A0A077ZKZ6_TRITR Loading...

Uncharacterized protein

AlphaFold DB , UniProt , Accession A0A077ZKZ6, Species TRITR (Trichuris trichiura, Whipworm), Gene n/a, Length 127 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
1M38.2Very low47.4Very low246 Ų246105.5 Ų105.5100%1.21252%0.517SS*.  096.80-79.9171.716900106.4N3M1-N3 PolarHBondContact O-N 3.03Å
2H37.2Very low48.3Very low173 Ų173101.3 Ų101.380%0.80150%0.498SS*.  trans-66.6122.4177.3-122.2-111.3000107.6I4H2-I4 PolarHBondContact O-N 2.69Å
3N42.7Very low49.4Very low68 Ų6895.1 Ų95.136%0.36447%0.467SS..  trans-81.385-170.5-163.612.2000108.5M1 R5 E6M1-N3 PolarHBondContact O-N 3.03Å; N3-R5 PolarHBondContact O-N 3.44Å; N3-R5 WeakPolarHBondContact OD1-CB 3.47Å; N3-R5 WeakPolarHBondContact OD1-CD 3.29Å; N3-R5 WeakPolarHBondContact OD1-CG 3.41Å; N3-E6 HydrophobicContact CB-CG 4.33Å; N3-E6 VanDerWaalsContact CB-OE2 3.29Å; N3-E6 WeakPolarHBondContact CB-OE2 3.31Å; N3-E6 WeakPolarHBondContact ND2-CG 3.28Å; N3-E6 PolarHBondContact ND2-OE2 3.26Å; N3-E6 PolarHBondContact O-N 3.32Å
4I40.9Very low50.2Low126 Ų12690.2 Ų90.265%0.64645%0.447SS*.Hα-helixtrans-50.6-23.3175.3-61.4166.1000111.2H2 L8H2-I4 PolarHBondContact O-N 2.69Å; I4-L8 HydrophobicContact CG2-CD1 3.92Å; I4-L8 PolarHBondContact O-N 2.99Å
5R47.6Very low50.8Low111 Ų11193.5 Ų93.542%0.41946%0.461SS..Hα-helixtrans-63-36.6174.8-55177.9175.7-119.811.2113.4N3 L9 G82N3-R5 PolarHBondContact O-N 3.44Å; N3-R5 WeakPolarHBondContact OD1-CB 3.47Å; N3-R5 WeakPolarHBondContact OD1-CD 3.29Å; N3-R5 WeakPolarHBondContact OD1-CG 3.41Å; R5-L9 HydrophobicContact CB-CD1 4.4Å; R5-L9 WeakPolarHBondContact O-CB 3.5Å; R5-L9 WeakPolarHBondContact O-CD1 3.46Å; R5-L9 WeakPolarHBondContact O-CG 3.24Å; R5-L9 PolarHBondContact O-N 3.48Å; R5-L9 VanDerWaalsContact O-N 3.11Å; R5-G82 PolarHBondContact NH1-O 3.04Å; R5-G82 VanDerWaalsContact NH2-C 3.32Å; R5-G82 PolarHBondContact NH2-O 2.76Å
6E46.4Very low51.3Low61 Ų6189.5 Ų89.529%0.28544%0.443SS..Hα-helixtrans-76.1-42.9-178.8-74.9174134.700110.9N3 L8 L10 Y38N3-E6 HydrophobicContact CB-CG 4.33Å; N3-E6 VanDerWaalsContact CB-OE2 3.29Å; N3-E6 WeakPolarHBondContact CB-OE2 3.31Å; N3-E6 WeakPolarHBondContact ND2-CG 3.28Å; N3-E6 PolarHBondContact ND2-OE2 3.26Å; N3-E6 PolarHBondContact O-N 3.32Å; E6-L8 PolarHBondContact O-N 2.97Å; E6-L10 HydrophobicContact CB-CD1 4.28Å; E6-L10 VanDerWaalsContact O-CB 3.31Å; E6-L10 WeakPolarHBondContact O-CB 3.43Å; E6-L10 VanDerWaalsContact O-CD1 3.29Å; E6-L10 WeakPolarHBondContact O-CD1 3.43Å; E6-L10 WeakPolarHBondContact O-CG 3.22Å; E6-L10 PolarHBondContact O-N 3.35Å; E6-Y38 WeakPolarHBondContact OE1-CD1 3.43Å
7E44.2Very low51.8Low141 Ų14185.6 Ų85.666%0.65943%0.425SS*.Hα-helixtrans-62.5-29.7-179-64.1-78.3115.900113.2P11E7-P11 WeakPolarHBondContact O-CD 3.27Å; E7-P11 WeakPolarHBondContact O-CG 3.26Å
8L53Low52.1Low94 Ų9486.1 Ų86.149%0.49243%0.425SS..Hα-helixtrans-95.7-40.3-179.9-74.2164.3000113.3I4 E6 P11 I12I4-L8 HydrophobicContact CG2-CD1 3.92Å; I4-L8 PolarHBondContact O-N 2.99Å; E6-L8 PolarHBondContact O-N 2.97Å; L8-P11 WeakPolarHBondContact O-CD 3.33Å; L8-P11 WeakPolarHBondContact O-CG 3.41Å; L8-I12 WeakPolarHBondContact O-CD1 3.4Å; L8-I12 WeakPolarHBondContact O-CG1 3.27Å
9L55Low52.3Low49 Ų4985.9 Ų85.926%0.25743%0.431SS..Hα-helixtrans-73.1-30.5-176.3-70.3170.8000112.4R5 M13R5-L9 HydrophobicContact CB-CD1 4.4Å; R5-L9 WeakPolarHBondContact O-CB 3.5Å; R5-L9 WeakPolarHBondContact O-CD1 3.46Å; R5-L9 WeakPolarHBondContact O-CG 3.24Å; R5-L9 PolarHBondContact O-N 3.48Å; R5-L9 VanDerWaalsContact O-N 3.11Å; L9-M13 HydrophobicContact CB-CE 4.09Å; L9-M13 VanDerWaalsContact O-CB 3.27Å; L9-M13 WeakPolarHBondContact O-CB 3.31Å; L9-M13 WeakPolarHBondContact O-CE 3.16Å; L9-M13 VanDerWaalsContact O-CG 3.23Å; L9-M13 WeakPolarHBondContact O-CG 3.17Å; L9-M13 PolarHBondContact O-N 3.46Å
10L58.4Low52.4Low29 Ų2985 Ų8515%0.15242%0.424CS..Hα-helixtrans-67-50.4-179.3-65.2175.1000114.5E6 I12 M13 S14 L32 Y38E6-L10 HydrophobicContact CB-CD1 4.28Å; E6-L10 VanDerWaalsContact O-CB 3.31Å; E6-L10 WeakPolarHBondContact O-CB 3.43Å; E6-L10 VanDerWaalsContact O-CD1 3.29Å; E6-L10 WeakPolarHBondContact O-CD1 3.43Å; E6-L10 WeakPolarHBondContact O-CG 3.22Å; E6-L10 PolarHBondContact O-N 3.35Å; L10-I12 VanDerWaalsContact C-N 3.28Å; L10-I12 PolarHBondContact O-N 3.24Å; L10-M13 HydrophobicContact CD2-CE 3.94Å; L10-M13 PolarHBondContact O-N 3.05Å; L10-S14 WeakPolarHBondContact O-CB 3.47Å; L10-S14 PolarHBondContact O-N 2.87Å; L10-L32 HydrophobicContact CD2-CD1 4.01Å; L10-Y38 HydrophobicContact CD1-CE1 3.57Å; L10-Y38 HydrophobicContact CD2-CE1 3.54Å; L10-Y38 VanDerWaalsContact CD2-CZ 3.42Å; L10-Y38 WeakPolarHBondContact CD2-OH 3.1Å; L10-Y38 HydrophobicContact CG-CE1 4.11Å
11P57.5Low52.5Low62 Ų6283.5 Ų83.540%0.40342%0.417SS..Hα-helixtrans-62.1-39.2175.421.5-31000111E7 L8 S14 E15E7-P11 WeakPolarHBondContact O-CD 3.27Å; E7-P11 WeakPolarHBondContact O-CG 3.26Å; L8-P11 WeakPolarHBondContact O-CD 3.33Å; L8-P11 WeakPolarHBondContact O-CG 3.41Å; P11-S14 PolarHBondContact O-N 3.02Å; P11-E15 WeakPolarHBondContact O-CB 3.33Å; P11-E15 WeakPolarHBondContact O-CG 3.41Å; P11-E15 PolarHBondContact O-N 3.41Å
12I58.8Low53.5Low55 Ų5580.5 Ų80.528%0.28240%0.4SS..Hα-helixtrans-65.7-48.7179.3-61.7168.2000111.6L8 L10 S14 E15 V16 V71L8-I12 WeakPolarHBondContact O-CD1 3.4Å; L8-I12 WeakPolarHBondContact O-CG1 3.27Å; L10-I12 VanDerWaalsContact C-N 3.28Å; L10-I12 PolarHBondContact O-N 3.24Å; I12-S14 VanDerWaalsContact C-N 3.3Å; I12-S14 PolarHBondContact O-N 2.85Å; I12-E15 PolarHBondContact O-N 3.28Å; I12-V16 HydrophobicContact CG2-CG2 4.32Å; I12-V16 VanDerWaalsContact O-CB 3.31Å; I12-V16 WeakPolarHBondContact O-CB 3.42Å; I12-V16 VanDerWaalsContact O-CG2 3.23Å; I12-V16 WeakPolarHBondContact O-CG2 3.15Å; I12-V16 PolarHBondContact O-N 2.87Å; I12-V71 HydrophobicContact CG2-CB 4.21Å; I12-V71 HydrophobicContact CG2-CG1 3.5Å; I12-V71 HydrophobicContact CG2-CG2 3.57Å
13M62.4Low54.5Low21 Ų2174.8 Ų74.810%0.10338%0.375CS..Hα-helixtrans-63.9-37.8176.8-73.8-172.2-6200111.3L9 L10 L17 L32 F37 W51L9-M13 HydrophobicContact CB-CE 4.09Å; L9-M13 VanDerWaalsContact O-CB 3.27Å; L9-M13 WeakPolarHBondContact O-CB 3.31Å; L9-M13 WeakPolarHBondContact O-CE 3.16Å; L9-M13 VanDerWaalsContact O-CG 3.23Å; L9-M13 WeakPolarHBondContact O-CG 3.17Å; L9-M13 PolarHBondContact O-N 3.46Å; L10-M13 HydrophobicContact CD2-CE 3.94Å; L10-M13 PolarHBondContact O-N 3.05Å; M13-L17 HydrophobicContact CB-CD1 4.17Å; M13-L17 WeakPolarHBondContact O-CB 3.45Å; M13-L17 WeakPolarHBondContact O-CD1 3.21Å; M13-L17 VanDerWaalsContact O-CG 3.31Å; M13-L17 WeakPolarHBondContact O-CG 3.42Å; M13-L17 PolarHBondContact O-N 2.77Å; M13-L32 HydrophobicContact CE-CD1 3.49Å; M13-L32 VanDerWaalsContact CE-CD1 3.49Å; M13-L32 HydrophobicContact CE-CD2 3.89Å; M13-L32 HydrophobicContact CE-CG 4.37Å; M13-L32 HydrophobicContact SD-CD1 4.2Å; M13-L32 HydrophobicContact SD-CD2 3.92Å; M13-F37 HydrophobicContact CE-CD1 4.33Å; M13-F37 HydrophobicContact CE-CE1 4.16Å; M13-F37 HydrophobicContact SD-CE1 4.03Å; M13-W51 HydrophobicContact SD-CZ3 4.37Å
