Å; I129-V131 VanDerWaalsContact C-N 3.35Å; I129-V131 PolarHBondContact O-N 2.84Å; V131-C134 PolarHBondContact O-N 2.87Å; V131-C135 WeakPolarHBondContact O-CB 3.37Å; V131-C135 PolarHBondContact O-N 3.49Å; V131-C135 PolarHBondContact O-SG 3.23Å; V131-V153 HydrophobicContact CG1-CG1 4.25Å; V131-F157 HydrophobicContact CB-CE2 4.26Å; V131-F157 HydrophobicContact CG2-CD2 4.1Å; V131-F157 HydrophobicContact CG2-CE2 3.28Å; V131-F157 HydrophobicContact CG2-CZ 3.55Å
132I91.1Very high89.6Confident53 Ų5360.6 Ų60.627%0.27232%0.321SS..Hα-helixtrans-60.4-49.7-179.3-62.2-53.9000111.1L67 I74 F128 I129 C134 C135 T136L67-I132 HydrophobicContact CD1-CD1 3.94Å; I74-I132 HydrophobicContact CD1-CD1 4.49Å; F128-I132 HydrophobicContact CD1-CG1 4.41Å; F128-I132 HydrophobicContact CE1-CG1 4.03Å; F128-I132 HydrophobicContact CE2-CD1 4.48Å; F128-I132 HydrophobicContact CE2-CG1 4.47Å; F128-I132 HydrophobicContact CZ-CD1 4.27Å; F128-I132 HydrophobicContact CZ-CG1 4.06Å; F128-I132 WeakPolarHBondContact O-CG1 3.44Å; F128-I132 PolarHBondContact O-N 3.39Å; I129-I132 PolarHBondContact O-N 3.49Å; I129-I132 VanDerWaalsContact O-N 3.17Å; I132-C134 PolarHBondContact O-N 2.72Å; I132-C135 PolarHBondContact O-N 2.83Å; I132-T136 HydrophobicContact CG2-CG2 4.27Å; I132-T136 WeakPolarHBondContact O-CG2 3.37Å; I132-T136 PolarHBondContact O-N 2.83Å; I132-T136 PolarHBondContact O-OG1 3.01Å
133I91.4Very high89.1Confident86 Ų8656 Ų5644%0.44130%0.297SS..Hα-helixtrans-59.2-49179.3-69.4174.1000110.6I129 C135 T136 C137I129-I133 HydrophobicContact CG2-CD1 3.49Å; I129-I133 VanDerWaalsContact CG2-CD1 3.49Å; I129-I133 HydrophobicContact CG2-CG1 4.06Å; I129-I133 WeakPolarHBondContact O-CB 3.16Å; I129-I133 WeakPolarHBondContact O-CG1 3.23Å; I129-I133 PolarHBondContact O-N 2.87Å; I133-C135 VanDerWaalsContact C-N 3.31Å; I133-C135 PolarHBondContact O-N 3.42Å; I133-T136 PolarHBondContact O-N 2.88Å; I133-T136 PolarHBondContact O-OG1 3.34Å; I133-T136 VanDerWaalsContact O-OG1 3.14Å; I133-C137 VanDerWaalsContact O-CB 3.29Å; I133-C137 WeakPolarHBondContact O-CB 3.4Å; I133-C137 PolarHBondContact O-N 3.3Å; I133-C137 PolarHBondContact O-SG 3.18Å
134C88.6Confident88.6Confident12 Ų1258.1 Ų58.18%0.08131%0.312CS..Hα-helixtrans-59.5-46.2179-67.20000110.2L130 V131 I132 T136 C137 Y138 V153 F157L130-C134 WeakPolarHBondContact O-CB 3.26Å; L130-C134 PolarHBondContact O-N 2.97Å; L130-C134 PolarHBondContact O-SG 2.9Å; V131-C134 PolarHBondContact O-N 2.87Å; I132-C134 PolarHBondContact O-N 2.72Å; C134-T136 VanDerWaalsContact C-N 3.32Å; C134-T136 PolarHBondContact O-N 2.69Å; C134-C137 PolarHBondContact O-N 3.35Å; C134-Y138 WeakPolarHBondContact O-CD2 3.45Å; C134-Y138 PolarHBondContact O-N 2.86Å; C134-V153 HydrophobicContact CB-CG1 4.03Å; C134-F157 HydrophobicContact CB-CB 4.19Å
135C86.2Confident88.1Confident7 Ų757.4 Ų57.45%0.04731%0.308CS..Hα-helixtrans-66-30-179.1-65.20000114L67 V131 I132 I133 F152L67-C135 HydrophobicContact CD1-CB 4.11Å; L67-C135 HydrophobicContact CD2-CB 4.22Å; V131-C135 WeakPolarHBondContact O-CB 3.37Å; V131-C135 PolarHBondContact O-N 3.49Å; V131-C135 PolarHBondContact O-SG 3.23Å; I132-C135 PolarHBondContact O-N 2.83Å; I133-C135 VanDerWaalsContact C-N 3.31Å; I133-C135 PolarHBondContact O-N 3.42Å; C135-F152 HydrophobicContact CB-CE2 4.33Å; C135-F152 HydrophobicContact CB-CZ 4.29Å; C135-F152 VanDerWaalsContact SG-CE2 3.6Å; C135-F152 WeakPolarHBondContact SG-CZ 3.42Å
136T86.6Confident87.5Confident87 Ų8754 Ų5453%0.53429%0.291SS..Hα-helixtrans-87.7-29.3179.755.80000113.4I132 I133 C134I132-T136 HydrophobicContact CG2-CG2 4.27Å; I132-T136 WeakPolarHBondContact O-CG2 3.37Å; I132-T136 PolarHBondContact O-N 2.83Å; I132-T136 PolarHBondContact O-OG1 3.01Å; I133-T136 PolarHBondContact O-N 2.88Å; I133-T136 PolarHBondContact O-OG1 3.34Å; I133-T136 VanDerWaalsContact O-OG1 3.14Å; C134-T136 VanDerWaalsContact C-N 3.32Å; C134-T136 PolarHBondContact O-N 2.69Å
137C86.2Confident86.9Confident101 Ų10150.6 Ų50.668%0.68228%0.276SS*.Hα-helixtrans-75.1-30.2178.7-73.50000113.2I133 C134I133-C137 VanDerWaalsContact O-CB 3.29Å; I133-C137 WeakPolarHBondContact O-CB 3.4Å; I133-C137 PolarHBondContact O-N 3.3Å; I133-C137 PolarHBondContact O-SG 3.18Å; C134-C137 PolarHBondContact O-N 3.35Å
138Y81.8Confident86.3Confident84 Ų8453.7 Ų53.733%0.32929%0.292SS..SBendtrans-72.7148.6174.4-73.9-74.3000111.8R63 C134 V153 V156R63-Y138 VanDerWaalsContact NH1-CB 3.28Å; C134-Y138 WeakPolarHBondContact O-CD2 3.45Å; C134-Y138 PolarHBondContact O-N 2.86Å; Y138-V153 WeakPolarHBondContact CE2-O 3.47Å; Y138-V156 WeakPolarHBondContact OH-CG2 3.5Å
139S77.9Confident85.7Confident58 Ų5850.3 Ų50.341%0.40628%0.281SS..  trans-49.2152.317347.80000112R63 E141R63-S139 PolarHBondContact NH1-O 3.07Å; S139-E141 PolarHBondContact O-N 2.82Å; S139-E141 WeakPolarHBondContact OG-CG 3.45Å; S139-E141 PolarHBondContact OG-OE1 3.23Å
140N82.9Confident85Confident78 Ų7848.1 Ų48.142%0.41727%0.273SS..  trans-81.649.1-176.1-134.5-5.7000112.1R64R64-N140 WeakPolarHBondContact CD-ND2 3.38Å; R64-N140 VanDerWaalsContact CG-OD1 3.31Å; R64-N140 WeakPolarHBondContact CG-OD1 3.27Å; R64-N140 PolarHBondContact NE-ND2 3.41Å
141E83.9Confident84.3Confident106 Ų10650.9 Ų50.950%0.49529%0.288SS..  trans-68157.1-174.8-76.8165.6-168.400113.1R63 S139 L143R63-E141 PolarHBondContact N-O 3.45Å; R63-E141 IonicContact NH1-OE2 3.94Å; S139-E141 PolarHBondContact O-N 2.82Å; S139-E141 WeakPolarHBondContact OG-CG 3.45Å; S139-E141 PolarHBondContact OG-OE1 3.23Å; E141-L143 PolarHBondContact O-N 3.45Å
142L84.7Confident83.8Confident109 Ų10951 Ų5157%0.57129%0.288SS*.EExtended strand (participates in β ladder)trans-78114.4171.5-70.9171.6000109.2K60 R62K60-L142 HydrophobicContact CB-CB 4.28Å; K60-L142 HydrophobicContact CB-CD2 4.41Å; K60-L142 HydrophobicContact CD-CB 4.13Å; K60-L142 HydrophobicContact CD-CD1 4.37Å; R62-L142 HydrophobicContact CG-CD2 4.02Å
143L85.3Confident83.5Confident20 Ų2048.4 Ų48.411%0.10528%0.275CS..EExtended strand (participates in β ladder)trans-104.1164.1176.6-68168.5000110K60 I61 R63 E141 A145 D151 F152K60-L143 CarbonylContact C-O 3.53Å; K60-L143 VanDerWaalsContact CA-O 3.24Å; K60-L143 WeakPolarHBondContact CA-O 3.32Å; I61-L143 PolarHBondContact N-O 2.91Å; I61-L143 PolarHBondContact O-N 2.86Å; R63-L143 HydrophobicContact CB-CD1 3.78Å; R63-L143 HydrophobicContact CG-CD1 3.89Å; E141-L143 PolarHBondContact O-N 3.45Å; L143-A145 PolarHBondContact O-N 3.25Å; L143-D151 HydrophobicContact CD2-CB 4.07Å; L143-D151 WeakPolarHBondContact CD2-O 3.24Å; L143-F152 HydrophobicContact CD1-CD2 4.37Å
144S82.4Confident83.2Confident49 Ų4944.8 Ų44.834%0.34326%0.259SS..EExtended strand (participates in β ladder)trans-55.2136.7169.4178.70000110.9S146 C147S144-S146 PolarHBondContact O-N 2.98Å; S144-S146 PolarHBondContact OG-N 3.42Å; S144-S146 PolarHBondContact OG-OG 3.05Å; S144-C147 PolarHBondContact O-N 2.92Å
145A83.8Confident82.9Confident7 Ų748 Ų486%0.05827%0.269CS..THydrogen-bonded Turntrans-62.1-18.7179.700000113.3R49 V53 A58 N59 I61 L143 C147R49-A145 PolarHBondContact NE-O 2.85Å; R49-A145 PolarHBondContact NH2-O 3.09Å; V53-A145 HydrophobicContact CG1-CB 3.99Å; V53-A145 HydrophobicContact CG2-CB 4.34Å; V53-A145 WeakPolarHBondContact CG2-O 3.34Å; A58-A145 HydrophobicContact CB-CB 3.63Å; A58-A145 WeakPolarHBondContact O-CB 3.28Å; N59-A145 PolarHBondContact O-N 3.43Å; I61-A145 HydrophobicContact CB-CB 4.41Å; I61-A145 HydrophobicContact CG2-CB 4.48Å; L143-A145 PolarHBondContact O-N 3.25Å; A145-C147 PolarHBondContact O-N 3.44Å
146S81.4Confident82.9Confident18 Ų1851.4 Ų51.413%0.12629%0.289CS..THydrogen-bonded Turntrans-66.5-13.6174.259.60000113.5S144 I148S144-S146 PolarHBondContact O-N 2.98Å; S144-S146 PolarHBondContact OG-N 3.42Å; S144-S146 PolarHBondContact OG-OG 3.05Å; S146-I148 VanDerWaalsContact C-N 3.27Å; S146-I148 PolarHBondContact O-N 2.85Å; S146-I148 WeakPolarHBondContact OG-CG1 3.46Å
147C83.2Confident83.1Confident3 Ų347.2 Ų47.22%0.0226%0.264CS..  trans51.247.2176.7-76.90000112.6R49 C66 A70 S144 A145 A149R49-C147 PolarHBondContact NH2-SG 3Å; C66-C147 WeakPolarHBondContact CA-SG 3.37Å; C66-C147 HydrophobicContact CB-CB 4.44Å; C66-C147 WeakPolarHBondContact CB-SG 3.47Å; C66-C147 VanDerWaalsContact SG-CA 3.52Å; C66-C147 WeakPolarHBondContact SG-CB 3.31Å; C66-C147 CovalentContact SG-SG 2.02Å; C66-C147 PolarHBondContact SG-SG 3.26Å; A70-C147 HydrophobicContact CB-CB 4.29Å; S144-C147 PolarHBondContact O-N 2.92Å; A145-C147 PolarHBondContact O-N 3.44Å; C147-A149 PolarHBondContact O-N 2.86Å
148I81.7Confident83.1Confident65 Ų6543 Ų4333%0.33323%0.234SC..  trans-61.7127.5178.2-59.6169.6000108S146 S150 D151 F152S146-I148 VanDerWaalsContact C-N 3.27Å; S146-I148 PolarHBondContact O-N 2.85Å; S146-I148 WeakPolarHBondContact OG-CG1 3.46Å; I148-S150 VanDerWaalsContact CG2-OG 3.27Å; I148-S150 WeakPolarHBondContact CG2-OG 3.37Å; I148-S150 PolarHBondContact O-N 3.19Å; I148-S150 VanDerWaalsContact O-N 3.1Å; I148-D151 PolarHBondContact O-N 3.45Å; I148-F152 VanDerWaalsContact O-CB 3.3Å; I148-F152 WeakPolarHBondContact O-CB 3.24Å; I148-F152 PolarHBondContact O-N 3.25Å
149A81.7Confident83.3Confident19 Ų1940.9 Ų40.916%0.15723%0.228CC..Hα-helixtrans-53.7-34.1-175.700000113.4V73 F77 C147 D151 V153 Y158V73-A149 HydrophobicContact CG1-CB 3.68Å; V73-A149 HydrophobicContact CG2-CB 4.35Å; F77-A149 HydrophobicContact CE2-CB 4.02Å; F77-A149 HydrophobicContact CZ-CB 4.11Å; C147-A149 PolarHBondContact O-N 2.86Å; A149-D151 VanDerWaalsContact C-N 3.35Å; A149-D151 PolarHBondContact O-N 3.01Å; A149-V153 WeakPolarHBondContact O-CG2 3.47Å; A149-V153 PolarHBondContact O-N 3.39Å; A149-Y158 VanDerWaalsContact C-OH 3.31Å; A149-Y158 WeakPolarHBondContact CB-OH 3.39Å
150S78.8Confident83.9Confident32 Ų3241.4 Ų41.422%0.22423%0.225CC..Hα-helixtrans-56.7-44.4176.760.70000113.5I148 G154 Y158I148-S150 VanDerWaalsContact CG2-OG 3.27Å; I148-S150 WeakPolarHBondContact CG2-OG 3.37Å; I148-S150 PolarHBondContact O-N 3.19Å; I148-S150 VanDerWaalsContact O-N 3.1Å; S150-G154 WeakPolarHBondContact O-CA 3.42Å; S150-G154 PolarHBondContact O-N 2.98Å; S150-Y158 PolarHBondContact N-OH 3.27Å
151D79.4Confident84.2Confident75 Ų7537.7 Ų37.740%0.40121%0.206SC..Hα-helixtrans-91.4-31.3-172.5-53.7-13.4000110.5R63 L143 I148 A149R63-D151 PolarHBondContact NH2-O 3.21Å; L143-D151 HydrophobicContact CD2-CB 4.07Å; L143-D151 WeakPolarHBondContact CD2-O 3.24Å; I148-D151 PolarHBondContact O-N 3.45Å; A149-D151 VanDerWaalsContact C-N 3.35Å; A149-D151 PolarHBondContact O-N 3.01Å
152F81.2Confident84.4Confident1 Ų132.8 Ų32.80%0.00418%0.183CC..Hα-helixtrans-69.8-55.3179.9168.9-121.7000112.5R63 C66 L67 A70 V73 C135 L143 I148R63-F152 HydrophobicContact CG-CD2 4.37Å; R63-F152 HydrophobicContact CG-CE2 4.44Å; R63-F152 PolarHBondContact NE-O 2.9Å; C66-F152 HydrophobicContact CB-CD2 4.12Å; C66-F152 HydrophobicContact CB-CE2 4.26Å; C66-F152 VanDerWaalsContact SG-CD2 3.51Å; L67-F152 HydrophobicContact CB-CE2 3.87Å; L67-F152 HydrophobicContact CB-CZ 3.89Å; L67-F152 HydrophobicContact CD1-CE2 4.46Å; L67-F152 HydrophobicContact CD1-CZ 3.71Å; L67-F152 HydrophobicContact CG-CZ 4.42Å; A70-F152 HydrophobicContact CB-CD1 4.36Å; A70-F152 HydrophobicContact CB-CE1 4Å; A70-F152 HydrophobicContact CB-CZ 4.28Å; V73-F152 HydrophobicContact CG1-CD1 4.23Å; V73-F152 HydrophobicContact CG1-CE1 4.41Å; C135-F152 HydrophobicContact CB-CE2 4.33Å; C135-F152 HydrophobicContact CB-CZ 4.29Å; C135-F152 VanDerWaalsContact SG-CE2 3.6Å; C135-F152 WeakPolarHBondContact SG-CZ 3.42Å; L143-F152 HydrophobicContact CD1-CD2 4.37Å; I148-F152 VanDerWaalsContact O-CB 3.3Å; I148-F152 WeakPolarHBondContact O-CB 3.24Å; I148-F152 PolarHBondContact O-N 3.25Å
153V85.3Confident84.6Confident0 Ų032.8 Ų32.80%018%0.178CC..Hα-helixtrans-89.7-21.8-174.7-1520000112.1V73 F77 V131 C134 Y138 A149 F157V73-V153 HydrophobicContact CG1-CG2 4.14Å; F77-V153 HydrophobicContact CE2-CG2 4.27Å; V131-V153 HydrophobicContact CG1-CG1 4.25Å; C134-V153 HydrophobicContact CB-CG1 4.03Å; Y138-V153 WeakPolarHBondContact CE2-O 3.47Å; A149-V153 WeakPolarHBondContact O-CG2 3.47Å; A149-V153 PolarHBondContact O-N 3.39Å; V153-F157 HydrophobicContact CB-CB 4.08Å; V153-F157 HydrophobicContact CB-CD1 3.87Å; V153-F157 HydrophobicContact CB-CG 3.95Å; V153-F157 HydrophobicContact CG1-CB 3.44Å; V153-F157 VanDerWaalsContact CG1-CB 3.44Å; V153-F157 HydrophobicContact CG1-CD1 3.53Å; V153-F157 HydrophobicContact CG1-CD2 3.55Å; V153-F157 HydrophobicContact CG1-CE1 4.2Å; V153-F157 HydrophobicContact CG1-CE2 4.23Å; V153-F157 HydrophobicContact CG1-CG 3.17Å; V153-F157 HydrophobicContact CG2-CD1 4.48Å
154G83.9Confident84.9Confident10 Ų1034.6 Ų34.610%0.10319%0.185CC..  trans78.8167.7177.700000113.8S150 V156 F157 Y158S150-G154 WeakPolarHBondContact O-CA 3.42Å; S150-G154 PolarHBondContact O-N 2.98Å; G154-V156 PolarHBondContact O-N 3.45Å; G154-F157 PolarHBondContact O-N 3.1Å; G154-Y158 WeakPolarHBondContact O-CD2 3.25Å
155R82.4Confident85.2Confident80 Ų8032.2 Ų32.230%0.30217%0.169SC..Hα-helixtrans-65.7-40.3-172.9-179.2173.9-67.9-178.16.1113.9F157 Y158 D159 N234 W237R155-F157 PolarHBondContact O-N 2.92Å; R155-Y158 WeakPolarHBondContact O-CB 3.08Å; R155-Y158 PolarHBondContact O-N 3.29Å; R155-D159 PolarHBondContact O-N 2.9Å; R155-N234 PolarHBondContact NH1-OD1 3.4Å; R155-N234 PolarHBondContact NH2-OD1 3.28Å; R155-W237 HydrophobicContact CB-CH2 4.49Å; R155-W237 HydrophobicContact CB-CZ2 4.25Å; R155-W237 HydrophobicContact CG-CZ2 3.94Å
