A0A096MNT1_PAPAN Loading...

Single-pass membrane protein with coiled-coil domains 3

AlphaFold DB , UniProt , Accession A0A096MNT1, Species PAPAN (Papio anubis, Olive baboon), Gene SMCO3, Length 225 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
1M50.4Low60.4Low232 Ų23296.4 Ų96.4100%1.14349%0.488SS*.  0133.60-84173145.300108.1
2A61Low61.3Low51 Ų5191.7 Ų91.742%0.42147%0.469SS..  trans-70.9143.1177.100000110.1S4 D5A2-S4 PolarHBondContact O-N 3.27Å; A2-S4 VanDerWaalsContact O-N 3.12Å; A2-D5 WeakPolarHBondContact O-CB 3.05Å; A2-D5 PolarHBondContact O-N 2.83Å
3Q52.7Low62.5Low177 Ų17793.7 Ų93.783%0.82747%0.472SS*.Hα-helixtrans-55.8-28.7178.6-94177.6-20.800113.2D5 F6Q3-D5 VanDerWaalsContact C-N 3.33Å; Q3-D5 PolarHBondContact O-N 2.71Å; Q3-F6 PolarHBondContact O-N 3.04Å
4S54.3Low63.2Low15 Ų1590.9 Ų90.911%0.10545%0.453CS..Hα-helixtrans-63.1-35.8174.352.70000113.3A2 F6 L7 Y8A2-S4 PolarHBondContact O-N 3.27Å; A2-S4 VanDerWaalsContact O-N 3.12Å; S4-F6 VanDerWaalsContact C-N 3.3Å; S4-F6 PolarHBondContact O-N 3.11Å; S4-L7 PolarHBondContact O-N 2.79Å; S4-Y8 WeakPolarHBondContact O-CD2 3.4Å; S4-Y8 PolarHBondContact O-N 3.41Å
5D60.3Low63.6Low31 Ų3187.1 Ų87.117%0.16643%0.432CS..Hα-helixtrans-74.8-26.1-176.8-63.6-17000111.8A2 Q3 Y8 P9 P12 R15A2-D5 WeakPolarHBondContact O-CB 3.05Å; A2-D5 PolarHBondContact O-N 2.83Å; Q3-D5 VanDerWaalsContact C-N 3.33Å; Q3-D5 PolarHBondContact O-N 2.71Å; D5-Y8 CarbonylContact O-C 3.56Å; D5-Y8 VanDerWaalsContact O-C 3.31Å; D5-P9 WeakPolarHBondContact O-CA 3.39Å; D5-P12 HydrophobicContact CB-CG 4.11Å; D5-R15 VanDerWaalsContact CG-NH2 3.26Å; D5-R15 IonicContact OD1-CZ 2.82Å; D5-R15 IonicContact OD1-NH1 3.55Å; D5-R15 PolarHBondContact OD1-NH1 3.27Å; D5-R15 VanDerWaalsContact OD1-NH1 3.15Å; D5-R15 IonicContact OD1-NH2 3.42Å; D5-R15 PolarHBondContact OD1-NH2 3.28Å; D5-R15 IonicContact OD2-NH2 2.87Å; D5-R15 PolarHBondContact OD2-NH2 3.1Å
6F58.6Low64.4Low182 Ų18290.3 Ų90.380%0.79845%0.445SS*.Hα-helixtrans-69-38.3172.5-176.9-99.9000111.7Q3 S4Q3-F6 PolarHBondContact O-N 3.04Å; S4-F6 VanDerWaalsContact C-N 3.3Å; S4-F6 PolarHBondContact O-N 3.11Å
7L57Low65.3Low120 Ų12088.1 Ų88.163%0.62843%0.433SS*.Hα-helixtrans-78-23.5177.2-63.2175.9000112.8S4S4-L7 PolarHBondContact O-N 2.79Å
8Y63.3Low65.7Low80 Ų8083.2 Ų83.231%0.31441%0.409SS..  trans-136.676.4-178.4-56.4-74.5000111.7S4 D5 E10 N11 A182S4-Y8 WeakPolarHBondContact O-CD2 3.4Å; S4-Y8 PolarHBondContact O-N 3.41Å; D5-Y8 CarbonylContact O-C 3.56Å; D5-Y8 VanDerWaalsContact O-C 3.31Å; Y8-E10 PolarHBondContact O-N 2.98Å; Y8-N11 WeakPolarHBondContact CB-ND2 3.22Å; Y8-N11 WeakPolarHBondContact O-CB 3.49Å; Y8-N11 PolarHBondContact O-N 3.27Å; Y8-A182 HydrophobicContact CE1-CB 4.48Å; Y8-A182 VanDerWaalsContact OH-CB 3.27Å; Y8-A182 WeakPolarHBondContact OH-CB 3.47Å
9P66.7Low66.2Low88 Ų8881.2 Ų81.257%0.57140%0.4SS*.THydrogen-bonded Turntrans-64.7-17.7-170.324.3-34.7000114.6D5D5-P9 WeakPolarHBondContact O-CA 3.39Å
10E71.9Confident67Low83 Ų8383.2 Ų83.239%0.38840%0.403SS..THydrogen-bonded Turntrans-89.9-11.7178.7-66.8-60.8131.300113.6Y8 K13 R14Y8-E10 PolarHBondContact O-N 2.98Å; E10-K13 PolarHBondContact O-N 3.29Å; E10-K13 IonicContact OE1-NZ 3.38Å; E10-K13 PolarHBondContact OE1-NZ 3.17Å; E10-K13 WeakPolarHBondContact OE2-CD 3.39Å; E10-K13 IonicContact OE2-NZ 3.67Å; E10-K13 PolarHBondContact OE2-NZ 2.84Å; E10-R14 PolarHBondContact O-N 3.33Å; E10-R14 VanDerWaalsContact O-N 3.14Å
11N67.9Low67.7Low1 Ų179.3 Ų79.31%0.00539%0.385CS..Hα-helixtrans-66-39.4179.6-71.71.7000113.4Y8 K13 R14 R15 E184Y8-N11 WeakPolarHBondContact CB-ND2 3.22Å; Y8-N11 WeakPolarHBondContact O-CB 3.49Å; Y8-N11 PolarHBondContact O-N 3.27Å; N11-K13 VanDerWaalsContact C-N 3.3Å; N11-K13 PolarHBondContact O-N 3.34Å; N11-R14 PolarHBondContact O-N 2.97Å; N11-R14 VanDerWaalsContact O-N 3.15Å; N11-R14 PolarHBondContact OD1-NH1 3.46Å; N11-R15 WeakPolarHBondContact O-CG 3.36Å; N11-R15 PolarHBondContact O-N 3.42Å; N11-E184 HydrophobicContact CB-CG 4.28Å; N11-E184 VanDerWaalsContact ND2-CG 3.34Å; N11-E184 WeakPolarHBondContact ND2-CG 3.33Å; N11-E184 PolarHBondContact ND2-OE2 3.36Å
12P71.7Confident69Low40 Ų4068.9 Ų68.926%0.2633%0.333SS..Hα-helixtrans-53.6-44.1172-27.834.4000113.5D5 R15 Q16D5-P12 HydrophobicContact CB-CG 4.11Å; P12-R15 PolarHBondContact O-N 2.79Å; P12-Q16 WeakPolarHBondContact O-CG 3.47Å; P12-Q16 PolarHBondContact O-N 3.14Å
13K77.3Confident70Confident118 Ų11870.5 Ų70.551%0.51333%0.332SS..Hα-helixtrans-65.7-42.1177.4-64.8-179.1-167.6155.50111.9E10 N11 R15 Q16 E17E10-K13 PolarHBondContact O-N 3.29Å; E10-K13 IonicContact OE1-NZ 3.38Å; E10-K13 PolarHBondContact OE1-NZ 3.17Å; E10-K13 WeakPolarHBondContact OE2-CD 3.39Å; E10-K13 IonicContact OE2-NZ 3.67Å; E10-K13 PolarHBondContact OE2-NZ 2.84Å; N11-K13 VanDerWaalsContact C-N 3.3Å; N11-K13 PolarHBondContact O-N 3.34Å; K13-R15 PolarHBondContact O-N 2.94Å; K13-Q16 WeakPolarHBondContact O-CB 3.36Å; K13-Q16 PolarHBondContact O-N 3.41Å; K13-E17 PolarHBondContact O-N 3.14Å
14R71.3Confident71.5Confident54 Ų5464 Ų6420%0.20430%0.301CS..Hα-helixtrans-63.9-38.9176.5-69.7-177.7-171.799.513.6112.4E10 N11 E17 V18 L188 I192E10-R14 PolarHBondContact O-N 3.33Å; E10-R14 VanDerWaalsContact O-N 3.14Å; N11-R14 PolarHBondContact O-N 2.97Å; N11-R14 VanDerWaalsContact O-N 3.15Å; N11-R14 PolarHBondContact OD1-NH1 3.46Å; R14-E17 PolarHBondContact O-N 3.26Å; R14-V18 WeakPolarHBondContact O-CG2 3.26Å; R14-V18 PolarHBondContact O-N 3.14Å; R14-L188 HydrophobicContact CB-CB 4.06Å; R14-L188 HydrophobicContact CB-CD1 3.68Å; R14-L188 HydrophobicContact CB-CG 4.45Å; R14-I192 HydrophobicContact CB-CD1 4.08Å; R14-I192 HydrophobicContact CG-CD1 4.19Å
15R69.9Low72.8Confident35 Ų3563.5 Ų63.513%0.13230%0.298CS..Hα-helixtrans-64.3-42.1174.4-69.6-173.8-60.4-1206.2111.5D5 N11 P12 K13 E17 V18 N19 E184 L188D5-R15 VanDerWaalsContact CG-NH2 3.26Å; D5-R15 IonicContact OD1-CZ 2.82Å; D5-R15 IonicContact OD1-NH1 3.55Å; D5-R15 PolarHBondContact OD1-NH1 3.27Å; D5-R15 VanDerWaalsContact OD1-NH1 3.15Å; D5-R15 IonicContact OD1-NH2 3.42Å; D5-R15 PolarHBondContact OD1-NH2 3.28Å; D5-R15 IonicContact OD2-NH2 2.87Å; D5-R15 PolarHBondContact OD2-NH2 3.1Å; N11-R15 WeakPolarHBondContact O-CG 3.36Å; N11-R15 PolarHBondContact O-N 3.42Å; P12-R15 PolarHBondContact O-N 2.79Å; K13-R15 PolarHBondContact O-N 2.94Å; R15-E17 VanDerWaalsContact C-N 3.29Å; R15-E17 PolarHBondContact O-N 3.41Å; R15-V18 PolarHBondContact O-N 3.3Å; R15-N19 PolarHBondContact O-N 2.84Å; R15-E184 WeakPolarHBondContact CD-OE1 3.4Å; R15-E184 IonicContact CZ-OE1 3.46Å; R15-E184 IonicContact NE-OE1 3.68Å; R15-E184 IonicContact NH1-OE1 3.15Å; R15-E184 PolarHBondContact NH1-OE1 3.17Å; R15-E184 IonicContact NH1-OE2 2.72Å; R15-L188 HydrophobicContact CG-CD1 3.78Å; R15-L188 HydrophobicContact CG-CD2 4.09Å
16Q76.6Confident73.9Confident138 Ų13863.3 Ų63.365%0.64530%0.296SS*.Hα-helixtrans-59.5-41.6172.6-74.5177.3-22.600111.9P12 K13 N19 R20P12-Q16 WeakPolarHBondContact O-CG 3.47Å; P12-Q16 PolarHBondContact O-N 3.14Å; K13-Q16 WeakPolarHBondContact O-CB 3.36Å; K13-Q16 PolarHBondContact O-N 3.41Å; Q16-N19 PolarHBondContact O-N 3.32Å; Q16-R20 WeakPolarHBondContact O-CB 3.4Å; Q16-R20 PolarHBondContact O-N 3.33Å
17E78.5Confident75.2Confident52 Ų5259 Ų5924%0.24328%0.282CS..Hα-helixtrans-67.1-43.1179-176.257.3-16500112.6K13 R14 R15 N19 R20 L21 I192K13-E17 PolarHBondContact O-N 3.14Å; R14-E17 PolarHBondContact O-N 3.26Å; R15-E17 VanDerWaalsContact C-N 3.29Å; R15-E17 PolarHBondContact O-N 3.41Å; E17-N19 VanDerWaalsContact C-N 3.3Å; E17-N19 PolarHBondContact O-N 3.06Å; E17-R20 PolarHBondContact O-N 3.19Å; E17-R20 IonicContact OE1-CZ 3.28Å; E17-R20 IonicContact OE1-NE 3.82Å; E17-R20 PolarHBondContact OE1-NE 3.44Å; E17-R20 IonicContact OE1-NH2 3.24Å; E17-R20 PolarHBondContact OE1-NH2 3.19Å; E17-R20 IonicContact OE2-CZ 2.82Å; E17-R20 IonicContact OE2-NE 2.65Å; E17-R20 PolarHBondContact OE2-NE 3.45Å; E17-R20 IonicContact OE2-NH2 3.21Å; E17-L21 HydrophobicContact CG-CD1 4.1Å; E17-L21 WeakPolarHBondContact O-CG 2.93Å; E17-L21 PolarHBondContact O-N 2.87Å; E17-I192 HydrophobicContact CB-CD1 4.12Å; E17-I192 HydrophobicContact CB-CG1 4.5Å; E17-I192 HydrophobicContact CG-CD1 4.04Å; E17-I192 HydrophobicContact CG-CG1 4.15Å; E17-I192 HydrophobicContact CG-CG2 4.33Å
18V73.3Confident76.6Confident0 Ų054 Ų540%026%0.256CS..Hα-helixtrans-57.2-45.1172.4171.40000110.8R14 R15 R20 L21 H22 V167 I175 L188 A191 I192 Y195R14-V18 WeakPolarHBondContact O-CG2 3.26Å; R14-V18 PolarHBondContact O-N 3.14Å; R15-V18 PolarHBondContact O-N 3.3Å; V18-R20 PolarHBondContact O-N 3.2Å; V18-L21 PolarHBondContact O-N 3.01Å; V18-H22 WeakPolarHBondContact O-CB 3.46Å; V18-H22 PolarHBondContact O-N 3.03Å; V18-V167 HydrophobicContact CG1-CG1 3.97Å; V18-I175 HydrophobicContact CG1-CG2 3.74Å; V18-L188 HydrophobicContact CG2-CD2 3.96Å; V18-A191 HydrophobicContact CG2-CB 4.27Å; V18-I192 HydrophobicContact CG2-CD1 4.25Å; V18-I192 HydrophobicContact CG2-CG1 3.58Å; V18-Y195 HydrophobicContact CG1-CD2 4.38Å; V18-Y195 HydrophobicContact CG1-CE2 3.88Å
19N74.4Confident77.7Confident46 Ų4650.2 Ų50.225%0.24624%0.242CC..Hα-helixtrans-62.7-42.8177.2-73.3-11.7000112.1R15 Q16 E17 L21 H22 Q23R15-N19 PolarHBondContact O-N 2.84Å; Q16-N19 PolarHBondContact O-N 3.32Å; E17-N19 VanDerWaalsContact C-N 3.3Å; E17-N19 PolarHBondContact O-N 3.06Å; N19-L21 PolarHBondContact O-N 2.87Å; N19-H22 PolarHBondContact O-N 3.17Å; N19-Q23 WeakPolarHBondContact O-CG 3.12Å; N19-Q23 PolarHBondContact O-N 3.03Å