14S60.8Low55.1Low27 Ų2773.6 Ų73.619%0.18937%0.372CS..Hα-helixtrans-62.2-51.4174.9-175.50000111.1L10 P11 I12 V16 L17 H18L10-S14 WeakPolarHBondContact O-CB 3.47Å; L10-S14 PolarHBondContact O-N 2.87Å; P11-S14 PolarHBondContact O-N 3.02Å; I12-S14 VanDerWaalsContact C-N 3.3Å; I12-S14 PolarHBondContact O-N 2.85Å; S14-V16 VanDerWaalsContact C-N 3.31Å; S14-V16 PolarHBondContact O-N 3.45Å; S14-L17 PolarHBondContact O-N 2.94Å; S14-H18 WeakPolarHBondContact O-CA 3.48Å; S14-H18 WeakPolarHBondContact O-CB 3.46Å; S14-H18 PolarHBondContact O-N 3.44Å
15E58.7Low55.9Low139 Ų13970.3 Ų70.365%0.6536%0.359SS*.Hα-helixtrans-65.7-33-179.9-72.9-172.8162.100113.3P11 I12 P19P11-E15 WeakPolarHBondContact O-CB 3.33Å; P11-E15 WeakPolarHBondContact O-CG 3.41Å; P11-E15 PolarHBondContact O-N 3.41Å; I12-E15 PolarHBondContact O-N 3.28Å; E15-P19 WeakPolarHBondContact O-CD 3.19Å; E15-P19 WeakPolarHBondContact O-CG 3.42Å
16V58.8Low56.3Low30 Ų3069.9 Ų69.918%0.18237%0.368CS..Hα-helixtrans-80.9-35.2179174.50000112.3I12 S14 F20 K67 V71I12-V16 HydrophobicContact CG2-CG2 4.32Å; I12-V16 VanDerWaalsContact O-CB 3.31Å; I12-V16 WeakPolarHBondContact O-CB 3.42Å; I12-V16 VanDerWaalsContact O-CG2 3.23Å; I12-V16 WeakPolarHBondContact O-CG2 3.15Å; I12-V16 PolarHBondContact O-N 2.87Å; S14-V16 VanDerWaalsContact C-N 3.31Å; S14-V16 PolarHBondContact O-N 3.45Å; V16-F20 WeakPolarHBondContact O-CD2 3.37Å; V16-F20 WeakPolarHBondContact O-CE2 3.19Å; V16-K67 HydrophobicContact CG1-CB 4.25Å; V16-K67 HydrophobicContact CG1-CD 4.41Å; V16-V71 HydrophobicContact CG2-CG2 4.27Å
17L59.9Low56.8Low24 Ų2472 Ų7213%0.12638%0.378CS..Hα-helixtrans-91.9-31.5-177.3-67.7161.1000112.9M13 S14 F20 L21 I28 W51M13-L17 HydrophobicContact CB-CD1 4.17Å; M13-L17 WeakPolarHBondContact O-CB 3.45Å; M13-L17 WeakPolarHBondContact O-CD1 3.21Å; M13-L17 VanDerWaalsContact O-CG 3.31Å; M13-L17 WeakPolarHBondContact O-CG 3.42Å; M13-L17 PolarHBondContact O-N 2.77Å; S14-L17 PolarHBondContact O-N 2.94Å; L17-F20 PolarHBondContact O-N 2.75Å; L17-L21 HydrophobicContact CB-CD1 4.21Å; L17-L21 HydrophobicContact CD2-CD1 3.81Å; L17-L21 HydrophobicContact CD2-CG 4.49Å; L17-L21 PolarHBondContact O-N 3.04Å; L17-I28 HydrophobicContact CB-CD1 3.75Å; L17-I28 HydrophobicContact CB-CG1 4.24Å; L17-I28 HydrophobicContact CD1-CG2 4.1Å; L17-W51 HydrophobicContact CD1-CH2 4.47Å
18H57.5Low57.6Low94 Ų9465.6 Ų65.644%0.43535%0.349SS..Hα-helixtrans-53.6-49.6-178.7178.5-109.7000113.6S14 F20 H22 I23 I28S14-H18 WeakPolarHBondContact O-CA 3.48Å; S14-H18 WeakPolarHBondContact O-CB 3.46Å; S14-H18 PolarHBondContact O-N 3.44Å; H18-F20 VanDerWaalsContact C-N 3.27Å; H18-F20 PolarHBondContact O-N 2.77Å; H18-H22 PolarHBondContact O-N 3.22Å; H18-I23 PolarHBondContact CD2-O 3.11Å; H18-I28 HydrophobicContact CB-CD1 4.19Å
19P56.5Low57.6Low82 Ų8264.7 Ų64.753%0.53234%0.342SS..Hα-helixtrans-74.2-15.117926.2-30.2000113.9E15E15-P19 WeakPolarHBondContact O-CD 3.19Å; E15-P19 WeakPolarHBondContact O-CG 3.42Å
20F53.3Low57.5Low67 Ų6765 Ų6529%0.29435%0.348SS..Hα-helixtrans-94.7-34.7-177-77.2-94.2000113.5V16 L17 H18 A63 I64 K67V16-F20 WeakPolarHBondContact O-CD2 3.37Å; V16-F20 WeakPolarHBondContact O-CE2 3.19Å; L17-F20 PolarHBondContact O-N 2.75Å; H18-F20 VanDerWaalsContact C-N 3.27Å; H18-F20 PolarHBondContact O-N 2.77Å; F20-A63 HydrophobicContact CE1-CB 4.45Å; F20-I64 HydrophobicContact CB-CD1 3.97Å; F20-I64 HydrophobicContact CD1-CD1 3.67Å; F20-I64 HydrophobicContact CD1-CG1 3.55Å; F20-I64 HydrophobicContact CE1-CD1 4.39Å; F20-I64 HydrophobicContact CE1-CG1 3.78Å; F20-I64 HydrophobicContact CG-CD1 3.97Å; F20-I64 HydrophobicContact CG-CG1 4Å; F20-I64 HydrophobicContact CZ-CG1 4.38Å; F20-K67 HydrophobicContact CE2-CD 3.86Å; F20-K67 HydrophobicContact CZ-CD 3.72Å
21L54.4Low57.4Low54 Ų5465.8 Ų65.828%0.28336%0.359SS..Hα-helixtrans-100.9-8.8-172-60.8179.8000113.2L17 I23 C58L17-L21 HydrophobicContact CB-CD1 4.21Å; L17-L21 HydrophobicContact CD2-CD1 3.81Å; L17-L21 HydrophobicContact CD2-CG 4.49Å; L17-L21 PolarHBondContact O-N 3.04Å; L21-I23 HydrophobicContact CB-CB 3.75Å; L21-I23 HydrophobicContact CB-CD1 3.49Å; L21-I23 VanDerWaalsContact CB-CD1 3.49Å; L21-I23 HydrophobicContact CB-CG1 3.48Å; L21-I23 VanDerWaalsContact CB-CG1 3.48Å; L21-I23 HydrophobicContact CD1-CD1 3.76Å; L21-I23 HydrophobicContact CG-CD1 4.17Å; L21-I23 WeakPolarHBondContact O-CG1 3.23Å; L21-I23 PolarHBondContact O-N 2.98Å; L21-C58 VanDerWaalsContact CD2-SG 3.53Å
22H58.7Low57.4Low184 Ų18463.5 Ų63.585%0.85234%0.343SS*.  trans52.124.3-166.1-83-118.8000111.6H18H18-H22 PolarHBondContact O-N 3.22Å
23I58.8Low57.1Low52 Ų5264.8 Ų64.827%0.26735%0.353SS..  trans-97.8129.5-178.1-70.8180000106.8H18 L21 E27 I28H18-I23 PolarHBondContact CD2-O 3.11Å; L21-I23 HydrophobicContact CB-CB 3.75Å; L21-I23 HydrophobicContact CB-CD1 3.49Å; L21-I23 VanDerWaalsContact CB-CD1 3.49Å; L21-I23 HydrophobicContact CB-CG1 3.48Å; L21-I23 VanDerWaalsContact CB-CG1 3.48Å; L21-I23 HydrophobicContact CD1-CD1 3.76Å; L21-I23 HydrophobicContact CG-CD1 4.17Å; L21-I23 WeakPolarHBondContact O-CG1 3.23Å; L21-I23 PolarHBondContact O-N 2.98Å; I23-E27 HydrophobicContact CB-CB 4.49Å; I23-E27 HydrophobicContact CG2-CB 3.15Å; I23-E27 HydrophobicContact CG2-CG 4.27Å; I23-I28 HydrophobicContact CB-CG1 4.37Å; I23-I28 HydrophobicContact CG2-CG1 3.79Å
24S56.5Low56.7Low43 Ų4370.6 Ų70.630%0.30138%0.384SS..  trans-61.7152.7177.962.40000111.2T26 E27 I28S24-T26 PolarHBondContact O-N 3.4Å; S24-E27 PolarHBondContact N-OE2 3.04Å; S24-E27 VanDerWaalsContact N-OE2 3.11Å; S24-E27 PolarHBondContact O-N 3.49Å; S24-E27 WeakPolarHBondContact OG-CG 3.23Å; S24-E27 PolarHBondContact OG-N 3.21Å; S24-E27 PolarHBondContact OG-OE2 2.8Å; S24-I28 PolarHBondContact O-N 2.97Å
25P57.5Low56.2Low57 Ų5773 Ų7337%0.3739%0.389SS..Hα-helixtrans-51.9-34.1174.2-27.636.8000112.6I28 Q29P25-I28 PolarHBondContact O-N 2.89Å; P25-Q29 WeakPolarHBondContact O-CB 3.01Å; P25-Q29 WeakPolarHBondContact O-CG 3.03Å; P25-Q29 PolarHBondContact O-N 3.34Å
26T56Low55.7Low102 Ų10267.3 Ų67.363%0.62637%0.367SS*.Hα-helixtrans-64.3-38.4175.5-49.60000113.1S24 S30S24-T26 PolarHBondContact O-N 3.4Å; T26-S30 VanDerWaalsContact O-CB 3.31Å; T26-S30 WeakPolarHBondContact O-CB 3.31Å; T26-S30 PolarHBondContact O-N 2.89Å; T26-S30 PolarHBondContact O-OG 3.32Å
27E56.7Low55.3Low105 Ų10568.7 Ų68.749%0.49137%0.37SS..Hα-helixtrans-77.1-31.1176.5-76.1177.5124.800111.9I23 S24 S30 A31I23-E27 HydrophobicContact CB-CB 4.49Å; I23-E27 HydrophobicContact CG2-CB 3.15Å; I23-E27 HydrophobicContact CG2-CG 4.27Å; S24-E27 PolarHBondContact N-OE2 3.04Å; S24-E27 VanDerWaalsContact N-OE2 3.11Å; S24-E27 PolarHBondContact O-N 3.49Å; S24-E27 WeakPolarHBondContact OG-CG 3.23Å; S24-E27 PolarHBondContact OG-N 3.21Å; S24-E27 PolarHBondContact OG-OE2 2.8Å; E27-S30 PolarHBondContact O-N 2.86Å; E27-A31 WeakPolarHBondContact O-CB 3.19Å; E27-A31 PolarHBondContact O-N 2.91Å