156V86.4Confident85.4Confident77 Ų7732.5 Ų32.547%0.46717%0.171SC..Hα-helixtrans-56.1-39.3-177.4177.30000111.3Y138 G154 D159 I160Y138-V156 WeakPolarHBondContact OH-CG2 3.5Å; G154-V156 PolarHBondContact O-N 3.45Å; V156-D159 PolarHBondContact O-N 3.3Å; V156-I160 HydrophobicContact CG1-CD1 3.88Å; V156-I160 WeakPolarHBondContact O-CG1 3.27Å; V156-I160 PolarHBondContact O-N 2.89Å; V156-I160 VanDerWaalsContact O-N 3.13Å
157F90Very high85.8Confident0 Ų037 Ų370%019%0.192CC..Hα-helixtrans-58.9-51.6174.4170.3-97.2000112F77 L130 V131 C134 V153 G154 R155 D159 I160 H161F77-F157 HydrophobicContact CB-CZ 4.03Å; F77-F157 AromaticContact CD1-CE1 3.85Å; F77-F157 HydrophobicContact CD1-CE1 3.85Å; F77-F157 HydrophobicContact CD1-CZ 4.08Å; F77-F157 AromaticContact CD2-CE1 3.63Å; F77-F157 HydrophobicContact CD2-CE1 3.63Å; F77-F157 AromaticContact CD2-CZ 3.73Å; F77-F157 HydrophobicContact CD2-CZ 3.73Å; F77-F157 AromaticContact CE1-CE1 3.81Å; F77-F157 HydrophobicContact CE1-CE1 3.81Å; F77-F157 HydrophobicContact CE1-CZ 4.49Å; F77-F157 HydrophobicContact CE2-CD1 4.44Å; F77-F157 AromaticContact CE2-CE1 3.57Å; F77-F157 HydrophobicContact CE2-CE1 3.57Å; F77-F157 HydrophobicContact CE2-CZ 4.16Å; F77-F157 AromaticContact CG-CE1 3.78Å; F77-F157 HydrophobicContact CG-CE1 3.78Å; F77-F157 AromaticContact CG-CZ 3.68Å; F77-F157 HydrophobicContact CG-CZ 3.68Å; F77-F157 HydrophobicContact CZ-CD1 4.48Å; F77-F157 AromaticContact CZ-CE1 3.67Å; F77-F157 HydrophobicContact CZ-CE1 3.67Å; L130-F157 HydrophobicContact CB-CD2 4.47Å; L130-F157 HydrophobicContact CB-CE2 4.33Å; L130-F157 HydrophobicContact CD2-CD2 3.79Å; L130-F157 HydrophobicContact CD2-CE2 3.82Å; L130-F157 HydrophobicContact CG-CD2 3.79Å; L130-F157 HydrophobicContact CG-CE2 4.03Å; V131-F157 HydrophobicContact CB-CE2 4.26Å; V131-F157 HydrophobicContact CG2-CD2 4.1Å; V131-F157 HydrophobicContact CG2-CE2 3.28Å; V131-F157 HydrophobicContact CG2-CZ 3.55Å; C134-F157 HydrophobicContact CB-CB 4.19Å; V153-F157 HydrophobicContact CB-CB 4.08Å; V153-F157 HydrophobicContact CB-CD1 3.87Å; V153-F157 HydrophobicContact CB-CG 3.95Å; V153-F157 HydrophobicContact CG1-CB 3.44Å; V153-F157 VanDerWaalsContact CG1-CB 3.44Å; V153-F157 HydrophobicContact CG1-CD1 3.53Å; V153-F157 HydrophobicContact CG1-CD2 3.55Å; V153-F157 HydrophobicContact CG1-CE1 4.2Å; V153-F157 HydrophobicContact CG1-CE2 4.23Å; V153-F157 HydrophobicContact CG1-CG 3.17Å; V153-F157 HydrophobicContact CG2-CD1 4.48Å; G154-F157 PolarHBondContact O-N 3.1Å; R155-F157 PolarHBondContact O-N 2.92Å; F157-D159 VanDerWaalsContact C-N 3.31Å; F157-D159 PolarHBondContact O-N 2.91Å; F157-I160 PolarHBondContact O-N 3.47Å; F157-H161 HydrophobicContact CE1-CB 4.11Å; F157-H161 HydrophobicContact CE2-CB 4.27Å; F157-H161 HydrophobicContact CZ-CB 3.95Å; F157-H161 AromaticContact CZ-CG 3.93Å; F157-H161 WeakPolarHBondContact O-CB 3.41Å; F157-H161 PolarHBondContact O-N 3.49Å
158Y86.2Confident86.2Confident13 Ų1337.7 Ų37.75%0.05120%0.195CC..Hα-helixtrans-60.3-41.7-178.5-80.7-77.2000112F77 A149 S150 G154 R155 Y162 W237F77-Y158 HydrophobicContact CE1-CD1 4.44Å; F77-Y158 AromaticContact CE1-CE1 3.83Å; F77-Y158 HydrophobicContact CE1-CE1 3.83Å; F77-Y158 HydrophobicContact CZ-CD1 4.43Å; F77-Y158 AromaticContact CZ-CE1 3.59Å; F77-Y158 HydrophobicContact CZ-CE1 3.59Å; F77-Y158 AromaticContact CZ-CZ 3.68Å; A149-Y158 VanDerWaalsContact C-OH 3.31Å; A149-Y158 WeakPolarHBondContact CB-OH 3.39Å; S150-Y158 PolarHBondContact N-OH 3.27Å; G154-Y158 WeakPolarHBondContact O-CD2 3.25Å; R155-Y158 WeakPolarHBondContact O-CB 3.08Å; R155-Y158 PolarHBondContact O-N 3.29Å; Y158-Y162 AromaticContact CD1-CD2 3.97Å; Y158-Y162 HydrophobicContact CD1-CD2 3.97Å; Y158-Y162 AromaticContact CD1-CE2 3.26Å; Y158-Y162 HydrophobicContact CD1-CE2 3.26Å; Y158-Y162 AromaticContact CD1-CZ 3.7Å; Y158-Y162 AromaticContact CE1-CE2 3.94Å; Y158-Y162 HydrophobicContact CE1-CE2 3.94Å; Y158-Y162 HydrophobicContact CG-CE2 4.22Å; Y158-Y162 VanDerWaalsContact O-CB 3.23Å; Y158-Y162 WeakPolarHBondContact O-CB 3.46Å; Y158-Y162 VanDerWaalsContact O-CD2 3.29Å; Y158-Y162 WeakPolarHBondContact O-CD2 3.38Å; Y158-Y162 PolarHBondContact O-N 3.48Å; Y158-W237 HydrophobicContact CD2-CH2 4.34Å; Y158-W237 HydrophobicContact CD2-CZ2 4.13Å; Y158-W237 HydrophobicContact CG-CZ2 4.17Å
159D86Confident86.5Confident38 Ų3834.8 Ų34.820%0.20318%0.182CC..Hα-helixtrans-62.9-45.5178.4-71.4-9.4000111.3R155 V156 F157 K163 T231R155-D159 PolarHBondContact O-N 2.9Å; V156-D159 PolarHBondContact O-N 3.3Å; F157-D159 VanDerWaalsContact C-N 3.31Å; F157-D159 PolarHBondContact O-N 2.91Å; D159-K163 WeakPolarHBondContact O-CB 3.47Å; D159-K163 WeakPolarHBondContact O-CD 3.49Å; D159-K163 WeakPolarHBondContact O-CG 3.47Å; D159-K163 PolarHBondContact O-N 2.74Å; D159-T231 WeakPolarHBondContact OD1-CG2 3.28Å
160I91.1Very high86.8Confident69 Ų6938.1 Ų38.135%0.35420%0.195SC..Hα-helixtrans-68.6-48.3179.2-64.2169.1000110.6F126 L130 V156 F157 Y162 K163 F164F126-I160 HydrophobicContact CZ-CG2 4.12Å; L130-I160 HydrophobicContact CD1-CD1 4.17Å; L130-I160 HydrophobicContact CD1-CG2 4.05Å; L130-I160 HydrophobicContact CD2-CB 4.04Å; L130-I160 HydrophobicContact CD2-CG2 3.65Å; V156-I160 HydrophobicContact CG1-CD1 3.88Å; V156-I160 WeakPolarHBondContact O-CG1 3.27Å; V156-I160 PolarHBondContact O-N 2.89Å; V156-I160 VanDerWaalsContact O-N 3.13Å; F157-I160 PolarHBondContact O-N 3.47Å; I160-Y162 PolarHBondContact O-N 3.21Å; I160-K163 PolarHBondContact O-N 2.84Å; I160-F164 VanDerWaalsContact O-CB 3.3Å; I160-F164 WeakPolarHBondContact O-CB 3.39Å; I160-F164 PolarHBondContact O-N 2.87Å
161H90.5Very high87.3Confident0 Ų038.8 Ų38.80%020%0.2CC..Hα-helixtrans-61.8-44.7-177.4176.677.3000112.2F77 E80 T81 L130 F157 N165F77-H161 AromaticContact CD1-CD2 3.89Å; F77-H161 AromaticContact CD1-NE2 3.5Å; E80-H161 IonicContact OE2-CD2 3.8Å; E80-H161 IonicContact OE2-CE1 3.16Å; E80-H161 IonicContact OE2-NE2 2.71Å; E80-H161 PolarHBondContact OE2-NE2 3.02Å; T81-H161 PolarHBondContact OG1-CE1 3.49Å; L130-H161 HydrophobicContact CD2-CB 4.38Å; F157-H161 HydrophobicContact CE1-CB 4.11Å; F157-H161 HydrophobicContact CE2-CB 4.27Å; F157-H161 HydrophobicContact CZ-CB 3.95Å; F157-H161 AromaticContact CZ-CG 3.93Å; F157-H161 WeakPolarHBondContact O-CB 3.41Å; F157-H161 PolarHBondContact O-N 3.49Å; H161-N165 PolarHBondContact CE1-ND2 3.4Å; H161-N165 PolarHBondContact ND1-ND2 3.41Å; H161-N165 PolarHBondContact NE2-ND2 2.89Å; H161-N165 WeakPolarHBondContact O-CB 3.29Å; H161-N165 PolarHBondContact O-N 2.95Å; H161-N165 PolarHBondContact O-ND2 3.27Å; H161-N165 VanDerWaalsContact O-ND2 3.12Å
162Y87.2Confident87.8Confident4 Ų435.8 Ų35.82%0.01618%0.184CC..Hα-helixtrans-77.4-30179.3-66.4-34.8000113.6Y158 I160 A166 F224 L227 N228Y158-Y162 AromaticContact CD1-CD2 3.97Å; Y158-Y162 HydrophobicContact CD1-CD2 3.97Å; Y158-Y162 AromaticContact CD1-CE2 3.26Å; Y158-Y162 HydrophobicContact CD1-CE2 3.26Å; Y158-Y162 AromaticContact CD1-CZ 3.7Å; Y158-Y162 AromaticContact CE1-CE2 3.94Å; Y158-Y162 HydrophobicContact CE1-CE2 3.94Å; Y158-Y162 HydrophobicContact CG-CE2 4.22Å; Y158-Y162 VanDerWaalsContact O-CB 3.23Å; Y158-Y162 WeakPolarHBondContact O-CB 3.46Å; Y158-Y162 VanDerWaalsContact O-CD2 3.29Å; Y158-Y162 WeakPolarHBondContact O-CD2 3.38Å; Y158-Y162 PolarHBondContact O-N 3.48Å; I160-Y162 PolarHBondContact O-N 3.21Å; Y162-A166 WeakPolarHBondContact O-CB 3.44Å; Y162-A166 PolarHBondContact O-N 3.18Å; Y162-F224 AromaticContact CD1-CD1 3.63Å; Y162-F224 HydrophobicContact CD1-CD1 3.63Å; Y162-F224 AromaticContact CD1-CE1 3.25Å; Y162-F224 HydrophobicContact CD1-CE1 3.25Å; Y162-F224 HydrophobicContact CD1-CZ 4.4Å; Y162-F224 HydrophobicContact CE1-CD1 4.23Å; Y162-F224 AromaticContact CE1-CE1 3.63Å; Y162-F224 HydrophobicContact CE1-CE1 3.63Å; Y162-F224 HydrophobicContact CG-CD1 4.15Å; Y162-F224 HydrophobicContact CG-CE1 4.19Å; Y162-L227 HydrophobicContact CD2-CD2 3.26Å; Y162-L227 HydrophobicContact CD2-CG 4.18Å; Y162-L227 HydrophobicContact CE2-CD2 3.18Å; Y162-L227 HydrophobicContact CE2-CG 4.42Å; Y162-L227 HydrophobicContact CG-CD2 4.06Å; Y162-N228 PolarHBondContact O-ND2 2.84Å
163K89Confident88.1Confident108 Ų10837.1 Ų37.147%0.4719%0.192SC..Hα-helixtrans-64.5-46.1167.9-76.1174.2-176.9179.80111.2D159 I160 A166 I167 N228D159-K163 WeakPolarHBondContact O-CB 3.47Å; D159-K163 WeakPolarHBondContact O-CD 3.49Å; D159-K163 WeakPolarHBondContact O-CG 3.47Å; D159-K163 PolarHBondContact O-N 2.74Å; I160-K163 PolarHBondContact O-N 2.84Å; K163-A166 PolarHBondContact O-N 2.78Å; K163-I167 VanDerWaalsContact O-CG1 3.3Å; K163-I167 WeakPolarHBondContact O-CG1 3.44Å; K163-I167 PolarHBondContact O-N 2.67Å; K163-N228 WeakPolarHBondContact CG-OD1 3.32Å
164F91.3Very high88.3Confident58 Ų5841.6 Ų41.625%0.25422%0.215SC..Hα-helixtrans-59.6-51.2178.6178.7-106.5000111.9T81 F126 I160 A166 I167 I168T81-F164 HydrophobicContact CG2-CD1 4.25Å; T81-F164 HydrophobicContact CG2-CE1 3.73Å; F126-F164 HydrophobicContact CD1-CD1 4.14Å; F126-F164 HydrophobicContact CD1-CE1 4.04Å; F126-F164 HydrophobicContact CD1-CE2 4.46Å; F126-F164 HydrophobicContact CD1-CG 4.38Å; F126-F164 HydrophobicContact CD1-CZ 4.19Å; F126-F164 HydrophobicContact CE1-CB 4.33Å; F126-F164 HydrophobicContact CE1-CD1 4.07Å; F126-F164 HydrophobicContact CE1-CD2 4.14Å; F126-F164 HydrophobicContact CE1-CE1 4.39Å; F126-F164 HydrophobicContact CE1-CE2 4.47Å; F126-F164 AromaticContact CE1-CG 3.92Å; F126-F164 HydrophobicContact CE1-CG 3.92Å; I160-F164 VanDerWaalsContact O-CB 3.3Å; I160-F164 WeakPolarHBondContact O-CB 3.39Å; I160-F164 PolarHBondContact O-N 2.87Å; F164-A166 VanDerWaalsContact C-N 3.31Å; F164-A166 PolarHBondContact O-N 2.9Å; F164-I167 PolarHBondContact O-N 3.35Å; F164-I168 HydrophobicContact CD1-CD1 4Å; F164-I168 HydrophobicContact CE1-CD1 3.42Å; F164-I168 VanDerWaalsContact CE1-CD1 3.42Å; F164-I168 HydrophobicContact CE2-CD1 4.13Å; F164-I168 HydrophobicContact CZ-CD1 3.51Å; F164-I168 HydrophobicContact CZ-CG1 4.47Å; F164-I168 PolarHBondContact O-N 3.2Å; F164-I168 VanDerWaalsContact O-N 3.12Å
165N89.3Confident88.6Confident0 Ų042.3 Ų42.30%022%0.217CC..Hα-helixtrans-66-32.7177.7-79.1-54.5000112.8T81 T84 H161 I168 G169 F224T81-N165 WeakPolarHBondContact CA-OD1 3.46Å; T81-N165 PolarHBondContact OG1-ND2 2.83Å; T81-N165 VanDerWaalsContact OG1-ND2 3.13Å; T84-N165 PolarHBondContact OG1-OD1 2.91Å; H161-N165 PolarHBondContact CE1-ND2 3.4Å; H161-N165 PolarHBondContact ND1-ND2 3.41Å; H161-N165 PolarHBondContact NE2-ND2 2.89Å; H161-N165 WeakPolarHBondContact O-CB 3.29Å; H161-N165 PolarHBondContact O-N 2.95Å; H161-N165 PolarHBondContact O-ND2 3.27Å; H161-N165 VanDerWaalsContact O-ND2 3.12Å; N165-I168 PolarHBondContact O-N 3.01Å; N165-G169 PolarHBondContact O-N 3.45Å; N165-F224 HydrophobicContact CB-CD2 4.38Å; N165-F224 HydrophobicContact CB-CE1 4.02Å; N165-F224 HydrophobicContact CB-CE2 3.69Å; N165-F224 HydrophobicContact CB-CZ 3.47Å; N165-F224 VanDerWaalsContact CB-CZ 3.47Å
166A86.8Confident88.8Confident12 Ų1240.3 Ų40.310%0.09921%0.209CC..Hα-helixtrans-64.1-42.5172.300000112.1Y162 K163 F164 I168 G169 M170 F224 N228Y162-A166 WeakPolarHBondContact O-CB 3.44Å; Y162-A166 PolarHBondContact O-N 3.18Å; K163-A166 PolarHBondContact O-N 2.78Å; F164-A166 VanDerWaalsContact C-N 3.31Å; F164-A166 PolarHBondContact O-N 2.9Å; A166-I168 PolarHBondContact O-N 3.27Å; A166-G169 PolarHBondContact O-N 2.78Å; A166-M170 WeakPolarHBondContact O-CB 3.37Å; A166-M170 VanDerWaalsContact O-CG 3.3Å; A166-M170 WeakPolarHBondContact O-CG 3.44Å; A166-M170 PolarHBondContact O-N 3.46Å; A166-F224 HydrophobicContact CB-CB 4.06Å; A166-N228 WeakPolarHBondContact CB-ND2 3.09Å
167I90.9Very high89Confident112 Ų11241.5 Ų41.557%0.57421%0.213SC*.Hα-helixtrans-61.5-46.2177.6-69.1163.6000110.5K163 F164 G169 M170 S171K163-I167 VanDerWaalsContact O-CG1 3.3Å; K163-I167 WeakPolarHBondContact O-CG1 3.44Å; K163-I167 PolarHBondContact O-N 2.67Å; F164-I167 PolarHBondContact O-N 3.35Å; I167-G169 VanDerWaalsContact C-N 3.34Å; I167-M170 PolarHBondContact O-N 3.05Å; I167-S171 WeakPolarHBondContact O-CB 3.43Å; I167-S171 PolarHBondContact O-N 3.46Å; I167-S171 PolarHBondContact O-OG 3.25Å
168I91.3Very high89Confident18 Ų1845.4 Ų45.49%0.09223%0.233CC..Hα-helixtrans-62.2-44.9175.8-62.8175.3000110.4T84 F88 F164 N165 A166 S171 T172T84-I168 HydrophobicContact CG2-CB 4.04Å; T84-I168 HydrophobicContact CG2-CG2 3.79Å; F88-I168 HydrophobicContact CB-CG2 3.68Å; F88-I168 HydrophobicContact CD2-CG2 4.31Å; F88-I168 HydrophobicContact CG-CG2 4.08Å; F164-I168 HydrophobicContact CD1-CD1 4Å; F164-I168 HydrophobicContact CE1-CD1 3.42Å; F164-I168 VanDerWaalsContact CE1-CD1 3.42Å; F164-I168 HydrophobicContact CE2-CD1 4.13Å; F164-I168 HydrophobicContact CZ-CD1 3.51Å; F164-I168 HydrophobicContact CZ-CG1 4.47Å; F164-I168 PolarHBondContact O-N 3.2Å; F164-I168 VanDerWaalsContact O-N 3.12Å; N165-I168 PolarHBondContact O-N 3.01Å; A166-I168 PolarHBondContact O-N 3.27Å; I168-S171 PolarHBondContact O-N 3.05Å; I168-T172 WeakPolarHBondContact O-CB 3.41Å; I168-T172 PolarHBondContact O-N 3.36Å; I168-T172 PolarHBondContact O-OG1 3.49Å
169G87.1Confident89.1Confident4 Ų444.9 Ų44.94%0.04123%0.231CC..Hα-helixtrans-58.3-49.3177.200000112.8N165 A166 I167 S171 T172 V173N165-G169 PolarHBondContact O-N 3.45Å; A166-G169 PolarHBondContact O-N 2.78Å; I167-G169 VanDerWaalsContact C-N 3.34Å; G169-S171 PolarHBondContact O-N 2.88Å; G169-T172 VanDerWaalsContact O-CB 3.25Å; G169-T172 WeakPolarHBondContact O-CB 3.47Å; G169-T172 PolarHBondContact O-N 2.91Å; G169-V173 WeakPolarHBondContact O-CG2 3.09Å; G169-V173 PolarHBondContact O-N 3.43Å; G169-V173 VanDerWaalsContact O-N 3.13Å
