A0A077Z173_TRITR Loading...

Putative tumor protein d52 family

AlphaFold DB , UniProt , Accession A0A077Z173, Species TRITR (Trichuris trichiura, Whipworm), Gene n/a, Length 135 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
1M82.8Confident93.7Very high180 Ų180127.7 Ų127.789%0.88759%0.585SS**  0-81.60-67.6-96.9-107.700113E3 E4 L5M1-E3 VanDerWaalsContact C-N 3.32Å; M1-E3 PolarHBondContact O-N 3.28Å; M1-E4 PolarHBondContact N-OE1 2.87Å; M1-E4 PolarHBondContact O-N 3.08Å; M1-L5 PolarHBondContact O-N 3.45Å
2R92.4Very high93.9Very high228 Ų228123.7 Ų123.786%0.8657%0.57SS**Hα-helixtrans-60.1-40.1-179.8-76.6-167.7178.4104.51113.5L5 R6R2-L5 PolarHBondContact O-N 3.24Å; R2-R6 PolarHBondContact O-N 3.12Å
3E94.8Very high93.9Very high117 Ų117121 Ų12155%0.54756%0.563SS.*Hα-helixtrans-67-36.1177.7-177.558.3-167.400112.7M1 R6 K7M1-E3 VanDerWaalsContact C-N 3.32Å; M1-E3 PolarHBondContact O-N 3.28Å; E3-R6 PolarHBondContact O-N 3.27Å; E3-R6 IonicContact OE1-CZ 3.31Å; E3-R6 IonicContact OE1-NE 2.98Å; E3-R6 PolarHBondContact OE1-NE 3.28Å; E3-R6 IonicContact OE1-NH2 2.69Å; E3-R6 PolarHBondContact OE1-NH2 3.12Å; E3-R6 IonicContact OE2-CZ 2.58Å; E3-R6 IonicContact OE2-NE 3.46Å; E3-R6 PolarHBondContact OE2-NE 2.96Å; E3-R6 IonicContact OE2-NH2 3.07Å; E3-K7 WeakPolarHBondContact O-CB 3.27Å; E3-K7 PolarHBondContact O-N 2.69Å
4E94.2Very high94.2Very high126 Ų126118 Ų11859%0.58956%0.557SS**Hα-helixtrans-66.3-43.1174.1-72.4152.6-117.900111.1M1 R6 K7 T8M1-E4 PolarHBondContact N-OE1 2.87Å; M1-E4 PolarHBondContact O-N 3.08Å; E4-R6 PolarHBondContact O-N 2.9Å; E4-K7 PolarHBondContact O-N 3.39Å; E4-T8 PolarHBondContact O-N 3.18Å; E4-T8 PolarHBondContact O-OG1 2.79Å; E4-T8 VanDerWaalsContact O-OG1 3.11Å
5L92.4Very high94.4Very high106 Ų106115.8 Ų115.856%0.55555%0.55SS*.Hα-helixtrans-59-48.1174.9-169.979.9000111.1M1 R2 K7 T8 E9M1-L5 PolarHBondContact O-N 3.45Å; R2-L5 PolarHBondContact O-N 3.24Å; L5-K7 VanDerWaalsContact C-N 3.3Å; L5-K7 PolarHBondContact O-N 3.18Å; L5-T8 WeakPolarHBondContact O-CB 3.47Å; L5-T8 PolarHBondContact O-N 3.43Å; L5-T8 VanDerWaalsContact O-N 3.12Å; L5-E9 WeakPolarHBondContact O-CG 3.28Å; L5-E9 PolarHBondContact O-N 3.42Å
6R94.9Very high94.3Very high104 Ų104119.8 Ų119.839%0.39256%0.558SS.*Hα-helixtrans-56-45.8176.4-173.3-171.972.782.43.3111.2R2 E3 E4 T8 E9 E10R2-R6 PolarHBondContact O-N 3.12Å; E3-R6 PolarHBondContact O-N 3.27Å; E3-R6 IonicContact OE1-CZ 3.31Å; E3-R6 IonicContact OE1-NE 2.98Å; E3-R6 PolarHBondContact OE1-NE 3.28Å; E3-R6 IonicContact OE1-NH2 2.69Å; E3-R6 PolarHBondContact OE1-NH2 3.12Å; E3-R6 IonicContact OE2-CZ 2.58Å; E3-R6 IonicContact OE2-NE 3.46Å; E3-R6 PolarHBondContact OE2-NE 2.96Å; E3-R6 IonicContact OE2-NH2 3.07Å; E4-R6 PolarHBondContact O-N 2.9Å; R6-T8 PolarHBondContact O-N 3.02Å; R6-E9 PolarHBondContact O-N 3.17Å; R6-E10 IonicContact CZ-OE1 2.78Å; R6-E10 IonicContact CZ-OE2 3.01Å; R6-E10 IonicContact NH1-OE1 3.78Å; R6-E10 PolarHBondContact NH1-OE1 2.85Å; R6-E10 IonicContact NH1-OE2 3.71Å; R6-E10 PolarHBondContact NH1-OE2 3.34Å; R6-E10 VanDerWaalsContact NH1-OE2 3.07Å; R6-E10 WeakPolarHBondContact O-CG 3.47Å; R6-E10 PolarHBondContact O-N 3.34Å
7K95.6Very high94.2Very high143 Ų143119.7 Ų119.762%0.62256%0.557SS**Hα-helixtrans-62-41.9177.1-172.9-179.5178-175.60112E3 E4 L5 E10 E11E3-K7 WeakPolarHBondContact O-CB 3.27Å; E3-K7 PolarHBondContact O-N 2.69Å; E4-K7 PolarHBondContact O-N 3.39Å; L5-K7 VanDerWaalsContact C-N 3.3Å; L5-K7 PolarHBondContact O-N 3.18Å; K7-E10 PolarHBondContact O-N 2.87Å; K7-E11 WeakPolarHBondContact O-CB 3.41Å; K7-E11 PolarHBondContact O-N 3.4Å
8T95.2Very high94.4Very high74 Ų74116.8 Ų116.845%0.45455%0.549SS..Hα-helixtrans-64.6-40.8175.5-60.30000112E4 L5 R6 E11 I12E4-T8 PolarHBondContact O-N 3.18Å; E4-T8 PolarHBondContact O-OG1 2.79Å; E4-T8 VanDerWaalsContact O-OG1 3.11Å; L5-T8 WeakPolarHBondContact O-CB 3.47Å; L5-T8 PolarHBondContact O-N 3.43Å; L5-T8 VanDerWaalsContact O-N 3.12Å; R6-T8 PolarHBondContact O-N 3.02Å; T8-E11 PolarHBondContact O-N 3.4Å; T8-I12 HydrophobicContact CG2-CD1 4.02Å; T8-I12 VanDerWaalsContact O-CG1 3.28Å; T8-I12 WeakPolarHBondContact O-CG1 3.39Å; T8-I12 PolarHBondContact O-N 3.37Å
9E95.9Very high94.5Very high117 Ų117115.8 Ų115.855%0.54755%0.547SS..Hα-helixtrans-64-41.7176.6-72.5175.615800112.1L5 R6 I12 N13L5-E9 WeakPolarHBondContact O-CG 3.28Å; L5-E9 PolarHBondContact O-N 3.42Å; R6-E9 PolarHBondContact O-N 3.17Å; E9-I12 PolarHBondContact O-N 3.24Å; E9-N13 PolarHBondContact O-N 2.8Å
10E96.5Very high94.4Very high97 Ų97113 Ų11345%0.45354%0.544SS..Hα-helixtrans-62-45.5174.1-75.2174.8179.400111.5R6 K7 I12 N13 T14R6-E10 IonicContact CZ-OE1 2.78Å; R6-E10 IonicContact CZ-OE2 3.01Å; R6-E10 IonicContact NH1-OE1 3.78Å; R6-E10 PolarHBondContact NH1-OE1 2.85Å; R6-E10 IonicContact NH1-OE2 3.71Å; R6-E10 PolarHBondContact NH1-OE2 3.34Å; R6-E10 VanDerWaalsContact NH1-OE2 3.07Å; R6-E10 WeakPolarHBondContact O-CG 3.47Å; R6-E10 PolarHBondContact O-N 3.34Å; K7-E10 PolarHBondContact O-N 2.87Å; E10-I12 PolarHBondContact O-N 3.05Å; E10-N13 WeakPolarHBondContact O-CB 3.38Å; E10-N13 PolarHBondContact O-N 3.12Å; E10-T14 PolarHBondContact O-N 3.05Å; E10-T14 PolarHBondContact O-OG1 3.04Å; E10-T14 VanDerWaalsContact O-OG1 3.11Å
11E96.3Very high94.4Very high113 Ų113110.5 Ų110.553%0.52854%0.542SS..Hα-helixtrans-61.1-44.2175.9-172.9176.8169.700111.8K7 T8 N13 T14 L15K7-E11 WeakPolarHBondContact O-CB 3.41Å; K7-E11 PolarHBondContact O-N 3.4Å; T8-E11 PolarHBondContact O-N 3.4Å; E11-N13 VanDerWaalsContact C-N 3.29Å; E11-N13 PolarHBondContact O-N 3.19Å; E11-T14 PolarHBondContact O-N 2.95Å; E11-L15 HydrophobicContact CG-CD1 4.17Å; E11-L15 HydrophobicContact CG-CG 4.36Å; E11-L15 WeakPolarHBondContact O-CB 3.45Å; E11-L15 VanDerWaalsContact O-CG 3.28Å; E11-L15 WeakPolarHBondContact O-CG 3.4Å; E11-L15 PolarHBondContact O-N 3.37Å
12I95.7Very high94.9Very high79 Ų79110.2 Ų110.241%0.40553%0.531SS..Hα-helixtrans-58.6-43.4175-71.7166.3000110.6T8 E9 E10 L15 R16T8-I12 HydrophobicContact CG2-CD1 4.02Å; T8-I12 VanDerWaalsContact O-CG1 3.28Å; T8-I12 WeakPolarHBondContact O-CG1 3.39Å; T8-I12 PolarHBondContact O-N 3.37Å; E9-I12 PolarHBondContact O-N 3.24Å; E10-I12 PolarHBondContact O-N 3.05Å; I12-L15 PolarHBondContact O-N 3.36Å; I12-R16 VanDerWaalsContact O-CG 3.32Å; I12-R16 WeakPolarHBondContact O-CG 3.12Å; I12-R16 PolarHBondContact O-N 3.08Å
13N94.6Very high94.6Very high89 Ų89105.6 Ų105.648%0.47652%0.52SS..Hα-helixtrans-64.1-45.7178.3-168.7-1.4000111E9 E10 E11 L15 R16 Q17E9-N13 PolarHBondContact O-N 2.8Å; E10-N13 WeakPolarHBondContact O-CB 3.38Å; E10-N13 PolarHBondContact O-N 3.12Å; E11-N13 VanDerWaalsContact C-N 3.29Å; E11-N13 PolarHBondContact O-N 3.19Å; N13-L15 PolarHBondContact O-N 3.23Å; N13-R16 PolarHBondContact O-N 3.14Å; N13-Q17 WeakPolarHBondContact O-CG 3.47Å; N13-Q17 PolarHBondContact O-N 3.49Å; N13-Q17 VanDerWaalsContact O-N 3.09Å; N13-Q17 PolarHBondContact OD1-NE2 2.65Å