20R83.1Confident78.8Confident120 Ų12048.2 Ų48.245%0.45323%0.23SC..Hα-helixtrans-62.2-41.8177.7-170.1-166.772.187.22.3111.9Q16 E17 V18 Q24Q16-R20 WeakPolarHBondContact O-CB 3.4Å; Q16-R20 PolarHBondContact O-N 3.33Å; E17-R20 PolarHBondContact O-N 3.19Å; E17-R20 IonicContact OE1-CZ 3.28Å; E17-R20 IonicContact OE1-NE 3.82Å; E17-R20 PolarHBondContact OE1-NE 3.44Å; E17-R20 IonicContact OE1-NH2 3.24Å; E17-R20 PolarHBondContact OE1-NH2 3.19Å; E17-R20 IonicContact OE2-CZ 2.82Å; E17-R20 IonicContact OE2-NE 2.65Å; E17-R20 PolarHBondContact OE2-NE 3.45Å; E17-R20 IonicContact OE2-NH2 3.21Å; V18-R20 PolarHBondContact O-N 3.2Å; R20-Q24 VanDerWaalsContact CZ-NE2 3.29Å; R20-Q24 WeakPolarHBondContact O-CG 3.44Å; R20-Q24 PolarHBondContact O-N 2.89Å; R20-Q24 PolarHBondContact O-NE2 3.27Å
21L80.8Confident79.6Confident3 Ų348.3 Ų48.32%0.01623%0.233CC..Hα-helixtrans-71.5-39.2178.4-71.3168.9000112E17 V18 N19 Q24 L25 I192 Y195 E196 L199E17-L21 HydrophobicContact CG-CD1 4.1Å; E17-L21 WeakPolarHBondContact O-CG 2.93Å; E17-L21 PolarHBondContact O-N 2.87Å; V18-L21 PolarHBondContact O-N 3.01Å; N19-L21 PolarHBondContact O-N 2.87Å; L21-Q24 PolarHBondContact O-N 3.21Å; L21-L25 PolarHBondContact O-N 3.49Å; L21-L25 VanDerWaalsContact O-N 3.09Å; L21-I192 HydrophobicContact CD1-CB 4.36Å; L21-I192 HydrophobicContact CD1-CG1 4.43Å; L21-I192 HydrophobicContact CD1-CG2 3.96Å; L21-Y195 HydrophobicContact CB-CD1 4.33Å; L21-Y195 HydrophobicContact CB-CD2 4.4Å; L21-Y195 HydrophobicContact CB-CG 3.96Å; L21-E196 HydrophobicContact CD1-CG 3.98Å; L21-E196 HydrophobicContact CD2-CG 4.18Å; L21-L199 HydrophobicContact CD2-CD2 4.49Å
22H78.6Confident80.6Confident12 Ų1248.2 Ų48.26%0.05623%0.233CC..Hα-helixtrans-58.9-48.6173.8-175.1105.8000111.2V18 N19 Q24 L25 L26 I62 Y195V18-H22 WeakPolarHBondContact O-CB 3.46Å; V18-H22 PolarHBondContact O-N 3.03Å; N19-H22 PolarHBondContact O-N 3.17Å; H22-Q24 PolarHBondContact O-N 3.38Å; H22-L25 WeakPolarHBondContact O-CB 3.45Å; H22-L25 PolarHBondContact O-N 2.84Å; H22-L25 VanDerWaalsContact O-N 3.12Å; H22-L26 PolarHBondContact O-N 2.97Å; H22-I62 WeakPolarHBondContact CE1-CD1 3.49Å; H22-Y195 HydrophobicContact CB-CE1 4.14Å; H22-Y195 AromaticContact ND1-CZ 3.72Å; H22-Y195 PolarHBondContact ND1-OH 2.92Å
23Q81.4Confident81.6Confident86 Ų8646.5 Ų46.540%0.40222%0.221SC..Hα-helixtrans-60.7-44.4178.6-73.3-62.4-23.300112.2N19 L25 L26 D27N19-Q23 WeakPolarHBondContact O-CG 3.12Å; N19-Q23 PolarHBondContact O-N 3.03Å; Q23-L25 PolarHBondContact O-N 2.9Å; Q23-L26 WeakPolarHBondContact O-CB 3.46Å; Q23-L26 PolarHBondContact O-N 3.39Å; Q23-D27 VanDerWaalsContact O-CG 3.31Å; Q23-D27 PolarHBondContact O-N 2.87Å
24Q84.4Confident82.3Confident40 Ų4044.9 Ų44.919%0.18722%0.218CC..Hα-helixtrans-61-33175.4-76.3170.581.800113.5R20 L21 H22 C28 L199R20-Q24 VanDerWaalsContact CZ-NE2 3.29Å; R20-Q24 WeakPolarHBondContact O-CG 3.44Å; R20-Q24 PolarHBondContact O-N 2.89Å; R20-Q24 PolarHBondContact O-NE2 3.27Å; L21-Q24 PolarHBondContact O-N 3.21Å; H22-Q24 PolarHBondContact O-N 3.38Å; Q24-C28 PolarHBondContact O-N 3.11Å; Q24-C28 VanDerWaalsContact O-N 3.07Å; Q24-C28 PolarHBondContact O-SG 2.81Å; Q24-L199 HydrophobicContact CB-CD1 3.67Å; Q24-L199 HydrophobicContact CB-CD2 4.42Å
25L82.3Confident83.2Confident5 Ų543 Ų433%0.02621%0.212CC..Hα-helixtrans-69.8-39.1175.9-172.563.6000111.1L21 H22 Q23 C28 L29 I62 I155 Y195 L199 F202L21-L25 PolarHBondContact O-N 3.49Å; L21-L25 VanDerWaalsContact O-N 3.09Å; H22-L25 WeakPolarHBondContact O-CB 3.45Å; H22-L25 PolarHBondContact O-N 2.84Å; H22-L25 VanDerWaalsContact O-N 3.12Å; Q23-L25 PolarHBondContact O-N 2.9Å; L25-C28 PolarHBondContact O-N 2.89Å; L25-L29 WeakPolarHBondContact O-CG 3.37Å; L25-L29 PolarHBondContact O-N 2.76Å; L25-I62 HydrophobicContact CD2-CD1 3.76Å; L25-I62 HydrophobicContact CD2-CG1 4.19Å; L25-I62 HydrophobicContact CD2-CG2 3.82Å; L25-I155 HydrophobicContact CD1-CD1 4.35Å; L25-Y195 HydrophobicContact CD2-CD1 4.22Å; L25-Y195 HydrophobicContact CD2-CE1 3.99Å; L25-L199 HydrophobicContact CB-CD1 3.99Å; L25-L199 HydrophobicContact CD1-CD1 4.34Å; L25-F202 HydrophobicContact CD1-CB 4.47Å; L25-F202 HydrophobicContact CD1-CD1 3.6Å; L25-F202 HydrophobicContact CD1-CE1 4.2Å; L25-F202 HydrophobicContact CD1-CG 4.32Å
26L83.3Confident84.1Confident26 Ų2641.3 Ų41.314%0.13621%0.206CC..Hα-helixtrans-63.4-42.4173.1-66.3178.5000111.8H22 Q23 C28 L29 S30 M56 I62H22-L26 PolarHBondContact O-N 2.97Å; Q23-L26 WeakPolarHBondContact O-CB 3.46Å; Q23-L26 PolarHBondContact O-N 3.39Å; L26-C28 PolarHBondContact O-N 3.34Å; L26-L29 HydrophobicContact CD2-CD1 4.46Å; L26-L29 WeakPolarHBondContact O-CB 3.42Å; L26-L29 PolarHBondContact O-N 3.44Å; L26-L29 VanDerWaalsContact O-N 3.15Å; L26-S30 PolarHBondContact O-N 3.39Å; L26-M56 HydrophobicContact CB-CE 4.08Å; L26-M56 HydrophobicContact CD2-CE 3.54Å; L26-M56 HydrophobicContact CG-CE 4.37Å; L26-I62 HydrophobicContact CD2-CG1 3.99Å
27D86.6Confident84.9Confident93 Ų9336.6 Ų36.650%0.49719%0.185SC..Hα-helixtrans-59.9-47.5176.4-65.6-27.8000110.7Q23 L29 S30 D31Q23-D27 VanDerWaalsContact O-CG 3.31Å; Q23-D27 PolarHBondContact O-N 2.87Å; D27-L29 VanDerWaalsContact C-N 3.28Å; D27-L29 PolarHBondContact O-N 2.91Å; D27-S30 WeakPolarHBondContact O-CB 3.27Å; D27-S30 PolarHBondContact O-N 3.14Å; D27-S30 VanDerWaalsContact O-N 3.14Å; D27-D31 PolarHBondContact O-N 3.37Å
28C84.6Confident85.5Confident13 Ų1339.2 Ų39.29%0.08820%0.196CC..Hα-helixtrans-63.4-32.9176.2-690000113Q24 L25 L26 S32 F202 K203Q24-C28 PolarHBondContact O-N 3.11Å; Q24-C28 VanDerWaalsContact O-N 3.07Å; Q24-C28 PolarHBondContact O-SG 2.81Å; L25-C28 PolarHBondContact O-N 2.89Å; L26-C28 PolarHBondContact O-N 3.34Å; C28-S32 PolarHBondContact O-N 3.39Å; C28-S32 PolarHBondContact O-OG 3.15Å; C28-F202 HydrophobicContact CB-CD1 3.61Å; C28-F202 HydrophobicContact CB-CE1 3.37Å; C28-F202 HydrophobicContact CB-CZ 4.47Å; C28-K203 VanDerWaalsContact SG-CE 3.53Å; C28-K203 VanDerWaalsContact SG-CG 3.52Å
29L86.6Confident86.2Confident1 Ų139.2 Ų39.21%0.00520%0.196CC..Hα-helixtrans-66.8-47172.9-78.1168.2000110L25 L26 D27 D31 S32 F33 M56 I62 N65 I69 L152 F202L25-L29 WeakPolarHBondContact O-CG 3.37Å; L25-L29 PolarHBondContact O-N 2.76Å; L26-L29 HydrophobicContact CD2-CD1 4.46Å; L26-L29 WeakPolarHBondContact O-CB 3.42Å; L26-L29 PolarHBondContact O-N 3.44Å; L26-L29 VanDerWaalsContact O-N 3.15Å; D27-L29 VanDerWaalsContact C-N 3.28Å; D27-L29 PolarHBondContact O-N 2.91Å; L29-D31 VanDerWaalsContact C-N 3.31Å; L29-D31 PolarHBondContact O-N 3.26Å; L29-S32 CarbonylContact O-C 3.31Å; L29-S32 WeakPolarHBondContact O-CA 3.4Å; L29-S32 VanDerWaalsContact O-CB 3.31Å; L29-S32 WeakPolarHBondContact O-CB 3.13Å; L29-S32 PolarHBondContact O-N 3.06Å; L29-F33 VanDerWaalsContact O-CD2 3.31Å; L29-F33 WeakPolarHBondContact O-CD2 3.42Å; L29-F33 PolarHBondContact O-N 3.22Å; L29-M56 HydrophobicContact CB-CE 4.09Å; L29-I62 HydrophobicContact CD1-CG2 4.14Å; L29-N65 HydrophobicContact CD1-CB 4.26Å; L29-I69 HydrophobicContact CD2-CD1 3.72Å; L29-L152 HydrophobicContact CD2-CD2 3.75Å; L29-F202 HydrophobicContact CD2-CE1 4.08Å; L29-F202 HydrophobicContact CD2-CZ 3.73Å; L29-F202 HydrophobicContact CG-CE1 4Å; L29-F202 HydrophobicContact CG-CZ 4.15Å
30S90.1Very high87Confident47 Ų4737.4 Ų37.433%0.32919%0.186SC..Hα-helixtrans-54.3-46.9177.3-168.40000111.6L26 D27 S32 F33 D34L26-S30 PolarHBondContact O-N 3.39Å; D27-S30 WeakPolarHBondContact O-CB 3.27Å; D27-S30 PolarHBondContact O-N 3.14Å; D27-S30 VanDerWaalsContact O-N 3.14Å; S30-S32 VanDerWaalsContact C-N 3.26Å; S30-S32 PolarHBondContact O-N 2.89Å; S30-F33 WeakPolarHBondContact O-CB 3.43Å; S30-F33 PolarHBondContact O-N 3.33Å; S30-F33 VanDerWaalsContact O-N 3.15Å; S30-D34 PolarHBondContact O-N 3.38Å
31D89.1Confident87.3Confident84 Ų8437.7 Ų37.745%0.44919%0.193SC..Hα-helixtrans-57.3-41.6174.8-70.2-24.3000111.7D27 L29 D34 V35D27-D31 PolarHBondContact O-N 3.37Å; L29-D31 VanDerWaalsContact C-N 3.31Å; L29-D31 PolarHBondContact O-N 3.26Å; D31-D34 PolarHBondContact O-N 3.18Å; D31-V35 WeakPolarHBondContact O-CG2 3.42Å; D31-V35 PolarHBondContact O-N 3.48Å
32S88.6Confident87.6Confident0 Ų038.3 Ų38.30%020%0.197CC..Hα-helixtrans-68.2-35.2179.3-55.20000112.4C28 L29 S30 T36C28-S32 PolarHBondContact O-N 3.39Å; C28-S32 PolarHBondContact O-OG 3.15Å; L29-S32 CarbonylContact O-C 3.31Å; L29-S32 WeakPolarHBondContact O-CA 3.4Å; L29-S32 VanDerWaalsContact O-CB 3.31Å; L29-S32 WeakPolarHBondContact O-CB 3.13Å; L29-S32 PolarHBondContact O-N 3.06Å; S30-S32 VanDerWaalsContact C-N 3.26Å; S30-S32 PolarHBondContact O-N 2.89Å; S32-T36 VanDerWaalsContact O-CB 3.3Å; S32-T36 WeakPolarHBondContact O-CB 3.49Å; S32-T36 PolarHBondContact O-N 2.83Å; S32-T36 PolarHBondContact O-OG1 3.24Å
33F92.4Very high87.9Confident4 Ų437.7 Ų37.72%0.01819%0.194CC..Hα-helixtrans-61.3-49.4171.6-89.5-93.6000110.9L29 S30 V35 T36 N37 I54 E55 M56 N65 I68 I69L29-F33 VanDerWaalsContact O-CD2 3.31Å; L29-F33 WeakPolarHBondContact O-CD2 3.42Å; L29-F33 PolarHBondContact O-N 3.22Å; S30-F33 WeakPolarHBondContact O-CB 3.43Å; S30-F33 PolarHBondContact O-N 3.33Å; S30-F33 VanDerWaalsContact O-N 3.15Å; F33-V35 PolarHBondContact O-N 3.05Å; F33-T36 PolarHBondContact O-N 3.1Å; F33-N37 WeakPolarHBondContact O-CB 3.44Å; F33-N37 PolarHBondContact O-N 3.44Å; F33-N37 PolarHBondContact O-ND2 2.96Å; F33-I54 HydrophobicContact CD1-CB 4.08Å; F33-I54 HydrophobicContact CD1-CD1 3.5Å; F33-I54 HydrophobicContact CD1-CG1 3.64Å; F33-I54 HydrophobicContact CE1-CB 4.03Å; F33-I54 HydrophobicContact CE1-CD1 3.72Å; F33-I54 HydrophobicContact CE1-CG1 4.01Å; F33-I54 HydrophobicContact CG-CD1 4.24Å; F33-E55 WeakPolarHBondContact CE1-O 3.37Å; F33-M56 HydrophobicContact CD1-CB 4.13Å; F33-M56 HydrophobicContact CD2-CB 3.85Å; F33-M56 HydrophobicContact CD2-CG 4.05Å; F33-M56 HydrophobicContact CD2-SD 4.43Å; F33-M56 HydrophobicContact CE1-CB 4.1Å; F33-M56 HydrophobicContact CE2-CB 3.83Å; F33-M56 HydrophobicContact CE2-CG 3.77Å; F33-M56 HydrophobicContact CG-CB 4.03Å; F33-M56 HydrophobicContact CZ-CB 3.97Å; F33-M56 HydrophobicContact CZ-CG 4.19Å; F33-N65 HydrophobicContact CE2-CB 4.05Å; F33-N65 HydrophobicContact CZ-CB 4.28Å; F33-I68 HydrophobicContact CE1-CB 4.3Å; F33-I68 HydrophobicContact CE1-CG2 3.57Å; F33-I68 HydrophobicContact CZ-CB 4.03Å; F33-I68 HydrophobicContact CZ-CG2 3.82Å; F33-I69 HydrophobicContact CD1-CG1 4.48Å; F33-I69 HydrophobicContact CD2-CD1 3.6Å; F33-I69 HydrophobicContact CD2-CG1 3.78Å; F33-I69 HydrophobicContact CE1-CG1 4.25Å; F33-I69 HydrophobicContact CE2-CD1 3.52Å; F33-I69 HydrophobicContact CE2-CG1 3.5Å; F33-I69 VanDerWaalsContact CE2-CG1 3.5Å; F33-I69 HydrophobicContact CG-CD1 4.41Å; F33-I69 HydrophobicContact CG-CG1 4.24Å; F33-I69 HydrophobicContact CZ-CD1 4.29Å; F33-I69 HydrophobicContact CZ-CG1 3.75Å