170M87.9Confident89.2Confident90 Ų9045.7 Ų45.744%0.44324%0.235SC..Hα-helixtrans-63.9-41.3177.3-70.3-58.4-6600111.9A166 I167 T172 V173 I174 V221A166-M170 WeakPolarHBondContact O-CB 3.37Å; A166-M170 VanDerWaalsContact O-CG 3.3Å; A166-M170 WeakPolarHBondContact O-CG 3.44Å; A166-M170 PolarHBondContact O-N 3.46Å; I167-M170 PolarHBondContact O-N 3.05Å; M170-T172 VanDerWaalsContact C-N 3.27Å; M170-T172 PolarHBondContact O-N 2.87Å; M170-V173 WeakPolarHBondContact O-CB 3.24Å; M170-V173 PolarHBondContact O-N 2.82Å; M170-V173 VanDerWaalsContact O-N 3.17Å; M170-I174 WeakPolarHBondContact O-CG1 3.32Å; M170-I174 PolarHBondContact O-N 3.18Å; M170-V221 HydrophobicContact CG-CG1 4.27Å; M170-V221 HydrophobicContact SD-CG1 3.57Å; M170-V221 VanDerWaalsContact SD-CG1 3.57Å
171S90.9Very high89Confident45 Ų4545.1 Ų45.132%0.31524%0.24SC..Hα-helixtrans-60.8-38.2175.1-570000111.7I167 I168 G169 I174 L175I167-S171 WeakPolarHBondContact O-CB 3.43Å; I167-S171 PolarHBondContact O-N 3.46Å; I167-S171 PolarHBondContact O-OG 3.25Å; I168-S171 PolarHBondContact O-N 3.05Å; G169-S171 PolarHBondContact O-N 2.88Å; S171-I174 PolarHBondContact O-N 3.38Å; S171-L175 WeakPolarHBondContact O-CB 3.47Å; S171-L175 WeakPolarHBondContact O-CG 3.26Å; S171-L175 PolarHBondContact O-N 2.9Å
172T89.5Confident88.9Confident13 Ų1346.2 Ų46.28%0.0825%0.246CC..Hα-helixtrans-60.8-44.5175-56.10000111.3I87 F88 C91 I168 G169 M170 L175 Y176I87-T172 HydrophobicContact CG2-CG2 3.94Å; F88-T172 WeakPolarHBondContact CB-OG1 3.35Å; F88-T172 WeakPolarHBondContact CD2-OG1 3.45Å; C91-T172 HydrophobicContact CB-CG2 4.04Å; C91-T172 WeakPolarHBondContact SG-CG2 3.43Å; I168-T172 WeakPolarHBondContact O-CB 3.41Å; I168-T172 PolarHBondContact O-N 3.36Å; I168-T172 PolarHBondContact O-OG1 3.49Å; G169-T172 VanDerWaalsContact O-CB 3.25Å; G169-T172 WeakPolarHBondContact O-CB 3.47Å; G169-T172 PolarHBondContact O-N 2.91Å; M170-T172 VanDerWaalsContact C-N 3.27Å; M170-T172 PolarHBondContact O-N 2.87Å; T172-L175 PolarHBondContact O-N 3.26Å; T172-Y176 VanDerWaalsContact O-CB 3.25Å; T172-Y176 WeakPolarHBondContact O-CB 3.35Å; T172-Y176 PolarHBondContact O-N 3.48Å
173V87.3Confident88.8Confident28 Ų2846.9 Ų46.917%0.1725%0.25CC..Hα-helixtrans-64.2-46.7178.7177.30000110.9G169 M170 Y176 L177 F217G169-V173 WeakPolarHBondContact O-CG2 3.09Å; G169-V173 PolarHBondContact O-N 3.43Å; G169-V173 VanDerWaalsContact O-N 3.13Å; M170-V173 WeakPolarHBondContact O-CB 3.24Å; M170-V173 PolarHBondContact O-N 2.82Å; M170-V173 VanDerWaalsContact O-N 3.17Å; V173-Y176 PolarHBondContact O-N 3.48Å; V173-L177 HydrophobicContact CG1-CD1 4.19Å; V173-L177 HydrophobicContact CG1-CG 4.42Å; V173-L177 WeakPolarHBondContact O-CG 3.36Å; V173-L177 PolarHBondContact O-N 3.3Å; V173-F217 HydrophobicContact CB-CD2 4.35Å; V173-F217 HydrophobicContact CB-CE2 4.42Å; V173-F217 HydrophobicContact CG1-CD2 4.35Å; V173-F217 HydrophobicContact CG1-CE2 4.17Å; V173-F217 HydrophobicContact CG2-CB 4.42Å; V173-F217 HydrophobicContact CG2-CD2 3.1Å; V173-F217 HydrophobicContact CG2-CE2 3.49Å; V173-F217 VanDerWaalsContact CG2-CE2 3.49Å; V173-F217 HydrophobicContact CG2-CG 3.99Å
174I89.9Confident88.6Confident94 Ų9450.5 Ų50.548%0.48226%0.261SS..Hα-helixtrans-60-49.6178-66.5167.2000110M170 S171 Y176 L177 L178M170-I174 WeakPolarHBondContact O-CG1 3.32Å; M170-I174 PolarHBondContact O-N 3.18Å; S171-I174 PolarHBondContact O-N 3.38Å; I174-Y176 PolarHBondContact O-N 3.37Å; I174-L177 PolarHBondContact O-N 3.47Å; I174-L178 HydrophobicContact CG2-CD1 4.11Å; I174-L178 HydrophobicContact CG2-CG 4.47Å; I174-L178 VanDerWaalsContact O-CG 3.29Å; I174-L178 WeakPolarHBondContact O-CG 3.34Å; I174-L178 PolarHBondContact O-N 2.93Å
175L90Very high88.3Confident26 Ų2654.4 Ų54.414%0.13628%0.277CS..Hα-helixtrans-57.9-39.4176.3-78.3176.9000112.3F88 L92 F95 S171 T172 L178 T179F88-L175 HydrophobicContact CD2-CD1 3.98Å; F88-L175 HydrophobicContact CE2-CD1 3.29Å; F88-L175 HydrophobicContact CE2-CG 4.44Å; F88-L175 HydrophobicContact CZ-CD1 3.68Å; L92-L175 HydrophobicContact CB-CD1 4.4Å; L92-L175 HydrophobicContact CD1-CD1 4.24Å; F95-L175 HydrophobicContact CD1-CD2 4.3Å; F95-L175 HydrophobicContact CD2-CD2 4.49Å; F95-L175 HydrophobicContact CG-CD2 4.25Å; S171-L175 WeakPolarHBondContact O-CB 3.47Å; S171-L175 WeakPolarHBondContact O-CG 3.26Å; S171-L175 PolarHBondContact O-N 2.9Å; T172-L175 PolarHBondContact O-N 3.26Å; L175-L178 PolarHBondContact O-N 2.95Å; L175-T179 WeakPolarHBondContact O-CB 3.25Å; L175-T179 PolarHBondContact O-N 2.83Å; L175-T179 PolarHBondContact O-OG1 2.94Å
176Y86.5Confident88Confident37 Ų3757.6 Ų57.615%0.14529%0.291CS..Hα-helixtrans-68.2-44.4178.8179.1-105.6000112.3T172 V173 I174 L178 T179 L180 S210 L213T172-Y176 VanDerWaalsContact O-CB 3.25Å; T172-Y176 WeakPolarHBondContact O-CB 3.35Å; T172-Y176 PolarHBondContact O-N 3.48Å; V173-Y176 PolarHBondContact O-N 3.48Å; I174-Y176 PolarHBondContact O-N 3.37Å; Y176-L178 VanDerWaalsContact C-N 3.33Å; Y176-L178 PolarHBondContact O-N 3.41Å; Y176-T179 WeakPolarHBondContact O-CB 3.41Å; Y176-T179 PolarHBondContact O-N 3.22Å; Y176-T179 VanDerWaalsContact O-N 3.14Å; Y176-L180 HydrophobicContact CD1-CD1 4.24Å; Y176-L180 HydrophobicContact CE1-CD1 3.49Å; Y176-L180 VanDerWaalsContact CE1-CD1 3.49Å; Y176-L180 HydrophobicContact CE1-CG 3.99Å; Y176-L180 HydrophobicContact CE2-CD2 4.48Å; Y176-L180 HydrophobicContact CE2-CG 4.3Å; Y176-L180 PolarHBondContact O-N 2.92Å; Y176-L180 WeakPolarHBondContact OH-CD2 3.28Å; Y176-S210 WeakPolarHBondContact OH-CB 3.34Å; Y176-L213 HydrophobicContact CD2-CD1 3.33Å; Y176-L213 HydrophobicContact CE2-CD1 3.65Å; Y176-L213 HydrophobicContact CG-CD1 4.1Å
177L89.1Confident87.6Confident103 Ų10360.9 Ų60.954%0.53931%0.31SS..Hα-helixtrans-60.8-42174-70.3176.7000111.8V173 I174 T179 L180 A181V173-L177 HydrophobicContact CG1-CD1 4.19Å; V173-L177 HydrophobicContact CG1-CG 4.42Å; V173-L177 WeakPolarHBondContact O-CG 3.36Å; V173-L177 PolarHBondContact O-N 3.3Å; I174-L177 PolarHBondContact O-N 3.47Å; L177-T179 VanDerWaalsContact C-N 3.32Å; L177-T179 PolarHBondContact O-N 3.3Å; L177-L180 PolarHBondContact O-N 2.87Å; L177-A181 WeakPolarHBondContact O-CB 3.25Å; L177-A181 PolarHBondContact O-N 3.35Å
178L90.8Very high87Confident81 Ų8163.2 Ų63.242%0.42432%0.319SS..Hα-helixtrans-61.4-42.9173.6-69173.5000111.2F95 I174 L175 Y176 L180 A181 I182F95-L178 HydrophobicContact CD2-CB 4.28Å; F95-L178 HydrophobicContact CE2-CB 3.83Å; F95-L178 HydrophobicContact CE2-CD1 4.45Å; I174-L178 HydrophobicContact CG2-CD1 4.11Å; I174-L178 HydrophobicContact CG2-CG 4.47Å; I174-L178 VanDerWaalsContact O-CG 3.29Å; I174-L178 WeakPolarHBondContact O-CG 3.34Å; I174-L178 PolarHBondContact O-N 2.93Å; L175-L178 PolarHBondContact O-N 2.95Å; Y176-L178 VanDerWaalsContact C-N 3.33Å; Y176-L178 PolarHBondContact O-N 3.41Å; L178-L180 VanDerWaalsContact C-N 3.34Å; L178-L180 PolarHBondContact O-N 2.94Å; L178-A181 PolarHBondContact O-N 3.36Å; L178-I182 WeakPolarHBondContact O-CD1 2.76Å; L178-I182 WeakPolarHBondContact O-CG1 3.18Å; L178-I182 PolarHBondContact O-N 3.33Å
179T88.5Confident86.3Confident2 Ų267.8 Ų67.81%0.01234%0.343CS..Hα-helixtrans-58-46.9175.7-570000111F95 I98 L175 Y176 L177 I182 I183 T206F95-T179 WeakPolarHBondContact CB-OG1 3.47Å; F95-T179 WeakPolarHBondContact CD2-OG1 3.33Å; I98-T179 HydrophobicContact CD1-CG2 3.56Å; L175-T179 WeakPolarHBondContact O-CB 3.25Å; L175-T179 PolarHBondContact O-N 2.83Å; L175-T179 PolarHBondContact O-OG1 2.94Å; Y176-T179 WeakPolarHBondContact O-CB 3.41Å; Y176-T179 PolarHBondContact O-N 3.22Å; Y176-T179 VanDerWaalsContact O-N 3.14Å; L177-T179 VanDerWaalsContact C-N 3.32Å; L177-T179 PolarHBondContact O-N 3.3Å; T179-I182 PolarHBondContact O-N 3.05Å; T179-I183 HydrophobicContact CG2-CD1 4.11Å; T179-I183 VanDerWaalsContact O-CG1 3.27Å; T179-I183 WeakPolarHBondContact O-CG1 3.47Å; T179-I183 PolarHBondContact O-N 3.45Å; T179-T206 HydrophobicContact CG2-CG2 4.15Å
180L87.5Confident85.3Confident56 Ų5669.9 Ų69.929%0.29336%0.357SS..Hα-helixtrans-62.2-42175.8-73-178.8000112.8Y176 L177 L178 I182 I183 R184Y176-L180 HydrophobicContact CD1-CD1 4.24Å; Y176-L180 HydrophobicContact CE1-CD1 3.49Å; Y176-L180 VanDerWaalsContact CE1-CD1 3.49Å; Y176-L180 HydrophobicContact CE1-CG 3.99Å; Y176-L180 HydrophobicContact CE2-CD2 4.48Å; Y176-L180 HydrophobicContact CE2-CG 4.3Å; Y176-L180 PolarHBondContact O-N 2.92Å; Y176-L180 WeakPolarHBondContact OH-CD2 3.28Å; L177-L180 PolarHBondContact O-N 2.87Å; L178-L180 VanDerWaalsContact C-N 3.34Å; L178-L180 PolarHBondContact O-N 2.94Å; L180-I182 VanDerWaalsContact C-N 3.33Å; L180-I182 PolarHBondContact O-N 3.14Å; L180-I183 PolarHBondContact O-N 3.21Å; L180-R184 WeakPolarHBondContact O-CG 3.38Å; L180-R184 PolarHBondContact O-N 3.06Å
181A88.5Confident83.8Confident56 Ų5672.6 Ų72.646%0.46338%0.378SS..Hα-helixtrans-62-41.9177.600000111.6L177 L178 R184 K185L177-A181 WeakPolarHBondContact O-CB 3.25Å; L177-A181 PolarHBondContact O-N 3.35Å; L178-A181 PolarHBondContact O-N 3.36Å; A181-R184 PolarHBondContact O-N 3.48Å; A181-K185 WeakPolarHBondContact O-CB 3.47Å; A181-K185 PolarHBondContact O-N 3.45Å
182I87Confident82.2Confident23 Ų2372.4 Ų72.412%0.11838%0.384CS..Hα-helixtrans-67.1-41.6176.2-61.5151.1000111F95 I98 W99 L178 T179 L180 R184 K185 K186F95-I182 HydrophobicContact CD2-CD1 3.96Å; F95-I182 HydrophobicContact CE2-CD1 3.49Å; F95-I182 VanDerWaalsContact CE2-CD1 3.49Å; F95-I182 HydrophobicContact CZ-CD1 4.35Å; I98-I182 HydrophobicContact CG2-CB 4.29Å; I98-I182 HydrophobicContact CG2-CG2 3.64Å; W99-I182 HydrophobicContact CD2-CD1 4.39Å; W99-I182 HydrophobicContact CE3-CD1 3.27Å; W99-I182 HydrophobicContact CE3-CG1 4.06Å; W99-I182 HydrophobicContact CZ3-CD1 3.68Å; W99-I182 HydrophobicContact CZ3-CG1 4.15Å; L178-I182 WeakPolarHBondContact O-CD1 2.76Å; L178-I182 WeakPolarHBondContact O-CG1 3.18Å; L178-I182 PolarHBondContact O-N 3.33Å; T179-I182 PolarHBondContact O-N 3.05Å; L180-I182 VanDerWaalsContact C-N 3.33Å; L180-I182 PolarHBondContact O-N 3.14Å; I182-R184 VanDerWaalsContact C-N 3.34Å; I182-R184 PolarHBondContact O-N 3.43Å; I182-K185 PolarHBondContact O-N 3.13Å; I182-K186 HydrophobicContact CG2-CD 4.03Å; I182-K186 HydrophobicContact CG2-CG 4.2Å; I182-K186 WeakPolarHBondContact O-CB 3.4Å; I182-K186 WeakPolarHBondContact O-CG 3.43Å; I182-K186 PolarHBondContact O-N 3.28Å
183I85.1Confident80.8Confident19 Ų1977.3 Ų77.310%0.09741%0.414CS..Hα-helixtrans-56.9-51.7175.6-71167.6000109.3I98 T179 L180 K185 K186 T187 F199 V203 T206I98-I183 HydrophobicContact CD1-CD1 3.84Å; I98-I183 HydrophobicContact CD1-CG1 3.91Å; I98-I183 HydrophobicContact CG2-CG1 4.27Å; T179-I183 HydrophobicContact CG2-CD1 4.11Å; T179-I183 VanDerWaalsContact O-CG1 3.27Å; T179-I183 WeakPolarHBondContact O-CG1 3.47Å; T179-I183 PolarHBondContact O-N 3.45Å; L180-I183 PolarHBondContact O-N 3.21Å; I183-K185 PolarHBondContact O-N 3.48Å; I183-K186 PolarHBondContact O-N 3.49Å; I183-T187 WeakPolarHBondContact O-CB 3.43Å; I183-T187 PolarHBondContact O-N 3.49Å; I183-T187 PolarHBondContact O-OG1 2.85Å; I183-F199 HydrophobicContact CB-CZ 4.5Å; I183-F199 HydrophobicContact CG2-CZ 4.27Å; I183-V203 HydrophobicContact CD1-CG2 4.45Å; I183-V203 HydrophobicContact CG1-CG2 4.19Å; I183-V203 HydrophobicContact CG2-CG1 4.12Å; I183-V203 HydrophobicContact CG2-CG2 3.81Å; I183-T206 HydrophobicContact CD1-CG2 3.91Å
184R84.9Confident79.2Confident184 Ų18480.4 Ų80.469%0.69443%0.433SS*.Hα-helixtrans-57-48.8178.3-74.6-178.8174.3170.1-1.4112.2L180 A181 I182 K186 T187 Q188L180-R184 WeakPolarHBondContact O-CG 3.38Å; L180-R184 PolarHBondContact O-N 3.06Å; A181-R184 PolarHBondContact O-N 3.48Å; I182-R184 VanDerWaalsContact C-N 3.34Å; I182-R184 PolarHBondContact O-N 3.43Å; R184-K186 PolarHBondContact O-N 2.83Å; R184-T187 PolarHBondContact O-N 3.17Å; R184-Q188 WeakPolarHBondContact O-CG 3.21Å; R184-Q188 PolarHBondContact O-N 2.84Å; R184-Q188 VanDerWaalsContact O-N 3.08Å
185K85.6Confident77.8Confident139 Ų13979.5 Ų79.560%0.60444%0.44SS*.Hα-helixtrans-61.6-42.9179.4-175176.6-179.2175.60112.4A181 I182 I183 Q188 N189A181-K185 WeakPolarHBondContact O-CB 3.47Å; A181-K185 PolarHBondContact O-N 3.45Å; I182-K185 PolarHBondContact O-N 3.13Å; I183-K185 PolarHBondContact O-N 3.48Å; K185-Q188 PolarHBondContact O-N 3.38Å; K185-N189 PolarHBondContact O-N 2.91Å
186K82Confident76.7Confident68 Ų6879.6 Ų79.630%0.29644%0.44SS..Hα-helixtrans-72-35.6178.9-74.6-169.7177.9-171.40112.4I98 W99 I182 I183 R184 Q188 N189 S190 F199I98-K186 PolarHBondContact O-NZ 2.86Å; W99-K186 PolarHBondContact O-NZ 3.49Å; W99-K186 VanDerWaalsContact O-NZ 3.07Å; I182-K186 HydrophobicContact CG2-CD 4.03Å; I182-K186 HydrophobicContact CG2-CG 4.2Å; I182-K186 WeakPolarHBondContact O-CB 3.4Å; I182-K186 WeakPolarHBondContact O-CG 3.43Å; I182-K186 PolarHBondContact O-N 3.28Å; I183-K186 PolarHBondContact O-N 3.49Å; R184-K186 PolarHBondContact O-N 2.83Å; K186-Q188 VanDerWaalsContact C-N 3.32Å; K186-Q188 PolarHBondContact O-N 3.42Å; K186-N189 PolarHBondContact O-N 3.32Å; K186-S190 WeakPolarHBondContact O-CB 3.27Å; K186-S190 PolarHBondContact O-N 2.91Å; K186-F199 HydrophobicContact CB-CE1 4.24Å; K186-F199 HydrophobicContact CB-CE2 3.88Å; K186-F199 HydrophobicContact CB-CZ 3.59Å; K186-F199 HydrophobicContact CD-CD2 4.47Å; K186-F199 HydrophobicContact CD-CE2 3.97Å
187T79Confident75.9Confident81 Ų8182.4 Ų82.450%0.49746%0.456SS..Hα-helixtrans-62.6-39.2174-63.10000111.6I183 R184I183-T187 WeakPolarHBondContact O-CB 3.43Å; I183-T187 PolarHBondContact O-N 3.49Å; I183-T187 PolarHBondContact O-OG1 2.85Å; R184-T187 PolarHBondContact O-N 3.17Å