14T97Very high94.2Very high79 Ų79106.6 Ų106.649%0.48552%0.523SS..Hα-helixtrans-59.1-46.4174.2-58.60000111.6E10 E11 R16 Q17 V18E10-T14 PolarHBondContact O-N 3.05Å; E10-T14 PolarHBondContact O-OG1 3.04Å; E10-T14 VanDerWaalsContact O-OG1 3.11Å; E11-T14 PolarHBondContact O-N 2.95Å; T14-R16 VanDerWaalsContact C-N 3.32Å; T14-R16 PolarHBondContact O-N 2.88Å; T14-Q17 WeakPolarHBondContact O-CB 3.42Å; T14-Q17 PolarHBondContact O-N 3.41Å; T14-Q17 VanDerWaalsContact O-N 3.15Å; T14-V18 HydrophobicContact CG2-CG2 4.3Å; T14-V18 VanDerWaalsContact O-CG2 3.31Å; T14-V18 WeakPolarHBondContact O-CG2 3.36Å; T14-V18 PolarHBondContact O-N 3.03Å
15L97.5Very high93.9Very high85 Ų85105.8 Ų105.845%0.44552%0.519SS..Hα-helixtrans-61.8-39178.7-72175.6000112E11 I12 N13 Q17 V18 I19E11-L15 HydrophobicContact CG-CD1 4.17Å; E11-L15 HydrophobicContact CG-CG 4.36Å; E11-L15 WeakPolarHBondContact O-CB 3.45Å; E11-L15 VanDerWaalsContact O-CG 3.28Å; E11-L15 WeakPolarHBondContact O-CG 3.4Å; E11-L15 PolarHBondContact O-N 3.37Å; I12-L15 PolarHBondContact O-N 3.36Å; N13-L15 PolarHBondContact O-N 3.23Å; L15-Q17 VanDerWaalsContact C-N 3.35Å; L15-Q17 PolarHBondContact O-N 3.15Å; L15-V18 PolarHBondContact O-N 3.46Å; L15-I19 WeakPolarHBondContact O-CB 3.48Å; L15-I19 WeakPolarHBondContact O-CD1 3.24Å; L15-I19 WeakPolarHBondContact O-CG1 3.4Å; L15-I19 PolarHBondContact O-N 3.04Å
16R92.9Very high93.5Very high179 Ų179102.8 Ų102.868%0.67551%0.51SS*.Hα-helixtrans-60.4-44.6173.7-75.2173.4177.1-177.30.7111.8I12 N13 T14 I19 A20I12-R16 VanDerWaalsContact O-CG 3.32Å; I12-R16 WeakPolarHBondContact O-CG 3.12Å; I12-R16 PolarHBondContact O-N 3.08Å; N13-R16 PolarHBondContact O-N 3.14Å; T14-R16 VanDerWaalsContact C-N 3.32Å; T14-R16 PolarHBondContact O-N 2.88Å; R16-I19 PolarHBondContact O-N 3.05Å; R16-A20 WeakPolarHBondContact O-CB 3.46Å; R16-A20 PolarHBondContact O-N 3.21Å
17Q93.4Very high92.7Very high119 Ų119100.4 Ų100.456%0.55651%0.512SS*.Hα-helixtrans-64-42.9176.5-66.5173.639.100111.2N13 T14 L15 A20 A21N13-Q17 WeakPolarHBondContact O-CG 3.47Å; N13-Q17 PolarHBondContact O-N 3.49Å; N13-Q17 VanDerWaalsContact O-N 3.09Å; N13-Q17 PolarHBondContact OD1-NE2 2.65Å; T14-Q17 WeakPolarHBondContact O-CB 3.42Å; T14-Q17 PolarHBondContact O-N 3.41Å; T14-Q17 VanDerWaalsContact O-N 3.15Å; L15-Q17 VanDerWaalsContact C-N 3.35Å; L15-Q17 PolarHBondContact O-N 3.15Å; Q17-A20 PolarHBondContact O-N 3.26Å; Q17-A21 WeakPolarHBondContact O-CB 3.18Å; Q17-A21 PolarHBondContact O-N 2.83Å
18V97.7Very high92.1Very high68 Ų6896.6 Ų96.641%0.41250%0.498SS..Hα-helixtrans-62.3-44.8176.4171.30000111T14 L15 A21 R22T14-V18 HydrophobicContact CG2-CG2 4.3Å; T14-V18 VanDerWaalsContact O-CG2 3.31Å; T14-V18 WeakPolarHBondContact O-CG2 3.36Å; T14-V18 PolarHBondContact O-N 3.03Å; L15-V18 PolarHBondContact O-N 3.46Å; V18-A21 PolarHBondContact O-N 3.34Å; V18-R22 HydrophobicContact CG1-CG 4.15Å; V18-R22 WeakPolarHBondContact O-CB 3.34Å; V18-R22 WeakPolarHBondContact O-CG 3.5Å; V18-R22 PolarHBondContact O-N 2.78Å
19I96.6Very high91.6Very high98 Ų9897 Ų9750%0.50350%0.497SS..Hα-helixtrans-61.7-48.3177.9-70.6163.4000110.3L15 R16 A21 R22 M23L15-I19 WeakPolarHBondContact O-CB 3.48Å; L15-I19 WeakPolarHBondContact O-CD1 3.24Å; L15-I19 WeakPolarHBondContact O-CG1 3.4Å; L15-I19 PolarHBondContact O-N 3.04Å; R16-I19 PolarHBondContact O-N 3.05Å; I19-A21 VanDerWaalsContact C-N 3.32Å; I19-A21 PolarHBondContact O-N 3.47Å; I19-R22 PolarHBondContact O-N 3.5Å; I19-R22 VanDerWaalsContact O-N 3.14Å; I19-M23 HydrophobicContact CG2-CG 4.24Å; I19-M23 HydrophobicContact CG2-SD 3.89Å; I19-M23 WeakPolarHBondContact O-CB 3.13Å; I19-M23 VanDerWaalsContact O-CG 3.31Å; I19-M23 WeakPolarHBondContact O-CG 3.28Å; I19-M23 PolarHBondContact O-N 2.77Å
20A91.4Very high90.6Very high59 Ų5997.2 Ų97.249%0.48850%0.497SS..Hα-helixtrans-59.2-44.3177.900000111.7R16 Q17 R22 M23 K24R16-A20 WeakPolarHBondContact O-CB 3.46Å; R16-A20 PolarHBondContact O-N 3.21Å; Q17-A20 PolarHBondContact O-N 3.26Å; A20-R22 PolarHBondContact O-N 2.73Å; A20-M23 PolarHBondContact O-N 3.32Å; A20-K24 WeakPolarHBondContact O-CB 2.99Å; A20-K24 PolarHBondContact O-N 3.3Å
21A94.1Very high89.3Confident60 Ų6099.7 Ų99.750%0.49651%0.508SS..Hα-helixtrans-62.7-40.8175.200000112.2Q17 V18 I19 K24 H25Q17-A21 WeakPolarHBondContact O-CB 3.18Å; Q17-A21 PolarHBondContact O-N 2.83Å; V18-A21 PolarHBondContact O-N 3.34Å; I19-A21 VanDerWaalsContact C-N 3.32Å; I19-A21 PolarHBondContact O-N 3.47Å; A21-K24 PolarHBondContact O-N 3.47Å; A21-H25 WeakPolarHBondContact O-CB 3.2Å; A21-H25 PolarHBondContact O-N 2.8Å
22R95Very high88.3Confident174 Ų174102.7 Ų102.766%0.65752%0.52SS*.Hα-helixtrans-68.9-38.9177.5-72-69.4-174.8-1771.5112.5V18 I19 A20 H25 A26V18-R22 HydrophobicContact CG1-CG 4.15Å; V18-R22 WeakPolarHBondContact O-CB 3.34Å; V18-R22 WeakPolarHBondContact O-CG 3.5Å; V18-R22 PolarHBondContact O-N 2.78Å; I19-R22 PolarHBondContact O-N 3.5Å; I19-R22 VanDerWaalsContact O-N 3.14Å; A20-R22 PolarHBondContact O-N 2.73Å; R22-H25 PolarHBondContact O-N 2.85Å; R22-A26 WeakPolarHBondContact O-CB 3.26Å; R22-A26 PolarHBondContact O-N 2.83Å
23M85.1Confident87.3Confident131 Ų131104.6 Ų104.665%0.64553%0.53SS*.Hα-helixtrans-63.5-44.8174-72177.776.300111.1I19 A20 A26 A27I19-M23 HydrophobicContact CG2-CG 4.24Å; I19-M23 HydrophobicContact CG2-SD 3.89Å; I19-M23 WeakPolarHBondContact O-CB 3.13Å; I19-M23 VanDerWaalsContact O-CG 3.31Å; I19-M23 WeakPolarHBondContact O-CG 3.28Å; I19-M23 PolarHBondContact O-N 2.77Å; A20-M23 PolarHBondContact O-N 3.32Å; M23-A26 PolarHBondContact O-N 2.86Å; M23-A27 PolarHBondContact O-N 3.49Å
24K85.9Confident85.8Confident139 Ų139103.5 Ų103.560%0.60454%0.539SS*.Hα-helixtrans-60.8-48.7174.2-177.3178.6177.71790111.4A20 A21 A26 A27 D28A20-K24 WeakPolarHBondContact O-CB 2.99Å; A20-K24 PolarHBondContact O-N 3.3Å; A21-K24 PolarHBondContact O-N 3.47Å; K24-A26 VanDerWaalsContact C-N 3.26Å; K24-A26 PolarHBondContact O-N 2.81Å; K24-A27 WeakPolarHBondContact O-CB 3.19Å; K24-A27 PolarHBondContact O-N 3.38Å; K24-D28 VanDerWaalsContact O-CG 3.3Å; K24-D28 PolarHBondContact O-N 2.76Å
25H89Confident84Confident109 Ų109103 Ų10351%0.50554%0.536SS..Hα-helixtrans-59.6-38.1177.2-176.5-93.3000112.2A21 R22 L29A21-H25 WeakPolarHBondContact O-CB 3.2Å; A21-H25 PolarHBondContact O-N 2.8Å; R22-H25 PolarHBondContact O-N 2.85Å; H25-L29 WeakPolarHBondContact O-CB 3.41Å; H25-L29 PolarHBondContact O-N 2.83Å
26A84.1Confident82.3Confident43 Ų43100.9 Ų100.936%0.35554%0.535SS..Hα-helixtrans-66.4-39.4174.400000112.1R22 M23 K24 K30R22-A26 WeakPolarHBondContact O-CB 3.26Å; R22-A26 PolarHBondContact O-N 2.83Å; M23-A26 PolarHBondContact O-N 2.86Å; K24-A26 VanDerWaalsContact C-N 3.26Å; K24-A26 PolarHBondContact O-N 2.81Å; A26-K30 WeakPolarHBondContact O-CB 3.13Å; A26-K30 WeakPolarHBondContact O-CG 3.45Å; A26-K30 PolarHBondContact O-N 3.32Å