34D92.4Very high88.3Confident84 Ų8436 Ų3645%0.44919%0.188SC..Hα-helixtrans-61.4-45-179.2-77.2-11.8000112S30 D31 N37 K38S30-D34 PolarHBondContact O-N 3.38Å; D31-D34 PolarHBondContact O-N 3.18Å; D34-N37 PolarHBondContact O-N 2.89Å; D34-K38 WeakPolarHBondContact O-CG 3.22Å; D34-K38 PolarHBondContact O-N 3.48Å
35V89.9Confident88.3Confident14 Ų1438.7 Ų38.79%0.08521%0.207CC..Hα-helixtrans-65.6-40.6177.1174.10000111.6D31 F33 N37 K38 L39 Y209 N210 I213D31-V35 WeakPolarHBondContact O-CG2 3.42Å; D31-V35 PolarHBondContact O-N 3.48Å; F33-V35 PolarHBondContact O-N 3.05Å; V35-N37 VanDerWaalsContact C-N 3.3Å; V35-N37 PolarHBondContact O-N 3.39Å; V35-K38 PolarHBondContact O-N 2.83Å; V35-L39 PolarHBondContact O-N 3.41Å; V35-Y209 HydrophobicContact CB-CD1 4.48Å; V35-Y209 HydrophobicContact CB-CE1 4Å; V35-Y209 HydrophobicContact CG1-CD1 3.91Å; V35-Y209 HydrophobicContact CG1-CE1 3.46Å; V35-Y209 VanDerWaalsContact CG1-CE1 3.46Å; V35-N210 WeakPolarHBondContact CB-OD1 3.43Å; V35-N210 HydrophobicContact CG2-CB 4.15Å; V35-N210 VanDerWaalsContact CG2-CG 3.48Å; V35-N210 WeakPolarHBondContact CG2-OD1 3.44Å; V35-I213 HydrophobicContact CG1-CB 3.58Å; V35-I213 HydrophobicContact CG1-CG1 3.76Å; V35-I213 HydrophobicContact CG1-CG2 3.69Å
36T90.6Very high88.3Confident0 Ų039.7 Ų39.70%021%0.211CC..Hα-helixtrans-63.4-38.4177.2-570000111.5S32 F33 L39 T40 I54 A72 I76 Y209S32-T36 VanDerWaalsContact O-CB 3.3Å; S32-T36 WeakPolarHBondContact O-CB 3.49Å; S32-T36 PolarHBondContact O-N 2.83Å; S32-T36 PolarHBondContact O-OG1 3.24Å; F33-T36 PolarHBondContact O-N 3.1Å; T36-L39 PolarHBondContact O-N 2.93Å; T36-T40 WeakPolarHBondContact O-CB 3.27Å; T36-T40 PolarHBondContact O-N 3.17Å; T36-T40 PolarHBondContact O-OG1 3.5Å; T36-I54 HydrophobicContact CG2-CD1 3.88Å; T36-I54 HydrophobicContact CG2-CG1 4.47Å; T36-A72 HydrophobicContact CG2-CB 4.07Å; T36-I76 HydrophobicContact CG2-CD1 3.94Å; T36-Y209 PolarHBondContact OG1-OH 3Å
37N92.9Very high88Confident38 Ų3838.8 Ų38.820%0.20321%0.206CC..Hα-helixtrans-67.3-41.3175.2-76.6-25.4000112.2F33 D34 V35 L39 T40 E41 S53 I54F33-N37 WeakPolarHBondContact O-CB 3.44Å; F33-N37 PolarHBondContact O-N 3.44Å; F33-N37 PolarHBondContact O-ND2 2.96Å; D34-N37 PolarHBondContact O-N 2.89Å; V35-N37 VanDerWaalsContact C-N 3.3Å; V35-N37 PolarHBondContact O-N 3.39Å; N37-L39 VanDerWaalsContact C-N 3.34Å; N37-L39 PolarHBondContact O-N 3.33Å; N37-T40 WeakPolarHBondContact O-CB 3.41Å; N37-T40 PolarHBondContact O-N 3.41Å; N37-E41 PolarHBondContact O-N 3.08Å; N37-S53 WeakPolarHBondContact OD1-CA 3.46Å; N37-S53 WeakPolarHBondContact OD1-CB 3.44Å; N37-I54 PolarHBondContact ND2-O 3.39Å; N37-I54 WeakPolarHBondContact OD1-CG1 3.45Å; N37-I54 PolarHBondContact OD1-N 3.45Å; N37-I54 PolarHBondContact OD1-O 2.9Å
38K91.1Very high87.7Confident107 Ų10736.7 Ų36.747%0.46521%0.207SC..Hα-helixtrans-61.7-41.7173.6-71.5169-176.4168.70112.1D34 V35 T40 E41 V42 I217D34-K38 WeakPolarHBondContact O-CG 3.22Å; D34-K38 PolarHBondContact O-N 3.48Å; V35-K38 PolarHBondContact O-N 2.83Å; K38-T40 VanDerWaalsContact C-N 3.34Å; K38-E41 PolarHBondContact O-N 3.37Å; K38-V42 WeakPolarHBondContact O-CG2 3.39Å; K38-V42 PolarHBondContact O-N 3.36Å; K38-V42 VanDerWaalsContact O-N 3.08Å; K38-I217 HydrophobicContact CB-CD1 3.88Å; K38-I217 HydrophobicContact CD-CD1 4.46Å
39L88.1Confident87.7Confident1 Ų136.7 Ų36.71%0.00521%0.207CC..Hα-helixtrans-62.2-44.7173.8179.358.6000111V35 T36 N37 E41 V42 L43 I76 L135 I213V35-L39 PolarHBondContact O-N 3.41Å; T36-L39 PolarHBondContact O-N 2.93Å; N37-L39 VanDerWaalsContact C-N 3.34Å; N37-L39 PolarHBondContact O-N 3.33Å; L39-E41 VanDerWaalsContact C-N 3.31Å; L39-E41 PolarHBondContact O-N 2.84Å; L39-V42 PolarHBondContact O-N 3.04Å; L39-L43 HydrophobicContact CD1-CD1 4.15Å; L39-L43 HydrophobicContact CD1-CG 4.12Å; L39-L43 HydrophobicContact CG-CD1 3.88Å; L39-L43 HydrophobicContact CG-CG 4.32Å; L39-L43 WeakPolarHBondContact O-CB 3.5Å; L39-L43 VanDerWaalsContact O-CG 3.24Å; L39-L43 WeakPolarHBondContact O-CG 3.32Å; L39-L43 PolarHBondContact O-N 3.29Å; L39-I76 HydrophobicContact CD2-CD1 4.18Å; L39-I76 HydrophobicContact CD2-CG2 4.16Å; L39-L135 HydrophobicContact CD1-CD1 4.09Å; L39-L135 HydrophobicContact CD1-CD2 4.37Å; L39-I213 HydrophobicContact CB-CG2 3.85Å; L39-I213 HydrophobicContact CD1-CD1 4.17Å; L39-I213 HydrophobicContact CD1-CG2 4.4Å; L39-I213 HydrophobicContact CD2-CD1 3.69Å; L39-I213 HydrophobicContact CD2-CG1 4.28Å; L39-I213 HydrophobicContact CG-CD1 4.39Å
40T89.7Confident87.7Confident7 Ų748.1 Ų48.14%0.04325%0.25CC..Hα-helixtrans-56.9-44.6176.9-66.70000111.6T36 N37 K38 L43 N44 L51T36-T40 WeakPolarHBondContact O-CB 3.27Å; T36-T40 PolarHBondContact O-N 3.17Å; T36-T40 PolarHBondContact O-OG1 3.5Å; N37-T40 WeakPolarHBondContact O-CB 3.41Å; N37-T40 PolarHBondContact O-N 3.41Å; K38-T40 VanDerWaalsContact C-N 3.34Å; T40-L43 PolarHBondContact O-N 3.47Å; T40-N44 WeakPolarHBondContact O-CB 3.38Å; T40-N44 PolarHBondContact O-N 3.36Å; T40-N44 PolarHBondContact O-OD1 3.17Å; T40-L51 HydrophobicContact CG2-CB 3.63Å; T40-L51 WeakPolarHBondContact CG2-O 3.48Å
41E90Very high87.6Confident127 Ų12746.7 Ų46.759%0.59324%0.239SC*.Hα-helixtrans-61-46.6176.1-175.1-179.2-170.700112.1N37 K38 L39 L43 N44 T45N37-E41 PolarHBondContact O-N 3.08Å; K38-E41 PolarHBondContact O-N 3.37Å; L39-E41 VanDerWaalsContact C-N 3.31Å; L39-E41 PolarHBondContact O-N 2.84Å; E41-L43 VanDerWaalsContact C-N 3.34Å; E41-L43 PolarHBondContact O-N 2.97Å; E41-N44 PolarHBondContact O-N 2.58Å; E41-T45 VanDerWaalsContact O-CB 3.27Å; E41-T45 WeakPolarHBondContact O-CB 3.46Å; E41-T45 PolarHBondContact O-N 3.39Å; E41-T45 PolarHBondContact O-OG1 3.09Å
42V87Confident87.7Confident15 Ų1546.5 Ų46.59%0.09125%0.249CC..Hα-helixtrans-59.7-45.4176.2166.90000111.1K38 L39 T45 H46 V131 V216 I217 V220K38-V42 WeakPolarHBondContact O-CG2 3.39Å; K38-V42 PolarHBondContact O-N 3.36Å; K38-V42 VanDerWaalsContact O-N 3.08Å; L39-V42 PolarHBondContact O-N 3.04Å; V42-T45 PolarHBondContact O-N 3.48Å; V42-H46 VanDerWaalsContact O-CB 3.31Å; V42-H46 WeakPolarHBondContact O-CB 3.43Å; V42-H46 PolarHBondContact O-CD2 3.35Å; V42-H46 VanDerWaalsContact O-CD2 3.32Å; V42-H46 PolarHBondContact O-N 3.38Å; V42-V131 HydrophobicContact CG1-CG1 4.08Å; V42-V131 HydrophobicContact CG1-CG2 3.76Å; V42-V216 HydrophobicContact CG1-CG1 4.37Å; V42-I217 HydrophobicContact CG2-CG1 3.9Å; V42-V220 HydrophobicContact CG1-CG2 4.17Å
43L85.6Confident87.9Confident0 Ų051 Ų510%028%0.28CS..Hα-helixtrans-65.1-44.3179.9-69.5172.3000112.1L39 T40 E41 T45 L47 G48 C49 L51 I76 L80 V131 L135L39-L43 HydrophobicContact CD1-CD1 4.15Å; L39-L43 HydrophobicContact CD1-CG 4.12Å; L39-L43 HydrophobicContact CG-CD1 3.88Å; L39-L43 HydrophobicContact CG-CG 4.32Å; L39-L43 WeakPolarHBondContact O-CB 3.5Å; L39-L43 VanDerWaalsContact O-CG 3.24Å; L39-L43 WeakPolarHBondContact O-CG 3.32Å; L39-L43 PolarHBondContact O-N 3.29Å; T40-L43 PolarHBondContact O-N 3.47Å; E41-L43 VanDerWaalsContact C-N 3.34Å; E41-L43 PolarHBondContact O-N 2.97Å; L43-T45 VanDerWaalsContact C-N 3.34Å; L43-L47 HydrophobicContact CD2-CD1 3.67Å; L43-L47 HydrophobicContact CD2-CG 4.4Å; L43-L47 CarbonylContact O-C 3.6Å; L43-L47 VanDerWaalsContact O-CA 3.32Å; L43-L47 WeakPolarHBondContact O-CA 3.47Å; L43-L47 WeakPolarHBondContact O-CB 3.26Å; L43-L47 PolarHBondContact O-N 3.17Å; L43-G48 PolarHBondContact O-N 2.81Å; L43-C49 HydrophobicContact CB-CB 4.13Å; L43-C49 PolarHBondContact O-N 3.41Å; L43-L51 HydrophobicContact CB-CD1 4.1Å; L43-L51 HydrophobicContact CD1-CD1 3.73Å; L43-I76 HydrophobicContact CD1-CB 4.28Å; L43-I76 HydrophobicContact CD1-CG1 3.95Å; L43-I76 HydrophobicContact CD1-CG2 3.57Å; L43-L80 HydrophobicContact CD2-CD2 3.76Å; L43-L80 HydrophobicContact CD2-CG 4.46Å; L43-V131 HydrophobicContact CD2-CG1 4.29Å; L43-L135 HydrophobicContact CD2-CD1 3.52Å; L43-L135 HydrophobicContact CG-CD1 4.49Å
44N88.3Confident87.9Confident51 Ų5152 Ų5227%0.27329%0.285SS..Hα-helixtrans-64.5-41.8178.1-70.3-9.9000111.4T40 E41 G48 C49 L51T40-N44 WeakPolarHBondContact O-CB 3.38Å; T40-N44 PolarHBondContact O-N 3.36Å; T40-N44 PolarHBondContact O-OD1 3.17Å; E41-N44 PolarHBondContact O-N 2.58Å; N44-G48 WeakPolarHBondContact O-CA 3.32Å; N44-G48 PolarHBondContact O-N 3.32Å; N44-C49 WeakPolarHBondContact CA-O 3.35Å; N44-C49 WeakPolarHBondContact OD1-CB 3.31Å; N44-C49 PolarHBondContact OD1-O 3.08Å; N44-L51 PolarHBondContact ND2-O 3.23Å; N44-L51 WeakPolarHBondContact OD1-CB 2.96Å; N44-L51 PolarHBondContact OD1-N 3.2Å
45T85.3Confident87.9Confident96 Ų9655.9 Ų55.959%0.58930%0.301SS*.Hα-helixtrans-72.5-45.1-177.3-56.40000112.1E41 V42 L43E41-T45 VanDerWaalsContact O-CB 3.27Å; E41-T45 WeakPolarHBondContact O-CB 3.46Å; E41-T45 PolarHBondContact O-N 3.39Å; E41-T45 PolarHBondContact O-OG1 3.09Å; V42-T45 PolarHBondContact O-N 3.48Å; L43-T45 VanDerWaalsContact C-N 3.34Å