188Q79.4Confident74.8Confident161 Ų16182.3 Ų82.375%0.75245%0.453SS*.Hα-helixtrans-68.2-34.7175.9-72.7175.4-23.900113.1R184 K185 K186R184-Q188 WeakPolarHBondContact O-CG 3.21Å; R184-Q188 PolarHBondContact O-N 2.84Å; R184-Q188 VanDerWaalsContact O-N 3.08Å; K185-Q188 PolarHBondContact O-N 3.38Å; K186-Q188 VanDerWaalsContact C-N 3.32Å; K186-Q188 PolarHBondContact O-N 3.42Å
189N76.4Confident73.9Confident114 Ų11479.6 Ų79.661%0.6144%0.438SS*.Hα-helixtrans-93.91.5-175.9-664000114.1K185 K186 V191K185-N189 PolarHBondContact O-N 2.91Å; K186-N189 PolarHBondContact O-N 3.32Å; N189-V191 PolarHBondContact O-N 3.48Å
190S65.3Low73.2Confident48 Ų4887 Ų8734%0.33647%0.466SS..  trans-78.6102.8-174.21800000111.5K186 D196K186-S190 WeakPolarHBondContact O-CB 3.27Å; K186-S190 PolarHBondContact O-N 2.91Å; S190-D196 PolarHBondContact OG-OD1 3.27Å
191V57.4Low72.4Confident146 Ų14692.4 Ų92.489%0.88548%0.482SS*.  trans-109.4-4.6170.8-174.70000111.8N189N189-V191 PolarHBondContact O-N 3.48Å
192G57.4Low71.5Confident42 Ų4291 Ų9143%0.43347%0.467SS..  trans-110.1119.1-169.300000115.8V194 D196G192-V194 PolarHBondContact O-N 2.94Å; G192-D196 VanDerWaalsContact O-CB 3.26Å; G192-D196 WeakPolarHBondContact O-CB 3.2Å; G192-D196 PolarHBondContact O-N 3.17Å
193T58.9Low71Confident116 Ų11691.5 Ų91.571%0.71247%0.47SS*.Hα-helixtrans-59.7-36.1-168.8-20.40000116.2
194V54.8Low70.5Confident93 Ų9394 Ų9456%0.56449%0.487SS*.Hα-helixtrans-87.3-40.2-170.8-178.60000112.9G192 D196 I197G192-V194 PolarHBondContact O-N 2.94Å; V194-D196 PolarHBondContact O-N 3.45Å; V194-I197 PolarHBondContact O-N 2.92Å
195A60Low69.8Low75 Ų7587.7 Ų87.762%0.6247%0.468SS*.Hα-helixtrans-66.1-29.1172.500000110.9I197 F199A195-I197 PolarHBondContact O-N 3.27Å; A195-F199 WeakPolarHBondContact O-CB 3.33Å; A195-F199 PolarHBondContact O-N 2.99Å; A195-F199 VanDerWaalsContact O-N 3.11Å
196D66.4Low69.3Low27 Ų2781.2 Ų81.214%0.14444%0.44CS..Hα-helixtrans-63.7-36.4178.5-163.933.4000112.6S190 G192 V194 R200S190-D196 PolarHBondContact OG-OD1 3.27Å; G192-D196 VanDerWaalsContact O-CB 3.26Å; G192-D196 WeakPolarHBondContact O-CB 3.2Å; G192-D196 PolarHBondContact O-N 3.17Å; V194-D196 PolarHBondContact O-N 3.45Å; D196-R200 WeakPolarHBondContact O-CB 3.46Å; D196-R200 WeakPolarHBondContact O-CG 3.49Å; D196-R200 PolarHBondContact O-N 3.36Å; D196-R200 IonicContact OD1-NE 3.27Å; D196-R200 PolarHBondContact OD1-NE 2.96Å; D196-R200 IonicContact OD2-CZ 2.74Å; D196-R200 IonicContact OD2-NE 2.77Å; D196-R200 PolarHBondContact OD2-NE 2.84Å; D196-R200 IonicContact OD2-NH2 3.7Å; D196-R200 PolarHBondContact OD2-NH2 3.29Å
197I69.6Low69Low96 Ų9685.4 Ų85.449%0.49246%0.458SS..Hα-helixtrans-67.1-48.5-179.6-61.4172.3000112.2V194 A195 F199 R200 R201V194-I197 PolarHBondContact O-N 2.92Å; A195-I197 PolarHBondContact O-N 3.27Å; I197-F199 VanDerWaalsContact C-N 3.35Å; I197-R200 PolarHBondContact O-N 2.64Å; I197-R201 WeakPolarHBondContact O-CG 3.32Å; I197-R201 PolarHBondContact O-N 2.86Å; I197-R201 VanDerWaalsContact O-N 3.1Å
198Q67.2Low68.8Low101 Ų10186.2 Ų86.247%0.47245%0.452SS..Hα-helixtrans-65.4-42.7179.2-74-175.6-38.600110.9R201 Q202Q198-R201 PolarHBondContact O-N 3.23Å; Q198-Q202 WeakPolarHBondContact O-CG 3.49Å; Q198-Q202 PolarHBondContact O-N 3.38Å
199F70.1Confident68.5Low25 Ų2579 Ų7911%0.1142%0.419CS..Hα-helixtrans-61.2-47175.9-179.7-106.3000111.7I98 I183 K186 A195 I197 R201 Q202 V203I98-F199 HydrophobicContact CG2-CE2 4.17Å; I183-F199 HydrophobicContact CB-CZ 4.5Å; I183-F199 HydrophobicContact CG2-CZ 4.27Å; K186-F199 HydrophobicContact CB-CE1 4.24Å; K186-F199 HydrophobicContact CB-CE2 3.88Å; K186-F199 HydrophobicContact CB-CZ 3.59Å; K186-F199 HydrophobicContact CD-CD2 4.47Å; K186-F199 HydrophobicContact CD-CE2 3.97Å; A195-F199 WeakPolarHBondContact O-CB 3.33Å; A195-F199 PolarHBondContact O-N 2.99Å; A195-F199 VanDerWaalsContact O-N 3.11Å; I197-F199 VanDerWaalsContact C-N 3.35Å; F199-R201 VanDerWaalsContact C-N 3.32Å; F199-R201 PolarHBondContact O-N 3.12Å; F199-Q202 PolarHBondContact O-N 3.07Å; F199-Q202 VanDerWaalsContact O-N 3.12Å; F199-V203 HydrophobicContact CD1-CG2 4.07Å; F199-V203 HydrophobicContact CD2-CG2 4.28Å; F199-V203 HydrophobicContact CE1-CG2 3.71Å; F199-V203 HydrophobicContact CE2-CG2 3.93Å; F199-V203 HydrophobicContact CG-CG2 4.34Å; F199-V203 HydrophobicContact CZ-CG2 3.63Å; F199-V203 VanDerWaalsContact O-CG2 3.29Å; F199-V203 WeakPolarHBondContact O-CG2 3.44Å; F199-V203 PolarHBondContact O-N 3.26Å
200R74.5Confident68.4Low157 Ų15774.5 Ų74.559%0.59240%0.396SS*.Hα-helixtrans-56.5-43175.7-78.8176.4-170.7-131.98.4112.2D196 I197 V203 V204D196-R200 WeakPolarHBondContact O-CB 3.46Å; D196-R200 WeakPolarHBondContact O-CG 3.49Å; D196-R200 PolarHBondContact O-N 3.36Å; D196-R200 IonicContact OD1-NE 3.27Å; D196-R200 PolarHBondContact OD1-NE 2.96Å; D196-R200 IonicContact OD2-CZ 2.74Å; D196-R200 IonicContact OD2-NE 2.77Å; D196-R200 PolarHBondContact OD2-NE 2.84Å; D196-R200 IonicContact OD2-NH2 3.7Å; D196-R200 PolarHBondContact OD2-NH2 3.29Å; I197-R200 PolarHBondContact O-N 2.64Å; R200-V203 PolarHBondContact O-N 3.37Å; R200-V204 VanDerWaalsContact O-CG2 3.32Å; R200-V204 WeakPolarHBondContact O-CG2 3.3Å; R200-V204 PolarHBondContact O-N 3.3Å
201R71Confident68.8Low169 Ų16976 Ų7664%0.63840%0.403SS*.Hα-helixtrans-62.4-46.4175.5-71.1-178.4-175.7-163.70.7111.7I197 Q198 F199 V203 V204 V205I197-R201 WeakPolarHBondContact O-CG 3.32Å; I197-R201 PolarHBondContact O-N 2.86Å; I197-R201 VanDerWaalsContact O-N 3.1Å; Q198-R201 PolarHBondContact O-N 3.23Å; F199-R201 VanDerWaalsContact C-N 3.32Å; F199-R201 PolarHBondContact O-N 3.12Å; R201-V203 VanDerWaalsContact C-N 3.33Å; R201-V203 PolarHBondContact O-N 2.8Å; R201-V204 PolarHBondContact O-N 2.92Å; R201-V205 WeakPolarHBondContact O-CG2 3.4Å; R201-V205 PolarHBondContact O-N 3.46Å; R201-V205 VanDerWaalsContact O-N 3.13Å
202Q70.4Confident69.4Low28 Ų2869.2 Ų69.213%0.13136%0.362CS..Hα-helixtrans-61.5-41.3177-72.7-179.1-14.700111.8A97 Q198 F199 V205 T206A97-Q202 PolarHBondContact O-OE1 2.83Å; Q198-Q202 WeakPolarHBondContact O-CG 3.49Å; Q198-Q202 PolarHBondContact O-N 3.38Å; F199-Q202 PolarHBondContact O-N 3.07Å; F199-Q202 VanDerWaalsContact O-N 3.12Å; Q202-V205 PolarHBondContact O-N 2.83Å; Q202-T206 WeakPolarHBondContact O-CB 3.36Å; Q202-T206 PolarHBondContact O-N 2.76Å; Q202-T206 PolarHBondContact O-OG1 3Å
203V75.2Confident70.3Confident32 Ų3268.3 Ų68.319%0.19435%0.347CS..Hα-helixtrans-63.4-43.3177.2171.20000111.6I183 F199 R200 R201 V205 T206 K207I183-V203 HydrophobicContact CD1-CG2 4.45Å; I183-V203 HydrophobicContact CG1-CG2 4.19Å; I183-V203 HydrophobicContact CG2-CG1 4.12Å; I183-V203 HydrophobicContact CG2-CG2 3.81Å; F199-V203 HydrophobicContact CD1-CG2 4.07Å; F199-V203 HydrophobicContact CD2-CG2 4.28Å; F199-V203 HydrophobicContact CE1-CG2 3.71Å; F199-V203 HydrophobicContact CE2-CG2 3.93Å; F199-V203 HydrophobicContact CG-CG2 4.34Å; F199-V203 HydrophobicContact CZ-CG2 3.63Å; F199-V203 VanDerWaalsContact O-CG2 3.29Å; F199-V203 WeakPolarHBondContact O-CG2 3.44Å; F199-V203 PolarHBondContact O-N 3.26Å; R200-V203 PolarHBondContact O-N 3.37Å; R201-V203 VanDerWaalsContact C-N 3.33Å; R201-V203 PolarHBondContact O-N 2.8Å; V203-V205 VanDerWaalsContact C-N 3.35Å; V203-V205 PolarHBondContact O-N 3.38Å; V203-T206 PolarHBondContact O-N 3.38Å; V203-K207 VanDerWaalsContact O-CB 3.28Å; V203-K207 WeakPolarHBondContact O-CB 3.29Å; V203-K207 PolarHBondContact O-N 3.1Å
204V75.2Confident71Confident73 Ų7368.7 Ų68.744%0.44234%0.339SS..Hα-helixtrans-61.2-43.9177.3170.80000111.2R200 R201 K207 R208R200-V204 VanDerWaalsContact O-CG2 3.32Å; R200-V204 WeakPolarHBondContact O-CG2 3.3Å; R200-V204 PolarHBondContact O-N 3.3Å; R201-V204 PolarHBondContact O-N 2.92Å; V204-K207 PolarHBondContact O-N 3.15Å; V204-R208 WeakPolarHBondContact O-CG 3.38Å; V204-R208 PolarHBondContact O-N 3.21Å; V204-R208 VanDerWaalsContact O-N 3.15Å
205V69.9Low71.8Confident50 Ų5066 Ų6630%0.30332%0.324SS..Hα-helixtrans-65.9-46.4177.3176.80000110.9R201 Q202 V203 K207 R208 L209R201-V205 WeakPolarHBondContact O-CG2 3.4Å; R201-V205 PolarHBondContact O-N 3.46Å; R201-V205 VanDerWaalsContact O-N 3.13Å; Q202-V205 PolarHBondContact O-N 2.83Å; V203-V205 VanDerWaalsContact C-N 3.35Å; V203-V205 PolarHBondContact O-N 3.38Å; V205-K207 VanDerWaalsContact C-N 3.31Å; V205-K207 PolarHBondContact O-N 3.39Å; V205-R208 PolarHBondContact O-N 3.49Å; V205-R208 VanDerWaalsContact O-N 3.1Å; V205-L209 HydrophobicContact CG1-CD1 4.11Å; V205-L209 PolarHBondContact O-N 3.3Å
206T75.4Confident72.4Confident3 Ų363.2 Ų63.22%0.01830%0.3CS..Hα-helixtrans-62.6-35.8177.8-59.40000112.2T179 I183 Q202 V203 R208 L209 S210T179-T206 HydrophobicContact CG2-CG2 4.15Å; I183-T206 HydrophobicContact CD1-CG2 3.91Å; Q202-T206 WeakPolarHBondContact O-CB 3.36Å; Q202-T206 PolarHBondContact O-N 2.76Å; Q202-T206 PolarHBondContact O-OG1 3Å; V203-T206 PolarHBondContact O-N 3.38Å; T206-R208 VanDerWaalsContact C-N 3.33Å; T206-R208 PolarHBondContact O-N 3.49Å; T206-L209 CarbonylContact O-C 3.42Å; T206-L209 PolarHBondContact O-N 3.37Å; T206-S210 PolarHBondContact O-N 2.88Å
207K75.5Confident72.7Confident156 Ų15664.9 Ų64.968%0.67831%0.306SS*.Hα-helixtrans-70.9-23.8174.9-170.8179.9179.3-177.30113.3V203 V204 V205 S210V203-K207 VanDerWaalsContact O-CB 3.28Å; V203-K207 WeakPolarHBondContact O-CB 3.29Å; V203-K207 PolarHBondContact O-N 3.1Å; V204-K207 PolarHBondContact O-N 3.15Å; V205-K207 VanDerWaalsContact C-N 3.31Å; V205-K207 PolarHBondContact O-N 3.39Å; K207-S210 VanDerWaalsContact C-OG 3.26Å; K207-S210 WeakPolarHBondContact CA-OG 3.41Å; K207-S210 PolarHBondContact O-OG 2.86Å
208R75.1Confident72.8Confident99 Ų9964.2 Ų64.237%0.37430%0.303SS..Hα-helixtrans-76.5-45.8170.6-72169.4175.1-174.10.7110.2V204 V205 T206 S210 V211 A262V204-R208 WeakPolarHBondContact O-CG 3.38Å; V204-R208 PolarHBondContact O-N 3.21Å; V204-R208 VanDerWaalsContact O-N 3.15Å; V205-R208 PolarHBondContact O-N 3.49Å; V205-R208 VanDerWaalsContact O-N 3.1Å; T206-R208 VanDerWaalsContact C-N 3.33Å; T206-R208 PolarHBondContact O-N 3.49Å; R208-S210 PolarHBondContact O-N 3.47Å; R208-V211 PolarHBondContact O-N 3.43Å; R208-A262 HydrophobicContact CB-CB 4.49Å; R208-A262 VanDerWaalsContact CD-O 3.31Å; R208-A262 WeakPolarHBondContact CD-O 3.44Å
209L72.8Confident73Confident9 Ų962 Ų625%0.04729%0.294CS..Hα-helixtrans-65.2-22.9174.8-66.6174.4000112.6R94 V205 T206 V211 V212 L213 L259R94-L209 HydrophobicContact CG-CD1 4.29Å; V205-L209 HydrophobicContact CG1-CD1 4.11Å; V205-L209 PolarHBondContact O-N 3.3Å; T206-L209 CarbonylContact O-C 3.42Å; T206-L209 PolarHBondContact O-N 3.37Å; L209-V211 VanDerWaalsContact C-N 3.31Å; L209-V211 PolarHBondContact O-N 3.36Å; L209-V212 WeakPolarHBondContact O-CB 3.26Å; L209-V212 PolarHBondContact O-N 3.35Å; L209-L213 WeakPolarHBondContact O-CB 3.33Å; L209-L213 VanDerWaalsContact O-CG 3.28Å; L209-L213 WeakPolarHBondContact O-CG 3.39Å; L209-L213 PolarHBondContact O-N 3.49Å; L209-L259 HydrophobicContact CD2-CD1 4.29Å
210S75.2Confident73.1Confident19 Ų1961.4 Ų61.413%0.13329%0.292CS..Hα-helixtrans-60.9-39.9177.260.70000113.4Y176 T206 K207 R208 V212 L213 F214Y176-S210 WeakPolarHBondContact OH-CB 3.34Å; T206-S210 PolarHBondContact O-N 2.88Å; K207-S210 VanDerWaalsContact C-OG 3.26Å; K207-S210 WeakPolarHBondContact CA-OG 3.41Å; K207-S210 PolarHBondContact O-OG 2.86Å; R208-S210 PolarHBondContact O-N 3.47Å; S210-V212 VanDerWaalsContact C-N 3.26Å; S210-V212 PolarHBondContact O-N 3.08Å; S210-L213 PolarHBondContact O-N 2.97Å; S210-F214 WeakPolarHBondContact O-CB 3.42Å; S210-F214 PolarHBondContact O-N 2.86Å
211V72.6Confident73.1Confident80 Ų8054.4 Ų54.449%0.48527%0.266SS..Hα-helixtrans-64-41.9178.7178.30000109.2R208 L209 S215 V258R208-V211 PolarHBondContact O-N 3.43Å; L209-V211 VanDerWaalsContact C-N 3.31Å; L209-V211 PolarHBondContact O-N 3.36Å; V211-S215 WeakPolarHBondContact O-CB 3.11Å; V211-S215 PolarHBondContact O-N 3.17Å; V211-S215 PolarHBondContact O-OG 3.27Å; V211-S215 VanDerWaalsContact O-OG 3.05Å; V211-V258 HydrophobicContact CG1-CG1 4.3Å
212V71.1Confident73.2Confident3 Ų349 Ų492%0.01825%0.252CS..Hα-helixtrans-62.8-51.2176.9176.90000111L209 S210 F214 S215 T216 Y255 V258 L259L209-V212 WeakPolarHBondContact O-CB 3.26Å; L209-V212 PolarHBondContact O-N 3.35Å; S210-V212 VanDerWaalsContact C-N 3.26Å; S210-V212 PolarHBondContact O-N 3.08Å; V212-F214 VanDerWaalsContact C-N 3.33Å; V212-F214 PolarHBondContact O-N 2.97Å; V212-S215 PolarHBondContact O-N 3.32Å; V212-T216 PolarHBondContact O-N 3.33Å; V212-T216 PolarHBondContact O-OG1 2.66Å; V212-T216 VanDerWaalsContact O-OG1 3.09Å; V212-Y255 HydrophobicContact CB-CE2 4.41Å; V212-Y255 HydrophobicContact CG1-CD2 3.45Å; V212-Y255 VanDerWaalsContact CG1-CD2 3.45Å; V212-Y255 HydrophobicContact CG1-CE1 4.3Å; V212-Y255 HydrophobicContact CG1-CE2 2.91Å; V212-Y255 HydrophobicContact CG1-CG 4.36Å; V212-V258 HydrophobicContact CG2-CG1 4.01Å; V212-L259 HydrophobicContact CG2-CD1 4.32Å
213L74.3Confident73.3Confident23 Ų2348.3 Ų48.312%0.1225%0.25CC..Hα-helixtrans-63.2-37.8179-69.3173.2000112.8I87 C91 Y176 L209 S210 T216 F217I87-L213 HydrophobicContact CG2-CD2 3.4Å; C91-L213 WeakPolarHBondContact SG-CD1 3.5Å; C91-L213 WeakPolarHBondContact SG-CD2 3.29Å; Y176-L213 HydrophobicContact CD2-CD1 3.33Å; Y176-L213 HydrophobicContact CE2-CD1 3.65Å; Y176-L213 HydrophobicContact CG-CD1 4.1Å; L209-L213 WeakPolarHBondContact O-CB 3.33Å; L209-L213 VanDerWaalsContact O-CG 3.28Å; L209-L213 WeakPolarHBondContact O-CG 3.39Å; L209-L213 PolarHBondContact O-N 3.49Å; S210-L213 PolarHBondContact O-N 2.97Å; L213-T216 PolarHBondContact O-N 2.81Å; L213-F217 WeakPolarHBondContact O-CB 3.4Å; L213-F217 PolarHBondContact O-N 3.07Å