27A78.5Confident80.6Confident54 Ų5494.3 Ų94.345%0.44652%0.516SS..Hα-helixtrans-65-46.717500000111.7M23 K24 L29 K30 Q31M23-A27 PolarHBondContact O-N 3.49Å; K24-A27 WeakPolarHBondContact O-CB 3.19Å; K24-A27 PolarHBondContact O-N 3.38Å; A27-L29 VanDerWaalsContact C-N 3.31Å; A27-L29 PolarHBondContact O-N 3.41Å; A27-K30 WeakPolarHBondContact O-CB 3.5Å; A27-K30 PolarHBondContact O-N 2.73Å; A27-Q31 PolarHBondContact O-N 2.69Å
28D82.3Confident78.9Confident62 Ų6297.2 Ų97.233%0.33252%0.522SS..Hα-helixtrans-62-40.6177.1-65.6-13.6000111K24 Q31 K32K24-D28 VanDerWaalsContact O-CG 3.3Å; K24-D28 PolarHBondContact O-N 2.76Å; D28-Q31 PolarHBondContact O-N 3.37Å; D28-K32 WeakPolarHBondContact O-CB 3.27Å; D28-K32 VanDerWaalsContact O-CG 3.28Å; D28-K32 WeakPolarHBondContact O-CG 3.26Å; D28-K32 PolarHBondContact O-N 2.72Å
29L84.7Confident77.2Confident82 Ų82101.3 Ų101.343%0.42954%0.536SS..Hα-helixtrans-66.9-42.1176.6-17162.5000111.5H25 A27 K32 L33H25-L29 WeakPolarHBondContact O-CB 3.41Å; H25-L29 PolarHBondContact O-N 2.83Å; A27-L29 VanDerWaalsContact C-N 3.31Å; A27-L29 PolarHBondContact O-N 3.41Å; L29-K32 PolarHBondContact O-N 3.48Å; L29-L33 HydrophobicContact CD1-CD1 4.41Å; L29-L33 HydrophobicContact CD1-CG 4.49Å; L29-L33 HydrophobicContact CG-CD1 4Å; L29-L33 WeakPolarHBondContact O-CB 3.3Å; L29-L33 WeakPolarHBondContact O-CG 3.37Å; L29-L33 PolarHBondContact O-N 2.68Å
30K74.6Confident75.5Confident123 Ų123102.4 Ų102.454%0.53554%0.539SS..Hα-helixtrans-58.3-47.7173.3-76.1172179.9-172.40111.1A26 A27 K32 L33 V35A26-K30 WeakPolarHBondContact O-CB 3.13Å; A26-K30 WeakPolarHBondContact O-CG 3.45Å; A26-K30 PolarHBondContact O-N 3.32Å; A27-K30 WeakPolarHBondContact O-CB 3.5Å; A27-K30 PolarHBondContact O-N 2.73Å; K30-K32 PolarHBondContact O-N 2.74Å; K30-L33 PolarHBondContact O-N 2.9Å; K30-V35 CarbonylContact C-O 3.55Å; K30-V35 WeakPolarHBondContact O-CB 3.05Å; K30-V35 PolarHBondContact O-N 3.43Å
31Q68.1Low74.3Confident149 Ų149103.5 Ų103.570%0.69654%0.536SS*.Hα-helixtrans-59.9-46.1177.4-174-175.66.700112A27 D28 L33 G34A27-Q31 PolarHBondContact O-N 2.69Å; D28-Q31 PolarHBondContact O-N 3.37Å; Q31-L33 VanDerWaalsContact C-N 3.29Å; Q31-L33 PolarHBondContact O-N 2.67Å; Q31-G34 PolarHBondContact O-N 2.79Å; Q31-G34 VanDerWaalsContact O-N 3.14Å
32K76.1Confident73Confident176 Ų176106.1 Ų106.177%0.76554%0.538SS*.Hα-helixtrans-63.8-33.5177.9-76.4175.9-179.2-178.70113.1D28 L29 K30 G34D28-K32 WeakPolarHBondContact O-CB 3.27Å; D28-K32 VanDerWaalsContact O-CG 3.28Å; D28-K32 WeakPolarHBondContact O-CG 3.26Å; D28-K32 PolarHBondContact O-N 2.72Å; L29-K32 PolarHBondContact O-N 3.48Å; K30-K32 PolarHBondContact O-N 2.74Å; K32-G34 PolarHBondContact O-N 2.69Å
33L75.8Confident71.7Confident118 Ų118103.6 Ų103.662%0.61853%0.534SS*.THydrogen-bonded Turntrans-74.82.6178.1-71.3170.2000112.7L29 K30 Q31 V35L29-L33 HydrophobicContact CD1-CD1 4.41Å; L29-L33 HydrophobicContact CD1-CG 4.49Å; L29-L33 HydrophobicContact CG-CD1 4Å; L29-L33 WeakPolarHBondContact O-CB 3.3Å; L29-L33 WeakPolarHBondContact O-CG 3.37Å; L29-L33 PolarHBondContact O-N 2.68Å; K30-L33 PolarHBondContact O-N 2.9Å; Q31-L33 VanDerWaalsContact C-N 3.29Å; Q31-L33 PolarHBondContact O-N 2.67Å; L33-V35 HydrophobicContact CB-CG2 3.76Å; L33-V35 PolarHBondContact O-N 3.13Å
34G62.4Low71.1Confident66 Ų66102.6 Ų102.668%0.6853%0.531SS*.THydrogen-bonded Turntrans63.89.9-175.700000112.5Q31 K32 G36Q31-G34 PolarHBondContact O-N 2.79Å; Q31-G34 VanDerWaalsContact O-N 3.14Å; K32-G34 PolarHBondContact O-N 2.69Å; G34-G36 PolarHBondContact O-N 2.82Å
35V58.7Low70.5Confident68 Ų6899.8 Ų99.841%0.41253%0.525SS..  trans-69.690162.7-171.70000101.4K30 L33 P37K30-V35 CarbonylContact C-O 3.55Å; K30-V35 WeakPolarHBondContact O-CB 3.05Å; K30-V35 PolarHBondContact O-N 3.43Å; L33-V35 HydrophobicContact CB-CG2 3.76Å; L33-V35 PolarHBondContact O-N 3.13Å; V35-P37 HydrophobicContact CB-CG 4.04Å; V35-P37 VanDerWaalsContact CG1-CD 3.45Å; V35-P37 HydrophobicContact CG1-CG 3.15Å; V35-P37 WeakPolarHBondContact O-CD 3.18Å
36G62.7Low69.6Low41 Ų4198 Ų9842%0.42353%0.525SS..  trans-93.333.5174.100000114.8G34G34-G36 PolarHBondContact O-N 2.82Å
37P55.7Low69.1Low42 Ų42100.1 Ų100.127%0.27353%0.528SS..Hα-helixtrans-115.35.3-152.218.111.6000110.6V35 I41V35-P37 HydrophobicContact CB-CG 4.04Å; V35-P37 VanDerWaalsContact CG1-CD 3.45Å; V35-P37 HydrophobicContact CG1-CG 3.15Å; V35-P37 WeakPolarHBondContact O-CD 3.18Å; P37-I41 HydrophobicContact CB-CD1 4.3Å; P37-I41 WeakPolarHBondContact O-CA 3.11Å; P37-I41 WeakPolarHBondContact O-CB 3.17Å; P37-I41 WeakPolarHBondContact O-CD1 3.24Å; P37-I41 WeakPolarHBondContact O-CG1 3.43Å; P37-I41 PolarHBondContact O-N 3.45Å
38W59.1Low68.7Low179 Ų17999.1 Ų99.168%0.67852%0.523SS*.Hα-helixtrans-79.3-30.8170.4-169.3-96.3000110.7I41 Q42W38-I41 HydrophobicContact CE3-CG2 4.46Å; W38-I41 HydrophobicContact CZ3-CG2 4.4Å; W38-Q42 WeakPolarHBondContact O-CA 3.22Å; W38-Q42 WeakPolarHBondContact O-CB 3.25Å; W38-Q42 PolarHBondContact O-N 3.04Å
39Q60.8Low68.1Low155 Ų155101.5 Ų101.572%0.72453%0.534SS*.Hα-helixtrans-70-43.5172.5-71.3176.6-50.300110.4Q42 Q43Q39-Q42 PolarHBondContact O-N 3.39Å; Q39-Q43 WeakPolarHBondContact O-CB 3.18Å; Q39-Q43 PolarHBondContact O-N 3.46Å
40E62.7Low67.3Low121 Ų121103.4 Ų103.457%0.56554%0.535SS*.Hα-helixtrans-64.8-46.9173.2-64.6173.4-165.700111.4Q42 Q43 D44E40-Q42 PolarHBondContact O-N 2.7Å; E40-Q43 CarbonylContact O-C 3.5Å; E40-Q43 PolarHBondContact O-N 2.83Å; E40-D44 VanDerWaalsContact O-CB 3.28Å; E40-D44 WeakPolarHBondContact O-CB 3.36Å; E40-D44 PolarHBondContact O-N 2.94Å
41I65.5Low67Low81 Ų81104.2 Ų104.242%0.41554%0.539SS..Hα-helixtrans-65.1-40176.1-69.3163.2000111.5P37 W38 Q43 D44 V45P37-I41 HydrophobicContact CB-CD1 4.3Å; P37-I41 WeakPolarHBondContact O-CA 3.11Å; P37-I41 WeakPolarHBondContact O-CB 3.17Å; P37-I41 WeakPolarHBondContact O-CD1 3.24Å; P37-I41 WeakPolarHBondContact O-CG1 3.43Å; P37-I41 PolarHBondContact O-N 3.45Å; W38-I41 HydrophobicContact CE3-CG2 4.46Å; W38-I41 HydrophobicContact CZ3-CG2 4.4Å; I41-Q43 VanDerWaalsContact C-N 3.28Å; I41-Q43 PolarHBondContact O-N 2.9Å; I41-D44 PolarHBondContact O-N 2.84Å; I41-V45 HydrophobicContact CG2-CG2 3.97Å; I41-V45 WeakPolarHBondContact O-CB 3.22Å; I41-V45 WeakPolarHBondContact O-CG2 3.17Å; I41-V45 PolarHBondContact O-N 3.47Å
42Q66.4Low66.5Low116 Ų116100.5 Ų100.554%0.54253%0.527SS..Hα-helixtrans-64.7-39176.1-179.1-179.6-14.500110.3W38 Q39 E40 S46W38-Q42 WeakPolarHBondContact O-CA 3.22Å; W38-Q42 WeakPolarHBondContact O-CB 3.25Å; W38-Q42 PolarHBondContact O-N 3.04Å; Q39-Q42 PolarHBondContact O-N 3.39Å; E40-Q42 PolarHBondContact O-N 2.7Å; Q42-S46 WeakPolarHBondContact O-CB 3.36Å; Q42-S46 PolarHBondContact O-N 3.01Å