46H81.9Confident87.9Confident26 Ų2656.7 Ų56.712%0.1230%0.304CS..Hα-helixtrans-103-27.4-168.4-64.1-67.8000113.8V42 A128 V131 V220V42-H46 VanDerWaalsContact O-CB 3.31Å; V42-H46 WeakPolarHBondContact O-CB 3.43Å; V42-H46 PolarHBondContact O-CD2 3.35Å; V42-H46 VanDerWaalsContact O-CD2 3.32Å; V42-H46 PolarHBondContact O-N 3.38Å; H46-A128 HydrophobicContact CB-CB 4.47Å; H46-A128 WeakPolarHBondContact O-CB 3.41Å; H46-V131 HydrophobicContact CB-CG2 4.2Å; H46-V220 WeakPolarHBondContact NE2-CG1 3.5Å
47L78.2Confident87.7Confident6 Ų661.7 Ų61.73%0.03133%0.326CS..SBendtrans-108.66.1177.3-60.7-172.5000112.9L43 C49 L80 V83 I117 L121 A128 V131 A132L43-L47 HydrophobicContact CD2-CD1 3.67Å; L43-L47 HydrophobicContact CD2-CG 4.4Å; L43-L47 CarbonylContact O-C 3.6Å; L43-L47 VanDerWaalsContact O-CA 3.32Å; L43-L47 WeakPolarHBondContact O-CA 3.47Å; L43-L47 WeakPolarHBondContact O-CB 3.26Å; L43-L47 PolarHBondContact O-N 3.17Å; L47-C49 PolarHBondContact O-N 2.82Å; L47-C49 VanDerWaalsContact O-N 3.17Å; L47-L80 HydrophobicContact CD1-CD2 4.03Å; L47-V83 HydrophobicContact CD1-CG2 4.43Å; L47-I117 HydrophobicContact CD2-CD1 4.31Å; L47-L121 HydrophobicContact CD2-CD1 4.49Å; L47-L121 WeakPolarHBondContact O-CD2 3.48Å; L47-A128 VanDerWaalsContact CD2-O 3.32Å; L47-A128 WeakPolarHBondContact CD2-O 3.41Å; L47-V131 HydrophobicContact CD1-CG1 3.86Å; L47-V131 HydrophobicContact CD2-CB 4.46Å; L47-V131 HydrophobicContact CD2-CG1 4.46Å; L47-V131 HydrophobicContact CG-CB 4.47Å; L47-V131 HydrophobicContact CG-CG1 3.99Å; L47-A132 HydrophobicContact CD2-CB 4.13Å
48G79.2Confident87Confident50 Ų5071 Ų7152%0.51536%0.358SS..  trans6320.4179.800000113.6L43 N44L43-G48 PolarHBondContact O-N 2.81Å; N44-G48 WeakPolarHBondContact O-CA 3.32Å; N44-G48 PolarHBondContact O-N 3.32Å
49C84Confident86.2Confident12 Ų1273.4 Ų73.48%0.08138%0.376CS..  trans-64.5159.2177.1-610000111.2L43 N44 L47 L51L43-C49 HydrophobicContact CB-CB 4.13Å; L43-C49 PolarHBondContact O-N 3.41Å; N44-C49 WeakPolarHBondContact CA-O 3.35Å; N44-C49 WeakPolarHBondContact OD1-CB 3.31Å; N44-C49 PolarHBondContact OD1-O 3.08Å; L47-C49 PolarHBondContact O-N 2.82Å; L47-C49 VanDerWaalsContact O-N 3.17Å; C49-L51 HydrophobicContact CB-CD1 4.02Å; C49-L51 HydrophobicContact CB-CG 4.14Å
50R86.9Confident85.5Confident241 Ų24174.3 Ų74.391%0.90939%0.385SS*.  trans-122.658.8175.6-64.5-174.8-176.91800.4110.6
51L89.5Confident84.9Confident18 Ų1875.7 Ų75.79%0.09439%0.394CS..PPolyproline II helixtrans-91.7135.3179.5-65.1164.4000109.5T40 L43 N44 C49 K75 I76 E79T40-L51 HydrophobicContact CG2-CB 3.63Å; T40-L51 WeakPolarHBondContact CG2-O 3.48Å; L43-L51 HydrophobicContact CB-CD1 4.1Å; L43-L51 HydrophobicContact CD1-CD1 3.73Å; N44-L51 PolarHBondContact ND2-O 3.23Å; N44-L51 WeakPolarHBondContact OD1-CB 2.96Å; N44-L51 PolarHBondContact OD1-N 3.2Å; C49-L51 HydrophobicContact CB-CD1 4.02Å; C49-L51 HydrophobicContact CB-CG 4.14Å; L51-K75 HydrophobicContact CD2-CB 3.79Å; L51-I76 HydrophobicContact CD1-CB 4.46Å; L51-I76 HydrophobicContact CD1-CG1 3.66Å; L51-I76 HydrophobicContact CD2-CG1 4.42Å; L51-E79 HydrophobicContact CD2-CG 3.84Å; L51-E79 HydrophobicContact CG-CG 4.2Å
52A90.8Very high84.3Confident80 Ų8069.7 Ų69.766%0.66137%0.366SS*.PPolyproline II helixtrans-82.1142.2174.800000110.2
53S91.4Very high84.1Confident93 Ų9371.7 Ų71.765%0.6537%0.373SS*.PPolyproline II helixtrans-63.1149.1166.455.10000110.4N37N37-S53 WeakPolarHBondContact OD1-CA 3.46Å; N37-S53 WeakPolarHBondContact OD1-CB 3.44Å
54I93.2Very high83.9Confident26 Ų2675.4 Ų75.413%0.13339%0.391CS..  trans-105.7152175.252.3168.9000111.2F33 T36 N37 I68 I69 A72F33-I54 HydrophobicContact CD1-CB 4.08Å; F33-I54 HydrophobicContact CD1-CD1 3.5Å; F33-I54 HydrophobicContact CD1-CG1 3.64Å; F33-I54 HydrophobicContact CE1-CB 4.03Å; F33-I54 HydrophobicContact CE1-CD1 3.72Å; F33-I54 HydrophobicContact CE1-CG1 4.01Å; F33-I54 HydrophobicContact CG-CD1 4.24Å; T36-I54 HydrophobicContact CG2-CD1 3.88Å; T36-I54 HydrophobicContact CG2-CG1 4.47Å; N37-I54 PolarHBondContact ND2-O 3.39Å; N37-I54 WeakPolarHBondContact OD1-CG1 3.45Å; N37-I54 PolarHBondContact OD1-N 3.45Å; N37-I54 PolarHBondContact OD1-O 2.9Å; I54-I68 HydrophobicContact CB-CG2 3.86Å; I54-I68 HydrophobicContact CD1-CG2 4.32Å; I54-I68 HydrophobicContact CG2-CG2 3.85Å; I54-I69 HydrophobicContact CD1-CG1 4.15Å; I54-A72 HydrophobicContact CD1-CB 3.85Å; I54-A72 HydrophobicContact CG1-CB 4.42Å; I54-A72 HydrophobicContact CG2-CB 3.64Å
55E92.9Very high83.8Confident165 Ų16573 Ų7377%0.77138%0.378SS*.  trans-126.6138.5176.2-172.3174.9-172.800109.8F33F33-E55 WeakPolarHBondContact CE1-O 3.37Å
56M88.4Confident83.8Confident32 Ų3268.4 Ų68.416%0.15835%0.35CS..  trans-74.8129.4177.3-171.1-178.6179.500109.8L26 L29 F33 R58 N65L26-M56 HydrophobicContact CB-CE 4.08Å; L26-M56 HydrophobicContact CD2-CE 3.54Å; L26-M56 HydrophobicContact CG-CE 4.37Å; L29-M56 HydrophobicContact CB-CE 4.09Å; F33-M56 HydrophobicContact CD1-CB 4.13Å; F33-M56 HydrophobicContact CD2-CB 3.85Å; F33-M56 HydrophobicContact CD2-CG 4.05Å; F33-M56 HydrophobicContact CD2-SD 4.43Å; F33-M56 HydrophobicContact CE1-CB 4.1Å; F33-M56 HydrophobicContact CE2-CB 3.83Å; F33-M56 HydrophobicContact CE2-CG 3.77Å; F33-M56 HydrophobicContact CG-CB 4.03Å; F33-M56 HydrophobicContact CZ-CB 3.97Å; F33-M56 HydrophobicContact CZ-CG 4.19Å; M56-R58 PolarHBondContact O-N 3.32Å; M56-N65 HydrophobicContact CG-CB 4.47Å; M56-N65 WeakPolarHBondContact CG-OD1 3.49Å
57K87.3Confident84Confident104 Ų10469.6 Ų69.645%0.45236%0.357SS..  trans-79100.8171.3-67.4-174.3176.5-175.50109.2D59 G60 N65 I68K57-D59 VanDerWaalsContact C-N 3.27Å; K57-D59 PolarHBondContact O-N 3.47Å; K57-G60 PolarHBondContact O-N 3.47Å; K57-N65 PolarHBondContact N-OD1 3.41Å; K57-N65 PolarHBondContact O-ND2 3.2Å; K57-I68 HydrophobicContact CD-CD1 4.14Å; K57-I68 HydrophobicContact CG-CD1 4.04Å
58R78.9Confident84.6Confident235 Ų23571 Ų7189%0.88736%0.364SS*.THydrogen-bonded Turntrans-65-30.1-177.7-64.2-173.1-176.7-178.81.5113.5M56M56-R58 PolarHBondContact O-N 3.32Å
59D74.7Confident85.1Confident156 Ų15668.7 Ų68.783%0.83434%0.34SS*.THydrogen-bonded Turntrans-91.1-6.5173.963.2-32.1000112.9K57K57-D59 VanDerWaalsContact C-N 3.27Å; K57-D59 PolarHBondContact O-N 3.47Å
60G72.3Confident85.3Confident20 Ų2069.1 Ų69.121%0.20634%0.341CS..SBendtrans-80.8166.2178.500000113.2K57 E64K57-G60 PolarHBondContact O-N 3.47Å; G60-E64 WeakPolarHBondContact CA-OE2 3.32Å
61T77.3Confident85.5Confident36 Ų3663 Ų6322%0.22132%0.323CS..  trans-73.9159.2174.863.20000111.6K63 E64 N65 G169T61-K63 PolarHBondContact O-N 3.19Å; T61-E64 PolarHBondContact N-OE2 2.88Å; T61-E64 PolarHBondContact O-N 3.05Å; T61-E64 VanDerWaalsContact OG1-CG 3.27Å; T61-E64 WeakPolarHBondContact OG1-CG 3.41Å; T61-E64 PolarHBondContact OG1-N 3.18Å; T61-E64 PolarHBondContact OG1-OE2 3.43Å; T61-N65 PolarHBondContact O-N 2.92Å; T61-N65 VanDerWaalsContact O-N 3.16Å; T61-N65 PolarHBondContact O-ND2 3.28Å; T61-G169 WeakPolarHBondContact CG2-O 3.28Å
62I77.8Confident85.6Confident1 Ų162.6 Ų62.61%0.00532%0.322CS..Hα-helixtrans-53.6-41169.7-72.2154.4000110.2H22 L25 L26 L29 N65 C66 I155 L159 Y195H22-I62 WeakPolarHBondContact CE1-CD1 3.49Å; L25-I62 HydrophobicContact CD2-CD1 3.76Å; L25-I62 HydrophobicContact CD2-CG1 4.19Å; L25-I62 HydrophobicContact CD2-CG2 3.82Å; L26-I62 HydrophobicContact CD2-CG1 3.99Å; L29-I62 HydrophobicContact CD1-CG2 4.14Å; I62-N65 PolarHBondContact O-N 2.91Å; I62-C66 PolarHBondContact O-N 3.25Å; I62-C66 PolarHBondContact O-SG 3.02Å; I62-I155 HydrophobicContact CG2-CG2 3.8Å; I62-L159 HydrophobicContact CB-CD1 4.46Å; I62-L159 HydrophobicContact CG2-CD1 4.3Å; I62-Y195 HydrophobicContact CD1-CE1 4.07Å
63K81.5Confident85.4Confident57 Ų5758.9 Ų58.925%0.24829%0.291CS..Hα-helixtrans-57.6-52.7178.6-164179.8165.7-72.10112.3T61 N65 C66 D67 L159 L160T61-K63 PolarHBondContact O-N 3.19Å; K63-N65 VanDerWaalsContact C-N 3.25Å; K63-N65 PolarHBondContact O-N 3.01Å; K63-C66 WeakPolarHBondContact O-CB 3.26Å; K63-C66 PolarHBondContact O-N 3.38Å; K63-C66 VanDerWaalsContact O-N 3.17Å; K63-D67 IonicContact NZ-OD2 3.98Å; K63-D67 PolarHBondContact NZ-OD2 3.41Å; K63-D67 PolarHBondContact O-N 3.4Å; K63-L159 HydrophobicContact CB-CD1 3.51Å; K63-L159 HydrophobicContact CG-CD1 4.1Å; K63-L160 HydrophobicContact CD-CD1 4.17Å; K63-L160 HydrophobicContact CD-CG 4.27Å
64E81.9Confident85.2Confident78 Ų7859.7 Ų59.736%0.36429%0.286SS..Hα-helixtrans-61-40.7-177.2-72.7166.212600110.6G60 T61 D67 I68G60-E64 WeakPolarHBondContact CA-OE2 3.32Å; T61-E64 PolarHBondContact N-OE2 2.88Å; T61-E64 PolarHBondContact O-N 3.05Å; T61-E64 VanDerWaalsContact OG1-CG 3.27Å; T61-E64 WeakPolarHBondContact OG1-CG 3.41Å; T61-E64 PolarHBondContact OG1-N 3.18Å; T61-E64 PolarHBondContact OG1-OE2 3.43Å; E64-D67 PolarHBondContact O-N 2.98Å; E64-I68 WeakPolarHBondContact O-CD1 3.25Å; E64-I68 VanDerWaalsContact O-CG1 3.23Å; E64-I68 WeakPolarHBondContact O-CG1 3.44Å; E64-I68 PolarHBondContact O-N 2.92Å
65N86.3Confident85.1Confident0 Ų064.2 Ų64.20%031%0.305CS..Hα-helixtrans-66.3-41175.8-75.2-55.8000112.4L29 F33 M56 K57 T61 I62 K63 I68 I69L29-N65 HydrophobicContact CD1-CB 4.26Å; F33-N65 HydrophobicContact CE2-CB 4.05Å; F33-N65 HydrophobicContact CZ-CB 4.28Å; M56-N65 HydrophobicContact CG-CB 4.47Å; M56-N65 WeakPolarHBondContact CG-OD1 3.49Å; K57-N65 PolarHBondContact N-OD1 3.41Å; K57-N65 PolarHBondContact O-ND2 3.2Å; T61-N65 PolarHBondContact O-N 2.92Å; T61-N65 VanDerWaalsContact O-N 3.16Å; T61-N65 PolarHBondContact O-ND2 3.28Å; I62-N65 PolarHBondContact O-N 2.91Å; K63-N65 VanDerWaalsContact C-N 3.25Å; K63-N65 PolarHBondContact O-N 3.01Å; N65-I68 PolarHBondContact O-N 3.44Å; N65-I69 WeakPolarHBondContact O-CG1 3.01Å; N65-I69 PolarHBondContact O-N 3.43Å