28I59.6Low54.5Low8 Ų869.9 Ų69.94%0.04137%0.374CS..Hα-helixtrans-63.6-48169.8-65.7164.3000109.6L17 H18 I23 S24 P25 S30 A31 L32L17-I28 HydrophobicContact CB-CD1 3.75Å; L17-I28 HydrophobicContact CB-CG1 4.24Å; L17-I28 HydrophobicContact CD1-CG2 4.1Å; H18-I28 HydrophobicContact CB-CD1 4.19Å; I23-I28 HydrophobicContact CB-CG1 4.37Å; I23-I28 HydrophobicContact CG2-CG1 3.79Å; S24-I28 PolarHBondContact O-N 2.97Å; P25-I28 PolarHBondContact O-N 2.89Å; I28-S30 VanDerWaalsContact C-N 3.33Å; I28-S30 PolarHBondContact O-N 2.83Å; I28-A31 PolarHBondContact O-N 3.43Å; I28-L32 HydrophobicContact CG2-CD1 3.76Å; I28-L32 HydrophobicContact CG2-CG 4.42Å; I28-L32 VanDerWaalsContact O-CB 3.31Å; I28-L32 WeakPolarHBondContact O-CB 3.29Å; I28-L32 WeakPolarHBondContact O-CD1 3.08Å; I28-L32 WeakPolarHBondContact O-CG 3.31Å; I28-L32 PolarHBondContact O-N 2.81Å
29Q54.1Low53.7Low75 Ų7569.4 Ų69.435%0.3538%0.377SS..Hα-helixtrans-57.5-47.3173.5-71.2-89.1-24.300110.7P25 A31 L32 V33 Y38P25-Q29 WeakPolarHBondContact O-CB 3.01Å; P25-Q29 WeakPolarHBondContact O-CG 3.03Å; P25-Q29 PolarHBondContact O-N 3.34Å; Q29-A31 PolarHBondContact O-N 2.79Å; Q29-L32 CarbonylContact O-C 3.6Å; Q29-L32 PolarHBondContact O-N 3.24Å; Q29-V33 WeakPolarHBondContact O-CB 3.34Å; Q29-V33 VanDerWaalsContact O-CG2 3.24Å; Q29-V33 WeakPolarHBondContact O-CG2 3.39Å; Q29-V33 PolarHBondContact O-N 3.45Å; Q29-Y38 WeakPolarHBondContact CA-OH 3.17Å; Q29-Y38 PolarHBondContact NE2-OH 3.21Å; Q29-Y38 PolarHBondContact OE1-OH 3.02Å
30S52.7Low52.9Low54 Ų5470.6 Ų70.638%0.37838%0.383SS..Hα-helixtrans-63.2-42.9178.2-630000111.8T26 E27 I28 L32 V33 I34T26-S30 VanDerWaalsContact O-CB 3.31Å; T26-S30 WeakPolarHBondContact O-CB 3.31Å; T26-S30 PolarHBondContact O-N 2.89Å; T26-S30 PolarHBondContact O-OG 3.32Å; E27-S30 PolarHBondContact O-N 2.86Å; I28-S30 VanDerWaalsContact C-N 3.33Å; I28-S30 PolarHBondContact O-N 2.83Å; S30-L32 VanDerWaalsContact C-N 3.34Å; S30-L32 PolarHBondContact O-N 3.08Å; S30-V33 PolarHBondContact O-N 3.28Å; S30-I34 WeakPolarHBondContact O-CB 3.2Å; S30-I34 WeakPolarHBondContact O-CD1 3.43Å; S30-I34 WeakPolarHBondContact O-CG1 3.35Å; S30-I34 PolarHBondContact O-N 2.88Å
31A56.2Low52.4Low47 Ų4779.6 Ų79.639%0.38842%0.415SS..Hα-helixtrans-62.9-42.6177.200000111.2E27 I28 Q29 R35E27-A31 WeakPolarHBondContact O-CB 3.19Å; E27-A31 PolarHBondContact O-N 2.91Å; I28-A31 PolarHBondContact O-N 3.43Å; Q29-A31 PolarHBondContact O-N 2.79Å; A31-R35 VanDerWaalsContact O-CB 3.27Å; A31-R35 WeakPolarHBondContact O-CB 3.29Å; A31-R35 PolarHBondContact O-N 3.33Å
32L57.3Low51.7Low14 Ų1480.4 Ų80.47%0.07343%0.43CS..Hα-helixtrans-66.9-38.6174.9-71.3167000111.2L10 M13 I28 Q29 S30 G36 F37 Y38L10-L32 HydrophobicContact CD2-CD1 4.01Å; M13-L32 HydrophobicContact CE-CD1 3.49Å; M13-L32 VanDerWaalsContact CE-CD1 3.49Å; M13-L32 HydrophobicContact CE-CD2 3.89Å; M13-L32 HydrophobicContact CE-CG 4.37Å; M13-L32 HydrophobicContact SD-CD1 4.2Å; M13-L32 HydrophobicContact SD-CD2 3.92Å; I28-L32 HydrophobicContact CG2-CD1 3.76Å; I28-L32 HydrophobicContact CG2-CG 4.42Å; I28-L32 VanDerWaalsContact O-CB 3.31Å; I28-L32 WeakPolarHBondContact O-CB 3.29Å; I28-L32 WeakPolarHBondContact O-CD1 3.08Å; I28-L32 WeakPolarHBondContact O-CG 3.31Å; I28-L32 PolarHBondContact O-N 2.81Å; Q29-L32 CarbonylContact O-C 3.6Å; Q29-L32 PolarHBondContact O-N 3.24Å; S30-L32 VanDerWaalsContact C-N 3.34Å; S30-L32 PolarHBondContact O-N 3.08Å; L32-G36 PolarHBondContact O-N 2.97Å; L32-F37 HydrophobicContact CB-CB 3.96Å; L32-F37 HydrophobicContact CD2-CB 3.78Å; L32-F37 HydrophobicContact CD2-CD1 3.55Å; L32-F37 HydrophobicContact CD2-CD2 3.99Å; L32-F37 HydrophobicContact CD2-CE1 4.04Å; L32-F37 HydrophobicContact CD2-CE2 4.44Å; L32-F37 HydrophobicContact CD2-CG 3.51Å; L32-F37 HydrophobicContact CD2-CZ 4.45Å; L32-F37 WeakPolarHBondContact O-CA 3.3Å; L32-F37 WeakPolarHBondContact O-CB 3.44Å; L32-F37 PolarHBondContact O-N 2.91Å; L32-Y38 VanDerWaalsContact C-CD2 3.47Å; L32-Y38 VanDerWaalsContact C-CE2 3.44Å; L32-Y38 HydrophobicContact CB-CD2 4.01Å; L32-Y38 HydrophobicContact CB-CE2 3.21Å; L32-Y38 HydrophobicContact CD1-CE2 4.49Å; L32-Y38 HydrophobicContact CG-CE2 4.47Å
33V53.3Low50.8Low81 Ų8172.8 Ų72.849%0.49140%0.399SS..Hα-helixtrans-68.3-48175.9171.40000110.7Q29 S30 G36 Y38Q29-V33 WeakPolarHBondContact O-CB 3.34Å; Q29-V33 VanDerWaalsContact O-CG2 3.24Å; Q29-V33 WeakPolarHBondContact O-CG2 3.39Å; Q29-V33 PolarHBondContact O-N 3.45Å; S30-V33 PolarHBondContact O-N 3.28Å; V33-G36 PolarHBondContact O-N 2.9Å; V33-Y38 HydrophobicContact CB-CD2 4.05Å; V33-Y38 HydrophobicContact CB-CE2 4.19Å; V33-Y38 HydrophobicContact CG2-CD2 3.38Å; V33-Y38 HydrophobicContact CG2-CE2 3.37Å; V33-Y38 HydrophobicContact CG2-CG 4.06Å; V33-Y38 VanDerWaalsContact N-CE2 3.32Å
34I53Low50.3Low144 Ų14474.8 Ų74.874%0.73842%0.418SS*.Hα-helixtrans-63-42.4-180-69.9165.7000110.7S30 G36S30-I34 WeakPolarHBondContact O-CB 3.2Å; S30-I34 WeakPolarHBondContact O-CD1 3.43Å; S30-I34 WeakPolarHBondContact O-CG1 3.35Å; S30-I34 PolarHBondContact O-N 2.88Å; I34-G36 PolarHBondContact O-N 3.05Å
35R51.8Low49.9Very low78 Ų7875.2 Ų75.229%0.29443%0.428SS..THydrogen-bonded Turntrans-75.74.5174.7-88.3-173.8154122.7-3.3113.7A31 F37 L50 A54A31-R35 VanDerWaalsContact O-CB 3.27Å; A31-R35 WeakPolarHBondContact O-CB 3.29Å; A31-R35 PolarHBondContact O-N 3.33Å; R35-F37 VanDerWaalsContact C-N 3.3Å; R35-F37 PolarHBondContact O-N 3.39Å; R35-L50 HydrophobicContact CB-CD2 4.35Å; R35-L50 HydrophobicContact CG-CD2 4.08Å; R35-L50 PolarHBondContact NE-O 3.04Å; R35-L50 VanDerWaalsContact O-CD1 3.31Å; R35-L50 WeakPolarHBondContact O-CD1 3.31Å; R35-A54 VanDerWaalsContact CZ-CA 3.48Å; R35-A54 VanDerWaalsContact CZ-CB 3.46Å; R35-A54 VanDerWaalsContact NH2-N 3.11Å
36G46.3Very low49.6Very low19 Ų1975.9 Ų75.920%0.19643%0.434CS..THydrogen-bonded Turntrans70.425176.700000113.9L32 V33 I34 Y38 T39L32-G36 PolarHBondContact O-N 2.97Å; V33-G36 PolarHBondContact O-N 2.9Å; I34-G36 PolarHBondContact O-N 3.05Å; G36-Y38 VanDerWaalsContact C-N 3.3Å; G36-Y38 PolarHBondContact O-N 3.42Å; G36-T39 WeakPolarHBondContact CA-OG1 3.47Å; G36-T39 PolarHBondContact O-N 3.37Å; G36-T39 PolarHBondContact O-OG1 2.88Å
37F50.9Low49.2Very low58 Ų5874.1 Ų74.125%0.25442%0.416SS..SBendtrans-70.9-25.7179.2-136.6-97.1000112.5M13 L32 R35 W47 W51M13-F37 HydrophobicContact CE-CD1 4.33Å; M13-F37 HydrophobicContact CE-CE1 4.16Å; M13-F37 HydrophobicContact SD-CE1 4.03Å; L32-F37 HydrophobicContact CB-CB 3.96Å; L32-F37 HydrophobicContact CD2-CB 3.78Å; L32-F37 HydrophobicContact CD2-CD1 3.55Å; L32-F37 HydrophobicContact CD2-CD2 3.99Å; L32-F37 HydrophobicContact CD2-CE1 4.04Å; L32-F37 HydrophobicContact CD2-CE2 4.44Å; L32-F37 HydrophobicContact CD2-CG 3.51Å; L32-F37 HydrophobicContact CD2-CZ 4.45Å; L32-F37 WeakPolarHBondContact O-CA 3.3Å; L32-F37 WeakPolarHBondContact O-CB 3.44Å; L32-F37 PolarHBondContact O-N 2.91Å; R35-F37 VanDerWaalsContact C-N 3.3Å; R35-F37 PolarHBondContact O-N 3.39Å; F37-W47 HydrophobicContact CE2-CB 4.03Å; F37-W47 HydrophobicContact CZ-CB 4.36Å; F37-W51 HydrophobicContact CE2-CE3 4.37Å; F37-W51 HydrophobicContact CZ-CE3 4.34Å