43Q68.4Low65.6Low120 Ų12099.3 Ų99.356%0.56152%0.522SS*.Hα-helixtrans-69-46.3175.8-169.7169400110.8Q39 E40 I41 V45 S46 E47Q39-Q43 WeakPolarHBondContact O-CB 3.18Å; Q39-Q43 PolarHBondContact O-N 3.46Å; E40-Q43 CarbonylContact O-C 3.5Å; E40-Q43 PolarHBondContact O-N 2.83Å; I41-Q43 VanDerWaalsContact C-N 3.28Å; I41-Q43 PolarHBondContact O-N 2.9Å; Q43-V45 PolarHBondContact O-N 2.73Å; Q43-S46 CarbonylContact O-C 3.53Å; Q43-S46 PolarHBondContact O-N 2.7Å; Q43-E47 HydrophobicContact CG-CG 4.35Å; Q43-E47 VanDerWaalsContact O-CB 3.25Å; Q43-E47 WeakPolarHBondContact O-CB 3.15Å; Q43-E47 VanDerWaalsContact O-CG 3.26Å; Q43-E47 WeakPolarHBondContact O-CG 3.12Å; Q43-E47 PolarHBondContact O-N 3.5Å
44D72.4Confident64.8Low111 Ų11198.9 Ų98.959%0.59452%0.516SS*.Hα-helixtrans-66.6-34.3177.9-71.7-13.6000112.7E40 I41 G48E40-D44 VanDerWaalsContact O-CB 3.28Å; E40-D44 WeakPolarHBondContact O-CB 3.36Å; E40-D44 PolarHBondContact O-N 2.94Å; I41-D44 PolarHBondContact O-N 2.84Å; D44-G48 VanDerWaalsContact O-CA 3.3Å; D44-G48 WeakPolarHBondContact O-CA 3.47Å; D44-G48 PolarHBondContact O-N 3.34Å
45V72.6Confident64.5Low80 Ų8097.6 Ų97.649%0.48550%0.497SS..Hα-helixtrans-74-41172.8170.80000109.9I41 Q43 G48 I49I41-V45 HydrophobicContact CG2-CG2 3.97Å; I41-V45 WeakPolarHBondContact O-CB 3.22Å; I41-V45 WeakPolarHBondContact O-CG2 3.17Å; I41-V45 PolarHBondContact O-N 3.47Å; Q43-V45 PolarHBondContact O-N 2.73Å; V45-G48 PolarHBondContact O-N 2.95Å; V45-I49 HydrophobicContact CG1-CD1 3.71Å; V45-I49 HydrophobicContact CG1-CG1 4.3Å; V45-I49 VanDerWaalsContact O-CB 3.27Å; V45-I49 WeakPolarHBondContact O-CB 3.22Å; V45-I49 WeakPolarHBondContact O-CD1 3.33Å; V45-I49 WeakPolarHBondContact O-CG1 3.2Å; V45-I49 PolarHBondContact O-N 2.97Å
46S69.9Low64.5Low70 Ų70101.7 Ų101.749%0.4951%0.511SS..Hα-helixtrans-64.2-44.9175.9-174.60000111.2Q42 Q43 R50Q42-S46 WeakPolarHBondContact O-CB 3.36Å; Q42-S46 PolarHBondContact O-N 3.01Å; Q43-S46 CarbonylContact O-C 3.53Å; Q43-S46 PolarHBondContact O-N 2.7Å; S46-R50 WeakPolarHBondContact O-CB 3.43Å; S46-R50 PolarHBondContact O-N 3.26Å
47E73.8Confident64.2Low89 Ų89102.9 Ų102.942%0.41652%0.517SS..Hα-helixtrans-71-34.4175.3-69.8-56.6148.600111.3Q43 R50 F51Q43-E47 HydrophobicContact CG-CG 4.35Å; Q43-E47 VanDerWaalsContact O-CB 3.25Å; Q43-E47 WeakPolarHBondContact O-CB 3.15Å; Q43-E47 VanDerWaalsContact O-CG 3.26Å; Q43-E47 WeakPolarHBondContact O-CG 3.12Å; Q43-E47 PolarHBondContact O-N 3.5Å; E47-R50 CarbonylContact O-C 3.58Å; E47-R50 PolarHBondContact O-N 2.66Å; E47-F51 WeakPolarHBondContact O-CA 3.04Å; E47-F51 WeakPolarHBondContact O-CB 3.1Å; E47-F51 PolarHBondContact O-N 3.33Å
48G70.4Confident63.9Low33 Ų33107.5 Ų107.534%0.3453%0.53SS..Hα-helixtrans-68.3-41.9174.300000112.2D44 V45 R50 V52D44-G48 VanDerWaalsContact O-CA 3.3Å; D44-G48 WeakPolarHBondContact O-CA 3.47Å; D44-G48 PolarHBondContact O-N 3.34Å; V45-G48 PolarHBondContact O-N 2.95Å; G48-R50 VanDerWaalsContact C-N 3.32Å; G48-V52 WeakPolarHBondContact O-CB 3.2Å; G48-V52 VanDerWaalsContact O-CG2 3.25Å; G48-V52 WeakPolarHBondContact O-CG2 3.23Å; G48-V52 PolarHBondContact O-N 3.5Å
49I69.7Low64Low112 Ų112104.3 Ų104.357%0.57452%0.523SS*.Hα-helixtrans-63.6-41.4171.5-71.5167.9000109.9V45 V52 K53V45-I49 HydrophobicContact CG1-CD1 3.71Å; V45-I49 HydrophobicContact CG1-CG1 4.3Å; V45-I49 VanDerWaalsContact O-CB 3.27Å; V45-I49 WeakPolarHBondContact O-CB 3.22Å; V45-I49 WeakPolarHBondContact O-CD1 3.33Å; V45-I49 WeakPolarHBondContact O-CG1 3.2Å; V45-I49 PolarHBondContact O-N 2.97Å; I49-V52 PolarHBondContact O-N 3.24Å; I49-K53 VanDerWaalsContact O-CB 3.23Å; I49-K53 WeakPolarHBondContact O-CB 3.42Å; I49-K53 PolarHBondContact O-N 3.35Å
50R68.4Low63.8Low121 Ų12199.7 Ų99.746%0.45751%0.511SS..Hα-helixtrans-68.9-43.6178.8-170.6175.5179.9-150.6-8.7112S46 E47 G48 V52 K53 E54S46-R50 WeakPolarHBondContact O-CB 3.43Å; S46-R50 PolarHBondContact O-N 3.26Å; E47-R50 CarbonylContact O-C 3.58Å; E47-R50 PolarHBondContact O-N 2.66Å; G48-R50 VanDerWaalsContact C-N 3.32Å; R50-V52 VanDerWaalsContact C-N 3.33Å; R50-V52 PolarHBondContact O-N 3.42Å; R50-K53 CarbonylContact O-C 3.57Å; R50-K53 WeakPolarHBondContact O-CA 3.44Å; R50-K53 WeakPolarHBondContact O-CB 3.37Å; R50-K53 PolarHBondContact O-N 2.76Å; R50-K53 VanDerWaalsContact O-N 3.12Å; R50-E54 HydrophobicContact CG-CG 4.31Å; R50-E54 WeakPolarHBondContact CG-OE1 3.25Å; R50-E54 IonicContact CZ-OE1 3.48Å; R50-E54 VanDerWaalsContact CZ-OE1 3.31Å; R50-E54 IonicContact NE-OE1 3.69Å; R50-E54 PolarHBondContact NE-OE1 3.12Å; R50-E54 IonicContact NH2-OE1 3.85Å; R50-E54 PolarHBondContact NH2-OE1 2.63Å; R50-E54 WeakPolarHBondContact O-CB 3.5Å; R50-E54 WeakPolarHBondContact O-CG 2.76Å; R50-E54 PolarHBondContact O-N 2.92Å
51F67.5Low63.5Low141 Ų14197.9 Ų97.962%0.61851%0.508SS*.Hα-helixtrans-63.3-41.6174.9-178.2-98.9000109.8E47 K53 E54 S55E47-F51 WeakPolarHBondContact O-CA 3.04Å; E47-F51 WeakPolarHBondContact O-CB 3.1Å; E47-F51 PolarHBondContact O-N 3.33Å; F51-K53 VanDerWaalsContact C-N 3.29Å; F51-K53 PolarHBondContact O-N 2.97Å; F51-E54 PolarHBondContact O-N 3.42Å; F51-S55 WeakPolarHBondContact O-CA 3.33Å; F51-S55 WeakPolarHBondContact O-CB 3.49Å; F51-S55 PolarHBondContact O-N 3.43Å
52V57Low63.3Low71 Ų7197.7 Ų97.743%0.4351%0.508SS..Hα-helixtrans-66.7-34174.5166.60000111.7G48 I49 R50 Y58G48-V52 WeakPolarHBondContact O-CB 3.2Å; G48-V52 VanDerWaalsContact O-CG2 3.25Å; G48-V52 WeakPolarHBondContact O-CG2 3.23Å; G48-V52 PolarHBondContact O-N 3.5Å; I49-V52 PolarHBondContact O-N 3.24Å; R50-V52 VanDerWaalsContact C-N 3.33Å; R50-V52 PolarHBondContact O-N 3.42Å; V52-Y58 HydrophobicContact CG1-CD2 3.62Å; V52-Y58 HydrophobicContact CG1-CE2 3.23Å; V52-Y58 WeakPolarHBondContact O-CD2 3.15Å
53K57.9Low63.1Low151 Ų15196.1 Ų96.166%0.65750%0.504SS*.Hα-helixtrans-72.1-35.8176.7-172.4178.1180-177.30113.3I49 R50 F51I49-K53 VanDerWaalsContact O-CB 3.23Å; I49-K53 WeakPolarHBondContact O-CB 3.42Å; I49-K53 PolarHBondContact O-N 3.35Å; R50-K53 CarbonylContact O-C 3.57Å; R50-K53 WeakPolarHBondContact O-CA 3.44Å; R50-K53 WeakPolarHBondContact O-CB 3.37Å; R50-K53 PolarHBondContact O-N 2.76Å; R50-K53 VanDerWaalsContact O-N 3.12Å; F51-K53 VanDerWaalsContact C-N 3.29Å; F51-K53 PolarHBondContact O-N 2.97Å
54E59.2Low63.1Low108 Ų10896.1 Ų96.151%0.50551%0.507SS..Hα-helixtrans-93.3-28.6-179.4-68.5179.5-175.300112.3R50 F51R50-E54 HydrophobicContact CG-CG 4.31Å; R50-E54 WeakPolarHBondContact CG-OE1 3.25Å; R50-E54 IonicContact CZ-OE1 3.48Å; R50-E54 VanDerWaalsContact CZ-OE1 3.31Å; R50-E54 IonicContact NE-OE1 3.69Å; R50-E54 PolarHBondContact NE-OE1 3.12Å; R50-E54 IonicContact NH2-OE1 3.85Å; R50-E54 PolarHBondContact NH2-OE1 2.63Å; R50-E54 WeakPolarHBondContact O-CB 3.5Å; R50-E54 WeakPolarHBondContact O-CG 2.76Å; R50-E54 PolarHBondContact O-N 2.92Å; F51-E54 PolarHBondContact O-N 3.42Å