66C84.8Confident84.8Confident0 Ų056.5 Ų56.50%027%0.269CS..Hα-helixtrans-59.7-46.3171.4-69.60000111.7I62 K63 I68 I69 I70 L152I62-C66 PolarHBondContact O-N 3.25Å; I62-C66 PolarHBondContact O-SG 3.02Å; K63-C66 WeakPolarHBondContact O-CB 3.26Å; K63-C66 PolarHBondContact O-N 3.38Å; K63-C66 VanDerWaalsContact O-N 3.17Å; C66-I68 VanDerWaalsContact C-N 3.31Å; C66-I68 PolarHBondContact O-N 2.86Å; C66-I69 PolarHBondContact O-N 3.19Å; C66-I70 WeakPolarHBondContact O-CB 3.42Å; C66-I70 VanDerWaalsContact O-CG1 3.25Å; C66-I70 WeakPolarHBondContact O-CG1 3.15Å; C66-I70 PolarHBondContact O-N 3.38Å; C66-L152 HydrophobicContact CB-CB 4.34Å; C66-L152 HydrophobicContact CB-CD2 4.16Å
67D86.4Confident84.6Confident52 Ų5256.8 Ų56.828%0.27827%0.27SS..Hα-helixtrans-62.1-38.9-179.7-72.2-22.3000111.4K63 E64 I70 Q71K63-D67 IonicContact NZ-OD2 3.98Å; K63-D67 PolarHBondContact NZ-OD2 3.41Å; K63-D67 PolarHBondContact O-N 3.4Å; E64-D67 PolarHBondContact O-N 2.98Å; D67-I70 PolarHBondContact O-N 2.96Å; D67-Q71 WeakPolarHBondContact O-CB 3.5Å; D67-Q71 VanDerWaalsContact O-CG 3.26Å; D67-Q71 WeakPolarHBondContact O-CG 3.34Å; D67-Q71 PolarHBondContact O-N 2.68Å
68I91.4Very high84.6Confident36 Ų3658.2 Ų58.219%0.18528%0.276CS..Hα-helixtrans-61-49175.1-69.4162.3000110.9F33 I54 K57 E64 N65 C66 Q71 A72F33-I68 HydrophobicContact CE1-CB 4.3Å; F33-I68 HydrophobicContact CE1-CG2 3.57Å; F33-I68 HydrophobicContact CZ-CB 4.03Å; F33-I68 HydrophobicContact CZ-CG2 3.82Å; I54-I68 HydrophobicContact CB-CG2 3.86Å; I54-I68 HydrophobicContact CD1-CG2 4.32Å; I54-I68 HydrophobicContact CG2-CG2 3.85Å; K57-I68 HydrophobicContact CD-CD1 4.14Å; K57-I68 HydrophobicContact CG-CD1 4.04Å; E64-I68 WeakPolarHBondContact O-CD1 3.25Å; E64-I68 VanDerWaalsContact O-CG1 3.23Å; E64-I68 WeakPolarHBondContact O-CG1 3.44Å; E64-I68 PolarHBondContact O-N 2.92Å; N65-I68 PolarHBondContact O-N 3.44Å; C66-I68 VanDerWaalsContact C-N 3.31Å; C66-I68 PolarHBondContact O-N 2.86Å; I68-Q71 PolarHBondContact O-N 3.31Å; I68-A72 PolarHBondContact O-N 2.89Å
69I89.6Confident84.9Confident0 Ų049.5 Ų49.50%025%0.245CC..Hα-helixtrans-62.2-46.9178.2-63.6171.4000110.4L29 F33 I54 N65 C66 Q71 A72 I73 L152L29-I69 HydrophobicContact CD2-CD1 3.72Å; F33-I69 HydrophobicContact CD1-CG1 4.48Å; F33-I69 HydrophobicContact CD2-CD1 3.6Å; F33-I69 HydrophobicContact CD2-CG1 3.78Å; F33-I69 HydrophobicContact CE1-CG1 4.25Å; F33-I69 HydrophobicContact CE2-CD1 3.52Å; F33-I69 HydrophobicContact CE2-CG1 3.5Å; F33-I69 VanDerWaalsContact CE2-CG1 3.5Å; F33-I69 HydrophobicContact CG-CD1 4.41Å; F33-I69 HydrophobicContact CG-CG1 4.24Å; F33-I69 HydrophobicContact CZ-CD1 4.29Å; F33-I69 HydrophobicContact CZ-CG1 3.75Å; I54-I69 HydrophobicContact CD1-CG1 4.15Å; N65-I69 WeakPolarHBondContact O-CG1 3.01Å; N65-I69 PolarHBondContact O-N 3.43Å; C66-I69 PolarHBondContact O-N 3.19Å; I69-Q71 VanDerWaalsContact C-N 3.32Å; I69-Q71 PolarHBondContact O-N 2.89Å; I69-A72 PolarHBondContact O-N 2.94Å; I69-I73 HydrophobicContact CG2-CD1 3.64Å; I69-I73 HydrophobicContact CG2-CG1 4.2Å; I69-I73 WeakPolarHBondContact O-CB 3.47Å; I69-I73 WeakPolarHBondContact O-CG1 3.36Å; I69-I73 PolarHBondContact O-N 2.89Å; I69-L152 HydrophobicContact CB-CD1 4.01Å; I69-L152 HydrophobicContact CG2-CD1 3.54Å
70I88.4Confident85.3Confident21 Ų2142.3 Ų42.311%0.10821%0.207CC..Hα-helixtrans-56.6-48178.8-70.7165.9000110.2C66 D67 A72 I73 M74 V149 L152 A153C66-I70 WeakPolarHBondContact O-CB 3.42Å; C66-I70 VanDerWaalsContact O-CG1 3.25Å; C66-I70 WeakPolarHBondContact O-CG1 3.15Å; C66-I70 PolarHBondContact O-N 3.38Å; D67-I70 PolarHBondContact O-N 2.96Å; I70-A72 VanDerWaalsContact C-N 3.34Å; I70-A72 PolarHBondContact O-N 3.41Å; I70-I73 PolarHBondContact O-N 3.44Å; I70-M74 HydrophobicContact CG2-CG 4.33Å; I70-M74 HydrophobicContact CG2-SD 3.95Å; I70-M74 WeakPolarHBondContact O-CB 3.46Å; I70-M74 VanDerWaalsContact O-CG 3.28Å; I70-M74 WeakPolarHBondContact O-CG 3.34Å; I70-M74 PolarHBondContact O-N 2.79Å; I70-V149 HydrophobicContact CG1-CG1 4.38Å; I70-V149 HydrophobicContact CG2-CG1 4.15Å; I70-L152 HydrophobicContact CD1-CB 3.8Å; I70-L152 HydrophobicContact CG1-CB 3.84Å; I70-L152 HydrophobicContact CG1-CD1 4.2Å; I70-A153 HydrophobicContact CD1-CB 4.13Å
71Q90.9Very high85.9Confident113 Ų11346.9 Ų46.953%0.52822%0.223SC..Hα-helixtrans-62.8-39.7179.3-74.518018.500112.6D67 I68 I69 M74 K75D67-Q71 WeakPolarHBondContact O-CB 3.5Å; D67-Q71 VanDerWaalsContact O-CG 3.26Å; D67-Q71 WeakPolarHBondContact O-CG 3.34Å; D67-Q71 PolarHBondContact O-N 2.68Å; I68-Q71 PolarHBondContact O-N 3.31Å; I69-Q71 VanDerWaalsContact C-N 3.32Å; I69-Q71 PolarHBondContact O-N 2.89Å; Q71-M74 PolarHBondContact O-N 3.34Å; Q71-K75 WeakPolarHBondContact O-CG 3.23Å; Q71-K75 PolarHBondContact O-N 3.41Å; Q71-K75 VanDerWaalsContact O-N 3.1Å
72A90.9Very high86.2Confident10 Ų1050.3 Ų50.38%0.08324%0.235CC..Hα-helixtrans-63.9-46.8175.800000111.6T36 I54 I68 I69 I70 M74 K75 I76T36-A72 HydrophobicContact CG2-CB 4.07Å; I54-A72 HydrophobicContact CD1-CB 3.85Å; I54-A72 HydrophobicContact CG1-CB 4.42Å; I54-A72 HydrophobicContact CG2-CB 3.64Å; I68-A72 PolarHBondContact O-N 2.89Å; I69-A72 PolarHBondContact O-N 2.94Å; I70-A72 VanDerWaalsContact C-N 3.34Å; I70-A72 PolarHBondContact O-N 3.41Å; A72-M74 VanDerWaalsContact C-N 3.34Å; A72-M74 PolarHBondContact O-N 3.47Å; A72-K75 WeakPolarHBondContact O-CB 3.45Å; A72-K75 PolarHBondContact O-N 2.84Å; A72-I76 WeakPolarHBondContact O-CG1 3.4Å; A72-I76 PolarHBondContact O-N 2.86Å
73I87.8Confident86.2Confident1 Ų151.1 Ų51.11%0.00524%0.24CC..Hα-helixtrans-60.5-43.5176.8-71.8175.9000111.2I69 I70 K75 I76 Q77 I145 L148 V149I69-I73 HydrophobicContact CG2-CD1 3.64Å; I69-I73 HydrophobicContact CG2-CG1 4.2Å; I69-I73 WeakPolarHBondContact O-CB 3.47Å; I69-I73 WeakPolarHBondContact O-CG1 3.36Å; I69-I73 PolarHBondContact O-N 2.89Å; I70-I73 PolarHBondContact O-N 3.44Å; I73-K75 VanDerWaalsContact C-N 3.29Å; I73-K75 PolarHBondContact O-N 3.44Å; I73-I76 WeakPolarHBondContact O-CB 3.39Å; I73-I76 PolarHBondContact O-N 2.96Å; I73-I76 VanDerWaalsContact O-N 3.17Å; I73-Q77 HydrophobicContact CG2-CG 4.33Å; I73-Q77 WeakPolarHBondContact O-CG 3.34Å; I73-Q77 PolarHBondContact O-N 3.07Å; I73-I145 HydrophobicContact CB-CG2 4.5Å; I73-I145 HydrophobicContact CG2-CG2 3.15Å; I73-L148 HydrophobicContact CD1-CD2 3.79Å; I73-L148 HydrophobicContact CD1-CG 4.41Å; I73-V149 HydrophobicContact CB-CG2 4.06Å; I73-V149 HydrophobicContact CD1-CG2 4.12Å; I73-V149 HydrophobicContact CG2-CG2 3.43Å; I73-V149 VanDerWaalsContact CG2-CG2 3.43Å
74M87.6Confident86.2Confident111 Ų11150.1 Ų50.155%0.54724%0.237SC..Hα-helixtrans-61.3-38.5177-73.8178.673.300112.1I70 Q71 A72 Q77 K78I70-M74 HydrophobicContact CG2-CG 4.33Å; I70-M74 HydrophobicContact CG2-SD 3.95Å; I70-M74 WeakPolarHBondContact O-CB 3.46Å; I70-M74 VanDerWaalsContact O-CG 3.28Å; I70-M74 WeakPolarHBondContact O-CG 3.34Å; I70-M74 PolarHBondContact O-N 2.79Å; Q71-M74 PolarHBondContact O-N 3.34Å; A72-M74 VanDerWaalsContact C-N 3.34Å; A72-M74 PolarHBondContact O-N 3.47Å; M74-Q77 PolarHBondContact O-N 2.99Å; M74-K78 WeakPolarHBondContact O-CB 3.38Å; M74-K78 PolarHBondContact O-N 2.65Å
75K89.4Confident86.2Confident121 Ų12149.8 Ų49.853%0.52624%0.236SC..Hα-helixtrans-65.6-43.5174-70.2172-175.2175.60111.3L51 Q71 A72 I73 K78 E79L51-K75 HydrophobicContact CD2-CB 3.79Å; Q71-K75 WeakPolarHBondContact O-CG 3.23Å; Q71-K75 PolarHBondContact O-N 3.41Å; Q71-K75 VanDerWaalsContact O-N 3.1Å; A72-K75 WeakPolarHBondContact O-CB 3.45Å; A72-K75 PolarHBondContact O-N 2.84Å; I73-K75 VanDerWaalsContact C-N 3.29Å; I73-K75 PolarHBondContact O-N 3.44Å; K75-K78 PolarHBondContact O-N 2.52Å; K75-E79 PolarHBondContact O-N 3.22Å
76I87.8Confident85.7Confident2 Ų251 Ų511%0.0125%0.245CC..Hα-helixtrans-56.7-50.4173.9-73.3161000110.5T36 L39 L43 L51 A72 I73 K78 E79 L80T36-I76 HydrophobicContact CG2-CD1 3.94Å; L39-I76 HydrophobicContact CD2-CD1 4.18Å; L39-I76 HydrophobicContact CD2-CG2 4.16Å; L43-I76 HydrophobicContact CD1-CB 4.28Å; L43-I76 HydrophobicContact CD1-CG1 3.95Å; L43-I76 HydrophobicContact CD1-CG2 3.57Å; L51-I76 HydrophobicContact CD1-CB 4.46Å; L51-I76 HydrophobicContact CD1-CG1 3.66Å; L51-I76 HydrophobicContact CD2-CG1 4.42Å; A72-I76 WeakPolarHBondContact O-CG1 3.4Å; A72-I76 PolarHBondContact O-N 2.86Å; I73-I76 WeakPolarHBondContact O-CB 3.39Å; I73-I76 PolarHBondContact O-N 2.96Å; I73-I76 VanDerWaalsContact O-N 3.17Å; I76-K78 VanDerWaalsContact C-N 3.28Å; I76-K78 PolarHBondContact O-N 3.41Å; I76-E79 PolarHBondContact O-N 3.3Å; I76-L80 HydrophobicContact CG2-CD1 3.8Å; I76-L80 HydrophobicContact CG2-CG 4.32Å; I76-L80 WeakPolarHBondContact O-CB 3.47Å; I76-L80 WeakPolarHBondContact O-CG 3.23Å; I76-L80 PolarHBondContact O-N 3.22Å
77Q84.6Confident85.3Confident39 Ų3951.1 Ų51.118%0.18225%0.246CC..Hα-helixtrans-58.9-40.1178.5-73.5-178.9-41.700111.9I73 M74 L80 Q81 T141 I145 N146I73-Q77 HydrophobicContact CG2-CG 4.33Å; I73-Q77 WeakPolarHBondContact O-CG 3.34Å; I73-Q77 PolarHBondContact O-N 3.07Å; M74-Q77 PolarHBondContact O-N 2.99Å; Q77-L80 PolarHBondContact O-N 3.35Å; Q77-Q81 WeakPolarHBondContact O-CB 3.24Å; Q77-Q81 PolarHBondContact O-N 3.24Å; Q77-T141 HydrophobicContact CG-CG2 4.18Å; Q77-I145 HydrophobicContact CG-CG2 4.17Å; Q77-N146 PolarHBondContact NE2-OD1 3.18Å
78K87.1Confident84.9Confident133 Ų13353.8 Ų53.858%0.57826%0.255SS*.Hα-helixtrans-64.8-42.7177-173176.7-177.6176.90112.6M74 K75 I76 Q81 K82M74-K78 WeakPolarHBondContact O-CB 3.38Å; M74-K78 PolarHBondContact O-N 2.65Å; K75-K78 PolarHBondContact O-N 2.52Å; I76-K78 VanDerWaalsContact C-N 3.28Å; I76-K78 PolarHBondContact O-N 3.41Å; K78-Q81 PolarHBondContact O-N 2.85Å; K78-K82 WeakPolarHBondContact O-CG 3.37Å; K78-K82 PolarHBondContact O-N 3.38Å