214F75Confident73Confident124 Ų12446.9 Ų46.954%0.54424%0.241SC..Hα-helixtrans-66.1-43.9175.6-176.5-102.4000111.6S210 V212 F217 L218S210-F214 WeakPolarHBondContact O-CB 3.42Å; S210-F214 PolarHBondContact O-N 2.86Å; V212-F214 VanDerWaalsContact C-N 3.33Å; V212-F214 PolarHBondContact O-N 2.97Å; F214-F217 WeakPolarHBondContact O-CB 3.21Å; F214-F217 PolarHBondContact O-N 3.1Å; F214-L218 HydrophobicContact CD1-CD1 4.03Å; F214-L218 HydrophobicContact CE1-CD1 3.4Å; F214-L218 HydrophobicContact CE1-CG 4.23Å; F214-L218 HydrophobicContact CE2-CD1 4.46Å; F214-L218 HydrophobicContact CZ-CD1 3.66Å; F214-L218 HydrophobicContact CZ-CG 4.21Å; F214-L218 PolarHBondContact O-N 3.44Å
215S71.8Confident72.9Confident36 Ų3645.8 Ų45.825%0.25224%0.24SC..Hα-helixtrans-60.8-45.1173.5-65.90000111.6V211 V212 F217 L218 L219V211-S215 WeakPolarHBondContact O-CB 3.11Å; V211-S215 PolarHBondContact O-N 3.17Å; V211-S215 PolarHBondContact O-OG 3.27Å; V211-S215 VanDerWaalsContact O-OG 3.05Å; V212-S215 PolarHBondContact O-N 3.32Å; S215-F217 VanDerWaalsContact C-N 3.34Å; S215-F217 PolarHBondContact O-N 3.35Å; S215-L218 PolarHBondContact O-N 3.36Å; S215-L219 VanDerWaalsContact O-CB 3.23Å; S215-L219 WeakPolarHBondContact O-CB 3.49Å; S215-L219 WeakPolarHBondContact O-CD1 3.28Å; S215-L219 VanDerWaalsContact O-CG 3.24Å; S215-L219 WeakPolarHBondContact O-CG 3.44Å; S215-L219 PolarHBondContact O-N 3.18Å
216T72Confident73Confident18 Ų1848.4 Ų48.411%0.1125%0.25CS..Hα-helixtrans-59.1-44.8173.7-57.80000111.4I87 V212 L213 L218 L219 Q220I87-T216 HydrophobicContact CD1-CG2 3.23Å; I87-T216 HydrophobicContact CG2-CG2 4.4Å; V212-T216 PolarHBondContact O-N 3.33Å; V212-T216 PolarHBondContact O-OG1 2.66Å; V212-T216 VanDerWaalsContact O-OG1 3.09Å; L213-T216 PolarHBondContact O-N 2.81Å; T216-L218 PolarHBondContact O-N 3.29Å; T216-L219 PolarHBondContact O-N 2.74Å; T216-Q220 HydrophobicContact CG2-CB 4.1Å; T216-Q220 WeakPolarHBondContact O-CA 3.45Å; T216-Q220 WeakPolarHBondContact O-CB 3.21Å; T216-Q220 PolarHBondContact O-N 3.48Å
217F72Confident72.9Confident61 Ų6148.4 Ų48.427%0.26825%0.25SC..Iπ-helixtrans-57.5-51.2179.4171.1-110000111.9V173 L213 F214 S215 V221 V222V173-F217 HydrophobicContact CB-CD2 4.35Å; V173-F217 HydrophobicContact CB-CE2 4.42Å; V173-F217 HydrophobicContact CG1-CD2 4.35Å; V173-F217 HydrophobicContact CG1-CE2 4.17Å; V173-F217 HydrophobicContact CG2-CB 4.42Å; V173-F217 HydrophobicContact CG2-CD2 3.1Å; V173-F217 HydrophobicContact CG2-CE2 3.49Å; V173-F217 VanDerWaalsContact CG2-CE2 3.49Å; V173-F217 HydrophobicContact CG2-CG 3.99Å; L213-F217 WeakPolarHBondContact O-CB 3.4Å; L213-F217 PolarHBondContact O-N 3.07Å; F214-F217 WeakPolarHBondContact O-CB 3.21Å; F214-F217 PolarHBondContact O-N 3.1Å; S215-F217 VanDerWaalsContact C-N 3.34Å; S215-F217 PolarHBondContact O-N 3.35Å; F217-V221 HydrophobicContact CD2-CB 3.58Å; F217-V221 HydrophobicContact CD2-CG1 3.9Å; F217-V221 HydrophobicContact CD2-CG2 3.91Å; F217-V221 HydrophobicContact CE2-CB 3.94Å; F217-V221 HydrophobicContact CE2-CG1 3.78Å; F217-V221 WeakPolarHBondContact O-CB 3.39Å; F217-V221 PolarHBondContact O-N 3.37Å; F217-V222 HydrophobicContact CE1-CG2 4.3Å; F217-V222 HydrophobicContact CZ-CG2 4.28Å; F217-V222 PolarHBondContact O-N 3.15Å
218L73.4Confident72.5Confident83 Ų8342.5 Ų42.544%0.43523%0.225SC..Iπ-helixtrans-65.7-40.3179.9-68.2-179.1000112.4F214 S215 T216 V222 P223F214-L218 HydrophobicContact CD1-CD1 4.03Å; F214-L218 HydrophobicContact CE1-CD1 3.4Å; F214-L218 HydrophobicContact CE1-CG 4.23Å; F214-L218 HydrophobicContact CE2-CD1 4.46Å; F214-L218 HydrophobicContact CZ-CD1 3.66Å; F214-L218 HydrophobicContact CZ-CG 4.21Å; F214-L218 PolarHBondContact O-N 3.44Å; S215-L218 PolarHBondContact O-N 3.36Å; T216-L218 PolarHBondContact O-N 3.29Å; L218-V222 HydrophobicContact CD2-CG2 4.5Å; L218-P223 WeakPolarHBondContact O-CD 3.31Å
219L71.2Confident72.4Confident54 Ų5441.6 Ų41.628%0.28324%0.239SC..Iπ-helixtrans-87.9-15.4-173.7-64.4167.6000113.8S215 T216 P223S215-L219 VanDerWaalsContact O-CB 3.23Å; S215-L219 WeakPolarHBondContact O-CB 3.49Å; S215-L219 WeakPolarHBondContact O-CD1 3.28Å; S215-L219 VanDerWaalsContact O-CG 3.24Å; S215-L219 WeakPolarHBondContact O-CG 3.44Å; S215-L219 PolarHBondContact O-N 3.18Å; T216-L219 PolarHBondContact O-N 2.74Å; L219-P223 WeakPolarHBondContact O-CG 3.4Å
220Q72.3Confident72.3Confident13 Ų1341.9 Ų41.96%0.06124%0.242CC..Iπ-helixtrans-123.7-50.4-173.8-163.2178.74.100113T84 T216 F224 R248T84-Q220 PolarHBondContact OG1-NE2 2.68Å; T216-Q220 HydrophobicContact CG2-CB 4.1Å; T216-Q220 WeakPolarHBondContact O-CA 3.45Å; T216-Q220 WeakPolarHBondContact O-CB 3.21Å; T216-Q220 PolarHBondContact O-N 3.48Å; Q220-F224 HydrophobicContact CG-CD2 4.04Å; Q220-F224 HydrophobicContact CG-CE2 3.54Å; Q220-F224 HydrophobicContact CG-CZ 4.31Å; Q220-F224 WeakPolarHBondContact O-CD2 3.47Å; Q220-F224 WeakPolarHBondContact O-CG 3.4Å; Q220-F224 PolarHBondContact O-N 3.2Å; Q220-R248 PolarHBondContact O-NH2 3.46Å
221V72.6Confident71.9Confident9 Ų942.9 Ų42.96%0.05525%0.247CC..Iπ-helixtrans-76.7-43.7-174.1-178.30000111.4M170 F217 F224 A225M170-V221 HydrophobicContact CG-CG1 4.27Å; M170-V221 HydrophobicContact SD-CG1 3.57Å; M170-V221 VanDerWaalsContact SD-CG1 3.57Å; F217-V221 HydrophobicContact CD2-CB 3.58Å; F217-V221 HydrophobicContact CD2-CG1 3.9Å; F217-V221 HydrophobicContact CD2-CG2 3.91Å; F217-V221 HydrophobicContact CE2-CB 3.94Å; F217-V221 HydrophobicContact CE2-CG1 3.78Å; F217-V221 WeakPolarHBondContact O-CB 3.39Å; F217-V221 PolarHBondContact O-N 3.37Å; V221-F224 PolarHBondContact O-N 2.9Å; V221-A225 WeakPolarHBondContact O-CB 3.23Å; V221-A225 PolarHBondContact O-N 2.93Å
222V73.8Confident71.8Confident55 Ų5551.2 Ų51.233%0.33327%0.27SS..Hα-helixtrans-59.6-47.8177.2175.40000111.2F217 L218 F224 A225 M226F217-V222 HydrophobicContact CE1-CG2 4.3Å; F217-V222 HydrophobicContact CZ-CG2 4.28Å; F217-V222 PolarHBondContact O-N 3.15Å; L218-V222 HydrophobicContact CD2-CG2 4.5Å; V222-F224 PolarHBondContact O-N 2.79Å; V222-A225 PolarHBondContact O-N 3.39Å; V222-M226 HydrophobicContact CG1-CG 4.42Å; V222-M226 HydrophobicContact CG1-SD 4.08Å; V222-M226 WeakPolarHBondContact O-CG 3.43Å; V222-M226 PolarHBondContact O-N 2.9Å
223P72.2Confident71.9Confident15 Ų1553.1 Ų53.110%0.09728%0.284CS..Hα-helixtrans-58.4-40.8172.9-30.939.2000114.2L218 L219 L227 T244L218-P223 WeakPolarHBondContact O-CD 3.31Å; L219-P223 WeakPolarHBondContact O-CG 3.4Å; P223-L227 VanDerWaalsContact O-CB 3.25Å; P223-L227 WeakPolarHBondContact O-CB 3.44Å; P223-L227 PolarHBondContact O-N 3.29Å; P223-T244 HydrophobicContact CB-CG2 3.9Å
224F69.9Low71.6Confident1 Ų157.2 Ų57.20%0.00431%0.306CS..Hα-helixtrans-64.3-42.5176.2-76.9-47.3000112.4Y162 N165 A166 Q220 V221 V222 L227 N228 R248Y162-F224 AromaticContact CD1-CD1 3.63Å; Y162-F224 HydrophobicContact CD1-CD1 3.63Å; Y162-F224 AromaticContact CD1-CE1 3.25Å; Y162-F224 HydrophobicContact CD1-CE1 3.25Å; Y162-F224 HydrophobicContact CD1-CZ 4.4Å; Y162-F224 HydrophobicContact CE1-CD1 4.23Å; Y162-F224 AromaticContact CE1-CE1 3.63Å; Y162-F224 HydrophobicContact CE1-CE1 3.63Å; Y162-F224 HydrophobicContact CG-CD1 4.15Å; Y162-F224 HydrophobicContact CG-CE1 4.19Å; N165-F224 HydrophobicContact CB-CD2 4.38Å; N165-F224 HydrophobicContact CB-CE1 4.02Å; N165-F224 HydrophobicContact CB-CE2 3.69Å; N165-F224 HydrophobicContact CB-CZ 3.47Å; N165-F224 VanDerWaalsContact CB-CZ 3.47Å; A166-F224 HydrophobicContact CB-CB 4.06Å; Q220-F224 HydrophobicContact CG-CD2 4.04Å; Q220-F224 HydrophobicContact CG-CE2 3.54Å; Q220-F224 HydrophobicContact CG-CZ 4.31Å; Q220-F224 WeakPolarHBondContact O-CD2 3.47Å; Q220-F224 WeakPolarHBondContact O-CG 3.4Å; Q220-F224 PolarHBondContact O-N 3.2Å; V221-F224 PolarHBondContact O-N 2.9Å; V222-F224 PolarHBondContact O-N 2.79Å; F224-L227 PolarHBondContact O-N 3.44Å; F224-N228 WeakPolarHBondContact O-CB 3.5Å; F224-N228 PolarHBondContact O-N 3.33Å; F224-N228 PolarHBondContact O-ND2 3.45Å; F224-R248 VanDerWaalsContact CD1-NH2 3.26Å; F224-R248 VanDerWaalsContact CD2-NH2 3.33Å
225A72Confident71.3Confident50 Ų5056 Ų5641%0.41331%0.311SS..Hα-helixtrans-64.9-44.6178.300000111.2V221 V222 L227 N228 A229V221-A225 WeakPolarHBondContact O-CB 3.23Å; V221-A225 PolarHBondContact O-N 2.93Å; V222-A225 PolarHBondContact O-N 3.39Å; A225-L227 PolarHBondContact O-N 3.48Å; A225-N228 PolarHBondContact O-N 3.21Å; A225-A229 WeakPolarHBondContact O-CB 3.39Å; A225-A229 PolarHBondContact O-N 3.02Å
226M73.5Confident71.2Confident106 Ų10658.6 Ų58.652%0.52232%0.322SS..Hα-helixtrans-61.2-43.3174.8-72.2-178.971.800112V222 A229 S230V222-M226 HydrophobicContact CG1-CG 4.42Å; V222-M226 HydrophobicContact CG1-SD 4.08Å; V222-M226 WeakPolarHBondContact O-CG 3.43Å; V222-M226 PolarHBondContact O-N 2.9Å; M226-A229 PolarHBondContact O-N 3.25Å; M226-S230 WeakPolarHBondContact O-CB 3.35Å; M226-S230 PolarHBondContact O-N 2.84Å
227L71.4Confident70.9Confident3 Ų358.3 Ų58.32%0.01632%0.319CS..Hα-helixtrans-66.5-41.7-179.8-171.558.7000112.1Y162 P223 F224 A225 S230 T231 M240 I241 T244Y162-L227 HydrophobicContact CD2-CD2 3.26Å; Y162-L227 HydrophobicContact CD2-CG 4.18Å; Y162-L227 HydrophobicContact CE2-CD2 3.18Å; Y162-L227 HydrophobicContact CE2-CG 4.42Å; Y162-L227 HydrophobicContact CG-CD2 4.06Å; P223-L227 VanDerWaalsContact O-CB 3.25Å; P223-L227 WeakPolarHBondContact O-CB 3.44Å; P223-L227 PolarHBondContact O-N 3.29Å; F224-L227 PolarHBondContact O-N 3.44Å; A225-L227 PolarHBondContact O-N 3.48Å; L227-S230 PolarHBondContact O-N 3.36Å; L227-T231 PolarHBondContact O-N 3.44Å; L227-M240 HydrophobicContact CD1-CB 3.75Å; L227-I241 HydrophobicContact CD1-CG1 3.92Å; L227-I241 HydrophobicContact CD2-CG1 4.4Å; L227-T244 HydrophobicContact CB-CG2 4.37Å
228N68.3Low70.7Confident31 Ų3162.6 Ų62.617%0.16634%0.337CS..Hα-helixtrans-62.8-41.9174.1-78.9-44.5000111.8Y162 K163 A166 F224 A225 S230 T231Y162-N228 PolarHBondContact O-ND2 2.84Å; K163-N228 WeakPolarHBondContact CG-OD1 3.32Å; A166-N228 WeakPolarHBondContact CB-ND2 3.09Å; F224-N228 WeakPolarHBondContact O-CB 3.5Å; F224-N228 PolarHBondContact O-N 3.33Å; F224-N228 PolarHBondContact O-ND2 3.45Å; A225-N228 PolarHBondContact O-N 3.21Å; N228-S230 VanDerWaalsContact C-N 3.26Å; N228-S230 PolarHBondContact O-N 3.02Å; N228-T231 WeakPolarHBondContact O-CB 3.31Å; N228-T231 WeakPolarHBondContact O-CG2 3.41Å; N228-T231 PolarHBondContact O-N 3.36Å; N228-T231 PolarHBondContact O-OG1 3.09Å
229A73.4Confident70.5Confident80 Ų8061.5 Ų61.566%0.66134%0.336SS*.Hα-helixtrans-64-32.9175.600000112.4A225 M226 T231A225-A229 WeakPolarHBondContact O-CB 3.39Å; A225-A229 PolarHBondContact O-N 3.02Å; M226-A229 PolarHBondContact O-N 3.25Å; A229-T231 VanDerWaalsContact C-N 3.3Å; A229-T231 PolarHBondContact O-N 3.04Å
230S70.2Confident70.4Confident15 Ų1560.9 Ų60.911%0.10533%0.333CS..G310 helixtrans-79.3-4.5179.7-175.30000114.6M226 L227 N228 W232 S233 L236 M240M226-S230 WeakPolarHBondContact O-CB 3.35Å; M226-S230 PolarHBondContact O-N 2.84Å; L227-S230 PolarHBondContact O-N 3.36Å; N228-S230 VanDerWaalsContact C-N 3.26Å; N228-S230 PolarHBondContact O-N 3.02Å; S230-W232 PolarHBondContact O-N 3.25Å; S230-S233 PolarHBondContact O-N 3.17Å; S230-L236 WeakPolarHBondContact OG-CB 3.46Å; S230-M240 WeakPolarHBondContact OG-CG 3.37Å
231T66.8Low70.2Confident40 Ų4061.4 Ų61.425%0.24534%0.336CS..G310 helixtrans-59.3-17.6-179520000113.6D159 L227 N228 A229 S233D159-T231 WeakPolarHBondContact OD1-CG2 3.28Å; L227-T231 PolarHBondContact O-N 3.44Å; N228-T231 WeakPolarHBondContact O-CB 3.31Å; N228-T231 WeakPolarHBondContact O-CG2 3.41Å; N228-T231 PolarHBondContact O-N 3.36Å; N228-T231 PolarHBondContact O-OG1 3.09Å; A229-T231 VanDerWaalsContact C-N 3.3Å; A229-T231 PolarHBondContact O-N 3.04Å; T231-S233 VanDerWaalsContact C-N 3.34Å; T231-S233 PolarHBondContact O-N 3.02Å
232W70.6Confident70.1Confident256 Ų25666.4 Ų66.497%0.9736%0.362SS*.G310 helixtrans-71.9-18.5179.5-117.122.9000115.4S230S230-W232 PolarHBondContact O-N 3.25Å
233S73.4Confident69.8Low43 Ų4368.6 Ų68.630%0.30137%0.37SS..  trans-126.1125.8-179.1172.80000112.3S230 T231 C235 L236 W237S230-S233 PolarHBondContact O-N 3.17Å; T231-S233 VanDerWaalsContact C-N 3.34Å; T231-S233 PolarHBondContact O-N 3.02Å; S233-C235 VanDerWaalsContact C-N 3.33Å; S233-C235 PolarHBondContact O-N 3.16Å; S233-L236 PolarHBondContact O-N 3.47Å; S233-W237 WeakPolarHBondContact O-CB 3.31Å; S233-W237 PolarHBondContact O-N 3.13Å
234N67.8Low69.7Low109 Ų10968.2 Ų68.258%0.58337%0.368SS*.Hα-helixtrans-59.1-40.6179-76.8-54.9000113.4R155R155-N234 PolarHBondContact NH1-OD1 3.4Å; R155-N234 PolarHBondContact NH2-OD1 3.28Å
235C68Low69.6Low97 Ų9770.5 Ų70.566%0.65538%0.382SS*.Hα-helixtrans-71.2-45.8-178.9-1750000110.6S233 W237 S239S233-C235 VanDerWaalsContact C-N 3.33Å; S233-C235 PolarHBondContact O-N 3.16Å; C235-W237 VanDerWaalsContact C-N 3.32Å; C235-W237 PolarHBondContact O-N 2.85Å; C235-S239 PolarHBondContact O-N 3.12Å; C235-S239 PolarHBondContact O-OG 3.39Å
236L69.6Low69.4Low91 Ų9177 Ų7748%0.47640%0.396SS..Hα-helixtrans-64.8-37.6178.5-64175.8000111.4S230 S233 K238 S239 M240S230-L236 WeakPolarHBondContact OG-CB 3.46Å; S233-L236 PolarHBondContact O-N 3.47Å; L236-K238 PolarHBondContact O-N 3.36Å; L236-S239 PolarHBondContact O-N 3.3Å; L236-M240 WeakPolarHBondContact O-CB 3.38Å; L236-M240 WeakPolarHBondContact O-CG 3.33Å; L236-M240 PolarHBondContact O-N 3.33Å