55S55.3Low62.9Low40 Ų4095.3 Ų95.328%0.2850%0.502SS..SBendtrans-74.7137.1177.7-176.70000109.3F51 A57 Y58F51-S55 WeakPolarHBondContact O-CA 3.33Å; F51-S55 WeakPolarHBondContact O-CB 3.49Å; F51-S55 PolarHBondContact O-N 3.43Å; S55-A57 PolarHBondContact O-N 3.48Å; S55-Y58 PolarHBondContact O-N 2.86Å
56E58.5Low62.7Low153 Ų15396.7 Ų96.772%0.71550%0.503SS*.Hα-helixtrans-60.3-2.1-161.3-58.1-179.5151.400115Y58 H59 A60E56-Y58 PolarHBondContact O-N 2.76Å; E56-H59 CarbonylContact O-C 3.53Å; E56-H59 PolarHBondContact O-N 3.49Å; E56-A60 WeakPolarHBondContact O-CA 3.27Å; E56-A60 WeakPolarHBondContact O-CB 3.14Å; E56-A60 PolarHBondContact O-N 2.78Å
57A56.8Low62.6Low66 Ų6698.9 Ų98.955%0.54551%0.505SS..Hα-helixtrans-64-38.8173.300000112.6S55 T61S55-A57 PolarHBondContact O-N 3.48Å; A57-T61 PolarHBondContact O-N 2.88Å; A57-T61 PolarHBondContact O-OG1 3.33Å
58Y50.5Low62Low139 Ų13997.5 Ų97.555%0.54551%0.509SS..Hα-helixtrans-74-38172.3-90.2-96.3000111.5V52 S55 E56 N62V52-Y58 HydrophobicContact CG1-CD2 3.62Å; V52-Y58 HydrophobicContact CG1-CE2 3.23Å; V52-Y58 WeakPolarHBondContact O-CD2 3.15Å; S55-Y58 PolarHBondContact O-N 2.86Å; E56-Y58 PolarHBondContact O-N 2.76Å; Y58-N62 WeakPolarHBondContact O-CB 3.45Å; Y58-N62 PolarHBondContact O-N 2.8Å; Y58-N62 PolarHBondContact O-ND2 2.67Å
59H59.3Low61.8Low112 Ų11299.4 Ų99.452%0.51951%0.514SS..Hα-helixtrans-69.3-36.8176-75.6-67.8000112.9E56 N62 D63E56-H59 CarbonylContact O-C 3.53Å; E56-H59 PolarHBondContact O-N 3.49Å; H59-N62 CarbonylContact O-C 3.57Å; H59-N62 PolarHBondContact O-N 3.01Å; H59-D63 WeakPolarHBondContact O-CA 3.18Å; H59-D63 WeakPolarHBondContact O-CB 3.3Å; H59-D63 PolarHBondContact O-N 2.71Å
60A57.6Low61.6Low59 Ų5998.6 Ų98.649%0.48851%0.511SS..Hα-helixtrans-69.2-35.5178.100000111.3E56 L64E56-A60 WeakPolarHBondContact O-CA 3.27Å; E56-A60 WeakPolarHBondContact O-CB 3.14Å; E56-A60 PolarHBondContact O-N 2.78Å; A60-L64 WeakPolarHBondContact O-CB 3.49Å; A60-L64 PolarHBondContact O-N 2.86Å
61T57.1Low61.6Low82 Ų8295.5 Ų95.550%0.50351%0.511SS..Hα-helixtrans-71.5-43.3173-52.70000110.9A57 D63 L64 I65A57-T61 PolarHBondContact O-N 2.88Å; A57-T61 PolarHBondContact O-OG1 3.33Å; T61-D63 PolarHBondContact O-N 3.39Å; T61-L64 PolarHBondContact O-N 3.22Å; T61-I65 HydrophobicContact CG2-CD1 3.87Å; T61-I65 HydrophobicContact CG2-CG1 4.48Å; T61-I65 WeakPolarHBondContact O-CB 3.07Å; T61-I65 WeakPolarHBondContact O-CG1 3.26Å; T61-I65 PolarHBondContact O-N 2.71Å
62N59.8Low61.7Low77 Ų7794.9 Ų94.941%0.41251%0.514SS..Hα-helixtrans-67.3-34.2176.3-77.7-21.2000112.7Y58 H59 Q66Y58-N62 WeakPolarHBondContact O-CB 3.45Å; Y58-N62 PolarHBondContact O-N 2.8Å; Y58-N62 PolarHBondContact O-ND2 2.67Å; H59-N62 CarbonylContact O-C 3.57Å; H59-N62 PolarHBondContact O-N 3.01Å; N62-Q66 WeakPolarHBondContact O-CB 3.25Å; N62-Q66 WeakPolarHBondContact O-CG 3.13Å; N62-Q66 PolarHBondContact O-N 3.46Å; N62-Q66 PolarHBondContact O-NE2 2.82Å
63D63.9Low62Low83 Ų8395 Ų9544%0.44452%0.515SS..Hα-helixtrans-75.7-37.1178.1-163.957.4000110.5H59 T61 Q66 Q67H59-D63 WeakPolarHBondContact O-CA 3.18Å; H59-D63 WeakPolarHBondContact O-CB 3.3Å; H59-D63 PolarHBondContact O-N 2.71Å; T61-D63 PolarHBondContact O-N 3.39Å; D63-Q66 PolarHBondContact O-N 2.76Å; D63-Q67 VanDerWaalsContact O-CB 3.22Å; D63-Q67 WeakPolarHBondContact O-CB 3.18Å; D63-Q67 WeakPolarHBondContact O-CG 3.28Å; D63-Q67 PolarHBondContact O-N 3.2Å; D63-Q67 PolarHBondContact OD2-NE2 3.48Å
64L67.3Low62.4Low120 Ų12091 Ų9163%0.62850%0.503SS*.Hα-helixtrans-67.3-41.2172.2-175.464.7000111.9A60 T61 A68A60-L64 WeakPolarHBondContact O-CB 3.49Å; A60-L64 PolarHBondContact O-N 2.86Å; T61-L64 PolarHBondContact O-N 3.22Å; L64-A68 WeakPolarHBondContact O-CB 2.95Å; L64-A68 PolarHBondContact O-N 3.47Å
65I68.9Low62.8Low95 Ų9590.1 Ų90.149%0.48751%0.505SS..Hα-helixtrans-67.9-41.1175.4-69.4171.9000110.6T61 A68 T69T61-I65 HydrophobicContact CG2-CD1 3.87Å; T61-I65 HydrophobicContact CG2-CG1 4.48Å; T61-I65 WeakPolarHBondContact O-CB 3.07Å; T61-I65 WeakPolarHBondContact O-CG1 3.26Å; T61-I65 PolarHBondContact O-N 2.71Å; I65-A68 PolarHBondContact O-N 2.74Å; I65-T69 VanDerWaalsContact O-CB 3.22Å; I65-T69 WeakPolarHBondContact O-CB 3.12Å; I65-T69 PolarHBondContact O-N 3.45Å; I65-T69 PolarHBondContact O-OG1 2.85Å
66Q67.5Low63Low109 Ų10990.1 Ų90.151%0.50951%0.511SS..Hα-helixtrans-66.9-45.7175.3-79.6172.189.100111.2N62 D63 A68 T69 D70N62-Q66 WeakPolarHBondContact O-CB 3.25Å; N62-Q66 WeakPolarHBondContact O-CG 3.13Å; N62-Q66 PolarHBondContact O-N 3.46Å; N62-Q66 PolarHBondContact O-NE2 2.82Å; D63-Q66 PolarHBondContact O-N 2.76Å; Q66-A68 VanDerWaalsContact C-N 3.32Å; Q66-A68 PolarHBondContact O-N 3.45Å; Q66-T69 CarbonylContact O-C 3.59Å; Q66-T69 PolarHBondContact O-N 2.7Å; Q66-T69 VanDerWaalsContact O-N 3.13Å; Q66-D70 VanDerWaalsContact O-CB 3.25Å; Q66-D70 WeakPolarHBondContact O-CB 3.41Å; Q66-D70 VanDerWaalsContact O-CG 3.3Å; Q66-D70 PolarHBondContact O-N 3.01Å
67Q67.4Low63.1Low115 Ų11585.5 Ų85.554%0.53750%0.496SS..Hα-helixtrans-60.5-40.6173.5-82.1-176.428.600112.1D63 A71D63-Q67 VanDerWaalsContact O-CB 3.22Å; D63-Q67 WeakPolarHBondContact O-CB 3.18Å; D63-Q67 WeakPolarHBondContact O-CG 3.28Å; D63-Q67 PolarHBondContact O-N 3.2Å; D63-Q67 PolarHBondContact OD2-NE2 3.48Å; Q67-A71 WeakPolarHBondContact O-CB 3.03Å; Q67-A71 PolarHBondContact O-N 3.36Å
68A61.8Low63.3Low60 Ų6088.8 Ų88.850%0.49650%0.498SS..Hα-helixtrans-65.2-41174.900000111.3L64 I65 Q66 L72L64-A68 WeakPolarHBondContact O-CB 2.95Å; L64-A68 PolarHBondContact O-N 3.47Å; I65-A68 PolarHBondContact O-N 2.74Å; Q66-A68 VanDerWaalsContact C-N 3.32Å; Q66-A68 PolarHBondContact O-N 3.45Å; A68-L72 WeakPolarHBondContact O-CB 3.14Å; A68-L72 PolarHBondContact O-N 3Å
69T65.5Low64Low73 Ų7386.5 Ų86.545%0.44850%0.498SS..Hα-helixtrans-68.5-40.8177.4-59.50000111.4I65 Q66 L72 T73I65-T69 VanDerWaalsContact O-CB 3.22Å; I65-T69 WeakPolarHBondContact O-CB 3.12Å; I65-T69 PolarHBondContact O-N 3.45Å; I65-T69 PolarHBondContact O-OG1 2.85Å; Q66-T69 CarbonylContact O-C 3.59Å; Q66-T69 PolarHBondContact O-N 2.7Å; Q66-T69 VanDerWaalsContact O-N 3.13Å; T69-L72 PolarHBondContact O-N 2.79Å; T69-T73 WeakPolarHBondContact O-CB 2.93Å; T69-T73 PolarHBondContact O-N 3.48Å; T69-T73 PolarHBondContact O-OG1 3.29Å
70D67.5Low64.4Low96 Ų9684.6 Ų84.651%0.51350%0.498SS..Hα-helixtrans-73.1-37.6178.9-76.3-15.9000111Q66 T73 T74Q66-D70 VanDerWaalsContact O-CB 3.25Å; Q66-D70 WeakPolarHBondContact O-CB 3.41Å; Q66-D70 VanDerWaalsContact O-CG 3.3Å; Q66-D70 PolarHBondContact O-N 3.01Å; D70-T73 PolarHBondContact O-N 2.98Å; D70-T74 WeakPolarHBondContact O-CA 3.18Å; D70-T74 WeakPolarHBondContact O-CB 3.32Å; D70-T74 PolarHBondContact O-N 3.5Å; D70-T74 PolarHBondContact O-OG1 3.25Å