79E85.4Confident84.2Confident52 Ų5258.5 Ų58.524%0.24328%0.281CS..Hα-helixtrans-66.5-41.7175.2-66.9-53.2137.900111.3L51 K75 I76 Q81 K82 V83L51-E79 HydrophobicContact CD2-CG 3.84Å; L51-E79 HydrophobicContact CG-CG 4.2Å; K75-E79 PolarHBondContact O-N 3.22Å; I76-E79 PolarHBondContact O-N 3.3Å; E79-Q81 VanDerWaalsContact C-N 3.31Å; E79-Q81 PolarHBondContact O-N 3.41Å; E79-K82 VanDerWaalsContact CD-NZ 3.28Å; E79-K82 WeakPolarHBondContact O-CB 3.34Å; E79-K82 PolarHBondContact O-N 2.7Å; E79-K82 IonicContact OE1-NZ 2.71Å; E79-K82 PolarHBondContact OE1-NZ 2.9Å; E79-K82 IonicContact OE2-NZ 3.1Å; E79-K82 PolarHBondContact OE2-NZ 2.82Å; E79-K82 VanDerWaalsContact OE2-NZ 3.1Å; E79-V83 PolarHBondContact O-N 2.87Å; E79-V83 VanDerWaalsContact O-N 3.14Å
80L83Confident83.5Confident5 Ų563.3 Ų63.33%0.02630%0.302CS..Hα-helixtrans-62.4-37.2175.2-72.5175.6000112.7L43 L47 I76 Q77 K82 V83 D84 L135 T141L43-L80 HydrophobicContact CD2-CD2 3.76Å; L43-L80 HydrophobicContact CD2-CG 4.46Å; L47-L80 HydrophobicContact CD1-CD2 4.03Å; I76-L80 HydrophobicContact CG2-CD1 3.8Å; I76-L80 HydrophobicContact CG2-CG 4.32Å; I76-L80 WeakPolarHBondContact O-CB 3.47Å; I76-L80 WeakPolarHBondContact O-CG 3.23Å; I76-L80 PolarHBondContact O-N 3.22Å; Q77-L80 PolarHBondContact O-N 3.35Å; L80-K82 VanDerWaalsContact C-N 3.34Å; L80-V83 WeakPolarHBondContact O-CB 3.4Å; L80-V83 PolarHBondContact O-N 3.44Å; L80-D84 PolarHBondContact O-N 2.92Å; L80-L135 HydrophobicContact CD1-CB 4.21Å; L80-L135 HydrophobicContact CD1-CD1 4.31Å; L80-L135 HydrophobicContact CD2-CB 3.94Å; L80-L135 HydrophobicContact CD2-CD1 3.84Å; L80-T141 HydrophobicContact CD1-CG2 4.28Å
81Q84.1Confident82.7Confident116 Ų11662.9 Ų62.954%0.54230%0.299SS..Hα-helixtrans-65.5-37.7175.6-172.6177.54.700111.8Q77 K78 E79 V83 D84 E85Q77-Q81 WeakPolarHBondContact O-CB 3.24Å; Q77-Q81 PolarHBondContact O-N 3.24Å; K78-Q81 PolarHBondContact O-N 2.85Å; E79-Q81 VanDerWaalsContact C-N 3.31Å; E79-Q81 PolarHBondContact O-N 3.41Å; Q81-V83 VanDerWaalsContact C-N 3.28Å; Q81-V83 PolarHBondContact O-N 3.4Å; Q81-D84 PolarHBondContact O-N 3.03Å; Q81-E85 HydrophobicContact CG-CG 4.45Å; Q81-E85 WeakPolarHBondContact O-CG 3.44Å; Q81-E85 PolarHBondContact O-N 3.2Å
82K82.9Confident81.8Confident109 Ų10963.5 Ų63.547%0.47430%0.302SS..Hα-helixtrans-62.3-39.4173.2-66.6171.5-173.21690111.6K78 E79 L80 A86K78-K82 WeakPolarHBondContact O-CG 3.37Å; K78-K82 PolarHBondContact O-N 3.38Å; E79-K82 VanDerWaalsContact CD-NZ 3.28Å; E79-K82 WeakPolarHBondContact O-CB 3.34Å; E79-K82 PolarHBondContact O-N 2.7Å; E79-K82 IonicContact OE1-NZ 2.71Å; E79-K82 PolarHBondContact OE1-NZ 2.9Å; E79-K82 IonicContact OE2-NZ 3.1Å; E79-K82 PolarHBondContact OE2-NZ 2.82Å; E79-K82 VanDerWaalsContact OE2-NZ 3.1Å; L80-K82 VanDerWaalsContact C-N 3.34Å; K82-A86 WeakPolarHBondContact O-CB 3.38Å; K82-A86 PolarHBondContact O-N 3.06Å
83V78.8Confident80.9Confident17 Ų1768.4 Ų68.410%0.10333%0.333CS..Hα-helixtrans-64.5-44.9175.31760000110.2L47 E79 L80 Q81 A86 L87 I117 A132L47-V83 HydrophobicContact CD1-CG2 4.43Å; E79-V83 PolarHBondContact O-N 2.87Å; E79-V83 VanDerWaalsContact O-N 3.14Å; L80-V83 WeakPolarHBondContact O-CB 3.4Å; L80-V83 PolarHBondContact O-N 3.44Å; Q81-V83 VanDerWaalsContact C-N 3.28Å; Q81-V83 PolarHBondContact O-N 3.4Å; V83-A86 PolarHBondContact O-N 3.24Å; V83-L87 HydrophobicContact CG1-CD1 4.15Å; V83-L87 HydrophobicContact CG1-CG 4.45Å; V83-L87 VanDerWaalsContact O-CG 3.27Å; V83-L87 WeakPolarHBondContact O-CG 3.5Å; V83-L87 PolarHBondContact O-N 3.38Å; V83-I117 HydrophobicContact CG1-CD1 4.28Å; V83-A132 HydrophobicContact CG1-CB 4.3Å
84D80.6Confident80Confident37 Ų3772.7 Ų72.720%0.19836%0.36CS..Hα-helixtrans-60.9-48.1177.6-174.536.8000112.8L80 Q81 A86 L87 K88 Y96 V136L80-D84 PolarHBondContact O-N 2.92Å; Q81-D84 PolarHBondContact O-N 3.03Å; D84-A86 VanDerWaalsContact C-N 3.34Å; D84-A86 PolarHBondContact O-N 3.45Å; D84-L87 WeakPolarHBondContact O-CB 3.48Å; D84-L87 PolarHBondContact O-N 3.09Å; D84-K88 WeakPolarHBondContact O-CB 3.28Å; D84-K88 PolarHBondContact O-N 3.43Å; D84-Y96 WeakPolarHBondContact OD1-CE2 3.2Å; D84-Y96 PolarHBondContact OD1-OH 3.16Å; D84-Y96 PolarHBondContact OD2-OH 3.37Å; D84-V136 HydrophobicContact CB-CG1 3.56Å; D84-V136 HydrophobicContact CB-CG2 4.37Å; D84-V136 VanDerWaalsContact CG-CG1 3.4Å; D84-V136 WeakPolarHBondContact OD1-CG1 3.46Å
85E81.6Confident79.2Confident71 Ų7170.3 Ų70.333%0.33235%0.349SS..Hα-helixtrans-64.6-39.8176.9-66.1-65.5176.700111.3Q81 L87 K88 D89Q81-E85 HydrophobicContact CG-CG 4.45Å; Q81-E85 WeakPolarHBondContact O-CG 3.44Å; Q81-E85 PolarHBondContact O-N 3.2Å; E85-L87 VanDerWaalsContact C-N 3.28Å; E85-L87 PolarHBondContact O-N 3.27Å; E85-K88 PolarHBondContact O-N 2.98Å; E85-K88 VanDerWaalsContact O-N 3.17Å; E85-K88 IonicContact OE2-NZ 3.71Å; E85-D89 WeakPolarHBondContact O-CB 3.49Å; E85-D89 PolarHBondContact O-N 3.37Å
86A77.1Confident78.2Confident25 Ų2566 Ų6621%0.20733%0.33CS..Hα-helixtrans-64.9-33175.200000112.6K82 V83 D84 K90 I120K82-A86 WeakPolarHBondContact O-CB 3.38Å; K82-A86 PolarHBondContact O-N 3.06Å; V83-A86 PolarHBondContact O-N 3.24Å; D84-A86 VanDerWaalsContact C-N 3.34Å; D84-A86 PolarHBondContact O-N 3.45Å; A86-K90 WeakPolarHBondContact O-CB 3.39Å; A86-K90 WeakPolarHBondContact O-CG 3.42Å; A86-K90 PolarHBondContact O-N 3.27Å; A86-I120 HydrophobicContact CB-CD1 3.54Å; A86-I120 HydrophobicContact CB-CG1 4.19Å
87L75.1Confident77.3Confident3 Ų375.4 Ų75.42%0.01637%0.365CS..Hα-helixtrans-67-47.5170.6-72.5171.1000110.3V83 D84 E85 D89 K90 L91 Y96 V113 V116 I117 A132V83-L87 HydrophobicContact CG1-CD1 4.15Å; V83-L87 HydrophobicContact CG1-CG 4.45Å; V83-L87 VanDerWaalsContact O-CG 3.27Å; V83-L87 WeakPolarHBondContact O-CG 3.5Å; V83-L87 PolarHBondContact O-N 3.38Å; D84-L87 WeakPolarHBondContact O-CB 3.48Å; D84-L87 PolarHBondContact O-N 3.09Å; E85-L87 VanDerWaalsContact C-N 3.28Å; E85-L87 PolarHBondContact O-N 3.27Å; L87-D89 VanDerWaalsContact C-N 3.34Å; L87-D89 PolarHBondContact O-N 3.38Å; L87-K90 PolarHBondContact O-N 3.38Å; L87-L91 HydrophobicContact CB-CD1 3.86Å; L87-L91 HydrophobicContact CD2-CD1 3.65Å; L87-L91 HydrophobicContact CG-CD1 4.37Å; L87-L91 VanDerWaalsContact O-CB 3.22Å; L87-L91 WeakPolarHBondContact O-CB 3.39Å; L87-L91 WeakPolarHBondContact O-CD1 3.35Å; L87-L91 PolarHBondContact O-N 3.07Å; L87-Y96 HydrophobicContact CB-CE2 4.44Å; L87-V113 HydrophobicContact CD2-CG1 3.96Å; L87-V113 HydrophobicContact CD2-CG2 4.48Å; L87-V116 HydrophobicContact CD2-CB 4.05Å; L87-V116 HydrophobicContact CD2-CG1 3.81Å; L87-I117 HydrophobicContact CD2-CG1 4.38Å; L87-A132 HydrophobicContact CD1-CB 4.48Å
88K78.2Confident76.6Confident108 Ų10878.1 Ų78.147%0.4738%0.376SS..Hα-helixtrans-63.2-37.5-179.4-173.6-178.7170-164.80113.4D84 E85 Y96D84-K88 WeakPolarHBondContact O-CB 3.28Å; D84-K88 PolarHBondContact O-N 3.43Å; E85-K88 PolarHBondContact O-N 2.98Å; E85-K88 VanDerWaalsContact O-N 3.17Å; E85-K88 IonicContact OE2-NZ 3.71Å; K88-Y96 HydrophobicContact CB-CD2 4.16Å; K88-Y96 HydrophobicContact CB-CE2 3.91Å; K88-Y96 HydrophobicContact CG-CE1 4.45Å; K88-Y96 HydrophobicContact CG-CE2 4.49Å
89D77.8Confident75.6Confident134 Ų13472.2 Ų72.272%0.71735%0.351SS*.Hα-helixtrans-72.5-32.9179.1-78.3-10.2000112.5E85 L87E85-D89 WeakPolarHBondContact O-CB 3.49Å; E85-D89 PolarHBondContact O-N 3.37Å; L87-D89 VanDerWaalsContact C-N 3.34Å; L87-D89 PolarHBondContact O-N 3.38Å
90K73.5Confident74.7Confident102 Ų10275.2 Ų75.244%0.44337%0.365SS..Hα-helixtrans-99.8-21.5-174.9-66.4-172.8-176.8-1730114A86 L87 V116 V119 I120A86-K90 WeakPolarHBondContact O-CB 3.39Å; A86-K90 WeakPolarHBondContact O-CG 3.42Å; A86-K90 PolarHBondContact O-N 3.27Å; L87-K90 PolarHBondContact O-N 3.38Å; K90-V116 HydrophobicContact CB-CG1 3.52Å; K90-V116 HydrophobicContact CB-CG2 4.48Å; K90-V116 HydrophobicContact CD-CG1 4.08Å; K90-V116 HydrophobicContact CG-CG1 4.4Å; K90-V119 HydrophobicContact CD-CB 4.48Å; K90-V119 HydrophobicContact CD-CG1 4.17Å; K90-V119 PolarHBondContact NZ-O 3.19Å; K90-V119 VanDerWaalsContact NZ-O 3.11Å; K90-I120 HydrophobicContact CD-CD1 4.41Å; K90-I120 HydrophobicContact CD-CG1 3.9Å
91L72.3Confident74.1Confident11 Ų1178.3 Ų78.36%0.05838%0.381CS..SBendtrans-87143.4171.9-84.2107.1000111L87 L95 L99 I112 V116L87-L91 HydrophobicContact CB-CD1 3.86Å; L87-L91 HydrophobicContact CD2-CD1 3.65Å; L87-L91 HydrophobicContact CG-CD1 4.37Å; L87-L91 VanDerWaalsContact O-CB 3.22Å; L87-L91 WeakPolarHBondContact O-CB 3.39Å; L87-L91 WeakPolarHBondContact O-CD1 3.35Å; L87-L91 PolarHBondContact O-N 3.07Å; L91-L95 HydrophobicContact CD2-CB 3.76Å; L91-L99 HydrophobicContact CD1-CD1 4.37Å; L91-L99 HydrophobicContact CD2-CD1 3.95Å; L91-I112 HydrophobicContact CD2-CG2 3.35Å; L91-V116 HydrophobicContact CD1-CB 3.77Å; L91-V116 HydrophobicContact CD1-CG1 3.92Å; L91-V116 HydrophobicContact CD1-CG2 3.47Å; L91-V116 VanDerWaalsContact CD1-CG2 3.47Å; L91-V116 HydrophobicContact CG-CB 4.44Å; L91-V116 HydrophobicContact CG-CG2 3.6Å
92E71.3Confident72.9Confident126 Ų12680.5 Ų80.559%0.58940%0.395SS*.  trans-58.7140.7166.1-64.8-172.1165.700110.3T94 L95 Y96E92-T94 PolarHBondContact O-N 3.08Å; E92-L95 HydrophobicContact CB-CD1 4.29Å; E92-L95 HydrophobicContact CB-CG 4.39Å; E92-L95 PolarHBondContact O-N 3.25Å; E92-Y96 PolarHBondContact O-N 2.77Å
93P72.2Confident72Confident113 Ų11384.2 Ų84.273%0.73441%0.411SS*.Hα-helixtrans-54.6-30.5-177.4-27.934000114.3R97P93-R97 WeakPolarHBondContact O-CB 3.36Å; P93-R97 PolarHBondContact O-N 3.12Å; P93-R97 VanDerWaalsContact O-N 3.11Å
94T70.5Confident71.4Confident92 Ų9286.2 Ų86.256%0.56442%0.419SS*.Hα-helixtrans-69.1-39.8176.649.20000112.3E92 K98E92-T94 PolarHBondContact O-N 3.08Å; T94-K98 PolarHBondContact O-N 3.26Å