38Y44.4Very low49.1Very low50 Ų5074.2 Ų74.220%0.19641%0.414CS..SBendtrans-91.6-11.7175.6-62.7-99.2000113.5E6 L10 Q29 L32 V33 G36E6-Y38 WeakPolarHBondContact OE1-CD1 3.43Å; L10-Y38 HydrophobicContact CD1-CE1 3.57Å; L10-Y38 HydrophobicContact CD2-CE1 3.54Å; L10-Y38 VanDerWaalsContact CD2-CZ 3.42Å; L10-Y38 WeakPolarHBondContact CD2-OH 3.1Å; L10-Y38 HydrophobicContact CG-CE1 4.11Å; Q29-Y38 WeakPolarHBondContact CA-OH 3.17Å; Q29-Y38 PolarHBondContact NE2-OH 3.21Å; Q29-Y38 PolarHBondContact OE1-OH 3.02Å; L32-Y38 VanDerWaalsContact C-CD2 3.47Å; L32-Y38 VanDerWaalsContact C-CE2 3.44Å; L32-Y38 HydrophobicContact CB-CD2 4.01Å; L32-Y38 HydrophobicContact CB-CE2 3.21Å; L32-Y38 HydrophobicContact CD1-CE2 4.49Å; L32-Y38 HydrophobicContact CG-CE2 4.47Å; V33-Y38 HydrophobicContact CB-CD2 4.05Å; V33-Y38 HydrophobicContact CB-CE2 4.19Å; V33-Y38 HydrophobicContact CG2-CD2 3.38Å; V33-Y38 HydrophobicContact CG2-CE2 3.37Å; V33-Y38 HydrophobicContact CG2-CG 4.06Å; V33-Y38 VanDerWaalsContact N-CE2 3.32Å; G36-Y38 VanDerWaalsContact C-N 3.3Å; G36-Y38 PolarHBondContact O-N 3.42Å
39T40Very low49Very low83 Ų8383.3 Ų83.351%0.50945%0.448SS..SBendtrans-108.6107.4-172.951.10000109.3G36G36-T39 WeakPolarHBondContact CA-OG1 3.47Å; G36-T39 PolarHBondContact O-N 3.37Å; G36-T39 PolarHBondContact O-OG1 2.88Å
40T39Very low48.9Very low107 Ų10782 Ų8266%0.65644%0.443SS*.  trans87.1128.6162.172.40000118A42 A43T40-A42 PolarHBondContact O-N 2.78Å; T40-A43 WeakPolarHBondContact O-CB 3.37Å; T40-A43 PolarHBondContact O-N 3.26Å
41R43.9Very low49.1Very low256 Ų25682 Ų8297%0.96644%0.435SS*.THydrogen-bonded Turntrans-42.3-4.5161.8-167.9176.8-180-144.41115.8
42A38.7Very low49.1Very low72 Ų7280.9 Ų80.960%0.59543%0.428SS*.THydrogen-bonded Turntrans-97-9.6176.700000113.7T40 S44T40-A42 PolarHBondContact O-N 2.78Å; A42-S44 PolarHBondContact O-N 3.04Å
43A41.2Very low49Very low23 Ų2384.8 Ų84.819%0.1945%0.449CS..Hα-helixtrans-72.8-9.6-179.600000114T40 G45 C46 W47T40-A43 WeakPolarHBondContact O-CB 3.37Å; T40-A43 PolarHBondContact O-N 3.26Å; A43-G45 PolarHBondContact O-N 3.16Å; A43-C46 PolarHBondContact O-N 2.95Å; A43-C46 VanDerWaalsContact O-N 3.11Å; A43-W47 WeakPolarHBondContact O-CB 3.46Å; A43-W47 VanDerWaalsContact O-CD1 3.29Å; A43-W47 PolarHBondContact O-N 3.23Å
44S47.6Very low48.9Very low95 Ų9582.1 Ų82.166%0.66444%0.435SS*.Hα-helixtrans-64.9-9.1177.464.70000114.3A42 W47A42-S44 PolarHBondContact O-N 3.04Å; S44-W47 PolarHBondContact O-NE1 3.13Å
45G47.1Very low48.8Very low51 Ų5177.1 Ų77.153%0.52641%0.409SS..Hα-helixtrans-99.2-39.1167.100000113.9A43A43-G45 PolarHBondContact O-N 3.16Å
46C52Low48.8Very low71 Ų7178.3 Ų78.348%0.4843%0.429SS..Hα-helixtrans-82.2-23.5-175.6-74.70000114A43 K48 R49 L50A43-C46 PolarHBondContact O-N 2.95Å; A43-C46 VanDerWaalsContact O-N 3.11Å; C46-K48 PolarHBondContact O-N 3.21Å; C46-R49 PolarHBondContact O-N 3.03Å; C46-L50 HydrophobicContact CB-CD1 4.12Å; C46-L50 WeakPolarHBondContact O-CG 3.27Å; C46-L50 PolarHBondContact O-N 2.64Å
47W48.4Very low49.2Very low66 Ų6684.8 Ų84.825%0.2546%0.455CS..Hα-helixtrans-55.1-37.4177.474.1-54.8000111.7F37 A43 S44 R49 L50 W51 T86F37-W47 HydrophobicContact CE2-CB 4.03Å; F37-W47 HydrophobicContact CZ-CB 4.36Å; A43-W47 WeakPolarHBondContact O-CB 3.46Å; A43-W47 VanDerWaalsContact O-CD1 3.29Å; A43-W47 PolarHBondContact O-N 3.23Å; S44-W47 PolarHBondContact O-NE1 3.13Å; W47-R49 VanDerWaalsContact C-N 3.31Å; W47-R49 PolarHBondContact O-N 2.77Å; W47-L50 PolarHBondContact O-N 3.25Å; W47-W51 WeakPolarHBondContact O-CA 2.94Å; W47-W51 WeakPolarHBondContact O-CB 3.44Å; W47-W51 PolarHBondContact O-N 2.97Å; W47-T86 HydrophobicContact CH2-CG2 4.02Å; W47-T86 HydrophobicContact CZ2-CG2 3.95Å
48K54.2Low49.2Very low106 Ų10683.7 Ų83.746%0.46145%0.454SS..Hα-helixtrans-60-40.6177.1-63.7-172.4-168.9-173.30112.7C46 G52 V89C46-K48 PolarHBondContact O-N 3.21Å; K48-G52 PolarHBondContact O-N 3.35Å; K48-V89 HydrophobicContact CD-CG2 3.67Å; K48-V89 HydrophobicContact CG-CG2 4.37Å
49R56Low49.4Very low200 Ų20090.6 Ų90.676%0.75549%0.488SS*.Hα-helixtrans-75.3-46.4178.3-68.6-174178.5-155.3-1.3111.3C46 W47 W51 G52 D53C46-R49 PolarHBondContact O-N 3.03Å; W47-R49 VanDerWaalsContact C-N 3.31Å; W47-R49 PolarHBondContact O-N 2.77Å; R49-W51 VanDerWaalsContact C-N 3.31Å; R49-W51 PolarHBondContact O-N 3.28Å; R49-G52 PolarHBondContact O-N 3.49Å; R49-D53 WeakPolarHBondContact O-CB 3.47Å; R49-D53 VanDerWaalsContact O-CG 3.31Å; R49-D53 PolarHBondContact O-N 2.71Å
50L53.5Low50Low48 Ų4893.1 Ų93.125%0.25150%0.498SS..Hα-helixtrans-63.9-38.8178.9-72.3165.4000112R35 C46 W47 A54R35-L50 HydrophobicContact CB-CD2 4.35Å; R35-L50 HydrophobicContact CG-CD2 4.08Å; R35-L50 PolarHBondContact NE-O 3.04Å; R35-L50 VanDerWaalsContact O-CD1 3.31Å; R35-L50 WeakPolarHBondContact O-CD1 3.31Å; C46-L50 HydrophobicContact CB-CD1 4.12Å; C46-L50 WeakPolarHBondContact O-CG 3.27Å; C46-L50 PolarHBondContact O-N 2.64Å; W47-L50 PolarHBondContact O-N 3.25Å; L50-A54 WeakPolarHBondContact O-CB 3.44Å; L50-A54 PolarHBondContact O-N 3.12Å
51W56.2Low50.4Low54 Ų5489.3 Ų89.321%0.20547%0.474CS..Hα-helixtrans-68.4-46.5173.5-166.5-101.5000110.2M13 L17 F37 W47 R49 D53 A54 I55 V68M13-W51 HydrophobicContact SD-CZ3 4.37Å; L17-W51 HydrophobicContact CD1-CH2 4.47Å; F37-W51 HydrophobicContact CE2-CE3 4.37Å; F37-W51 HydrophobicContact CZ-CE3 4.34Å; W47-W51 WeakPolarHBondContact O-CA 2.94Å; W47-W51 WeakPolarHBondContact O-CB 3.44Å; W47-W51 PolarHBondContact O-N 2.97Å; R49-W51 VanDerWaalsContact C-N 3.31Å; R49-W51 PolarHBondContact O-N 3.28Å; W51-D53 VanDerWaalsContact C-N 3.35Å; W51-D53 PolarHBondContact O-N 2.92Å; W51-A54 PolarHBondContact O-N 3.15Å; W51-I55 HydrophobicContact CD2-CD1 4.45Å; W51-I55 HydrophobicContact CG-CD1 4.27Å; W51-I55 HydrophobicContact CG-CG1 4.47Å; W51-I55 HydrophobicContact CZ2-CD1 4.25Å; W51-I55 WeakPolarHBondContact O-CB 3.22Å; W51-I55 VanDerWaalsContact O-CG1 3.24Å; W51-I55 WeakPolarHBondContact O-CG1 3.47Å; W51-I55 PolarHBondContact O-N 3.34Å; W51-V68 HydrophobicContact CH2-CG2 4.41Å; W51-V68 HydrophobicContact CZ2-CB 4.31Å; W51-V68 HydrophobicContact CZ2-CG1 3.83Å; W51-V68 HydrophobicContact CZ2-CG2 3.48Å; W51-V68 VanDerWaalsContact CZ2-CG2 3.48Å
52G55.6Low50.5Low22 Ų2278.7 Ų78.723%0.22744%0.444CS..Hα-helixtrans-57.7-42.3174.300000113.5K48 R49 S56K48-G52 PolarHBondContact O-N 3.35Å; R49-G52 PolarHBondContact O-N 3.49Å; G52-S56 WeakPolarHBondContact O-CB 3.16Å; G52-S56 PolarHBondContact O-N 2.84Å