237W65.9Low69.1Low13 Ų1374.3 Ų74.35%0.04939%0.386CS..Hα-helixtrans-57.8-46.6-179.4-17584.5000113.3R155 Y158 S233 C235 M240 I241R155-W237 HydrophobicContact CB-CH2 4.49Å; R155-W237 HydrophobicContact CB-CZ2 4.25Å; R155-W237 HydrophobicContact CG-CZ2 3.94Å; Y158-W237 HydrophobicContact CD2-CH2 4.34Å; Y158-W237 HydrophobicContact CD2-CZ2 4.13Å; Y158-W237 HydrophobicContact CG-CZ2 4.17Å; S233-W237 WeakPolarHBondContact O-CB 3.31Å; S233-W237 PolarHBondContact O-N 3.13Å; C235-W237 VanDerWaalsContact C-N 3.32Å; C235-W237 PolarHBondContact O-N 2.85Å; W237-M240 PolarHBondContact O-N 2.83Å; W237-I241 HydrophobicContact CD2-CD1 3.57Å; W237-I241 HydrophobicContact CD2-CG1 4.45Å; W237-I241 HydrophobicContact CE3-CD1 3.69Å; W237-I241 HydrophobicContact CG-CD1 4.38Å; W237-I241 HydrophobicContact CH2-CD1 3.42Å; W237-I241 VanDerWaalsContact CH2-CD1 3.42Å; W237-I241 HydrophobicContact CZ2-CD1 3.3Å; W237-I241 HydrophobicContact CZ3-CD1 3.61Å; W237-I241 WeakPolarHBondContact O-CG1 3.38Å; W237-I241 PolarHBondContact O-N 2.98Å
238K68.3Low68.9Low151 Ų15174.8 Ų74.866%0.65739%0.388SS*.Hα-helixtrans-64.5-46.7178.9-76.8-170.2176.2-175.80111.8L236 M240 I241 L242L236-K238 PolarHBondContact O-N 3.36Å; K238-M240 VanDerWaalsContact C-N 3.35Å; K238-I241 PolarHBondContact O-N 3.33Å; K238-L242 PolarHBondContact O-N 3.05Å
239S69.8Low68.9Low59 Ų5975 Ų7541%0.41340%0.397SS..Hα-helixtrans-63.8-41.9178.4-58.50000111.5C235 L236 L242 I243C235-S239 PolarHBondContact O-N 3.12Å; C235-S239 PolarHBondContact O-OG 3.39Å; L236-S239 PolarHBondContact O-N 3.3Å; S239-L242 PolarHBondContact O-N 3.49Å; S239-I243 WeakPolarHBondContact O-CD1 3.31Å; S239-I243 VanDerWaalsContact O-CG1 3.28Å; S239-I243 WeakPolarHBondContact O-CG1 3.44Å; S239-I243 PolarHBondContact O-N 3.02Å
240M67.6Low68.8Low41 Ų4175.3 Ų75.320%0.20239%0.387CS..Hα-helixtrans-68.5-36.7179.2-71.7-62.612700112.3L227 S230 L236 W237 K238 L242 I243 T244L227-M240 HydrophobicContact CD1-CB 3.75Å; S230-M240 WeakPolarHBondContact OG-CG 3.37Å; L236-M240 WeakPolarHBondContact O-CB 3.38Å; L236-M240 WeakPolarHBondContact O-CG 3.33Å; L236-M240 PolarHBondContact O-N 3.33Å; W237-M240 PolarHBondContact O-N 2.83Å; K238-M240 VanDerWaalsContact C-N 3.35Å; M240-L242 VanDerWaalsContact C-N 3.31Å; M240-L242 PolarHBondContact O-N 3.46Å; M240-I243 HydrophobicContact CE-CD1 3.88Å; M240-I243 PolarHBondContact O-N 3.23Å; M240-T244 VanDerWaalsContact O-CB 3.24Å; M240-T244 WeakPolarHBondContact O-CB 3.21Å; M240-T244 WeakPolarHBondContact O-CG2 3.38Å; M240-T244 PolarHBondContact O-N 3.42Å; M240-T244 PolarHBondContact O-OG1 2.97Å
241I68.6Low68.7Low24 Ų2475 Ų7512%0.12339%0.387CS..Hα-helixtrans-57.2-47.9171.6-76.1172.4000110.5L227 W237 K238 I243 T244 V245L227-I241 HydrophobicContact CD1-CG1 3.92Å; L227-I241 HydrophobicContact CD2-CG1 4.4Å; W237-I241 HydrophobicContact CD2-CD1 3.57Å; W237-I241 HydrophobicContact CD2-CG1 4.45Å; W237-I241 HydrophobicContact CE3-CD1 3.69Å; W237-I241 HydrophobicContact CG-CD1 4.38Å; W237-I241 HydrophobicContact CH2-CD1 3.42Å; W237-I241 VanDerWaalsContact CH2-CD1 3.42Å; W237-I241 HydrophobicContact CZ2-CD1 3.3Å; W237-I241 HydrophobicContact CZ3-CD1 3.61Å; W237-I241 WeakPolarHBondContact O-CG1 3.38Å; W237-I241 PolarHBondContact O-N 2.98Å; K238-I241 PolarHBondContact O-N 3.33Å; I241-I243 PolarHBondContact O-N 2.95Å; I241-T244 PolarHBondContact O-N 3.34Å; I241-T244 PolarHBondContact O-OG1 2.92Å; I241-V245 HydrophobicContact CG2-CG2 4.02Å; I241-V245 VanDerWaalsContact O-CB 3.31Å; I241-V245 WeakPolarHBondContact O-CB 3.29Å; I241-V245 WeakPolarHBondContact O-CG2 3.32Å; I241-V245 PolarHBondContact O-N 3.12Å
242L69.8Low68.8Low115 Ų11573.9 Ų73.960%0.60238%0.379SS*.Hα-helixtrans-63.2-45.5-179.1-174.164.6000111.6K238 S239 M240 T244K238-L242 PolarHBondContact O-N 3.05Å; S239-L242 PolarHBondContact O-N 3.49Å; M240-L242 VanDerWaalsContact C-N 3.31Å; M240-L242 PolarHBondContact O-N 3.46Å; L242-T244 VanDerWaalsContact C-N 3.3Å; L242-T244 PolarHBondContact O-N 3.38Å
243I68.8Low68.8Low100 Ų10065.7 Ų65.751%0.51336%0.357SS..Hα-helixtrans-67.3-28.9179.7-67.5165000112.1S239 M240 I241 P247S239-I243 WeakPolarHBondContact O-CD1 3.31Å; S239-I243 VanDerWaalsContact O-CG1 3.28Å; S239-I243 WeakPolarHBondContact O-CG1 3.44Å; S239-I243 PolarHBondContact O-N 3.02Å; M240-I243 HydrophobicContact CE-CD1 3.88Å; M240-I243 PolarHBondContact O-N 3.23Å; I241-I243 PolarHBondContact O-N 2.95Å; I243-P247 WeakPolarHBondContact O-CD 3.44Å; I243-P247 WeakPolarHBondContact O-CG 3.46Å
244T69.3Low68.8Low7 Ų767 Ų674%0.04336%0.359CS..Hα-helixtrans-91-33.6-177.255.40000112.8P223 L227 M240 I241 L242 R248P223-T244 HydrophobicContact CB-CG2 3.9Å; L227-T244 HydrophobicContact CB-CG2 4.37Å; M240-T244 VanDerWaalsContact O-CB 3.24Å; M240-T244 WeakPolarHBondContact O-CB 3.21Å; M240-T244 WeakPolarHBondContact O-CG2 3.38Å; M240-T244 PolarHBondContact O-N 3.42Å; M240-T244 PolarHBondContact O-OG1 2.97Å; I241-T244 PolarHBondContact O-N 3.34Å; I241-T244 PolarHBondContact O-OG1 2.92Å; L242-T244 VanDerWaalsContact C-N 3.3Å; L242-T244 PolarHBondContact O-N 3.38Å; T244-R248 WeakPolarHBondContact O-CB 3.47Å
245V69.1Low68.9Low49 Ų4962.7 Ų62.730%0.29734%0.335SS..Hα-helixtrans-68.8-38.3-178.9171.10000111.8I241 R248 G249I241-V245 HydrophobicContact CG2-CG2 4.02Å; I241-V245 VanDerWaalsContact O-CB 3.31Å; I241-V245 WeakPolarHBondContact O-CB 3.29Å; I241-V245 WeakPolarHBondContact O-CG2 3.32Å; I241-V245 PolarHBondContact O-N 3.12Å; V245-R248 WeakPolarHBondContact O-CB 3.48Å; V245-R248 PolarHBondContact O-N 3.17Å; V245-G249 PolarHBondContact O-N 3.08Å; V245-G249 VanDerWaalsContact O-N 3.13Å
246W67Low68.9Low187 Ų18760.3 Ų60.371%0.70832%0.319SS*.Hα-helixtrans-66.4-56-177.3-104.963.4000114.2R248 G249 I250W246-R248 PolarHBondContact O-N 3.13Å; W246-R248 VanDerWaalsContact O-N 3.14Å; W246-G249 PolarHBondContact O-N 3.44Å; W246-G249 VanDerWaalsContact O-N 3.14Å; W246-I250 WeakPolarHBondContact O-CG1 3.35Å; W246-I250 PolarHBondContact O-N 3.14Å; W246-I250 VanDerWaalsContact O-N 3.15Å
247P67.8Low69.2Low50 Ų5060.3 Ų60.333%0.32532%0.318SS..Hα-helixtrans-58.1-29176.5-2535.5000112.4I243 I250 G251I243-P247 WeakPolarHBondContact O-CD 3.44Å; I243-P247 WeakPolarHBondContact O-CG 3.46Å; P247-I250 PolarHBondContact O-N 3.39Å; P247-G251 PolarHBondContact O-N 3.17Å
248R66.2Low69.7Low12 Ų1261.4 Ų61.45%0.04533%0.326CS..Hα-helixtrans-69.9-44.9177.3-159.8-163-137.399.765112.4E80 Q220 F224 T244 V245 W246 I250 G251 M252E80-R248 VanDerWaalsContact OE1-CD 3.28Å; E80-R248 WeakPolarHBondContact OE1-CD 3.12Å; E80-R248 IonicContact OE1-CZ 3.69Å; E80-R248 IonicContact OE1-NE 2.64Å; E80-R248 PolarHBondContact OE1-NE 3.48Å; E80-R248 IonicContact OE1-NH1 2.97Å; E80-R248 PolarHBondContact OE1-NH1 3.29Å; Q220-R248 PolarHBondContact O-NH2 3.46Å; F224-R248 VanDerWaalsContact CD1-NH2 3.26Å; F224-R248 VanDerWaalsContact CD2-NH2 3.33Å; T244-R248 WeakPolarHBondContact O-CB 3.47Å; V245-R248 WeakPolarHBondContact O-CB 3.48Å; V245-R248 PolarHBondContact O-N 3.17Å; W246-R248 PolarHBondContact O-N 3.13Å; W246-R248 VanDerWaalsContact O-N 3.14Å; R248-I250 VanDerWaalsContact C-N 3.26Å; R248-I250 PolarHBondContact O-N 2.78Å; R248-G251 PolarHBondContact O-N 2.96Å; R248-M252 WeakPolarHBondContact O-CG 3.45Å; R248-M252 PolarHBondContact O-N 2.84Å
249G69Low69.8Low35 Ų3554.9 Ų54.936%0.36130%0.298SS..Hα-helixtrans-58-42.5173.800000111.6V245 W246 T253V245-G249 PolarHBondContact O-N 3.08Å; V245-G249 VanDerWaalsContact O-N 3.13Å; W246-G249 PolarHBondContact O-N 3.44Å; W246-G249 VanDerWaalsContact O-N 3.14Å; G249-T253 PolarHBondContact O-N 3.36Å; G249-T253 PolarHBondContact O-OG1 2.78Å
250I70.7Confident69.9Low87 Ų8753.7 Ų53.745%0.44629%0.289SS..Hα-helixtrans-64.1-46.6174.3-61170000110.5W246 P247 R248 M252 T253 I254W246-I250 WeakPolarHBondContact O-CG1 3.35Å; W246-I250 PolarHBondContact O-N 3.14Å; W246-I250 VanDerWaalsContact O-N 3.15Å; P247-I250 PolarHBondContact O-N 3.39Å; R248-I250 VanDerWaalsContact C-N 3.26Å; R248-I250 PolarHBondContact O-N 2.78Å; I250-M252 PolarHBondContact O-N 2.98Å; I250-T253 CarbonylContact O-C 3.59Å; I250-T253 WeakPolarHBondContact O-CA 3.36Å; I250-T253 WeakPolarHBondContact O-CB 3.41Å; I250-T253 PolarHBondContact O-N 2.83Å; I250-I254 HydrophobicContact CG2-CD1 3.62Å; I250-I254 HydrophobicContact CG2-CG1 4.15Å; I250-I254 WeakPolarHBondContact O-CG1 3.36Å; I250-I254 PolarHBondContact O-N 3.39Å
251G69.2Low70.2Confident10 Ų1059.2 Ų59.210%0.10331%0.312CS..Hα-helixtrans-62.9-38.7-179.100000114.1P247 R248 T253 I254 Y255P247-G251 PolarHBondContact O-N 3.17Å; R248-G251 PolarHBondContact O-N 2.96Å; G251-T253 PolarHBondContact O-N 3.28Å; G251-I254 PolarHBondContact O-N 3.43Å; G251-Y255 PolarHBondContact O-N 3.34Å
252M68.2Low70.3Confident16 Ų1659.3 Ų59.38%0.07932%0.316CS..Hα-helixtrans-64.2-27.9173.2-69.5-67.6-80.300112.2F32 I36 R248 I250 P256F32-M252 HydrophobicContact CE2-CE 4.46Å; F32-M252 HydrophobicContact CZ-CE 4.3Å; F32-M252 HydrophobicContact CZ-SD 4.09Å; I36-M252 HydrophobicContact CB-CE 4.44Å; I36-M252 HydrophobicContact CG1-CE 3.7Å; I36-M252 HydrophobicContact CG1-SD 4.48Å; I36-M252 WeakPolarHBondContact CG2-O 3.47Å; R248-M252 WeakPolarHBondContact O-CG 3.45Å; R248-M252 PolarHBondContact O-N 2.84Å; I250-M252 PolarHBondContact O-N 2.98Å; M252-P256 WeakPolarHBondContact O-CD 3.4Å
253T70.9Confident70.3Confident84 Ų8454.9 Ų54.952%0.51529%0.293SS..Hα-helixtrans-84.4-35.4177.8-46.60000112.2G249 I250 G251 Y255 P256G249-T253 PolarHBondContact O-N 3.36Å; G249-T253 PolarHBondContact O-OG1 2.78Å; I250-T253 CarbonylContact O-C 3.59Å; I250-T253 WeakPolarHBondContact O-CA 3.36Å; I250-T253 WeakPolarHBondContact O-CB 3.41Å; I250-T253 PolarHBondContact O-N 2.83Å; G251-T253 PolarHBondContact O-N 3.28Å; T253-Y255 VanDerWaalsContact C-N 3.3Å; T253-Y255 PolarHBondContact O-N 3.43Å; T253-P256 VanDerWaalsContact O-CD 3.25Å; T253-P256 WeakPolarHBondContact O-CD 3.42Å; T253-P256 WeakPolarHBondContact O-CG 3.25Å
254I73.1Confident70.3Confident69 Ų6952.7 Ų52.735%0.35429%0.285SS..Hα-helixtrans-66-35.2174.6-69.9172.7000110.7I250 G251 I257 V258I250-I254 HydrophobicContact CG2-CD1 3.62Å; I250-I254 HydrophobicContact CG2-CG1 4.15Å; I250-I254 WeakPolarHBondContact O-CG1 3.36Å; I250-I254 PolarHBondContact O-N 3.39Å; G251-I254 PolarHBondContact O-N 3.43Å; I254-I257 WeakPolarHBondContact O-CB 3.43Å; I254-I257 PolarHBondContact O-N 2.78Å; I254-V258 HydrophobicContact CG2-CG2 3.66Å; I254-V258 WeakPolarHBondContact O-CG2 3.32Å; I254-V258 PolarHBondContact O-N 3.1Å
255Y69.6Low70.4Confident19 Ų1957.4 Ų57.48%0.07531%0.306CS..Hα-helixtrans-52.7-58.2-178-179.1-73000114.4F32 I36 V212 G251 T253 I257 V258 L259F32-Y255 AromaticContact CD1-CD1 3.7Å; F32-Y255 HydrophobicContact CD1-CD1 3.7Å; F32-Y255 HydrophobicContact CD1-CD2 4.35Å; F32-Y255 AromaticContact CD1-CE1 3.18Å; F32-Y255 HydrophobicContact CD1-CE1 3.18Å; F32-Y255 AromaticContact CD1-CE2 3.84Å; F32-Y255 HydrophobicContact CD1-CE2 3.84Å; F32-Y255 HydrophobicContact CD1-CG 4.28Å; F32-Y255 AromaticContact CD1-CZ 3.26Å; F32-Y255 AromaticContact CE1-CD1 3.2Å; F32-Y255 HydrophobicContact CE1-CD1 3.2Å; F32-Y255 AromaticContact CE1-CD2 3.44Å; F32-Y255 HydrophobicContact CE1-CD2 3.44Å; F32-Y255 VanDerWaalsContact CE1-CD2 3.44Å; F32-Y255 AromaticContact CE1-CE1 3.15Å; F32-Y255 HydrophobicContact CE1-CE1 3.15Å; F32-Y255 AromaticContact CE1-CE2 3.32Å; F32-Y255 HydrophobicContact CE1-CE2 3.32Å; F32-Y255 AromaticContact CE1-CG 3.37Å; F32-Y255 HydrophobicContact CE1-CG 3.37Å; F32-Y255 AromaticContact CE1-CZ 3.22Å; F32-Y255 HydrophobicContact CG-CE1 4.39Å; F32-Y255 HydrophobicContact CZ-CD1 4.28Å; F32-Y255 AromaticContact CZ-CD2 3.8Å; F32-Y255 HydrophobicContact CZ-CD2 3.8Å; F32-Y255 HydrophobicContact CZ-CE1 4.34Å; F32-Y255 AromaticContact CZ-CE2 3.78Å; F32-Y255 HydrophobicContact CZ-CE2 3.78Å; F32-Y255 HydrophobicContact CZ-CG 4.04Å; I36-Y255 HydrophobicContact CD1-CD1 3.89Å; I36-Y255 HydrophobicContact CD1-CG 4.37Å; V212-Y255 HydrophobicContact CB-CE2 4.41Å; V212-Y255 HydrophobicContact CG1-CD2 3.45Å; V212-Y255 VanDerWaalsContact CG1-CD2 3.45Å; V212-Y255 HydrophobicContact CG1-CE1 4.3Å; V212-Y255 HydrophobicContact CG1-CE2 2.91Å; V212-Y255 HydrophobicContact CG1-CG 4.36Å; G251-Y255 PolarHBondContact O-N 3.34Å; T253-Y255 VanDerWaalsContact C-N 3.3Å; T253-Y255 PolarHBondContact O-N 3.43Å; Y255-I257 PolarHBondContact O-N 2.96Å; Y255-V258 PolarHBondContact O-N 3.09Å; Y255-V258 VanDerWaalsContact O-N 3.12Å; Y255-L259 HydrophobicContact CD1-CB 4.44Å; Y255-L259 HydrophobicContact CE1-CB 4.23Å; Y255-L259 HydrophobicContact CE1-CD2 4.06Å; Y255-L259 PolarHBondContact O-N 2.94Å
256P69.1Low70.3Confident47 Ų4757.2 Ų57.231%0.30530%0.303SS..Hα-helixtrans-63.2-32.4-17622.8-33.8000111.1I36 M252 T253 L259 V260I36-P256 HydrophobicContact CD1-CG 4.29Å; M252-P256 WeakPolarHBondContact O-CD 3.4Å; T253-P256 VanDerWaalsContact O-CD 3.25Å; T253-P256 WeakPolarHBondContact O-CD 3.42Å; T253-P256 WeakPolarHBondContact O-CG 3.25Å; P256-L259 PolarHBondContact O-N 2.74Å; P256-V260 WeakPolarHBondContact O-CB 3.4Å; P256-V260 WeakPolarHBondContact O-CG2 3.2Å; P256-V260 PolarHBondContact O-N 2.78Å
257I76.4Confident70.6Confident92 Ų9252.9 Ų52.947%0.47229%0.289SS..Hα-helixtrans-62.1-52.3174.2-59.5172.5000109.6I254 Y255 L259 V260 F261I254-I257 WeakPolarHBondContact O-CB 3.43Å; I254-I257 PolarHBondContact O-N 2.78Å; Y255-I257 PolarHBondContact O-N 2.96Å; I257-L259 VanDerWaalsContact C-N 3.29Å; I257-L259 PolarHBondContact O-N 2.9Å; I257-V260 PolarHBondContact O-N 3.08Å; I257-F261 HydrophobicContact CG2-CD2 3.81Å; I257-F261 HydrophobicContact CG2-CE2 3.6Å; I257-F261 WeakPolarHBondContact O-CD2 3.47Å; I257-F261 PolarHBondContact O-N 2.92Å; I257-F261 VanDerWaalsContact O-N 3.07Å