95L68.9Low71.1Confident61 Ų6190.9 Ų90.932%0.31944%0.438SS..Hα-helixtrans-75.6-39.3177.4-66.5174.4000111.4L91 E92 R97 K98 L99 I112L91-L95 HydrophobicContact CD2-CB 3.76Å; E92-L95 HydrophobicContact CB-CD1 4.29Å; E92-L95 HydrophobicContact CB-CG 4.39Å; E92-L95 PolarHBondContact O-N 3.25Å; L95-R97 VanDerWaalsContact C-N 3.27Å; L95-R97 PolarHBondContact O-N 3.05Å; L95-K98 WeakPolarHBondContact O-CB 3.5Å; L95-K98 PolarHBondContact O-N 2.88Å; L95-K98 VanDerWaalsContact O-N 3.09Å; L95-L99 PolarHBondContact O-N 2.89Å; L95-I112 HydrophobicContact CB-CG2 4.21Å; L95-I112 HydrophobicContact CD2-CD1 4.44Å
96Y68.6Low70.4Confident31 Ų3191.2 Ų91.212%0.12244%0.44CS..Hα-helixtrans-60.5-38.7173.6-174.6-95.6000111.6D84 L87 K88 E92 K98 L99 Q100D84-Y96 WeakPolarHBondContact OD1-CE2 3.2Å; D84-Y96 PolarHBondContact OD1-OH 3.16Å; D84-Y96 PolarHBondContact OD2-OH 3.37Å; L87-Y96 HydrophobicContact CB-CE2 4.44Å; K88-Y96 HydrophobicContact CB-CD2 4.16Å; K88-Y96 HydrophobicContact CB-CE2 3.91Å; K88-Y96 HydrophobicContact CG-CE1 4.45Å; K88-Y96 HydrophobicContact CG-CE2 4.49Å; E92-Y96 PolarHBondContact O-N 2.77Å; Y96-K98 VanDerWaalsContact C-N 3.31Å; Y96-K98 PolarHBondContact O-N 3.17Å; Y96-L99 HydrophobicContact CD2-CD1 4.33Å; Y96-L99 WeakPolarHBondContact O-CB 3.45Å; Y96-L99 PolarHBondContact O-N 2.67Å; Y96-L99 VanDerWaalsContact O-N 3.17Å; Y96-Q100 VanDerWaalsContact CE1-NE2 3.33Å; Y96-Q100 PolarHBondContact O-N 3.06Å; Y96-Q100 PolarHBondContact OH-NE2 3.35Å
97R70.3Confident70.1Confident199 Ų19994.5 Ų94.575%0.75146%0.457SS*.Hα-helixtrans-63.3-34.3174.4-166.6173.1-175.6168.31113.1P93 L95 L99 Q100 D101P93-R97 WeakPolarHBondContact O-CB 3.36Å; P93-R97 PolarHBondContact O-N 3.12Å; P93-R97 VanDerWaalsContact O-N 3.11Å; L95-R97 VanDerWaalsContact C-N 3.27Å; L95-R97 PolarHBondContact O-N 3.05Å; R97-L99 VanDerWaalsContact C-N 3.33Å; R97-Q100 PolarHBondContact O-N 3.29Å; R97-D101 PolarHBondContact O-N 3.34Å
98K69.3Low70Confident95 Ų9598.5 Ų98.541%0.41348%0.476SS..Hα-helixtrans-68.4-29.6174.7-72.1-176.2174.1-164.60113.1T94 L95 Y96 Q100 D101 E104T94-K98 PolarHBondContact O-N 3.26Å; L95-K98 WeakPolarHBondContact O-CB 3.5Å; L95-K98 PolarHBondContact O-N 2.88Å; L95-K98 VanDerWaalsContact O-N 3.09Å; Y96-K98 VanDerWaalsContact C-N 3.31Å; Y96-K98 PolarHBondContact O-N 3.17Å; K98-Q100 VanDerWaalsContact C-N 3.26Å; K98-Q100 PolarHBondContact O-N 2.98Å; K98-D101 PolarHBondContact O-N 3.27Å; K98-E104 HydrophobicContact CB-CG 4.17Å; K98-E104 WeakPolarHBondContact CD-OE1 3.47Å; K98-E104 HydrophobicContact CG-CG 4.46Å; K98-E104 IonicContact NZ-OE1 3.75Å
99L66.1Low69.7Low10 Ų1094.3 Ų94.35%0.05246%0.458CS..Hα-helixtrans-62.5-38173.2-62.7175.7000111.7L91 L95 Y96 R97 K109 I112 V113L91-L99 HydrophobicContact CD1-CD1 4.37Å; L91-L99 HydrophobicContact CD2-CD1 3.95Å; L95-L99 PolarHBondContact O-N 2.89Å; Y96-L99 HydrophobicContact CD2-CD1 4.33Å; Y96-L99 WeakPolarHBondContact O-CB 3.45Å; Y96-L99 PolarHBondContact O-N 2.67Å; Y96-L99 VanDerWaalsContact O-N 3.17Å; R97-L99 VanDerWaalsContact C-N 3.33Å; L99-K109 HydrophobicContact CD2-CB 3.86Å; L99-K109 HydrophobicContact CD2-CG 4.21Å; L99-K109 WeakPolarHBondContact O-CE 3.14Å; L99-K109 PolarHBondContact O-NZ 2.78Å; L99-I112 HydrophobicContact CD2-CB 4.23Å; L99-I112 HydrophobicContact CD2-CG2 3.92Å; L99-I112 HydrophobicContact CG-CG2 4.3Å; L99-V113 HydrophobicContact CD1-CG2 3.56Å; L99-V113 HydrophobicContact CD2-CG2 3.45Å; L99-V113 VanDerWaalsContact CD2-CG2 3.45Å; L99-V113 HydrophobicContact CG-CG2 4.15Å
100Q66.8Low69.3Low115 Ų11588.4 Ų88.454%0.53743%0.426SS..Hα-helixtrans-81.6-14.3178.5-61.1-169.3-9.500113.4Y96 R97 K98 I102Y96-Q100 VanDerWaalsContact CE1-NE2 3.33Å; Y96-Q100 PolarHBondContact O-N 3.06Å; Y96-Q100 PolarHBondContact OH-NE2 3.35Å; R97-Q100 PolarHBondContact O-N 3.29Å; K98-Q100 VanDerWaalsContact C-N 3.26Å; K98-Q100 PolarHBondContact O-N 2.98Å; Q100-I102 PolarHBondContact O-N 3.01Å
101D69.2Low69.3Low69 Ų6986.2 Ų86.237%0.36943%0.427SS..  trans-76.3120.1-179.7-164.5-23.2000111.1R97 K98 K103 E104 K109R97-D101 PolarHBondContact O-N 3.34Å; K98-D101 PolarHBondContact O-N 3.27Å; D101-K103 PolarHBondContact O-N 2.94Å; D101-K103 WeakPolarHBondContact OD1-CB 3.49Å; D101-K103 PolarHBondContact OD1-N 3.35Å; D101-E104 HydrophobicContact CB-CG 4.03Å; D101-E104 PolarHBondContact O-N 2.96Å; D101-K109 WeakPolarHBondContact O-CE 3.1Å; D101-K109 PolarHBondContact O-NZ 3.49Å
102I60.3Low69.3Low162 Ų16287.6 Ų87.683%0.83143%0.434SS*.THydrogen-bonded Turntrans-63.6-21.3178.5-68.9170.8000112Q100Q100-I102 PolarHBondContact O-N 3.01Å
103K62.7Low69.2Low188 Ų18881.7 Ų81.782%0.81741%0.407SS*.THydrogen-bonded Turntrans-78.1-19.4-178.3-63.9-177.8179-178.60114.1D101D101-K103 PolarHBondContact O-N 2.94Å; D101-K103 WeakPolarHBondContact OD1-CB 3.49Å; D101-K103 PolarHBondContact OD1-N 3.35Å
104E67.1Low69.2Low58 Ų5879.7 Ų79.727%0.27139%0.387SS..SBendtrans-81.2141.3-177.8-65.4-75-163.900111.2K98 D101 K109K98-E104 HydrophobicContact CB-CG 4.17Å; K98-E104 WeakPolarHBondContact CD-OE1 3.47Å; K98-E104 HydrophobicContact CG-CG 4.46Å; K98-E104 IonicContact NZ-OE1 3.75Å; D101-E104 HydrophobicContact CB-CG 4.03Å; D101-E104 PolarHBondContact O-N 2.96Å; E104-K109 HydrophobicContact CB-CG 4.32Å; E104-K109 WeakPolarHBondContact O-CE 3.34Å
105K74.3Confident69.1Low135 Ų13582.6 Ų82.659%0.58740%0.395SS*.  trans-68.2141.6-177.2-68.9179.3-178.1169.30111.3T107 E108 K109K105-T107 PolarHBondContact O-N 3.48Å; K105-E108 HydrophobicContact CB-CB 4.4Å; K105-E108 HydrophobicContact CB-CG 4.22Å; K105-E108 PolarHBondContact O-N 3.1Å; K105-K109 PolarHBondContact O-N 3.35Å
106E67.8Low68.9Low79 Ų7980.4 Ų80.437%0.36938%0.384SS..Hα-helixtrans-57.6-35.3-179-160.1171.5-120.200112K109 I110 K134E106-K109 PolarHBondContact O-N 3.45Å; E106-I110 HydrophobicContact CG-CD1 4.4Å; E106-I110 WeakPolarHBondContact O-CD1 3.48Å; E106-I110 WeakPolarHBondContact O-CG1 3.41Å; E106-I110 PolarHBondContact O-N 3.32Å; E106-K134 WeakPolarHBondContact OE1-CD 3.18Å; E106-K134 IonicContact OE1-NZ 2.68Å; E106-K134 PolarHBondContact OE1-NZ 3.33Å
107T70.7Confident68.9Low94 Ų9479 Ų7958%0.57738%0.379SS*.Hα-helixtrans-66.1-37.5175.252.30000113.6K105 I110 A111K105-T107 PolarHBondContact O-N 3.48Å; T107-I110 PolarHBondContact O-N 3.21Å; T107-A111 PolarHBondContact O-N 3.17Å; T107-A111 VanDerWaalsContact O-N 3.08Å
108E72.4Confident68.7Low86 Ų8671.5 Ų71.540%0.40236%0.356SS..Hα-helixtrans-71.2-38.6178.1-71.5165.5-178.500110.1K105 A111 I112K105-E108 HydrophobicContact CB-CB 4.4Å; K105-E108 HydrophobicContact CB-CG 4.22Å; K105-E108 PolarHBondContact O-N 3.1Å; E108-A111 PolarHBondContact O-N 3.22Å; E108-I112 WeakPolarHBondContact O-CD1 3.17Å; E108-I112 VanDerWaalsContact O-CG1 3.25Å; E108-I112 WeakPolarHBondContact O-CG1 3.42Å; E108-I112 PolarHBondContact O-N 3.17Å
109K70.9Confident68.4Low21 Ų2171.7 Ų71.79%0.09137%0.365CS..Hα-helixtrans-61.9-43172-63.6-177.3-178.5-165.50112.3L99 D101 E104 K105 E106 I112 V113 V133L99-K109 HydrophobicContact CD2-CB 3.86Å; L99-K109 HydrophobicContact CD2-CG 4.21Å; L99-K109 WeakPolarHBondContact O-CE 3.14Å; L99-K109 PolarHBondContact O-NZ 2.78Å; D101-K109 WeakPolarHBondContact O-CE 3.1Å; D101-K109 PolarHBondContact O-NZ 3.49Å; E104-K109 HydrophobicContact CB-CG 4.32Å; E104-K109 WeakPolarHBondContact O-CE 3.34Å; K105-K109 PolarHBondContact O-N 3.35Å; E106-K109 PolarHBondContact O-N 3.45Å; K109-I112 PolarHBondContact O-N 2.88Å; K109-V113 WeakPolarHBondContact O-CG2 3.48Å; K109-V113 PolarHBondContact O-N 2.81Å; K109-V133 HydrophobicContact CB-CG1 3.78Å; K109-V133 HydrophobicContact CB-CG2 4.07Å; K109-V133 HydrophobicContact CD-CG1 4.13Å
110I70.8Confident68.2Low9 Ų973.9 Ų73.95%0.04638%0.376CS..Hα-helixtrans-60.5-46.3177.1-71.8166.7000110.5E106 T107 I112 V113 Q114 A130 V133E106-I110 HydrophobicContact CG-CD1 4.4Å; E106-I110 WeakPolarHBondContact O-CD1 3.48Å; E106-I110 WeakPolarHBondContact O-CG1 3.41Å; E106-I110 PolarHBondContact O-N 3.32Å; T107-I110 PolarHBondContact O-N 3.21Å; I110-I112 PolarHBondContact O-N 2.86Å; I110-V113 PolarHBondContact O-N 2.84Å; I110-Q114 VanDerWaalsContact O-CB 3.26Å; I110-Q114 WeakPolarHBondContact O-CB 3.45Å; I110-Q114 PolarHBondContact O-N 3.28Å; I110-A130 HydrophobicContact CD1-CB 3.71Å; I110-A130 HydrophobicContact CG1-CB 4.02Å; I110-V133 HydrophobicContact CG1-CG2 4.29Å
111A72.6Confident68.1Low57 Ų5771.7 Ų71.747%0.47137%0.368SS..Hα-helixtrans-62-42.7178.500000112.3T107 E108 V113 Q114T107-A111 PolarHBondContact O-N 3.17Å; T107-A111 VanDerWaalsContact O-N 3.08Å; E108-A111 PolarHBondContact O-N 3.22Å; A111-V113 PolarHBondContact O-N 2.88Å; A111-Q114 PolarHBondContact O-N 3.3Å
112I72.1Confident67.9Low40 Ų4071.1 Ų71.121%0.20538%0.379CS..Hα-helixtrans-60.9-44.5176.3-71166.1000111.1L91 L95 L99 E108 K109 I110L91-I112 HydrophobicContact CD2-CG2 3.35Å; L95-I112 HydrophobicContact CB-CG2 4.21Å; L95-I112 HydrophobicContact CD2-CD1 4.44Å; L99-I112 HydrophobicContact CD2-CB 4.23Å; L99-I112 HydrophobicContact CD2-CG2 3.92Å; L99-I112 HydrophobicContact CG-CG2 4.3Å; E108-I112 WeakPolarHBondContact O-CD1 3.17Å; E108-I112 VanDerWaalsContact O-CG1 3.25Å; E108-I112 WeakPolarHBondContact O-CG1 3.42Å; E108-I112 PolarHBondContact O-N 3.17Å; K109-I112 PolarHBondContact O-N 2.88Å; I110-I112 PolarHBondContact O-N 2.86Å
113V69.4Low67.8Low2 Ų272 Ų721%0.01238%0.379CS..Hα-helixtrans-73.6-33-179.9169.40000112.4L87 L99 K109 I110 A111 Q115 V116 I117 A132 V133L87-V113 HydrophobicContact CD2-CG1 3.96Å; L87-V113 HydrophobicContact CD2-CG2 4.48Å; L99-V113 HydrophobicContact CD1-CG2 3.56Å; L99-V113 HydrophobicContact CD2-CG2 3.45Å; L99-V113 VanDerWaalsContact CD2-CG2 3.45Å; L99-V113 HydrophobicContact CG-CG2 4.15Å; K109-V113 WeakPolarHBondContact O-CG2 3.48Å; K109-V113 PolarHBondContact O-N 2.81Å; I110-V113 PolarHBondContact O-N 2.84Å; A111-V113 PolarHBondContact O-N 2.88Å; V113-Q115 VanDerWaalsContact C-N 3.3Å; V113-Q115 PolarHBondContact O-N 3.47Å; V113-V116 PolarHBondContact O-N 3.38Å; V113-I117 HydrophobicContact CG1-CD1 4.35Å; V113-I117 HydrophobicContact CG1-CG1 3.45Å; V113-I117 VanDerWaalsContact CG1-CG1 3.45Å; V113-I117 WeakPolarHBondContact O-CB 3.27Å; V113-I117 WeakPolarHBondContact O-CG1 3.42Å; V113-I117 PolarHBondContact O-N 2.82Å; V113-A132 HydrophobicContact CG1-CB 3.95Å; V113-V133 HydrophobicContact CB-CG2 3.79Å; V113-V133 HydrophobicContact CG1-CG2 4.22Å; V113-V133 HydrophobicContact CG2-CG2 3.47Å; V113-V133 VanDerWaalsContact CG2-CG2 3.47Å