71A66.9Low65Low55 Ų5586.8 Ų86.846%0.45550%0.501SS..Hα-helixtrans-64.9-44.9171.500000110.6Q67 T74 V75Q67-A71 WeakPolarHBondContact O-CB 3.03Å; Q67-A71 PolarHBondContact O-N 3.36Å; A71-T74 PolarHBondContact O-N 3.47Å; A71-V75 WeakPolarHBondContact O-CB 3.28Å; A71-V75 VanDerWaalsContact O-CG2 3.24Å; A71-V75 WeakPolarHBondContact O-CG2 3.47Å; A71-V75 PolarHBondContact O-N 2.97Å
72L69.1Low65.7Low129 Ų12989.7 Ų89.768%0.67551%0.507SS*.Hα-helixtrans-64.5-41.4176.4-175.762.2000111.7A68 T69 G76A68-L72 WeakPolarHBondContact O-CB 3.14Å; A68-L72 PolarHBondContact O-N 3Å; T69-L72 PolarHBondContact O-N 2.79Å; L72-G76 WeakPolarHBondContact O-CA 3.5Å; L72-G76 PolarHBondContact O-N 3.39Å
73T64.7Low66.5Low74 Ų7491.1 Ų91.145%0.45451%0.509SS..Hα-helixtrans-71-35.9177.5-57.60000111T69 D70 S77T69-T73 WeakPolarHBondContact O-CB 2.93Å; T69-T73 PolarHBondContact O-N 3.48Å; T69-T73 PolarHBondContact O-OG1 3.29Å; D70-T73 PolarHBondContact O-N 2.98Å; T73-S77 WeakPolarHBondContact O-CA 3.44Å; T73-S77 WeakPolarHBondContact O-CB 3.31Å; T73-S77 PolarHBondContact O-N 3.05Å; T73-S77 PolarHBondContact O-OG 3.02Å
74T66.4Low67Low67 Ų6788.5 Ų88.541%0.41150%0.502SS..Hα-helixtrans-71.4-41176.6-64.10000111D70 A71 K78D70-T74 WeakPolarHBondContact O-CA 3.18Å; D70-T74 WeakPolarHBondContact O-CB 3.32Å; D70-T74 PolarHBondContact O-N 3.5Å; D70-T74 PolarHBondContact O-OG1 3.25Å; A71-T74 PolarHBondContact O-N 3.47Å; T74-K78 HydrophobicContact CG2-CD 4.25Å; T74-K78 VanDerWaalsContact O-CB 3.3Å; T74-K78 WeakPolarHBondContact O-CB 3.48Å; T74-K78 VanDerWaalsContact O-CG 3.27Å; T74-K78 WeakPolarHBondContact O-CG 3.44Å; T74-K78 PolarHBondContact O-N 3.19Å
75V68.1Low67.1Low88 Ų8888.6 Ų88.653%0.53350%0.499SS..Hα-helixtrans-68.1-43.7173.11740000109.9A71 S77 K78 V79A71-V75 WeakPolarHBondContact O-CB 3.28Å; A71-V75 VanDerWaalsContact O-CG2 3.24Å; A71-V75 WeakPolarHBondContact O-CG2 3.47Å; A71-V75 PolarHBondContact O-N 2.97Å; V75-S77 VanDerWaalsContact C-N 3.33Å; V75-S77 PolarHBondContact O-N 2.7Å; V75-K78 PolarHBondContact O-N 3.34Å; V75-V79 HydrophobicContact CG1-CG2 4.4Å; V75-V79 WeakPolarHBondContact O-CB 3.36Å; V75-V79 VanDerWaalsContact O-CG2 3.26Å; V75-V79 WeakPolarHBondContact O-CG2 3.21Å; V75-V79 PolarHBondContact O-N 3.11Å
76G59.5Low67.4Low41 Ų4188.8 Ų88.842%0.42350%0.501SS..Hα-helixtrans-59.1-41.1174.200000112.8L72 S80L72-G76 WeakPolarHBondContact O-CA 3.5Å; L72-G76 PolarHBondContact O-N 3.39Å; G76-S80 WeakPolarHBondContact O-CB 3.39Å; G76-S80 PolarHBondContact O-N 2.91Å
77S60.6Low67.7Low55 Ų5589.5 Ų89.539%0.38550%0.499SS..Hα-helixtrans-74.6-38.4177.6-60.30000112.1T73 V75 S80 N81T73-S77 WeakPolarHBondContact O-CA 3.44Å; T73-S77 WeakPolarHBondContact O-CB 3.31Å; T73-S77 PolarHBondContact O-N 3.05Å; T73-S77 PolarHBondContact O-OG 3.02Å; V75-S77 VanDerWaalsContact C-N 3.33Å; V75-S77 PolarHBondContact O-N 2.7Å; S77-S80 PolarHBondContact O-N 3.38Å; S77-N81 VanDerWaalsContact O-CB 3.26Å; S77-N81 WeakPolarHBondContact O-CB 3.41Å; S77-N81 PolarHBondContact O-N 3Å; S77-N81 PolarHBondContact O-ND2 3.36Å
78K59.5Low68Low135 Ų13588.4 Ų88.459%0.58750%0.5SS*.Hα-helixtrans-64.3-41.9173.2-78.5177.8-174.9178.50110.9T74 V75 K82T74-K78 HydrophobicContact CG2-CD 4.25Å; T74-K78 VanDerWaalsContact O-CB 3.3Å; T74-K78 WeakPolarHBondContact O-CB 3.48Å; T74-K78 VanDerWaalsContact O-CG 3.27Å; T74-K78 WeakPolarHBondContact O-CG 3.44Å; T74-K78 PolarHBondContact O-N 3.19Å; V75-K78 PolarHBondContact O-N 3.34Å; K78-K82 VanDerWaalsContact O-CB 3.28Å; K78-K82 WeakPolarHBondContact O-CB 3.43Å; K78-K82 WeakPolarHBondContact O-CG 3.48Å; K78-K82 PolarHBondContact O-N 2.99Å
79V65.6Low69Low91 Ų9187.7 Ų87.755%0.55249%0.49SS*.Hα-helixtrans-68-41.9175174.10000110.8V75 N81 K82 F83V75-V79 HydrophobicContact CG1-CG2 4.4Å; V75-V79 WeakPolarHBondContact O-CB 3.36Å; V75-V79 VanDerWaalsContact O-CG2 3.26Å; V75-V79 WeakPolarHBondContact O-CG2 3.21Å; V75-V79 PolarHBondContact O-N 3.11Å; V79-N81 PolarHBondContact O-N 3.12Å; V79-K82 PolarHBondContact O-N 3.45Å; V79-F83 WeakPolarHBondContact O-CB 3.47Å; V79-F83 PolarHBondContact O-N 2.91Å
80S68Low69.6Low73 Ų7389.1 Ų89.151%0.5150%0.5SS..Hα-helixtrans-60.6-45175.3-174.80000111.9G76 S77 F83 G84G76-S80 WeakPolarHBondContact O-CB 3.39Å; G76-S80 PolarHBondContact O-N 2.91Å; S77-S80 PolarHBondContact O-N 3.38Å; S80-F83 PolarHBondContact O-N 3.25Å; S80-G84 PolarHBondContact O-N 3.46Å
81N70.6Confident70.1Confident104 Ų10488 Ų8856%0.55651%0.505SS*.Hα-helixtrans-67.8-41.5176.7-69.8-10.5000111.5S77 V79 F83 G84 Q85S77-N81 VanDerWaalsContact O-CB 3.26Å; S77-N81 WeakPolarHBondContact O-CB 3.41Å; S77-N81 PolarHBondContact O-N 3Å; S77-N81 PolarHBondContact O-ND2 3.36Å; V79-N81 PolarHBondContact O-N 3.12Å; N81-F83 VanDerWaalsContact C-N 3.32Å; N81-F83 PolarHBondContact O-N 2.87Å; N81-G84 PolarHBondContact O-N 3.38Å; N81-Q85 WeakPolarHBondContact O-CB 3.49Å; N81-Q85 WeakPolarHBondContact O-CG 3.42Å; N81-Q85 PolarHBondContact O-N 2.79Å
82K71.1Confident70.9Confident143 Ų14389.1 Ų89.162%0.62250%0.5SS*.Hα-helixtrans-62.8-40.1173.3-68.9-99-168.2-170.20110.9K78 V79 Q85 L86K78-K82 VanDerWaalsContact O-CB 3.28Å; K78-K82 WeakPolarHBondContact O-CB 3.43Å; K78-K82 WeakPolarHBondContact O-CG 3.48Å; K78-K82 PolarHBondContact O-N 2.99Å; V79-K82 PolarHBondContact O-N 3.45Å; K82-Q85 CarbonylContact O-C 3.52Å; K82-Q85 WeakPolarHBondContact O-CB 3.42Å; K82-Q85 PolarHBondContact O-N 3.23Å; K82-L86 WeakPolarHBondContact O-CB 3.28Å; K82-L86 VanDerWaalsContact O-CG 3.24Å; K82-L86 WeakPolarHBondContact O-CG 3.21Å; K82-L86 PolarHBondContact O-N 2.88Å
83F77.7Confident71.4Confident107 Ų10788.3 Ų88.347%0.46949%0.49SS..Hα-helixtrans-70.9-39179.4-173.9-116.2000112.1V79 S80 N81 L86 R87V79-F83 WeakPolarHBondContact O-CB 3.47Å; V79-F83 PolarHBondContact O-N 2.91Å; S80-F83 PolarHBondContact O-N 3.25Å; N81-F83 VanDerWaalsContact C-N 3.32Å; N81-F83 PolarHBondContact O-N 2.87Å; F83-L86 WeakPolarHBondContact O-CB 3.48Å; F83-L86 PolarHBondContact O-N 3.09Å; F83-R87 VanDerWaalsContact CD1-NH1 3.33Å; F83-R87 VanDerWaalsContact CE1-NH1 3.29Å; F83-R87 PolarHBondContact O-N 3.19Å
84G72.9Confident72.4Confident29 Ų2988.2 Ų88.230%0.29949%0.493SS..Hα-helixtrans-61.8-43.7168.500000111.9S80 N81 L86 R87 T88S80-G84 PolarHBondContact O-N 3.46Å; N81-G84 PolarHBondContact O-N 3.38Å; G84-L86 VanDerWaalsContact C-N 3.32Å; G84-L86 PolarHBondContact O-N 3.28Å; G84-R87 WeakPolarHBondContact O-CB 3.47Å; G84-R87 PolarHBondContact O-N 2.95Å; G84-T88 PolarHBondContact O-N 3.28Å
85Q70Confident73.1Confident121 Ų12191.5 Ų91.557%0.56550%0.502SS*.Hα-helixtrans-63.1-37.6172.9-74.1171.125.600111.7N81 K82 R87 T88 T89N81-Q85 WeakPolarHBondContact O-CB 3.49Å; N81-Q85 WeakPolarHBondContact O-CG 3.42Å; N81-Q85 PolarHBondContact O-N 2.79Å; K82-Q85 CarbonylContact O-C 3.52Å; K82-Q85 WeakPolarHBondContact O-CB 3.42Å; K82-Q85 PolarHBondContact O-N 3.23Å; Q85-R87 VanDerWaalsContact C-N 3.3Å; Q85-R87 PolarHBondContact O-N 3.48Å; Q85-T88 CarbonylContact O-C 3.56Å; Q85-T88 PolarHBondContact O-N 2.85Å; Q85-T88 PolarHBondContact O-OG1 3.15Å; Q85-T89 WeakPolarHBondContact O-CG2 3.34Å; Q85-T89 PolarHBondContact O-N 2.98Å