258V74.7Confident71Confident36 Ų3655.8 Ų55.822%0.21830%0.299CS..Hα-helixtrans-60.4-39.2177.5174.90000111.2V211 V212 I254 Y255 F261 A262V211-V258 HydrophobicContact CG1-CG1 4.3Å; V212-V258 HydrophobicContact CG2-CG1 4.01Å; I254-V258 HydrophobicContact CG2-CG2 3.66Å; I254-V258 WeakPolarHBondContact O-CG2 3.32Å; I254-V258 PolarHBondContact O-N 3.1Å; Y255-V258 PolarHBondContact O-N 3.09Å; Y255-V258 VanDerWaalsContact O-N 3.12Å; V258-F261 PolarHBondContact O-N 3.12Å; V258-A262 WeakPolarHBondContact O-CB 3.26Å; V258-A262 PolarHBondContact O-N 3.11Å
259L71.1Confident71.3Confident13 Ų1360.6 Ų60.67%0.06832%0.322CS..Hα-helixtrans-64.8-44.2178.1-167.974000111.7L209 V212 Y255 P256 I257 F261 A262 Q263 L266L209-L259 HydrophobicContact CD2-CD1 4.29Å; V212-L259 HydrophobicContact CG2-CD1 4.32Å; Y255-L259 HydrophobicContact CD1-CB 4.44Å; Y255-L259 HydrophobicContact CE1-CB 4.23Å; Y255-L259 HydrophobicContact CE1-CD2 4.06Å; Y255-L259 PolarHBondContact O-N 2.94Å; P256-L259 PolarHBondContact O-N 2.74Å; I257-L259 VanDerWaalsContact C-N 3.29Å; I257-L259 PolarHBondContact O-N 2.9Å; L259-F261 VanDerWaalsContact C-N 3.27Å; L259-F261 PolarHBondContact O-N 2.77Å; L259-A262 PolarHBondContact O-N 3.29Å; L259-Q263 HydrophobicContact CD1-CG 4.15Å; L259-Q263 HydrophobicContact CG-CG 4.44Å; L259-Q263 WeakPolarHBondContact O-CB 3.12Å; L259-Q263 PolarHBondContact O-N 3.27Å; L259-L266 HydrophobicContact CB-CD2 4.42Å; L259-L266 HydrophobicContact CD2-CD2 3.85Å; L259-L266 HydrophobicContact CG-CD2 3.96Å
260V72.3Confident71.6Confident34 Ų3461.4 Ų61.421%0.20632%0.319CS..Hα-helixtrans-59.6-39.1175.2170.70000111.1P256 I257 L266 V270P256-V260 WeakPolarHBondContact O-CB 3.4Å; P256-V260 WeakPolarHBondContact O-CG2 3.2Å; P256-V260 PolarHBondContact O-N 2.78Å; I257-V260 PolarHBondContact O-N 3.08Å; V260-L266 HydrophobicContact CB-CD2 4.44Å; V260-L266 HydrophobicContact CG2-CD2 3.69Å; V260-L266 HydrophobicContact CG2-CG 4Å; V260-V270 HydrophobicContact CG1-CG2 4.27Å; V260-V270 HydrophobicContact CG2-CG2 4.06Å
261F73.6Confident72Confident158 Ų15862.6 Ų62.669%0.69332%0.323SS*.Hα-helixtrans-74.8-35.5176.1-75.3-66.1000113.5I257 V258 L259I257-F261 HydrophobicContact CG2-CD2 3.81Å; I257-F261 HydrophobicContact CG2-CE2 3.6Å; I257-F261 WeakPolarHBondContact O-CD2 3.47Å; I257-F261 PolarHBondContact O-N 2.92Å; I257-F261 VanDerWaalsContact O-N 3.07Å; V258-F261 PolarHBondContact O-N 3.12Å; L259-F261 VanDerWaalsContact C-N 3.27Å; L259-F261 PolarHBondContact O-N 2.77Å
262A70.2Confident72.5Confident26 Ų2668.3 Ų68.322%0.21535%0.345CS..Hα-helixtrans-77.6-30.4-17800000113R208 V258 L259R208-A262 HydrophobicContact CB-CB 4.49Å; R208-A262 VanDerWaalsContact CD-O 3.31Å; R208-A262 WeakPolarHBondContact CD-O 3.44Å; V258-A262 WeakPolarHBondContact O-CB 3.26Å; V258-A262 PolarHBondContact O-N 3.11Å; L259-A262 PolarHBondContact O-N 3.29Å
263Q70.1Confident72.9Confident22 Ų2272.5 Ų72.510%0.10337%0.367CS..  trans-106.5106-179.1-67.9-176.4-23.300111.1D29 L259 E265 L266 K267D29-Q263 PolarHBondContact OD2-NE2 3.33Å; L259-Q263 HydrophobicContact CD1-CG 4.15Å; L259-Q263 HydrophobicContact CG-CG 4.44Å; L259-Q263 WeakPolarHBondContact O-CB 3.12Å; L259-Q263 PolarHBondContact O-N 3.27Å; Q263-E265 PolarHBondContact O-N 3.45Å; Q263-L266 HydrophobicContact CB-CB 3.92Å; Q263-L266 PolarHBondContact O-N 3.1Å; Q263-L266 VanDerWaalsContact O-N 3.16Å; Q263-K267 PolarHBondContact O-N 3.43Å
264P69.3Low73.4Confident53 Ų5372.4 Ų72.434%0.34437%0.366SS..Hα-helixtrans-64.6-28.5179.126.7-33.7000112.7K267 Q268P264-K267 PolarHBondContact O-N 3.28Å; P264-Q268 WeakPolarHBondContact O-CG 3.24Å; P264-Q268 PolarHBondContact O-N 3.47Å
265E70.6Confident73.5Confident106 Ų10670.4 Ų70.450%0.49536%0.363SS..Hα-helixtrans-62.3-45.3175-63.2135.6171.900110.5Q263 Q268 H269Q263-E265 PolarHBondContact O-N 3.45Å; E265-Q268 PolarHBondContact O-N 3.29Å; E265-H269 PolarHBondContact O-CD2 3.28Å; E265-H269 PolarHBondContact O-N 3.27Å; E265-H269 VanDerWaalsContact O-N 3.11Å
266L67Low73.7Confident46 Ų4676.4 Ų76.424%0.24139%0.389CS..Hα-helixtrans-67.8-41.4177.3-170.261.4000111.2L259 V260 Q263 Q268 H269 V270L259-L266 HydrophobicContact CB-CD2 4.42Å; L259-L266 HydrophobicContact CD2-CD2 3.85Å; L259-L266 HydrophobicContact CG-CD2 3.96Å; V260-L266 HydrophobicContact CB-CD2 4.44Å; V260-L266 HydrophobicContact CG2-CD2 3.69Å; V260-L266 HydrophobicContact CG2-CG 4Å; Q263-L266 HydrophobicContact CB-CB 3.92Å; Q263-L266 PolarHBondContact O-N 3.1Å; Q263-L266 VanDerWaalsContact O-N 3.16Å; L266-Q268 VanDerWaalsContact C-N 3.33Å; L266-Q268 PolarHBondContact O-N 3.11Å; L266-H269 PolarHBondContact O-N 3.46Å; L266-H269 VanDerWaalsContact O-N 3.12Å; L266-V270 WeakPolarHBondContact O-CG2 3.43Å; L266-V270 PolarHBondContact O-N 3.46Å
267K74.2Confident74Confident95 Ų9580.2 Ų80.241%0.41341%0.405SS..Hα-helixtrans-54.4-47.5173.3-171.4-178174.7-171.30111.9Q263 P264 H269 V270 E271Q263-K267 PolarHBondContact O-N 3.43Å; P264-K267 PolarHBondContact O-N 3.28Å; K267-H269 VanDerWaalsContact C-N 3.33Å; K267-H269 PolarHBondContact O-N 2.94Å; K267-V270 PolarHBondContact O-N 3.33Å; K267-E271 WeakPolarHBondContact CE-OE1 3.33Å; K267-E271 IonicContact NZ-OE1 2.74Å; K267-E271 WeakPolarHBondContact O-CB 3.16Å; K267-E271 WeakPolarHBondContact O-CG 3.19Å; K267-E271 PolarHBondContact O-N 3.25Å
268Q75Confident73.6Confident111 Ų11184.7 Ų84.752%0.51942%0.421SS..Hα-helixtrans-63.2-38177.2-73.3-179.44.900112.5P264 E265 L266 K272P264-Q268 WeakPolarHBondContact O-CG 3.24Å; P264-Q268 PolarHBondContact O-N 3.47Å; E265-Q268 PolarHBondContact O-N 3.29Å; L266-Q268 VanDerWaalsContact C-N 3.33Å; L266-Q268 PolarHBondContact O-N 3.11Å; Q268-K272 WeakPolarHBondContact O-CB 3.49Å; Q268-K272 VanDerWaalsContact O-CG 3.25Å; Q268-K272 WeakPolarHBondContact O-CG 2.98Å; Q268-K272 PolarHBondContact O-N 3.34Å
269H73.3Confident72.7Confident114 Ų11493 Ų9353%0.52845%0.449SS..Hα-helixtrans-66.2-43175-79-63.5000112.2E265 L266 K267 K272 L273E265-H269 PolarHBondContact O-CD2 3.28Å; E265-H269 PolarHBondContact O-N 3.27Å; E265-H269 VanDerWaalsContact O-N 3.11Å; L266-H269 PolarHBondContact O-N 3.46Å; L266-H269 VanDerWaalsContact O-N 3.12Å; K267-H269 VanDerWaalsContact C-N 3.33Å; K267-H269 PolarHBondContact O-N 2.94Å; H269-K272 PolarHBondContact O-N 3.42Å; H269-L273 WeakPolarHBondContact O-CG 3.31Å; H269-L273 PolarHBondContact O-N 3.13Å
270V76Confident71.4Confident52 Ų5297.3 Ų97.332%0.31548%0.476SS..Hα-helixtrans-63.1-46.41751730000110.5V260 L266 K267 K272 L273 V274V260-V270 HydrophobicContact CG1-CG2 4.27Å; V260-V270 HydrophobicContact CG2-CG2 4.06Å; L266-V270 WeakPolarHBondContact O-CG2 3.43Å; L266-V270 PolarHBondContact O-N 3.46Å; K267-V270 PolarHBondContact O-N 3.33Å; V270-K272 VanDerWaalsContact C-N 3.31Å; V270-K272 PolarHBondContact O-N 2.93Å; V270-L273 PolarHBondContact O-N 3.33Å; V270-L273 VanDerWaalsContact O-N 3.1Å; V270-V274 HydrophobicContact CG1-CG2 4.04Å; V270-V274 WeakPolarHBondContact O-CB 2.93Å; V270-V274 VanDerWaalsContact O-CG2 3.28Å; V270-V274 WeakPolarHBondContact O-CG2 3.29Å; V270-V274 PolarHBondContact O-N 3.36Å
271E79.1Confident70.1Confident111 Ų11199.2 Ų99.252%0.51949%0.489SS..Hα-helixtrans-60.6-38.2176.2-75.4175.7173.200112.3K267 G275K267-E271 WeakPolarHBondContact CE-OE1 3.33Å; K267-E271 IonicContact NZ-OE1 2.74Å; K267-E271 WeakPolarHBondContact O-CB 3.16Å; K267-E271 WeakPolarHBondContact O-CG 3.19Å; K267-E271 PolarHBondContact O-N 3.25Å; E271-G275 WeakPolarHBondContact O-CA 3.28Å; E271-G275 PolarHBondContact O-N 2.93Å
272K78.7Confident68.7Low131 Ų13198.8 Ų98.857%0.5750%0.499SS*.Hα-helixtrans-64.8-40.9172.9-76.4172.7-175.7175.10112.1Q268 H269 V270 K276Q268-K272 WeakPolarHBondContact O-CB 3.49Å; Q268-K272 VanDerWaalsContact O-CG 3.25Å; Q268-K272 WeakPolarHBondContact O-CG 2.98Å; Q268-K272 PolarHBondContact O-N 3.34Å; H269-K272 PolarHBondContact O-N 3.42Å; V270-K272 VanDerWaalsContact C-N 3.31Å; V270-K272 PolarHBondContact O-N 2.93Å; K272-K276 WeakPolarHBondContact O-CG 3.07Å; K272-K276 PolarHBondContact O-N 2.93Å
273L77.5Confident67.5Low104 Ų104102 Ų10255%0.54551%0.512SS..Hα-helixtrans-69.4-47.2177.9-73.7167.8000111.6H269 V270 G275 K276 I277H269-L273 WeakPolarHBondContact O-CG 3.31Å; H269-L273 PolarHBondContact O-N 3.13Å; V270-L273 PolarHBondContact O-N 3.33Å; V270-L273 VanDerWaalsContact O-N 3.1Å; L273-G275 VanDerWaalsContact C-N 3.29Å; L273-G275 PolarHBondContact O-N 3.37Å; L273-K276 WeakPolarHBondContact O-CB 3.49Å; L273-K276 PolarHBondContact O-N 3.04Å; L273-K276 VanDerWaalsContact O-N 3.09Å; L273-I277 WeakPolarHBondContact O-CG1 3.05Å; L273-I277 PolarHBondContact O-N 3.39Å
274V80.2Confident66.1Low82 Ų82107.9 Ų107.950%0.49754%0.544SS..Hα-helixtrans-61.2-41174.7173.20000110.4V270 K276 I277 K278V270-V274 HydrophobicContact CG1-CG2 4.04Å; V270-V274 WeakPolarHBondContact O-CB 2.93Å; V270-V274 VanDerWaalsContact O-CG2 3.28Å; V270-V274 WeakPolarHBondContact O-CG2 3.29Å; V270-V274 PolarHBondContact O-N 3.36Å; V274-K276 VanDerWaalsContact C-N 3.33Å; V274-K276 PolarHBondContact O-N 3.15Å; V274-I277 PolarHBondContact O-N 3.33Å; V274-K278 WeakPolarHBondContact O-CB 3.42Å; V274-K278 PolarHBondContact O-N 3.14Å
275G74.5Confident64.9Low27 Ų27109 Ų10928%0.27856%0.558SS.*Hα-helixtrans-62.6-36.6173.400000112.9E271 L273 R279E271-G275 WeakPolarHBondContact O-CA 3.28Å; E271-G275 PolarHBondContact O-N 2.93Å; L273-G275 VanDerWaalsContact C-N 3.29Å; L273-G275 PolarHBondContact O-N 3.37Å; G275-R279 WeakPolarHBondContact O-CB 3.35Å; G275-R279 WeakPolarHBondContact O-CG 3.45Å; G275-R279 PolarHBondContact O-N 2.86Å
276K75.3Confident63.4Low145 Ų145106.9 Ų106.963%0.6356%0.559SS**Hα-helixtrans-67-45.1172-78.8-179.5179.7-172.20111.9K272 L273 V274 K278 R279 T280K272-K276 WeakPolarHBondContact O-CG 3.07Å; K272-K276 PolarHBondContact O-N 2.93Å; L273-K276 WeakPolarHBondContact O-CB 3.49Å; L273-K276 PolarHBondContact O-N 3.04Å; L273-K276 VanDerWaalsContact O-N 3.09Å; V274-K276 VanDerWaalsContact C-N 3.33Å; V274-K276 PolarHBondContact O-N 3.15Å; K276-K278 VanDerWaalsContact C-N 3.34Å; K276-K278 PolarHBondContact O-N 2.85Å; K276-R279 CarbonylContact O-C 3.52Å; K276-R279 WeakPolarHBondContact O-CA 3.28Å; K276-R279 PolarHBondContact O-N 3.05Å; K276-R279 VanDerWaalsContact O-N 3.13Å; K276-T280 PolarHBondContact O-N 3.46Å; K276-T280 PolarHBondContact O-OG1 2.99Å; K276-T280 VanDerWaalsContact O-OG1 3.08Å
277I74.5Confident62.3Low126 Ų126109.5 Ų109.565%0.64657%0.573SS**Hα-helixtrans-60.6-45.2176.8-65.9165.6000110.2L273 V274 R279 T280L273-I277 WeakPolarHBondContact O-CG1 3.05Å; L273-I277 PolarHBondContact O-N 3.39Å; V274-I277 PolarHBondContact O-N 3.33Å; I277-R279 VanDerWaalsContact C-N 3.26Å; I277-R279 PolarHBondContact O-N 3.09Å; I277-T280 WeakPolarHBondContact O-CB 3.24Å; I277-T280 PolarHBondContact O-N 2.8Å; I277-T280 VanDerWaalsContact O-N 3.14Å
278K68.5Low60.7Low186 Ų186108.7 Ų108.781%0.80958%0.579SS**Hα-helixtrans-68.2-26.5177.2-159.9176.1-175-178.10112.7V274 K276V274-K278 WeakPolarHBondContact O-CB 3.42Å; V274-K278 PolarHBondContact O-N 3.14Å; K276-K278 VanDerWaalsContact C-N 3.34Å; K276-K278 PolarHBondContact O-N 2.85Å
279R56Low59Low211 Ų211112.1 Ų112.180%0.79659%0.589SS**THydrogen-bonded Turntrans-86.1-5.3173.3-78-179.2-172.8-176.33113.6G275 K276 I277 P281G275-R279 WeakPolarHBondContact O-CB 3.35Å; G275-R279 WeakPolarHBondContact O-CG 3.45Å; G275-R279 PolarHBondContact O-N 2.86Å; K276-R279 CarbonylContact O-C 3.52Å; K276-R279 WeakPolarHBondContact O-CA 3.28Å; K276-R279 PolarHBondContact O-N 3.05Å; K276-R279 VanDerWaalsContact O-N 3.13Å; I277-R279 VanDerWaalsContact C-N 3.26Å; I277-R279 PolarHBondContact O-N 3.09Å; R279-P281 WeakPolarHBondContact O-CD 3.12Å
280T43.1Very low57.6Low104 Ų104111.1 Ų111.164%0.63859%0.591SS**SBendtrans-80.494.5165-51.40000106.1K276 I277 T282K276-T280 PolarHBondContact O-N 3.46Å; K276-T280 PolarHBondContact O-OG1 2.99Å; K276-T280 VanDerWaalsContact O-OG1 3.08Å; I277-T280 WeakPolarHBondContact O-CB 3.24Å; I277-T280 PolarHBondContact O-N 2.8Å; I277-T280 VanDerWaalsContact O-N 3.14Å; T280-T282 PolarHBondContact O-N 3.26Å
281P44.7Very low56Low74 Ų74112.2 Ų112.248%0.48160%0.598SS.*  trans-74.6130.5178.9-0.423.5000105.8R279 I283R279-P281 WeakPolarHBondContact O-CD 3.12Å; P281-I283 HydrophobicContact CB-CB 4.33Å; P281-I283 HydrophobicContact CB-CG1 4.33Å; P281-I283 PolarHBondContact O-N 2.85Å
282T45Very low54.5Low148 Ų148111.5 Ų111.591%0.90860%0.601SS**SBendtrans-66.641.5162.138.70000111.7T280T280-T282 PolarHBondContact O-N 3.26Å
283I44.7Very low53Low94 Ų94110.2 Ų110.248%0.48260%0.604SS.*  trans-137.250.3-177.4-41.9179.6000109.9P281 A286P281-I283 HydrophobicContact CB-CB 4.33Å; P281-I283 HydrophobicContact CB-CG1 4.33Å; P281-I283 PolarHBondContact O-N 2.85Å; I283-A286 HydrophobicContact CG2-CB 4.13Å
284D41.5Very low51.3Low145 Ų145114.6 Ų114.678%0.77561%0.613SS**SBendtrans-105.71.2159.6-75.7-25.1000112.3
285A43.3Very low49.7Very low77 Ų77117.3 Ų117.364%0.63662%0.622SS**SBendtrans-91.8-23.9172.500000113.9Y289A285-Y289 WeakPolarHBondContact O-CE2 3.43Å
286A39.7Very low48.6Very low62 Ų62119.6 Ų119.651%0.51264%0.638SS.*SBendtrans-93.4-29.3-172.400000114.7I283I283-A286 HydrophobicContact CG2-CB 4.13Å
287N42.9Very low47.4Very low100 Ų100119.7 Ų119.754%0.53564%0.643SS.*THydrogen-bonded Turntrans-91.4-2.1-177.2-72.8-11000114.6Y289 T291N287-Y289 VanDerWaalsContact C-N 3.26Å; N287-Y289 PolarHBondContact O-N 3.36Å; N287-T291 PolarHBondContact O-OG1 3.23Å