53D56Low51.1Low97 Ų9777.5 Ų77.552%0.51943%0.434SS..Hα-helixtrans-71.3-39.8176-69.2-15.5000111.6R49 W51 I55 S56 E57R49-D53 WeakPolarHBondContact O-CB 3.47Å; R49-D53 VanDerWaalsContact O-CG 3.31Å; R49-D53 PolarHBondContact O-N 2.71Å; W51-D53 VanDerWaalsContact C-N 3.35Å; W51-D53 PolarHBondContact O-N 2.92Å; D53-I55 VanDerWaalsContact C-N 3.29Å; D53-I55 PolarHBondContact O-N 3.39Å; D53-S56 PolarHBondContact O-N 3.44Å; D53-E57 PolarHBondContact O-N 2.88Å
54A51.2Low51.6Low24 Ų2476.7 Ų76.720%0.19843%0.427CS..Hα-helixtrans-64-39.9175.900000111.8R35 L50 W51R35-A54 VanDerWaalsContact CZ-CA 3.48Å; R35-A54 VanDerWaalsContact CZ-CB 3.46Å; R35-A54 VanDerWaalsContact NH2-N 3.11Å; L50-A54 WeakPolarHBondContact O-CB 3.44Å; L50-A54 PolarHBondContact O-N 3.12Å; W51-A54 PolarHBondContact O-N 3.15Å
55I50.5Low51.7Low39 Ų3972.5 Ų72.520%0.240%0.398CS..Hα-helixtrans-66.4-57173.8-77.2-163.4000107.4W51 D53 E57 C58 L61W51-I55 HydrophobicContact CD2-CD1 4.45Å; W51-I55 HydrophobicContact CG-CD1 4.27Å; W51-I55 HydrophobicContact CG-CG1 4.47Å; W51-I55 HydrophobicContact CZ2-CD1 4.25Å; W51-I55 WeakPolarHBondContact O-CB 3.22Å; W51-I55 VanDerWaalsContact O-CG1 3.24Å; W51-I55 WeakPolarHBondContact O-CG1 3.47Å; W51-I55 PolarHBondContact O-N 3.34Å; D53-I55 VanDerWaalsContact C-N 3.29Å; D53-I55 PolarHBondContact O-N 3.39Å; I55-E57 PolarHBondContact O-N 2.97Å; I55-C58 WeakPolarHBondContact O-CB 2.97Å; I55-C58 PolarHBondContact O-N 3.4Å; I55-L61 VanDerWaalsContact CA-CD1 3.48Å; I55-L61 HydrophobicContact CB-CD1 3.69Å; I55-L61 HydrophobicContact CB-CD2 4.04Å; I55-L61 HydrophobicContact CD1-CD2 4.12Å; I55-L61 HydrophobicContact CG1-CD1 4.36Å; I55-L61 HydrophobicContact CG1-CD2 3.74Å; I55-L61 HydrophobicContact CG2-CB 4.43Å; I55-L61 HydrophobicContact CG2-CD1 3.1Å; I55-L61 HydrophobicContact CG2-CD2 3.91Å; I55-L61 HydrophobicContact CG2-CG 4.03Å; I55-L61 WeakPolarHBondContact O-CD1 3.46Å
56S52.3Low52Low103 Ų10371.9 Ų71.972%0.7238%0.382SS*.Hα-helixtrans-50.5-22.8-175.4-170.10000116.5G52 D53G52-S56 WeakPolarHBondContact O-CB 3.16Å; G52-S56 PolarHBondContact O-N 2.84Å; D53-S56 PolarHBondContact O-N 3.44Å
57E54.4Low52.2Low155 Ų15571.1 Ų71.172%0.72437%0.37SS*.THydrogen-bonded Turntrans-82.1-13.1174.3-69.8173.8178.700114.9D53 I55D53-E57 PolarHBondContact O-N 2.88Å; I55-E57 PolarHBondContact O-N 2.97Å
58C50.2Low52.6Low35 Ų3569 Ų6924%0.23637%0.365CS..  trans-94.7103.4-178.5-71.30000111.5L21 I55 N60 L61L21-C58 VanDerWaalsContact CD2-SG 3.53Å; I55-C58 WeakPolarHBondContact O-CB 2.97Å; I55-C58 PolarHBondContact O-N 3.4Å; C58-N60 PolarHBondContact O-N 3.11Å; C58-L61 HydrophobicContact CB-CD1 3.67Å; C58-L61 HydrophobicContact CB-CD2 3.74Å; C58-L61 HydrophobicContact CB-CG 3.41Å; C58-L61 VanDerWaalsContact CB-CG 3.41Å; C58-L61 WeakPolarHBondContact O-CD1 3.44Å; C58-L61 WeakPolarHBondContact O-CG 2.89Å
59E49.6Very low52.6Low196 Ų19667.2 Ų67.292%0.91636%0.359SS*.THydrogen-bonded Turntrans-59.8-9.5-179.6-76.3179.3137.800115.5
60N51.6Low52.7Low135 Ų13560.1 Ų60.172%0.72234%0.336SS*.THydrogen-bonded Turntrans-117.630.4-172.7-77.6-36.5000115.5C58C58-N60 PolarHBondContact O-N 3.11Å
61L48.9Very low52.9Low27 Ų2759.4 Ų59.414%0.14133%0.333CS..  trans-85.3-14.9-166.9-80.4164000119.6I55 C58 A63 I64 G65I55-L61 VanDerWaalsContact CA-CD1 3.48Å; I55-L61 HydrophobicContact CB-CD1 3.69Å; I55-L61 HydrophobicContact CB-CD2 4.04Å; I55-L61 HydrophobicContact CD1-CD2 4.12Å; I55-L61 HydrophobicContact CG1-CD1 4.36Å; I55-L61 HydrophobicContact CG1-CD2 3.74Å; I55-L61 HydrophobicContact CG2-CB 4.43Å; I55-L61 HydrophobicContact CG2-CD1 3.1Å; I55-L61 HydrophobicContact CG2-CD2 3.91Å; I55-L61 HydrophobicContact CG2-CG 4.03Å; I55-L61 WeakPolarHBondContact O-CD1 3.46Å; C58-L61 HydrophobicContact CB-CD1 3.67Å; C58-L61 HydrophobicContact CB-CD2 3.74Å; C58-L61 HydrophobicContact CB-CG 3.41Å; C58-L61 VanDerWaalsContact CB-CG 3.41Å; C58-L61 WeakPolarHBondContact O-CD1 3.44Å; C58-L61 WeakPolarHBondContact O-CG 2.89Å; L61-A63 PolarHBondContact O-N 3.2Å; L61-A63 VanDerWaalsContact O-N 3.1Å; L61-I64 HydrophobicContact CD2-CB 3.79Å; L61-I64 HydrophobicContact CD2-CD1 3.77Å; L61-I64 HydrophobicContact CD2-CG1 4.33Å; L61-I64 HydrophobicContact CD2-CG2 3.89Å; L61-I64 HydrophobicContact CG-CD1 4.45Å; L61-I64 WeakPolarHBondContact O-CA 3.5Å; L61-I64 PolarHBondContact O-N 2.87Å; L61-G65 PolarHBondContact O-N 3.34Å
62G46Very low52.8Low34 Ų3458.5 Ų58.535%0.35133%0.334SS..Hα-helixtrans-51.8-39.3179.600000111C98G62-C98 PolarHBondContact O-SG 3.43Å
63A50Low53Low47 Ų4761.3 Ų61.339%0.38834%0.344SS..Hα-helixtrans-75.7-20.1176.700000114.7F20 L61F20-A63 HydrophobicContact CE1-CB 4.45Å; L61-A63 PolarHBondContact O-N 3.2Å; L61-A63 VanDerWaalsContact O-N 3.1Å
64I52.3Low53Low6 Ų658 Ų583%0.03133%0.329CS..Hα-helixtrans-87.4-37.4-178-65168.4000110F20 L61 E66 K67 V68F20-I64 HydrophobicContact CB-CD1 3.97Å; F20-I64 HydrophobicContact CD1-CD1 3.67Å; F20-I64 HydrophobicContact CD1-CG1 3.55Å; F20-I64 HydrophobicContact CE1-CD1 4.39Å; F20-I64 HydrophobicContact CE1-CG1 3.78Å; F20-I64 HydrophobicContact CG-CD1 3.97Å; F20-I64 HydrophobicContact CG-CG1 4Å; F20-I64 HydrophobicContact CZ-CG1 4.38Å; L61-I64 HydrophobicContact CD2-CB 3.79Å; L61-I64 HydrophobicContact CD2-CD1 3.77Å; L61-I64 HydrophobicContact CD2-CG1 4.33Å; L61-I64 HydrophobicContact CD2-CG2 3.89Å; L61-I64 HydrophobicContact CG-CD1 4.45Å; L61-I64 WeakPolarHBondContact O-CA 3.5Å; L61-I64 PolarHBondContact O-N 2.87Å; I64-E66 VanDerWaalsContact C-N 3.31Å; I64-E66 PolarHBondContact O-N 3.02Å; I64-K67 PolarHBondContact O-N 3.1Å; I64-K67 VanDerWaalsContact O-N 3.15Å; I64-V68 HydrophobicContact CG2-CG2 3.93Å; I64-V68 WeakPolarHBondContact O-CG2 3.16Å; I64-V68 PolarHBondContact O-N 2.84Å
65G49.7Very low53.1Low6 Ų657.3 Ų57.36%0.06232%0.324CS..Hα-helixtrans-61.9-36.1-179.700000113.6L61 M69L61-G65 PolarHBondContact O-N 3.34Å; G65-M69 WeakPolarHBondContact O-CB 3.33Å; G65-M69 PolarHBondContact O-N 2.86Å
66E54.3Low53.2Low39 Ų3959.2 Ų59.218%0.18233%0.331CS..Hα-helixtrans-63.3-48172.1-171-175.1150.200111.3I64 V68 M69 D70 P101 F102I64-E66 VanDerWaalsContact C-N 3.31Å; I64-E66 PolarHBondContact O-N 3.02Å; E66-V68 VanDerWaalsContact C-N 3.31Å; E66-V68 PolarHBondContact O-N 3.38Å; E66-M69 WeakPolarHBondContact O-CB 3.45Å; E66-M69 PolarHBondContact O-N 2.92Å; E66-M69 VanDerWaalsContact O-N 3.12Å; E66-D70 PolarHBondContact O-N 2.91Å; E66-P101 WeakPolarHBondContact OE1-CA 3.41Å; E66-F102 PolarHBondContact OE1-N 3.38Å
67K54.4Low53.4Low54 Ų5461.5 Ų61.524%0.23533%0.33CS..Hα-helixtrans-61.9-37.7178.5-70.8-172.9172.1-163.70113.2V16 F20 I64 M69 D70 V71V16-K67 HydrophobicContact CG1-CB 4.25Å; V16-K67 HydrophobicContact CG1-CD 4.41Å; F20-K67 HydrophobicContact CE2-CD 3.86Å; F20-K67 HydrophobicContact CZ-CD 3.72Å; I64-K67 PolarHBondContact O-N 3.1Å; I64-K67 VanDerWaalsContact O-N 3.15Å; K67-M69 VanDerWaalsContact C-N 3.33Å; K67-D70 PolarHBondContact O-N 2.82Å; K67-V71 VanDerWaalsContact O-CG2 3.31Å; K67-V71 WeakPolarHBondContact O-CG2 3.24Å; K67-V71 PolarHBondContact O-N 3.1Å