86L74.6Confident73.7Confident100 Ų10092.9 Ų92.952%0.52450%0.502SS..Hα-helixtrans-61.4-39.1174.7-75.7171.5000111.4K82 F83 G84 T88 T89 F92K82-L86 WeakPolarHBondContact O-CB 3.28Å; K82-L86 VanDerWaalsContact O-CG 3.24Å; K82-L86 WeakPolarHBondContact O-CG 3.21Å; K82-L86 PolarHBondContact O-N 2.88Å; F83-L86 WeakPolarHBondContact O-CB 3.48Å; F83-L86 PolarHBondContact O-N 3.09Å; G84-L86 VanDerWaalsContact C-N 3.32Å; G84-L86 PolarHBondContact O-N 3.28Å; L86-T88 VanDerWaalsContact C-N 3.25Å; L86-T88 PolarHBondContact O-N 3.48Å; L86-T89 HydrophobicContact CD2-CG2 4.34Å; L86-T89 WeakPolarHBondContact O-CB 3.18Å; L86-T89 PolarHBondContact O-N 3.38Å; L86-T89 VanDerWaalsContact O-N 3.15Å; L86-T89 PolarHBondContact O-OG1 2.81Å; L86-F92 WeakPolarHBondContact O-CB 3.34Å
87R73.6Confident74.6Confident123 Ų12397.1 Ų97.146%0.46451%0.511SS..Hα-helixtrans-64.1-28.5172.8-68.1-171.6178.8115.3-13.7113.7F83 G84 Q85 F92F83-R87 VanDerWaalsContact CD1-NH1 3.33Å; F83-R87 VanDerWaalsContact CE1-NH1 3.29Å; F83-R87 PolarHBondContact O-N 3.19Å; G84-R87 WeakPolarHBondContact O-CB 3.47Å; G84-R87 PolarHBondContact O-N 2.95Å; Q85-R87 VanDerWaalsContact C-N 3.3Å; Q85-R87 PolarHBondContact O-N 3.48Å; R87-F92 HydrophobicContact CB-CD1 4Å; R87-F92 HydrophobicContact CB-CE1 4.06Å; R87-F92 HydrophobicContact CB-CG 4.36Å; R87-F92 HydrophobicContact CB-CZ 4.49Å; R87-F92 HydrophobicContact CG-CD1 4.31Å; R87-F92 HydrophobicContact CG-CD2 4.43Å; R87-F92 HydrophobicContact CG-CE1 4.02Å; R87-F92 HydrophobicContact CG-CE2 4.17Å; R87-F92 HydrophobicContact CG-CZ 3.95Å; R87-F92 WeakPolarHBondContact O-CD1 3.31Å
88T74.8Confident75.5Confident92 Ų92102.9 Ų102.956%0.56453%0.529SS*.Hα-helixtrans-88.2-6.9176.364.20000113.3G84 Q85 L86G84-T88 PolarHBondContact O-N 3.28Å; Q85-T88 CarbonylContact O-C 3.56Å; Q85-T88 PolarHBondContact O-N 2.85Å; Q85-T88 PolarHBondContact O-OG1 3.15Å; L86-T88 VanDerWaalsContact C-N 3.25Å; L86-T88 PolarHBondContact O-N 3.48Å
89T82.6Confident76.6Confident45 Ų45100.5 Ų100.528%0.27653%0.526SS..SBendtrans-64.8149.3177.5630000111.5Q85 L86 A91 F92 K93Q85-T89 WeakPolarHBondContact O-CG2 3.34Å; Q85-T89 PolarHBondContact O-N 2.98Å; L86-T89 HydrophobicContact CD2-CG2 4.34Å; L86-T89 WeakPolarHBondContact O-CB 3.18Å; L86-T89 PolarHBondContact O-N 3.38Å; L86-T89 VanDerWaalsContact O-N 3.15Å; L86-T89 PolarHBondContact O-OG1 2.81Å; T89-A91 PolarHBondContact O-N 3.4Å; T89-A91 VanDerWaalsContact O-N 3.12Å; T89-F92 PolarHBondContact O-N 3.38Å; T89-F92 VanDerWaalsContact O-N 3.08Å; T89-F92 PolarHBondContact OG1-N 3.14Å; T89-K93 PolarHBondContact O-N 2.81Å
90P78.4Confident76.8Confident103 Ų10397.8 Ų97.867%0.66952%0.516SS*.Hα-helixtrans-51.7-34.8173.5-26.434.1000113K93 S94P90-K93 PolarHBondContact O-N 3.49Å; P90-S94 PolarHBondContact O-N 3.34Å; P90-S94 PolarHBondContact O-OG 3.4Å; P90-S94 VanDerWaalsContact O-OG 3.12Å
91A78.6Confident77Confident74 Ų7498.1 Ų98.161%0.61252%0.518SS*.Hα-helixtrans-63.3-43.6178.500000113T89 F95T89-A91 PolarHBondContact O-N 3.4Å; T89-A91 VanDerWaalsContact O-N 3.12Å; A91-F95 PolarHBondContact O-N 2.79Å; A91-F95 VanDerWaalsContact O-N 3.14Å
92F81.9Confident76.7Confident78 Ų7896.3 Ų96.334%0.34252%0.518SS..Hα-helixtrans-72.6-37.3176.9-169.6-89.6000111.7L86 R87 T89 F95 E96L86-F92 WeakPolarHBondContact O-CB 3.34Å; R87-F92 HydrophobicContact CB-CD1 4Å; R87-F92 HydrophobicContact CB-CE1 4.06Å; R87-F92 HydrophobicContact CB-CG 4.36Å; R87-F92 HydrophobicContact CB-CZ 4.49Å; R87-F92 HydrophobicContact CG-CD1 4.31Å; R87-F92 HydrophobicContact CG-CD2 4.43Å; R87-F92 HydrophobicContact CG-CE1 4.02Å; R87-F92 HydrophobicContact CG-CE2 4.17Å; R87-F92 HydrophobicContact CG-CZ 3.95Å; R87-F92 WeakPolarHBondContact O-CD1 3.31Å; T89-F92 PolarHBondContact O-N 3.38Å; T89-F92 VanDerWaalsContact O-N 3.08Å; T89-F92 PolarHBondContact OG1-N 3.14Å; F92-F95 WeakPolarHBondContact O-CB 3.5Å; F92-F95 PolarHBondContact O-N 2.9Å; F92-E96 WeakPolarHBondContact O-CB 3.48Å; F92-E96 PolarHBondContact O-N 3.43Å
93K80.3Confident76.5Confident111 Ų11196.8 Ų96.848%0.48352%0.517SS..Hα-helixtrans-61.6-43.5173-73.4-175.6178.3177.50112.5T89 P90 F95 E96 E97T89-K93 PolarHBondContact O-N 2.81Å; P90-K93 PolarHBondContact O-N 3.49Å; K93-F95 VanDerWaalsContact C-N 3.28Å; K93-F95 PolarHBondContact O-N 3.4Å; K93-E96 PolarHBondContact O-N 3.48Å; K93-E97 WeakPolarHBondContact O-CB 3.2Å; K93-E97 VanDerWaalsContact O-CG 3.28Å; K93-E97 WeakPolarHBondContact O-CG 3.19Å; K93-E97 PolarHBondContact O-N 2.98Å
94S85.1Confident75.9Confident73 Ų7394.7 Ų94.751%0.5152%0.515SS..Hα-helixtrans-65.5-31.9174.6-62.10000112.6P90 K98P90-S94 PolarHBondContact O-N 3.34Å; P90-S94 PolarHBondContact O-OG 3.4Å; P90-S94 VanDerWaalsContact O-OG 3.12Å; S94-K98 WeakPolarHBondContact O-CB 3.39Å; S94-K98 PolarHBondContact O-N 2.92Å
95F82.2Confident75.2Confident136 Ų13697.3 Ų97.360%0.59653%0.529SS*.Hα-helixtrans-68.3-45.3172179.5-98.4000111.5A91 F92 K93 K98 V99A91-F95 PolarHBondContact O-N 2.79Å; A91-F95 VanDerWaalsContact O-N 3.14Å; F92-F95 WeakPolarHBondContact O-CB 3.5Å; F92-F95 PolarHBondContact O-N 2.9Å; K93-F95 VanDerWaalsContact C-N 3.28Å; K93-F95 PolarHBondContact O-N 3.4Å; F95-K98 PolarHBondContact O-N 3.29Å; F95-V99 HydrophobicContact CE1-CG2 4.37Å; F95-V99 HydrophobicContact CZ-CG2 4.39Å; F95-V99 WeakPolarHBondContact O-CG2 3.37Å; F95-V99 PolarHBondContact O-N 3.42Å
96E80.5Confident75.1Confident116 Ų11696.3 Ų96.354%0.54253%0.531SS..Hα-helixtrans-63-43.6176.9-175.6-179.5173.500111.8F92 K93 K98 V99 G100F92-E96 WeakPolarHBondContact O-CB 3.48Å; F92-E96 PolarHBondContact O-N 3.43Å; K93-E96 PolarHBondContact O-N 3.48Å; E96-K98 VanDerWaalsContact C-N 3.33Å; E96-K98 PolarHBondContact O-N 2.92Å; E96-V99 CarbonylContact O-C 3.55Å; E96-V99 PolarHBondContact O-N 2.84Å; E96-G100 WeakPolarHBondContact O-CA 3.28Å; E96-G100 PolarHBondContact O-N 3.31Å
97E78.9Confident74.5Confident131 Ų13197.6 Ų97.661%0.61253%0.533SS*.Hα-helixtrans-61.5-41.2177-77.2170.8-175.100111.7K93 V99 G100 S101K93-E97 WeakPolarHBondContact O-CB 3.2Å; K93-E97 VanDerWaalsContact O-CG 3.28Å; K93-E97 WeakPolarHBondContact O-CG 3.19Å; K93-E97 PolarHBondContact O-N 2.98Å; E97-V99 VanDerWaalsContact C-N 3.27Å; E97-V99 PolarHBondContact O-N 3.06Å; E97-G100 PolarHBondContact O-N 2.91Å; E97-S101 VanDerWaalsContact O-CB 3.27Å; E97-S101 WeakPolarHBondContact O-CB 3.43Å; E97-S101 PolarHBondContact O-N 3.23Å
98K77.7Confident74Confident175 Ų175100.2 Ų100.276%0.76155%0.55SS**Hα-helixtrans-66-31.6177.9-162.1168-174.61780112.2S94 F95 E96S94-K98 WeakPolarHBondContact O-CB 3.39Å; S94-K98 PolarHBondContact O-N 2.92Å; F95-K98 PolarHBondContact O-N 3.29Å; E96-K98 VanDerWaalsContact C-N 3.33Å; E96-K98 PolarHBondContact O-N 2.92Å