288S41.9Very low46.3Very low78 Ų78118.8 Ų118.855%0.54564%0.639SS.*Hα-helixtrans-69.6-25173.7-156.40000112.2T292S288-T292 PolarHBondContact O-OG1 3.44Å; S288-T292 VanDerWaalsContact O-OG1 3.09Å
289Y38.9Very low45.5Very low183 Ų183111.9 Ų111.972%0.71862%0.621SS**Hα-helixtrans-83.8-29-179.5-63.3-79.6000114.1A285 N287 T292A285-Y289 WeakPolarHBondContact O-CE2 3.43Å; N287-Y289 VanDerWaalsContact C-N 3.26Å; N287-Y289 PolarHBondContact O-N 3.36Å; Y289-T292 PolarHBondContact O-OG1 3.15Å
290T42.8Very low45.4Very low94 Ų94108 Ų10858%0.57762%0.616SS**Hα-helixtrans-86.7-24.3-178.924.10000113.4
291T43.5Very low46.2Very low74 Ų74108.6 Ų108.645%0.45462%0.615SS.*Hα-helixtrans-79-35.5-178.3-50.70000112.1N287 R294 M295N287-T291 PolarHBondContact O-OG1 3.23Å; T291-R294 PolarHBondContact O-N 3.47Å; T291-M295 HydrophobicContact CG2-CE 3.97Å; T291-M295 HydrophobicContact CG2-CG 4.48Å; T291-M295 WeakPolarHBondContact O-CG 3.47Å; T291-M295 PolarHBondContact O-N 3.25Å; T291-M295 VanDerWaalsContact O-N 3.15Å
292T47.7Very low47Very low97 Ų97110.2 Ų110.260%0.59562%0.62SS**Hα-helixtrans-66.7-38.4179.835.20000112.7S288 Y289S288-T292 PolarHBondContact O-OG1 3.44Å; S288-T292 VanDerWaalsContact O-OG1 3.09Å; Y289-T292 PolarHBondContact O-OG1 3.15Å
293V47.3Very low47.8Very low104 Ų104106.1 Ų106.163%0.6360%0.601SS**Hα-helixtrans-69.6-34.9177.1-1770000111.8
294R42.3Very low48.8Very low196 Ų196106.1 Ų106.174%0.7460%0.602SS**Hα-helixtrans-76.4-26.6-179.4-150178.6-155.4143.54.9113.5T291T291-R294 PolarHBondContact O-N 3.47Å
295M45.5Very low49.8Very low138 Ų138107.3 Ų107.368%0.6860%0.595SS**Hα-helixtrans-73.6-28.9177.7-73-149-178.200113.2T291 M297T291-M295 HydrophobicContact CG2-CE 3.97Å; T291-M295 HydrophobicContact CG2-CG 4.48Å; T291-M295 WeakPolarHBondContact O-CG 3.47Å; T291-M295 PolarHBondContact O-N 3.25Å; T291-M295 VanDerWaalsContact O-N 3.15Å; M295-M297 VanDerWaalsContact C-N 3.35Å; M295-M297 PolarHBondContact O-N 3.49Å
296A51.3Low50.8Low75 Ų75110.1 Ų110.162%0.6260%0.595SS**Hα-helixtrans-64.5-38.717500000112.1
297M50.2Low51.6Low148 Ų148116.8 Ų116.873%0.72961%0.607SS**Hα-helixtrans-76.3-25.1-178.6-64.4-172.579.600114.1M295M295-M297 VanDerWaalsContact C-N 3.35Å; M295-M297 PolarHBondContact O-N 3.49Å
298N51.1Low52.2Low106 Ų106121 Ų12157%0.56762%0.616SS**Hα-helixtrans-83.7-12.2-179.7-89.50.3000114L302N298-L302 PolarHBondContact O-N 3.42Å
299G52Low52.9Low41 Ų41125.5 Ų125.542%0.42362%0.621SS.*Hα-helixtrans-64.7-39179.400000113L302 A303G299-L302 PolarHBondContact O-N 3.36Å; G299-A303 PolarHBondContact O-N 3.1Å
300D55Low53.6Low131 Ų131120.8 Ų120.870%0.70162%0.615SS**Hα-helixtrans-70.8-34.9-177-70.2-23.2000112.6N304D300-N304 PolarHBondContact O-N 3.48Å
301D60.1Low54.1Low115 Ų115120.9 Ų120.962%0.61562%0.615SS**Hα-helixtrans-70.8-31.9176.6-87.8-20.2000112.6N304 R305D301-N304 PolarHBondContact O-N 3.38Å; D301-R305 PolarHBondContact O-N 3.46Å; D301-R305 VanDerWaalsContact O-N 3.14Å
302L61.5Low54.5Low109 Ų109125.1 Ų125.157%0.57163%0.627SS**Hα-helixtrans-71.4-42.4-178.4-148.381.2000111.6N298 G299 N304 R305 E306N298-L302 PolarHBondContact O-N 3.42Å; G299-L302 PolarHBondContact O-N 3.36Å; L302-N304 VanDerWaalsContact C-N 3.26Å; L302-N304 PolarHBondContact O-N 3.11Å; L302-R305 PolarHBondContact O-N 3.45Å; L302-R305 VanDerWaalsContact O-N 3.11Å; L302-E306 PolarHBondContact O-N 3.14Å; L302-E306 VanDerWaalsContact O-N 3.1Å
303A61.4Low54.8Low62 Ų62127.4 Ų127.451%0.51263%0.629SS.*Hα-helixtrans-60.5-37.617600000111.8G299 R305 R307G299-A303 PolarHBondContact O-N 3.1Å; A303-R305 VanDerWaalsContact C-N 3.34Å; A303-R307 PolarHBondContact O-N 3.35Å
304N65.2Low54.8Low94 Ų94129.4 Ų129.450%0.50363%0.631SS.*Hα-helixtrans-72.7-28.9178.3-136.5-4000112.4D300 D301 L302D300-N304 PolarHBondContact O-N 3.48Å; D301-N304 PolarHBondContact O-N 3.38Å; L302-N304 VanDerWaalsContact C-N 3.26Å; L302-N304 PolarHBondContact O-N 3.11Å
305R63.2Low55.2Low170 Ų170126.1 Ų126.164%0.64263%0.628SS**Hα-helixtrans-75.7-35.5178.2-142.7175.9-169.1-172.95.2112.8D301 L302 A303 R308 R309D301-R305 PolarHBondContact O-N 3.46Å; D301-R305 VanDerWaalsContact O-N 3.14Å; L302-R305 PolarHBondContact O-N 3.45Å; L302-R305 VanDerWaalsContact O-N 3.11Å; A303-R305 VanDerWaalsContact C-N 3.34Å; R305-R308 PolarHBondContact O-N 3.25Å; R305-R309 PolarHBondContact O-N 3.33Å
306E62.8Low55.6Low136 Ų136123.3 Ų123.364%0.63662%0.619SS**Hα-helixtrans-65.7-39.5175.3-76-172.4155.500112L302 R308 R309 S310L302-E306 PolarHBondContact O-N 3.14Å; L302-E306 VanDerWaalsContact O-N 3.1Å; E306-R308 PolarHBondContact O-N 3.36Å; E306-R309 PolarHBondContact O-N 3.22Å; E306-S310 PolarHBondContact O-N 3.06Å
307R56.7Low55.4Low201 Ų201126.5 Ų126.576%0.75862%0.619SS**Hα-helixtrans-60.6-33176.7-159.8177.6-83.4-169.3-3.8112.5A303 T311A303-R307 PolarHBondContact O-N 3.35Å; R307-T311 PolarHBondContact O-OG1 3.28Å
308R55.3Low55.4Low189 Ų189121.5 Ų121.571%0.71361%0.605SS**Hα-helixtrans-77.8-24.6174.5-68.9-171.6-167.4-171.44.7114.6R305 E306 T311R305-R308 PolarHBondContact O-N 3.25Å; E306-R308 PolarHBondContact O-N 3.36Å; R308-T311 PolarHBondContact O-OG1 3.37Å
309R57.8Low55.3Low172 Ų172123.6 Ų123.665%0.64961%0.609SS**Hα-helixtrans-75-36.8178.5-78.5-171.2-162.9179.26.5112.3R305 E306 T311 K312 F313R305-R309 PolarHBondContact O-N 3.33Å; E306-R309 PolarHBondContact O-N 3.22Å; R309-T311 VanDerWaalsContact C-N 3.26Å; R309-T311 PolarHBondContact O-N 3.21Å; R309-K312 PolarHBondContact O-N 3.32Å; R309-F313 PolarHBondContact O-N 3.17Å
310S54.1Low55.2Low85 Ų85127.3 Ų127.359%0.59462%0.618SS**Hα-helixtrans-60.4-37.4179.8-1640000112E306 F313E306-S310 PolarHBondContact O-N 3.06Å; S310-F313 PolarHBondContact O-N 3.31Å
311T53.1Low55.1Low95 Ų95127.2 Ų127.258%0.58362%0.617SS**Hα-helixtrans-69.3-37177.52.90000113.3R307 R308 R309R307-T311 PolarHBondContact O-OG1 3.28Å; R308-T311 PolarHBondContact O-OG1 3.37Å; R309-T311 VanDerWaalsContact C-N 3.26Å; R309-T311 PolarHBondContact O-N 3.21Å
312K50.9Low54.5Low164 Ų164127.5 Ų127.571%0.71362%0.619SS**Hα-helixtrans-71.5-31.5177.3-85.7-173.4176.7-177.40113.1R309 L315 T316R309-K312 PolarHBondContact O-N 3.32Å; K312-L315 PolarHBondContact O-N 2.8Å; K312-T316 PolarHBondContact O-N 3.48Å; K312-T316 PolarHBondContact O-OG1 3.5Å
313F53.2Low54.3Low145 Ų145128.5 Ų128.564%0.63662%0.624SS**Hα-helixtrans-68.4-36.7-177.7-157.7-101.5000112.3R309 S310 T316 K317R309-F313 PolarHBondContact O-N 3.17Å; S310-F313 PolarHBondContact O-N 3.31Å; F313-T316 PolarHBondContact O-N 3.33Å; F313-K317 PolarHBondContact O-N 3.42Å
314Q48.7Very low53.8Low145 Ų145128.7 Ų128.768%0.67863%0.625SS**Hα-helixtrans-63.6-41.3175.5-72.6-70.7-11.100112.5T316 K317Q314-T316 VanDerWaalsContact C-N 3.28Å; Q314-T316 PolarHBondContact O-N 3.35Å; Q314-K317 PolarHBondContact O-N 3.37Å
315L50.9Low53.3Low128 Ų128128 Ų12867%0.6763%0.625SS**Hα-helixtrans-66.8-28.6178.1-111.3123.5000113.5K312K312-L315 PolarHBondContact O-N 2.8Å
316T52.7Low52.9Low78 Ų78127.4 Ų127.448%0.47963%0.627SS.*Hα-helixtrans-79.7-33.8-176.9-41.40000111.6K312 F313 Q314 G318 K319 L320K312-T316 PolarHBondContact O-N 3.48Å; K312-T316 PolarHBondContact O-OG1 3.5Å; F313-T316 PolarHBondContact O-N 3.33Å; Q314-T316 VanDerWaalsContact C-N 3.28Å; Q314-T316 PolarHBondContact O-N 3.35Å; T316-G318 PolarHBondContact O-N 3.32Å; T316-K319 PolarHBondContact O-N 3.26Å; T316-L320 PolarHBondContact O-N 3.3Å
317K48.5Very low52.2Low143 Ų143130.4 Ų130.462%0.62263%0.632SS**Hα-helixtrans-64.2-38.3177.2-125.4179-178.6-1770112.3F313 Q314 L320 L321F313-K317 PolarHBondContact O-N 3.42Å; Q314-K317 PolarHBondContact O-N 3.37Å; K317-L320 PolarHBondContact O-N 3.47Å; K317-L321 PolarHBondContact O-N 3.47Å
318G48.6Very low52.2Low42 Ų42123.2 Ų123.243%0.43362%0.616SS.*Hα-helixtrans-65.4-37.1176.800000114T316T316-G318 PolarHBondContact O-N 3.32Å
319K49Very low51.9Low150 Ų150119.1 Ų119.165%0.65261%0.608SS**Hα-helixtrans-72.7-35.2178.2-77.6-173.5177.5-177.50113.3T316 N322 L323T316-K319 PolarHBondContact O-N 3.26Å; K319-N322 PolarHBondContact O-N 3.33Å; K319-L323 PolarHBondContact O-N 3.49Å
320L51.2Low51.6Low120 Ų120116.3 Ų116.363%0.62861%0.606SS**Hα-helixtrans-67.7-36.1178-91.3156.9000112.5T316 K317 L323 A324T316-L320 PolarHBondContact O-N 3.3Å; K317-L320 PolarHBondContact O-N 3.47Å; L320-L323 PolarHBondContact O-N 3.26Å; L320-A324 PolarHBondContact O-N 3.43Å
321L52Low51.5Low129 Ų129118.1 Ų118.168%0.67561%0.608SS**Hα-helixtrans-64-41.9176.9-139.189.9000111.6K317 L323 A324 T325K317-L321 PolarHBondContact O-N 3.47Å; L321-L323 PolarHBondContact O-N 3.23Å; L321-A324 PolarHBondContact O-N 3.39Å; L321-T325 PolarHBondContact O-N 3.21Å; L321-T325 PolarHBondContact O-OG1 3.37Å
322N47.9Very low51.5Low121 Ų121119 Ų11965%0.64761%0.609SS**Hα-helixtrans-68.2-30.8179.1-78.7-19.8000113.6K319 K326K319-N322 PolarHBondContact O-N 3.33Å; N322-K326 PolarHBondContact O-N 3.45Å
323L56.2Low51.7Low130 Ų130114.7 Ų114.768%0.68160%0.6SS**Hα-helixtrans-73.2-34.7176.6-109.7113.8000112.7K319 L320 L321 K326 R327K319-L323 PolarHBondContact O-N 3.49Å; L320-L323 PolarHBondContact O-N 3.26Å; L321-L323 PolarHBondContact O-N 3.23Å; L323-K326 PolarHBondContact O-N 3.5Å; L323-R327 PolarHBondContact O-N 3.36Å
324A51.3Low51.4Low65 Ų65115.8 Ų115.854%0.53760%0.6SS.*Hα-helixtrans-65.4-42.8177.100000111.5L320 L321 K326 R327 A328L320-A324 PolarHBondContact O-N 3.43Å; L321-A324 PolarHBondContact O-N 3.39Å; A324-K326 PolarHBondContact O-N 3.28Å; A324-R327 PolarHBondContact O-N 3.45Å; A324-A328 PolarHBondContact O-N 3.03Å
325T55Low51.3Low81 Ų81119.1 Ų119.150%0.49761%0.607SS.*Hα-helixtrans-65.5-37.9178.9-38.50000112.1L321 R327 A328 N329L321-T325 PolarHBondContact O-N 3.21Å; L321-T325 PolarHBondContact O-OG1 3.37Å; T325-R327 VanDerWaalsContact C-N 3.33Å; T325-R327 PolarHBondContact O-N 3.34Å; T325-A328 PolarHBondContact O-N 3.35Å; T325-N329 PolarHBondContact O-N 3.47Å
326K54.7Low51.4Low157 Ų157122.5 Ų122.568%0.68361%0.611SS**Hα-helixtrans-68.4-32178-155.1173.5-173178.50112.5N322 L323 A324N322-K326 PolarHBondContact O-N 3.45Å; L323-K326 PolarHBondContact O-N 3.5Å; A324-K326 PolarHBondContact O-N 3.28Å
327R49Very low51.4Low198 Ų198125.1 Ų125.175%0.74762%0.622SS**Hα-helixtrans-75.6-32.8179.4-148175.5-169.8175.62.3112.7L323 A324 T325 L331L323-R327 PolarHBondContact O-N 3.36Å; A324-R327 PolarHBondContact O-N 3.45Å; T325-R327 VanDerWaalsContact C-N 3.33Å; T325-R327 PolarHBondContact O-N 3.34Å; R327-L331 PolarHBondContact O-N 3.31Å
328A55Low51.6Low50 Ų50125.7 Ų125.741%0.41362%0.624SS.*Hα-helixtrans-67.6-40.3175.900000112.5A324 T325 N330 L331 L332A324-A328 PolarHBondContact O-N 3.03Å; T325-A328 PolarHBondContact O-N 3.35Å; A328-N330 PolarHBondContact O-N 3.4Å; A328-L331 PolarHBondContact O-N 3.48Å; A328-L332 PolarHBondContact O-N 3.46Å
329N50Low51.7Low103 Ų103126.2 Ų126.255%0.55163%0.63SS**Hα-helixtrans-68.6-33.3-179.7-72.3-8.8000113T325 S333T325-N329 PolarHBondContact O-N 3.47Å; N329-S333 PolarHBondContact O-N 3.32Å
330N51.5Low51.6Low114 Ų114126.3 Ų126.361%0.6164%0.638SS**Hα-helixtrans-70.1-33.7176.3-75.4-7.2000112.8A328 S333 Y334A328-N330 PolarHBondContact O-N 3.4Å; N330-S333 PolarHBondContact O-N 3.48Å; N330-Y334 PolarHBondContact O-N 3.44Å
331L51.4Low51.2Low123 Ų123126 Ų12664%0.64465%0.645SS**Hα-helixtrans-71.2-33.6178.3-85.5159.9000112.7R327 A328 S333 Y334 R335R327-L331 PolarHBondContact O-N 3.31Å; A328-L331 PolarHBondContact O-N 3.48Å; L331-S333 VanDerWaalsContact C-N 3.35Å; L331-Y334 PolarHBondContact O-N 3.36Å; L331-R335 PolarHBondContact O-N 3.27Å
332L54.2Low50.9Low113 Ų113130.6 Ų130.659%0.59267%0.669SS**Hα-helixtrans-70.8-30.4175.4-78.3164.9000112.8A328A328-L332 PolarHBondContact O-N 3.46Å
333S53.6Low51Low74 Ų74131.1 Ų131.152%0.51767%0.67SS.*Hα-helixtrans-71.2-38.5174.6-172.80000112N329 N330 L331 R335 R336N329-S333 PolarHBondContact O-N 3.32Å; N330-S333 PolarHBondContact O-N 3.48Å; L331-S333 VanDerWaalsContact C-N 3.35Å; S333-R335 PolarHBondContact O-N 3.44Å; S333-R336 PolarHBondContact O-N 3.3Å
334Y46.9Very low50.7Low167 Ų167131.2 Ų131.266%0.65567%0.669SS**Hα-helixtrans-67.4-34.3179.2-154.4-97.1000113N330 L331 R336 F338N330-Y334 PolarHBondContact O-N 3.44Å; L331-Y334 PolarHBondContact O-N 3.36Å; Y334-R336 VanDerWaalsContact C-N 3.3Å; Y334-R336 PolarHBondContact O-N 3.44Å; Y334-F338 HydrophobicContact CE1-CD2 4.36Å; Y334-F338 HydrophobicContact CE1-CE2 4.26Å
335R48Very low50.7Low215 Ų215134.8 Ų134.881%0.81168%0.676SS**Hα-helixtrans-71.8-22.9178.2-154.5178.5-170.8-1682.1113.3L331 S333L331-R335 PolarHBondContact O-N 3.27Å; S333-R335 PolarHBondContact O-N 3.44Å
336R51.9Low50.5Low200 Ų200138 Ų13876%0.75569%0.687SS**Hα-helixtrans-82.4-24.2-177.9-153.4179.5-78.5167.2-6.2113S333 Y334S333-R336 PolarHBondContact O-N 3.3Å; Y334-R336 VanDerWaalsContact C-N 3.3Å; Y334-R336 PolarHBondContact O-N 3.44Å
337N52.5Low50.2Low132 Ų132136.8 Ų136.871%0.70669%0.687SS**Hα-helixtrans-84.6-19.1-178.8-76.8-10.3000114.8
338F52.8Low50.3Low155 Ų155132.7 Ų132.768%0.6868%0.683SS**SBendtrans-92.1-7.5177.7-96.3-83.4000114.2Y334Y334-F338 HydrophobicContact CE1-CD2 4.36Å; Y334-F338 HydrophobicContact CE1-CE2 4.26Å
339G52.4Low49.9Very low53 Ų53138.6 Ų138.655%0.54670%0.702SS.*THydrogen-bonded Turntrans-85.4-8.3-178.200000115.9
340N46.7Very low49.9Very low153 Ų153141.4 Ų141.482%0.81871%0.714SS**THydrogen-bonded Turntrans-117.228.8-175-80.510.5000113.5
341S41.5Very low49.8Very low113 Ų113143.7 Ų143.779%0.7972%0.723SS**  trans-12826172.9-140.50000113.6
342I45.8Very low49.7Very low226 Ų226145.5 Ų145.5100%1.15973%0.73SS**  trans-128.80157.4-52.3176.5000105.1

Retrieved 342 of 342 residues in 279.5 ms (Link to these results)

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