68V56.7Low53.3Low23 Ų2360.1 Ų60.114%0.13933%0.327CS..Hα-helixtrans-69.4-38.2177.71750000110.1W51 I64 E66 V71 V72W51-V68 HydrophobicContact CH2-CG2 4.41Å; W51-V68 HydrophobicContact CZ2-CB 4.31Å; W51-V68 HydrophobicContact CZ2-CG1 3.83Å; W51-V68 HydrophobicContact CZ2-CG2 3.48Å; W51-V68 VanDerWaalsContact CZ2-CG2 3.48Å; I64-V68 HydrophobicContact CG2-CG2 3.93Å; I64-V68 WeakPolarHBondContact O-CG2 3.16Å; I64-V68 PolarHBondContact O-N 2.84Å; E66-V68 VanDerWaalsContact C-N 3.31Å; E66-V68 PolarHBondContact O-N 3.38Å; V68-V71 PolarHBondContact O-N 3.04Å; V68-V72 HydrophobicContact CG1-CG2 4.39Å; V68-V72 WeakPolarHBondContact O-CB 3.11Å; V68-V72 WeakPolarHBondContact O-CG2 3.13Å; V68-V72 PolarHBondContact O-N 2.74Å
69M54.5Low53.3Low67 Ų6767.2 Ų67.233%0.3336%0.357SS..Hα-helixtrans-64.1-42.2174.5-172.2161.27.400111.4G65 E66 K67 V72 N73 I91G65-M69 WeakPolarHBondContact O-CB 3.33Å; G65-M69 PolarHBondContact O-N 2.86Å; E66-M69 WeakPolarHBondContact O-CB 3.45Å; E66-M69 PolarHBondContact O-N 2.92Å; E66-M69 VanDerWaalsContact O-N 3.12Å; K67-M69 VanDerWaalsContact C-N 3.33Å; M69-V72 PolarHBondContact O-N 3.42Å; M69-N73 VanDerWaalsContact O-CB 3.27Å; M69-N73 WeakPolarHBondContact O-CB 2.69Å; M69-N73 PolarHBondContact O-N 2.96Å; M69-I91 HydrophobicContact CB-CD1 3.69Å; M69-I91 HydrophobicContact CB-CG2 4.5Å; M69-I91 HydrophobicContact CE-CB 3.58Å; M69-I91 HydrophobicContact CE-CD1 4.41Å; M69-I91 HydrophobicContact CE-CG2 3.56Å; M69-I91 HydrophobicContact CG-CD1 3.74Å; M69-I91 HydrophobicContact SD-CB 4.03Å; M69-I91 HydrophobicContact SD-CD1 4.1Å
70D59.4Low53.1Low52 Ų5259.4 Ų59.428%0.27833%0.329SS..Hα-helixtrans-62.8-42.6174.9-73.9-17.3000112.2E66 K67 N73 A74 L107E66-D70 PolarHBondContact O-N 2.91Å; K67-D70 PolarHBondContact O-N 2.82Å; D70-N73 PolarHBondContact O-N 3.11Å; D70-A74 VanDerWaalsContact O-CB 3.31Å; D70-A74 WeakPolarHBondContact O-CB 3.18Å; D70-A74 PolarHBondContact O-N 3.22Å; D70-L107 HydrophobicContact CB-CD1 4.04Å
71V57.5Low52.7Low32 Ų3262.8 Ų62.819%0.19434%0.34CS..Hα-helixtrans-64.3-43.3175.3166.40000111.5I12 V16 K67 V68 N73 A74 A75I12-V71 HydrophobicContact CG2-CB 4.21Å; I12-V71 HydrophobicContact CG2-CG1 3.5Å; I12-V71 HydrophobicContact CG2-CG2 3.57Å; V16-V71 HydrophobicContact CG2-CG2 4.27Å; K67-V71 VanDerWaalsContact O-CG2 3.31Å; K67-V71 WeakPolarHBondContact O-CG2 3.24Å; K67-V71 PolarHBondContact O-N 3.1Å; V68-V71 PolarHBondContact O-N 3.04Å; V71-N73 VanDerWaalsContact C-N 3.28Å; V71-N73 PolarHBondContact O-N 2.83Å; V71-A74 PolarHBondContact O-N 3.28Å; V71-A75 VanDerWaalsContact O-CB 3.27Å; V71-A75 WeakPolarHBondContact O-CB 3.39Å; V71-A75 PolarHBondContact O-N 2.92Å
72V54.6Low52.7Low36 Ų3662.3 Ų62.322%0.21834%0.342CS..Hα-helixtrans-65-35.4176.5170.20000110.6V68 M69 K76V68-V72 HydrophobicContact CG1-CG2 4.39Å; V68-V72 WeakPolarHBondContact O-CB 3.11Å; V68-V72 WeakPolarHBondContact O-CG2 3.13Å; V68-V72 PolarHBondContact O-N 2.74Å; M69-V72 PolarHBondContact O-N 3.42Å; V72-K76 WeakPolarHBondContact O-CG 3.41Å; V72-K76 PolarHBondContact O-N 2.85Å
73N58.1Low52.6Low81 Ų8163 Ų6343%0.43334%0.336SS..Hα-helixtrans-73.9-41.5177.4-158.950.3000111.9M69 D70 V71 A75 K76 E77M69-N73 VanDerWaalsContact O-CB 3.27Å; M69-N73 WeakPolarHBondContact O-CB 2.69Å; M69-N73 PolarHBondContact O-N 2.96Å; D70-N73 PolarHBondContact O-N 3.11Å; V71-N73 VanDerWaalsContact C-N 3.28Å; V71-N73 PolarHBondContact O-N 2.83Å; N73-A75 VanDerWaalsContact C-N 3.28Å; N73-A75 PolarHBondContact O-N 2.75Å; N73-K76 CarbonylContact O-C 3.57Å; N73-K76 WeakPolarHBondContact O-CA 3.31Å; N73-K76 VanDerWaalsContact O-CB 3.29Å; N73-K76 WeakPolarHBondContact O-CB 3.27Å; N73-K76 PolarHBondContact O-N 2.84Å; N73-E77 PolarHBondContact O-N 3.06Å
74A57.8Low52.5Low26 Ų2666 Ų6622%0.21535%0.354CS..Hα-helixtrans-61.4-38.6171.600000111.3D70 V71 K76 E77 L78D70-A74 VanDerWaalsContact O-CB 3.31Å; D70-A74 WeakPolarHBondContact O-CB 3.18Å; D70-A74 PolarHBondContact O-N 3.22Å; V71-A74 PolarHBondContact O-N 3.28Å; A74-K76 VanDerWaalsContact C-N 3.3Å; A74-K76 PolarHBondContact O-N 3.47Å; A74-E77 PolarHBondContact O-N 3.48Å; A74-L78 WeakPolarHBondContact O-CB 3.48Å; A74-L78 VanDerWaalsContact O-CG 3.28Å; A74-L78 WeakPolarHBondContact O-CG 2.91Å; A74-L78 PolarHBondContact O-N 3.49Å
75A51.6Low52.4Low11 Ų1172.7 Ų72.79%0.09139%0.39CS..Hα-helixtrans-67.6-29.4173.400000113V71 N73 F83V71-A75 VanDerWaalsContact O-CB 3.27Å; V71-A75 WeakPolarHBondContact O-CB 3.39Å; V71-A75 PolarHBondContact O-N 2.92Å; N73-A75 VanDerWaalsContact C-N 3.28Å; N73-A75 PolarHBondContact O-N 2.75Å; A75-F83 HydrophobicContact CB-CD1 3.99Å; A75-F83 HydrophobicContact CB-CE1 3.6Å; A75-F83 HydrophobicContact CB-CE2 4.31Å; A75-F83 HydrophobicContact CB-CZ 3.79Å; A75-F83 WeakPolarHBondContact O-CD2 3.18Å
76K52.4Low52.1Low79 Ų7974 Ų7434%0.34340%0.396SS..Hα-helixtrans-70.2-42169.1-78.1178.2166.8-170.70111.9V72 N73 A74 L78 E79 T86V72-K76 WeakPolarHBondContact O-CG 3.41Å; V72-K76 PolarHBondContact O-N 2.85Å; N73-K76 CarbonylContact O-C 3.57Å; N73-K76 WeakPolarHBondContact O-CA 3.31Å; N73-K76 VanDerWaalsContact O-CB 3.29Å; N73-K76 WeakPolarHBondContact O-CB 3.27Å; N73-K76 PolarHBondContact O-N 2.84Å; A74-K76 VanDerWaalsContact C-N 3.3Å; A74-K76 PolarHBondContact O-N 3.47Å; K76-L78 VanDerWaalsContact C-N 3.28Å; K76-L78 PolarHBondContact O-N 3.34Å; K76-E79 PolarHBondContact O-N 3.35Å; K76-T86 VanDerWaalsContact CE-O 3.26Å; K76-T86 WeakPolarHBondContact CE-O 3.32Å; K76-T86 WeakPolarHBondContact CE-OG1 3.41Å; K76-T86 PolarHBondContact NZ-O 3.44Å
77E56.4Low51.5Low151 Ų15180.8 Ų80.871%0.70643%0.425SS*.Hα-helixtrans-66.5-29.4176.4-72.7-174.7156.600112.6N73 A74 E79N73-E77 PolarHBondContact O-N 3.06Å; A74-E77 PolarHBondContact O-N 3.48Å; E77-E79 PolarHBondContact O-N 2.95Å
78L53.5Low50.9Low126 Ų12686.1 Ų86.166%0.6645%0.451SS*.THydrogen-bonded Turntrans-69.76.1174.7-77.9168.4000114.1A74 K76 G80A74-L78 WeakPolarHBondContact O-CB 3.48Å; A74-L78 VanDerWaalsContact O-CG 3.28Å; A74-L78 WeakPolarHBondContact O-CG 2.91Å; A74-L78 PolarHBondContact O-N 3.49Å; K76-L78 VanDerWaalsContact C-N 3.28Å; K76-L78 PolarHBondContact O-N 3.34Å; L78-G80 PolarHBondContact O-N 3.36Å
79E48.9Very low50.4Low184 Ų18487.9 Ų87.986%0.8646%0.462SS*.THydrogen-bonded Turntrans43.529.3171-121.5-176.6-171.800114.3K76 E77 E81K76-E79 PolarHBondContact O-N 3.35Å; E77-E79 PolarHBondContact O-N 2.95Å; E79-E81 PolarHBondContact O-N 2.65Å
80G45.4Very low49.9Very low32 Ų3289 Ų8933%0.3347%0.469SS..  trans-69121.4-179.700000108.9L78 G82 F83L78-G80 PolarHBondContact O-N 3.36Å; G80-G82 VanDerWaalsContact C-N 3.33Å; G80-G82 PolarHBondContact O-N 3.33Å; G80-F83 PolarHBondContact O-N 3.24Å; G80-F83 VanDerWaalsContact O-N 3.08Å
81E43.8Very low49.2Very low205 Ų20588 Ų8896%0.95846%0.463SS*.THydrogen-bonded Turntrans-51.295.5173.8-170.3167.3-170.700109.3E79E79-E81 PolarHBondContact O-N 2.65Å