99V83.4Confident72.6Confident86 Ų86104.7 Ų104.752%0.52156%0.562SS.*Hα-helixtrans-83.1-36175.3175.20000111.6F95 E96 E97 A102 Y103F95-V99 HydrophobicContact CE1-CG2 4.37Å; F95-V99 HydrophobicContact CZ-CG2 4.39Å; F95-V99 WeakPolarHBondContact O-CG2 3.37Å; F95-V99 PolarHBondContact O-N 3.42Å; E96-V99 CarbonylContact O-C 3.55Å; E96-V99 PolarHBondContact O-N 2.84Å; E97-V99 VanDerWaalsContact C-N 3.27Å; E97-V99 PolarHBondContact O-N 3.06Å; V99-A102 WeakPolarHBondContact O-CB 3.41Å; V99-A102 PolarHBondContact O-N 3.42Å; V99-Y103 PolarHBondContact O-N 2.9Å
100G70.8Confident71.4Confident33 Ų33109.3 Ų109.334%0.3458%0.583SS.*Hα-helixtrans-70.9-38-179.900000112.6E96 E97 A102 Y103 S104E96-G100 WeakPolarHBondContact O-CA 3.28Å; E96-G100 PolarHBondContact O-N 3.31Å; E97-G100 PolarHBondContact O-N 2.91Å; G100-A102 PolarHBondContact O-N 2.88Å; G100-Y103 PolarHBondContact O-N 2.91Å; G100-S104 PolarHBondContact O-N 3.22Å; G100-S104 PolarHBondContact O-OG 3.35Å
101S71.5Confident69.6Low80 Ų80107.6 Ų107.656%0.55958%0.584SS**Hα-helixtrans-62.8-31.3172.8-161.70000111.6E97 S104 S105E97-S101 VanDerWaalsContact O-CB 3.27Å; E97-S101 WeakPolarHBondContact O-CB 3.43Å; E97-S101 PolarHBondContact O-N 3.23Å; S101-S104 PolarHBondContact O-OG 2.93Å; S101-S105 PolarHBondContact O-OG 3.22Å
102A64.4Low68.6Low66 Ų66110.3 Ų110.355%0.54560%0.599SS.*Hα-helixtrans-72.8-30.4171.800000112.9V99 G100V99-A102 WeakPolarHBondContact O-CB 3.41Å; V99-A102 PolarHBondContact O-N 3.42Å; G100-A102 PolarHBondContact O-N 2.88Å
103Y66.2Low66.6Low154 Ų154113.7 Ų113.760%0.60463%0.625SS**Hα-helixtrans-83.1-39.1-178.9-174-98.9000113.8V99 G100 S105 V106 K107V99-Y103 PolarHBondContact O-N 2.9Å; G100-Y103 PolarHBondContact O-N 2.91Å; Y103-S105 VanDerWaalsContact C-N 3.33Å; Y103-S105 PolarHBondContact O-N 3.45Å; Y103-V106 WeakPolarHBondContact O-CB 3.45Å; Y103-V106 PolarHBondContact O-N 3.14Å; Y103-V106 VanDerWaalsContact O-N 3.08Å; Y103-K107 HydrophobicContact CE1-CD 4.07Å; Y103-K107 PolarHBondContact O-N 2.98Å
104S65.5Low64.9Low62 Ų62113.6 Ų113.643%0.43465%0.645SS.*Hα-helixtrans-66.4-35.9-178.657.30000112.6G100 S101 V106 K107 E108G100-S104 PolarHBondContact O-N 3.22Å; G100-S104 PolarHBondContact O-OG 3.35Å; S101-S104 PolarHBondContact O-OG 2.93Å; S104-V106 PolarHBondContact O-N 2.95Å; S104-K107 PolarHBondContact O-N 3.41Å; S104-K107 VanDerWaalsContact O-N 3.12Å; S104-E108 PolarHBondContact O-N 3.46Å
105S58.6Low63Low85 Ų85113.9 Ų113.959%0.59466%0.66SS**Hα-helixtrans-51.6-24171.5-57.90000112.8S101 Y103S101-S105 PolarHBondContact O-OG 3.22Å; Y103-S105 VanDerWaalsContact C-N 3.33Å; Y103-S105 PolarHBondContact O-N 3.45Å
106V68.4Low61.1Low99 Ų99113.4 Ų113.460%0.667%0.673SS**Hα-helixtrans-95.8-35.5-177.9-174.70000112.6Y103 S104Y103-V106 WeakPolarHBondContact O-CB 3.45Å; Y103-V106 PolarHBondContact O-N 3.14Å; Y103-V106 VanDerWaalsContact O-N 3.08Å; S104-V106 PolarHBondContact O-N 2.95Å
107K61.9Low59.7Low128 Ų128115 Ų11556%0.55769%0.692SS**Hα-helixtrans-89.5-27.7-170.2-170.5175178-178.70115Y103 S104 K109 I110Y103-K107 HydrophobicContact CE1-CD 4.07Å; Y103-K107 PolarHBondContact O-N 2.98Å; S104-K107 PolarHBondContact O-N 3.41Å; S104-K107 VanDerWaalsContact O-N 3.12Å; K107-K109 PolarHBondContact O-N 3.07Å; K107-I110 PolarHBondContact O-N 2.58Å
108E62Low58.4Low178 Ų178118.5 Ų118.583%0.83271%0.708SS**THydrogen-bonded Turntrans-60.3-20.6179.2-173.6167.9-174.400112.8S104 I110S104-E108 PolarHBondContact O-N 3.46Å; E108-I110 PolarHBondContact O-N 3.46Å
109K46.9Very low57.2Low186 Ų186113.8 Ų113.881%0.80971%0.709SS**THydrogen-bonded Turntrans-65.2-5.4172-72.3175.6177.2-78.20114.6K107K107-K109 PolarHBondContact O-N 3.07Å
110I56.3Low55.8Low142 Ų142119.2 Ų119.273%0.72873%0.728SS**SBendtrans-124.5-14.2-165.4-70.4172.7000116.8K107 E108K107-I110 PolarHBondContact O-N 2.58Å; E108-I110 PolarHBondContact O-N 3.46Å
111G41.1Very low54.9Low67 Ų67125 Ų12569%0.69175%0.751SS**  trans-84171.4-176.500000118.1
112S57.2Low53.5Low131 Ų131125.2 Ų125.292%0.91675%0.753SS**  trans85.974.9164.6-63.10000121
113V40.5Very low53.1Low148 Ų148129.3 Ų129.390%0.89777%0.766SS**  trans-164.2132155.767.80000112.5
114A43Very low52.1Low109 Ų109130.7 Ų130.790%0.90178%0.778SS**  trans96.8114.9159.900000124.8
115G45.9Very low51.3Low80 Ų80132.3 Ų132.383%0.82580%0.795SS**  trans140.1119.1145.500000120.7
116S43Very low50.5Low125 Ų125136.1 Ų136.187%0.87480%0.803SS**  trans-158.9122.3165.934.90000115
117T50.1Low49.7Very low151 Ų151136.8 Ų136.893%0.92681%0.813SS**  trans-163.8143.3172.7-450000114.7
118E53.1Low49.1Very low204 Ų204135.7 Ų135.795%0.95382%0.819SS**  trans-115.9163.9178.1-89.2167.6125.700114.5
119G51.2Low48.9Very low75 Ų75134.9 Ų134.977%0.77382%0.82SS**  trans-122.7167.7-15500000124.3
120Q53.4Low49.2Very low201 Ų201129.5 Ų129.594%0.93981%0.81SS**  trans36.9146.3144.1-64.6176.8-68.300125.3
121N52.3Low48.6Very low154 Ų154131.6 Ų131.682%0.82482%0.817SS**  cis-172.8123.6-25.8-17538.4000110.5
122S42.6Very low49.2Very low85 Ų85135.1 Ų135.159%0.59483%0.825SS**  trans-103.6146.8165.451.80000110.2
123N56.3Low48.5Very low151 Ų151137.6 Ų137.681%0.80782%0.82SS**  trans159.6115.4131.6-81.6-12000114A125N123-A125 PolarHBondContact O-N 2.69Å
124Q44.2Very low48.5Very low183 Ų183139.4 Ų139.486%0.85582%0.818SS**  trans-50.5109.6151.7-143.3168.113.800108.2Q126Q124-Q126 VanDerWaalsContact C-N 3.29Å; Q124-Q126 PolarHBondContact O-N 3.11Å
125A50.2Low48.8Very low97 Ų97144.1 Ų144.180%0.80284%0.835SS**  trans-78.781.1177.400000109.7N123N123-A125 PolarHBondContact O-N 2.69Å
126Q41.7Very low48.9Very low164 Ų164147.4 Ų147.477%0.76684%0.836SS**  trans-81.9115159.1-165.2152.3-31.500106.8Q124Q124-Q126 VanDerWaalsContact C-N 3.29Å; Q124-Q126 PolarHBondContact O-N 3.11Å
127S51.7Low49.2Very low114 Ų114148.5 Ų148.580%0.79783%0.834SS**  trans-128.691.3169.5-63.70000109
128P48.3Very low49.2Very low105 Ų105148.4 Ų148.468%0.68283%0.829SS**  trans-80.4133.4152.732.2-23.9000107.7
129N56.8Low49Very low160 Ų160145.1 Ų145.186%0.85682%0.821SS**  trans-146.8116.8153-144.35.2000112.2
130A53.2Low48.8Very low73 Ų73149.5 Ų149.560%0.60382%0.824SS**  trans56.8105.8144.500000119.3
131E45Very low48.5Very low186 Ų186146.1 Ų146.187%0.86982%0.817SS**  -1.4123.3128.2-71.8166.978.900115.9
132T54.3Low48.3Very low142 Ų142145.5 Ų145.587%0.87182%0.816SS**  trans-143.2110.8142.9-57.80000109
133K40.8Very low48.7Very low183 Ų183150.2 Ų150.280%0.79683%0.833SS**  trans-55.5169.7168.1-92-178.4167.1-168.20113.2
134Q41.8Very low48.1Very low186 Ų186150.1 Ų150.187%0.86984%0.836SS**  trans80.3123.5160-88.6168.66.800113.6
135V48.7Very low48.4Very low208 Ų208147.1 Ų147.1100%1.26183%0.834SS**  cis-145.2029.5173.50000109.4

Retrieved 135 of 135 residues in 195.8 ms (Link to these results)