82G48.7Very low48.4Very low18 Ų1895.7 Ų95.719%0.18649%0.489CS..THydrogen-bonded Turntrans140.4-10.4-168.800000119.6R5 G80R5-G82 PolarHBondContact NH1-O 3.04Å; R5-G82 VanDerWaalsContact NH2-C 3.32Å; R5-G82 PolarHBondContact NH2-O 2.76Å; G80-G82 VanDerWaalsContact C-N 3.33Å; G80-G82 PolarHBondContact O-N 3.33Å
83F45.4Very low48.1Very low48 Ų48101.2 Ų101.221%0.21151%0.512CS..  trans-102.1-0.9174.5-69.5-82.8000113.7A75 G80 D85 T86A75-F83 HydrophobicContact CB-CD1 3.99Å; A75-F83 HydrophobicContact CB-CE1 3.6Å; A75-F83 HydrophobicContact CB-CE2 4.31Å; A75-F83 HydrophobicContact CB-CZ 3.79Å; A75-F83 WeakPolarHBondContact O-CD2 3.18Å; G80-F83 PolarHBondContact O-N 3.24Å; G80-F83 VanDerWaalsContact O-N 3.08Å; F83-D85 PolarHBondContact O-N 2.93Å; F83-T86 PolarHBondContact O-N 2.81Å; F83-T86 PolarHBondContact O-OG1 2.89Å
84S47.4Very low47.6Very low110 Ų110104.7 Ų104.777%0.76953%0.526SS*.THydrogen-bonded Turntrans-64.9-21.1177.2470000114
85D49.4Very low46.8Very low146 Ų146104.9 Ų104.978%0.78152%0.524SS*.THydrogen-bonded Turntrans-88.5-3.7-179.3-74.8-32.3000114.4F83 K87F83-D85 PolarHBondContact O-N 2.93Å; D85-K87 PolarHBondContact O-N 3.38Å
86T43.9Very low46.2Very low33 Ų33107.7 Ų107.720%0.20255%0.554CS.*  trans-77.171.8170.741.10000110.1W47 K76 F83 E88W47-T86 HydrophobicContact CH2-CG2 4.02Å; W47-T86 HydrophobicContact CZ2-CG2 3.95Å; K76-T86 VanDerWaalsContact CE-O 3.26Å; K76-T86 WeakPolarHBondContact CE-O 3.32Å; K76-T86 WeakPolarHBondContact CE-OG1 3.41Å; K76-T86 PolarHBondContact NZ-O 3.44Å; F83-T86 PolarHBondContact O-N 2.81Å; F83-T86 PolarHBondContact O-OG1 2.89Å; T86-E88 PolarHBondContact O-N 2.88Å
87K40.8Very low45.7Very low183 Ų183111.7 Ų111.780%0.79658%0.579SS**  trans-46.6113.1156.9-83.4-174175.2179.10107.1D85 V89D85-K87 PolarHBondContact O-N 3.38Å; K87-V89 VanDerWaalsContact C-N 3.28Å; K87-V89 PolarHBondContact O-N 3.25Å
88E43.7Very low45.2Very low166 Ų166107.4 Ų107.478%0.77657%0.565SS**  trans-9.384163-161.3173.3-174.200110.9T86 D90T86-E88 PolarHBondContact O-N 2.88Å; E88-D90 PolarHBondContact O-N 2.72Å
89V44.6Very low44.4Very low59 Ų59105.3 Ų105.336%0.35858%0.575SS.*  trans-68.9122.8166.4161.80000103.2K48 K87 I91K48-V89 HydrophobicContact CD-CG2 3.67Å; K48-V89 HydrophobicContact CG-CG2 4.37Å; K87-V89 VanDerWaalsContact C-N 3.28Å; K87-V89 PolarHBondContact O-N 3.25Å; V89-I91 HydrophobicContact CB-CG1 4.32Å; V89-I91 HydrophobicContact CG1-CG1 3.79Å; V89-I91 PolarHBondContact O-N 2.9Å
90D44.9Very low44.2Very low90 Ų90104.9 Ų104.948%0.48157%0.57SS.*  trans-64.670.4172.6-159.1-4.1000108.8E88 R92 E93E88-D90 PolarHBondContact O-N 2.72Å; D90-R92 PolarHBondContact O-N 3.4Å; D90-R92 WeakPolarHBondContact OD1-CB 3.06Å; D90-E93 HydrophobicContact CB-CB 4.05Å; D90-E93 VanDerWaalsContact O-CB 3.3Å; D90-E93 WeakPolarHBondContact O-CB 3.31Å; D90-E93 PolarHBondContact O-N 3.43Å; D90-E93 PolarHBondContact OD1-N 2.76Å
91I43.9Very low43.9Very low32 Ų32108.5 Ų108.516%0.16459%0.588CS.*G310 helixtrans-63.2-22.4171.8-55.7166.2000108M69 V89 E93 H94 T95M69-I91 HydrophobicContact CB-CD1 3.69Å; M69-I91 HydrophobicContact CB-CG2 4.5Å; M69-I91 HydrophobicContact CE-CB 3.58Å; M69-I91 HydrophobicContact CE-CD1 4.41Å; M69-I91 HydrophobicContact CE-CG2 3.56Å; M69-I91 HydrophobicContact CG-CD1 3.74Å; M69-I91 HydrophobicContact SD-CB 4.03Å; M69-I91 HydrophobicContact SD-CD1 4.1Å; V89-I91 HydrophobicContact CB-CG1 4.32Å; V89-I91 HydrophobicContact CG1-CG1 3.79Å; V89-I91 PolarHBondContact O-N 2.9Å; I91-E93 VanDerWaalsContact C-N 3.25Å; I91-E93 PolarHBondContact O-N 3.07Å; I91-H94 CarbonylContact O-C 3.39Å; I91-H94 WeakPolarHBondContact O-CA 3.24Å; I91-H94 PolarHBondContact O-N 3.42Å; I91-T95 HydrophobicContact CG2-CG2 3.96Å; I91-T95 PolarHBondContact O-N 3.38Å; I91-T95 PolarHBondContact O-OG1 2.77Å
92R40.8Very low43.7Very low194 Ų194103 Ų10373%0.73256%0.561SS**G310 helixtrans-60.6-32170.7-135.7-171.5-59.5-142.20.6112.5D90 H94D90-R92 PolarHBondContact O-N 3.4Å; D90-R92 WeakPolarHBondContact OD1-CB 3.06Å; R92-H94 PolarHBondContact O-N 3.5Å
93E48.2Very low43.2Very low151 Ų151106.6 Ų106.671%0.70658%0.579SS**G310 helixtrans-70.1-15.8171.7-165.7176-149.200112.6D90 I91D90-E93 HydrophobicContact CB-CB 4.05Å; D90-E93 VanDerWaalsContact O-CB 3.3Å; D90-E93 WeakPolarHBondContact O-CB 3.31Å; D90-E93 PolarHBondContact O-N 3.43Å; D90-E93 PolarHBondContact OD1-N 2.76Å; I91-E93 VanDerWaalsContact C-N 3.25Å; I91-E93 PolarHBondContact O-N 3.07Å
94H48.3Very low42.8Very low154 Ų154110.3 Ų110.371%0.71360%0.601SS**THydrogen-bonded Turntrans-118.6-2.1-179.1-84.26.3000115.4I91 R92I91-H94 CarbonylContact O-C 3.39Å; I91-H94 WeakPolarHBondContact O-CA 3.24Å; I91-H94 PolarHBondContact O-N 3.42Å; R92-H94 PolarHBondContact O-N 3.5Å
95T41.1Very low42.7Very low30 Ų30110 Ų11018%0.18459%0.588CS.*  trans-123.632.1178.544.50000112.3I91 D97I91-T95 HydrophobicContact CG2-CG2 3.96Å; I91-T95 PolarHBondContact O-N 3.38Å; I91-T95 PolarHBondContact O-OG1 2.77Å; T95-D97 PolarHBondContact O-N 3.03Å; T95-D97 VanDerWaalsContact O-N 3.1Å
96G38.6Very low42.4Very low70 Ų70108.2 Ų108.272%0.72257%0.573SS**THydrogen-bonded Turntrans-54.3117.7170.400000110.3
97D43.1Very low42.3Very low163 Ų163109.6 Ų109.687%0.87258%0.579SS**THydrogen-bonded Turntrans97.324.2167.6-141.316.1000119.4T95T95-D97 PolarHBondContact O-N 3.03Å; T95-D97 VanDerWaalsContact O-N 3.1Å
98C45.1Very low42.4Very low61 Ų61106 Ų10641%0.41257%0.565SS.*  trans-101.179.7165.2-98.20000112.7G62 K100G62-C98 PolarHBondContact O-SG 3.43Å; C98-K100 VanDerWaalsContact C-N 3.3Å; C98-K100 PolarHBondContact O-N 3.24Å
99G35.8Very low42.6Very low83 Ų83104 Ų10486%0.85655%0.553SS**  trans-77.648.8-17800000116.6
100K44.7Very low42.1Very low175 Ų175105.6 Ų105.676%0.76156%0.558SS**  trans-155.8104.6165.3-162163.1-175.11770113.4C98C98-K100 VanDerWaalsContact C-N 3.3Å; C98-K100 PolarHBondContact O-N 3.24Å
101P40.3Very low42Very low108 Ų108108 Ų10870%0.70157%0.568SS**PPolyproline II helixtrans-65.4136.7179.725.8-32.9000112.1E66E66-P101 WeakPolarHBondContact OE1-CA 3.41Å
102F39.5Very low42Very low90 Ų90113.6 Ų113.640%0.39559%0.593SS.*PPolyproline II helixtrans-68.4130.6163.9-120-116.5000109.4E66 K106E66-F102 PolarHBondContact OE1-N 3.38Å; F102-K106 HydrophobicContact CD1-CB 4.11Å; F102-K106 HydrophobicContact CD1-CD 3.9Å; F102-K106 HydrophobicContact CD1-CG 4.06Å; F102-K106 HydrophobicContact CE1-CB 4.25Å; F102-K106 HydrophobicContact CE1-CD 3.22Å; F102-K106 HydrophobicContact CE1-CG 3.69Å; F102-K106 HydrophobicContact CZ-CD 3.92Å; F102-K106 VanDerWaalsContact CZ-NZ 3.3Å
103T37.7Very low41.9Very low93 Ų93110.6 Ų110.657%0.57159%0.591SS**PPolyproline II helixtrans-74.6134.1178.749.80000111E105 K106T103-E105 PolarHBondContact O-N 2.77Å; T103-K106 PolarHBondContact O-N 3.33Å
104N37.8Very low41.4Very low125 Ų125108.6 Ų108.667%0.66859%0.591SS**Hα-helixtrans-38.8-35.5173.757.9-5.9000115.4K106 L107 E108N104-K106 PolarHBondContact O-N 3.3Å; N104-L107 WeakPolarHBondContact O-CA 3.31Å; N104-L107 WeakPolarHBondContact O-CB 3.33Å; N104-L107 PolarHBondContact O-N 2.88Å; N104-E108 PolarHBondContact O-N 2.88Å
105E44.6Very low40.9Very low105 Ų105107.9 Ų107.949%0.49160%0.598SS.*Hα-helixtrans-57-35.2178.4-164.2-163.2142.600113.2T103 L107 K109T103-E105 PolarHBondContact O-N 2.77Å; E105-L107 VanDerWaalsContact C-N 3.32Å; E105-K109 PolarHBondContact O-N 3.24Å; E105-K109 VanDerWaalsContact O-N 3.11Å; E105-K109 IonicContact OE1-NZ 2.69Å; E105-K109 PolarHBondContact OE1-NZ 3.46Å
106K43.6Very low40.6Very low108 Ų108109.8 Ų109.847%0.4762%0.624SS.*Hα-helixtrans-74.5-27.7179.7-173.5152.8171.4-169.40111.9F102 T103 N104 M110F102-K106 HydrophobicContact CD1-CB 4.11Å; F102-K106 HydrophobicContact CD1-CD 3.9Å; F102-K106 HydrophobicContact CD1-CG 4.06Å; F102-K106 HydrophobicContact CE1-CB 4.25Å; F102-K106 HydrophobicContact CE1-CD 3.22Å; F102-K106 HydrophobicContact CE1-CG 3.69Å; F102-K106 HydrophobicContact CZ-CD 3.92Å; F102-K106 VanDerWaalsContact CZ-NZ 3.3Å; T103-K106 PolarHBondContact O-N 3.33Å; N104-K106 PolarHBondContact O-N 3.3Å; K106-M110 HydrophobicContact CG-CE 3.65Å; K106-M110 VanDerWaalsContact O-CE 3.24Å; K106-M110 WeakPolarHBondContact O-CE 3.42Å; K106-M110 WeakPolarHBondContact O-CG 3.21Å; K106-M110 PolarHBondContact O-N 3.48Å
107L41.4Very low40.6Very low62 Ų62110.4 Ų110.433%0.32562%0.617SS.*Hα-helixtrans-75.3-42.9174-119.9158.3000110.9D70 N104 E105 K109 M110 M111D70-L107 HydrophobicContact CB-CD1 4.04Å; N104-L107 WeakPolarHBondContact O-CA 3.31Å; N104-L107 WeakPolarHBondContact O-CB 3.33Å; N104-L107 PolarHBondContact O-N 2.88Å; E105-L107 VanDerWaalsContact C-N 3.32Å; L107-K109 VanDerWaalsContact C-N 3.32Å; L107-K109 PolarHBondContact O-N 2.9Å; L107-M110 PolarHBondContact O-N 3.37Å; L107-M111 WeakPolarHBondContact O-CG 3.43Å; L107-M111 PolarHBondContact O-N 3.01Å
108E43.4Very low40.7Very low107 Ų107110.3 Ų110.350%0.562%0.617SS.*Hα-helixtrans-62.6-38177.1-157.9178.417100112.3N104 M110 M111 Q112N104-E108 PolarHBondContact O-N 2.88Å; E108-M110 VanDerWaalsContact C-N 3.32Å; E108-M110 PolarHBondContact O-N 3.47Å; E108-M111 HydrophobicContact CB-CE 4.27Å; E108-M111 HydrophobicContact CG-CE 4.23Å; E108-M111 PolarHBondContact O-N 3.29Å; E108-Q112 WeakPolarHBondContact O-CG 3.07Å; E108-Q112 PolarHBondContact O-N 2.75Å
109K46.5Very low40.8Very low125 Ų125113 Ų11354%0.54363%0.627SS.*Hα-helixtrans-65.2-31.3172-80.3171.5173.2161.30113.7E105 L107E105-K109 PolarHBondContact O-N 3.24Å; E105-K109 VanDerWaalsContact O-N 3.11Å; E105-K109 IonicContact OE1-NZ 2.69Å; E105-K109 PolarHBondContact OE1-NZ 3.46Å; L107-K109 VanDerWaalsContact C-N 3.32Å; L107-K109 PolarHBondContact O-N 2.9Å
110M35.3Very low41.7Very low92 Ų92115.7 Ų115.745%0.45362%0.621SS.*Hα-helixtrans-76.2-35.4176-74.5-174.2-114.200111.7K106 L107 E108 Q112 L113K106-M110 HydrophobicContact CG-CE 3.65Å; K106-M110 VanDerWaalsContact O-CE 3.24Å; K106-M110 WeakPolarHBondContact O-CE 3.42Å; K106-M110 WeakPolarHBondContact O-CG 3.21Å; K106-M110 PolarHBondContact O-N 3.48Å; L107-M110 PolarHBondContact O-N 3.37Å; E108-M110 VanDerWaalsContact C-N 3.32Å; E108-M110 PolarHBondContact O-N 3.47Å; M110-Q112 PolarHBondContact O-N 3.36Å; M110-L113 PolarHBondContact O-N 2.9Å
111M41.6Very low42.4Very low139 Ų139113.2 Ų113.269%0.68562%0.621SS**Hα-helixtrans-64.6-17.9172.8-66.7-169.4-71.500113.5L107 E108L107-M111 WeakPolarHBondContact O-CG 3.43Å; L107-M111 PolarHBondContact O-N 3.01Å; E108-M111 HydrophobicContact CB-CE 4.27Å; E108-M111 HydrophobicContact CG-CE 4.23Å; E108-M111 PolarHBondContact O-N 3.29Å
112Q43.8Very low43.5Very low150 Ų150115.8 Ų115.870%0.70163%0.626SS**THydrogen-bonded Turntrans-102.20.6-179.3-69.6-164.2-21.700114.6E108 M110 P114E108-Q112 WeakPolarHBondContact O-CG 3.07Å; E108-Q112 PolarHBondContact O-N 2.75Å; M110-Q112 PolarHBondContact O-N 3.36Å; Q112-P114 WeakPolarHBondContact O-CD 3.37Å
113L39.4Very low44.6Very low132 Ų132119 Ų11969%0.69164%0.642SS**SBendtrans-74.1118.8173.3-84.6161.6000109M110 T115M110-L113 PolarHBondContact O-N 2.9Å; L113-T115 PolarHBondContact O-N 3.07Å
114P36.8Very low46Very low108 Ų108122.1 Ų122.170%0.70166%0.655SS**  trans-65.2138.3-176.826.6-32000109.2Q112 G116Q112-P114 WeakPolarHBondContact O-CD 3.37Å; P114-G116 PolarHBondContact O-N 3.11Å
115T39.5Very low47.2Very low139 Ų139121.3 Ų121.385%0.85365%0.654SS**  trans-36.5107.2157.3-48.20000107L113 S117L113-T115 PolarHBondContact O-N 3.07Å; T115-S117 PolarHBondContact O-N 2.78Å
116G34.3Very low48.1Very low71 Ų71119.5 Ų119.573%0.73266%0.664SS**  trans-49107.4-177.800000107.4P114 D118P114-G116 PolarHBondContact O-N 3.11Å; G116-D118 PolarHBondContact O-N 2.83Å
117S37.6Very low48.6Very low83 Ų83123 Ų12358%0.5871%0.713SS**  trans-51.2127.9176.7177.80000106.7T115 N119T115-S117 PolarHBondContact O-N 2.78Å; S117-N119 PolarHBondContact O-N 3.28Å; S117-N119 PolarHBondContact O-OD1 3.42Å
118D45.3Very low49Very low161 Ų161126 Ų12686%0.86173%0.732SS**  trans-65.389.8165.6-127.5-22.2000106.4G116G116-D118 PolarHBondContact O-N 2.83Å
119N48.3Very low49.3Very low118 Ų118127 Ų12763%0.63175%0.745SS**  trans-130.562.3170.541.52.1000110.7S117 V121S117-N119 PolarHBondContact O-N 3.28Å; S117-N119 PolarHBondContact O-OD1 3.42Å; N119-V121 PolarHBondContact O-N 2.75Å
120D53.8Low49.5Very low138 Ų138127.1 Ų127.174%0.73876%0.756SS**  trans-65.381.6145.6-90.6-29.5000108.5M122D120-M122 HydrophobicContact CB-SD 4.04Å; D120-M122 PolarHBondContact O-N 3.47Å
121V60.3Low50.3Low123 Ų123129.2 Ų129.275%0.74577%0.773SS**  trans-71102.9158.3165.40000106.2N119 E123N119-V121 PolarHBondContact O-N 2.75Å; V121-E123 PolarHBondContact O-N 3.39Å
122M63.5Low50.8Low163 Ų163128.6 Ų128.680%0.80378%0.779SS**  trans-66.5102.8169-34.9-58.3-123.500107.7D120 D124D120-M122 HydrophobicContact CB-SD 4.04Å; D120-M122 PolarHBondContact O-N 3.47Å; M122-D124 PolarHBondContact O-N 2.73Å; M122-D124 VanDerWaalsContact O-N 3.13Å
123E62.2Low51.3Low157 Ų157127.1 Ų127.173%0.73478%0.784SS**  trans-70.896166.2-158-169.1146.500107.6V121 T125V121-E123 PolarHBondContact O-N 3.39Å; E123-T125 VanDerWaalsContact C-N 3.26Å; E123-T125 WeakPolarHBondContact CG-OG1 3.17Å; E123-T125 PolarHBondContact O-N 2.74Å; E123-T125 VanDerWaalsContact O-N 3.16Å; E123-T125 PolarHBondContact OE1-OG1 3.2Å
124D66.7Low52.1Low158 Ų158126.8 Ų126.885%0.84579%0.791SS**  trans-83.480.2165.7-168.420.8000108.6M122M122-D124 PolarHBondContact O-N 2.73Å; M122-D124 VanDerWaalsContact O-N 3.13Å
125T62.5Low53.3Low108 Ų108128.2 Ų128.266%0.66380%0.798SS**  trans-89.298.5166.24.50000108.8E123E123-T125 VanDerWaalsContact C-N 3.26Å; E123-T125 WeakPolarHBondContact CG-OG1 3.17Å; E123-T125 PolarHBondContact O-N 2.74Å; E123-T125 VanDerWaalsContact O-N 3.16Å; E123-T125 PolarHBondContact OE1-OG1 3.2Å
126G64.6Low54.5Low67 Ų67127.3 Ų127.369%0.69179%0.793SS**  trans120.6108.7142.500000117.8
127A54.6Low56.3Low181 Ų181132.5 Ų132.5100%1.49680%0.799SS**  -173.90113.500000110.1

Retrieved 127 of 127 residues in 21.2 ms (Link to these results)