114Q73.3Confident67.5Low70 Ų7063.8 Ų63.833%0.32735%0.346SS..Hα-helixtrans-60.1-40.2-176.6-173.9174.8-2.500112.7I110 A111 V116 S118 A124 S129I110-Q114 VanDerWaalsContact O-CB 3.26Å; I110-Q114 WeakPolarHBondContact O-CB 3.45Å; I110-Q114 PolarHBondContact O-N 3.28Å; A111-Q114 PolarHBondContact O-N 3.3Å; Q114-V116 PolarHBondContact O-N 2.86Å; Q114-S118 PolarHBondContact O-N 3Å; Q114-S118 PolarHBondContact O-OG 3.34Å; Q114-A124 HydrophobicContact CG-CB 3.72Å; Q114-A124 VanDerWaalsContact O-CB 3.26Å; Q114-A124 WeakPolarHBondContact O-CB 3.42Å; Q114-S129 WeakPolarHBondContact CA-OG 3.34Å; Q114-S129 VanDerWaalsContact CB-OG 3.28Å; Q114-S129 WeakPolarHBondContact CB-OG 3.27Å; Q114-S129 WeakPolarHBondContact CG-OG 3.46Å
115Q67.4Low67.4Low154 Ų15464.5 Ų64.572%0.7236%0.355SS*.Hα-helixtrans-62.2-35177.6-167.3171.8100112V113 V119V113-Q115 VanDerWaalsContact C-N 3.3Å; V113-Q115 PolarHBondContact O-N 3.47Å; Q115-V119 WeakPolarHBondContact O-CG2 3.31Å
116V65.9Low67.1Low15 Ų1559.8 Ų59.89%0.09134%0.339CS..Hα-helixtrans-85.2-39.6-179.5178.10000112.7L87 K90 L91 V113 Q114 S118 V119 I120L87-V116 HydrophobicContact CD2-CB 4.05Å; L87-V116 HydrophobicContact CD2-CG1 3.81Å; K90-V116 HydrophobicContact CB-CG1 3.52Å; K90-V116 HydrophobicContact CB-CG2 4.48Å; K90-V116 HydrophobicContact CD-CG1 4.08Å; K90-V116 HydrophobicContact CG-CG1 4.4Å; L91-V116 HydrophobicContact CD1-CB 3.77Å; L91-V116 HydrophobicContact CD1-CG1 3.92Å; L91-V116 HydrophobicContact CD1-CG2 3.47Å; L91-V116 VanDerWaalsContact CD1-CG2 3.47Å; L91-V116 HydrophobicContact CG-CB 4.44Å; L91-V116 HydrophobicContact CG-CG2 3.6Å; V113-V116 PolarHBondContact O-N 3.38Å; Q114-V116 PolarHBondContact O-N 2.86Å; V116-S118 PolarHBondContact O-N 3.41Å; V116-V119 WeakPolarHBondContact O-CA 3.48Å; V116-V119 PolarHBondContact O-N 2.87Å; V116-I120 HydrophobicContact CG1-CD1 3.79Å; V116-I120 HydrophobicContact CG1-CG1 4.37Å; V116-I120 WeakPolarHBondContact O-CG1 3.3Å; V116-I120 PolarHBondContact O-N 3.09Å
117I67.4Low67.2Low2 Ų256.2 Ų56.21%0.0132%0.323CS..Hα-helixtrans-58-34.3173-73.2-75.8000110.2L47 V83 L87 V113 V119 I120 L121 A124 A128 A132L47-I117 HydrophobicContact CD2-CD1 4.31Å; V83-I117 HydrophobicContact CG1-CD1 4.28Å; L87-I117 HydrophobicContact CD2-CG1 4.38Å; V113-I117 HydrophobicContact CG1-CD1 4.35Å; V113-I117 HydrophobicContact CG1-CG1 3.45Å; V113-I117 VanDerWaalsContact CG1-CG1 3.45Å; V113-I117 WeakPolarHBondContact O-CB 3.27Å; V113-I117 WeakPolarHBondContact O-CG1 3.42Å; V113-I117 PolarHBondContact O-N 2.82Å; I117-V119 VanDerWaalsContact C-N 3.29Å; I117-V119 PolarHBondContact O-N 3.43Å; I117-I120 PolarHBondContact O-N 3.44Å; I117-I120 VanDerWaalsContact O-N 3.14Å; I117-L121 HydrophobicContact CG2-CD1 3.78Å; I117-L121 HydrophobicContact CG2-CG 4.29Å; I117-L121 WeakPolarHBondContact O-CB 3.32Å; I117-L121 PolarHBondContact O-N 3.37Å; I117-A124 HydrophobicContact CB-CB 4.09Å; I117-A124 HydrophobicContact CG2-CB 3.72Å; I117-A128 HydrophobicContact CG2-CB 3.86Å; I117-A132 HydrophobicContact CD1-CB 3.92Å; I117-A132 HydrophobicContact CG1-CB 4.38Å
118S66.3Low67.2Low41 Ų4151.8 Ų51.829%0.28730%0.296SS..Hα-helixtrans-63.8-39175.2-77.20000110.6Q114 V116 I120 G122 A124Q114-S118 PolarHBondContact O-N 3Å; Q114-S118 PolarHBondContact O-OG 3.34Å; V116-S118 PolarHBondContact O-N 3.41Å; S118-I120 VanDerWaalsContact C-N 3.28Å; S118-I120 PolarHBondContact O-N 3.21Å; S118-G122 CarbonylContact C-O 3.58Å; S118-G122 CarbonylContact O-C 3.54Å; S118-G122 WeakPolarHBondContact O-CA 3.35Å; S118-G122 PolarHBondContact O-N 3.32Å; S118-A124 WeakPolarHBondContact OG-CB 3.25Å; S118-A124 PolarHBondContact OG-N 3.24Å; S118-A124 VanDerWaalsContact OG-N 3.14Å
119V62.6Low67.2Low99 Ų9947.7 Ų47.760%0.628%0.277SS*.Hα-helixtrans-74.6-19.9178.8-1740000111.9K90 Q115 V116 I117K90-V119 HydrophobicContact CD-CB 4.48Å; K90-V119 HydrophobicContact CD-CG1 4.17Å; K90-V119 PolarHBondContact NZ-O 3.19Å; K90-V119 VanDerWaalsContact NZ-O 3.11Å; Q115-V119 WeakPolarHBondContact O-CG2 3.31Å; V116-V119 WeakPolarHBondContact O-CA 3.48Å; V116-V119 PolarHBondContact O-N 2.87Å; I117-V119 VanDerWaalsContact C-N 3.29Å; I117-V119 PolarHBondContact O-N 3.43Å
120I63.3Low67.4Low55 Ų5546.7 Ų46.728%0.28227%0.273SS..Hα-helixtrans-91.4-45.1178.5-63.2164.9000111.5A86 K90 V116 I117 S118A86-I120 HydrophobicContact CB-CD1 3.54Å; A86-I120 HydrophobicContact CB-CG1 4.19Å; K90-I120 HydrophobicContact CD-CD1 4.41Å; K90-I120 HydrophobicContact CD-CG1 3.9Å; V116-I120 HydrophobicContact CG1-CD1 3.79Å; V116-I120 HydrophobicContact CG1-CG1 4.37Å; V116-I120 WeakPolarHBondContact O-CG1 3.3Å; V116-I120 PolarHBondContact O-N 3.09Å; I117-I120 PolarHBondContact O-N 3.44Å; I117-I120 VanDerWaalsContact O-N 3.14Å; S118-I120 VanDerWaalsContact C-N 3.28Å; S118-I120 PolarHBondContact O-N 3.21Å
121L64.4Low67.7Low69 Ų6946.3 Ų46.336%0.36127%0.271SS..Hα-helixtrans-105.2-1.6-173-58.8-179.9000113.3L47 I117 E123L47-L121 HydrophobicContact CD2-CD1 4.49Å; L47-L121 WeakPolarHBondContact O-CD2 3.48Å; I117-L121 HydrophobicContact CG2-CD1 3.78Å; I117-L121 HydrophobicContact CG2-CG 4.29Å; I117-L121 WeakPolarHBondContact O-CB 3.32Å; I117-L121 PolarHBondContact O-N 3.37Å; L121-E123 PolarHBondContact O-N 2.92Å
122G64.1Low67.7Low58 Ų5843.6 Ų43.660%0.59825%0.248SC*.SBendtrans87.5-73.1-176.900000112.4S118S118-G122 CarbonylContact C-O 3.58Å; S118-G122 CarbonylContact O-C 3.54Å; S118-G122 WeakPolarHBondContact O-CA 3.35Å; S118-G122 PolarHBondContact O-N 3.32Å
123E58.4Low67.7Low179 Ų17942.2 Ų42.284%0.83624%0.242SC*.SBendtrans-105.4104.5176.6-70.8-178.9175.600109.8L121 T125L121-E123 PolarHBondContact O-N 2.92Å; E123-T125 PolarHBondContact O-N 3.13Å
124A56.7Low68.1Low16 Ų1644.1 Ų44.113%0.13225%0.25CC..  trans-77116.4170.800000110.9Q114 I117 S118Q114-A124 HydrophobicContact CG-CB 3.72Å; Q114-A124 VanDerWaalsContact O-CB 3.26Å; Q114-A124 WeakPolarHBondContact O-CB 3.42Å; I117-A124 HydrophobicContact CB-CB 4.09Å; I117-A124 HydrophobicContact CG2-CB 3.72Å; S118-A124 WeakPolarHBondContact OG-CB 3.25Å; S118-A124 PolarHBondContact OG-N 3.24Å; S118-A124 VanDerWaalsContact OG-N 3.14Å
125T65.1Low68.2Low74 Ų7440.8 Ų40.845%0.45423%0.234SC..  trans-76148157.660.60000109.6E123 A127 A128 S129E123-T125 PolarHBondContact O-N 3.13Å; T125-A127 PolarHBondContact O-N 3.01Å; T125-A128 WeakPolarHBondContact O-CB 3.41Å; T125-A128 PolarHBondContact O-N 2.98Å; T125-A128 VanDerWaalsContact O-N 3.15Å; T125-A128 WeakPolarHBondContact OG1-CB 3.35Å; T125-A128 PolarHBondContact OG1-N 3.2Å; T125-A128 VanDerWaalsContact OG1-N 3.14Å; T125-S129 PolarHBondContact O-N 2.96Å; T125-S129 PolarHBondContact O-OG 2.82Å; T125-S129 VanDerWaalsContact O-OG 3.05Å
126S66.6Low68.4Low36 Ų3635.1 Ų35.125%0.25221%0.21SC..Hα-helixtrans-51.3-37.2168.350.30000111.2S129 A130 Q223S126-S129 PolarHBondContact O-N 2.89Å; S126-A130 WeakPolarHBondContact O-CB 3.36Å; S126-A130 PolarHBondContact O-N 2.87Å; S126-Q223 PolarHBondContact OG-O 3.14Å; S126-Q223 VanDerWaalsContact OG-O 3.05Å
127A70.8Confident68.3Low3 Ų335.7 Ų35.73%0.02522%0.219CC..Hα-helixtrans-60.7-48.9175.600000113.1T125 S129 A130 V131 V220 Q223 M224T125-A127 PolarHBondContact O-N 3.01Å; A127-S129 VanDerWaalsContact C-N 3.26Å; A127-S129 PolarHBondContact O-N 3.31Å; A127-A130 PolarHBondContact O-N 2.79Å; A127-V131 WeakPolarHBondContact O-CG2 3.49Å; A127-V131 PolarHBondContact O-N 2.91Å; A127-V220 HydrophobicContact CB-CG1 4.35Å; A127-Q223 HydrophobicContact CB-CB 4.33Å; A127-M224 HydrophobicContact CB-CG 4.19Å
128A71.6Confident68.3Low2 Ų237.3 Ų37.32%0.01723%0.231CC..Hα-helixtrans-55.3-44.1175.700000112.4H46 L47 I117 T125 V131 A132H46-A128 HydrophobicContact CB-CB 4.47Å; H46-A128 WeakPolarHBondContact O-CB 3.41Å; L47-A128 VanDerWaalsContact CD2-O 3.32Å; L47-A128 WeakPolarHBondContact CD2-O 3.41Å; I117-A128 HydrophobicContact CG2-CB 3.86Å; T125-A128 WeakPolarHBondContact O-CB 3.41Å; T125-A128 PolarHBondContact O-N 2.98Å; T125-A128 VanDerWaalsContact O-N 3.15Å; T125-A128 WeakPolarHBondContact OG1-CB 3.35Å; T125-A128 PolarHBondContact OG1-N 3.2Å; T125-A128 VanDerWaalsContact OG1-N 3.14Å; A128-V131 PolarHBondContact O-N 3.23Å; A128-A132 PolarHBondContact O-N 3.44Å
129S72.3Confident68.5Low0 Ų040.7 Ų40.70%025%0.245CC..Hα-helixtrans-69.1-39.5-177.6-46.80000111.7Q114 T125 S126 A127 A132 V133Q114-S129 WeakPolarHBondContact CA-OG 3.34Å; Q114-S129 VanDerWaalsContact CB-OG 3.28Å; Q114-S129 WeakPolarHBondContact CB-OG 3.27Å; Q114-S129 WeakPolarHBondContact CG-OG 3.46Å; T125-S129 PolarHBondContact O-N 2.96Å; T125-S129 PolarHBondContact O-OG 2.82Å; T125-S129 VanDerWaalsContact O-OG 3.05Å; S126-S129 PolarHBondContact O-N 2.89Å; A127-S129 VanDerWaalsContact C-N 3.26Å; A127-S129 PolarHBondContact O-N 3.31Å; S129-A132 PolarHBondContact O-N 2.95Å; S129-V133 WeakPolarHBondContact O-CG2 3.22Å; S129-V133 PolarHBondContact O-N 3.15Å
130A73.9Confident69Low0 Ų036.3 Ų36.30%022%0.219CC..Hα-helixtrans-65.7-39.9174.700000113.1I110 S126 A127 V133 K134 L219 Q223I110-A130 HydrophobicContact CD1-CB 3.71Å; I110-A130 HydrophobicContact CG1-CB 4.02Å; S126-A130 WeakPolarHBondContact O-CB 3.36Å; S126-A130 PolarHBondContact O-N 2.87Å; A127-A130 PolarHBondContact O-N 2.79Å; A130-V133 PolarHBondContact O-N 3.22Å; A130-K134 WeakPolarHBondContact O-CB 3.45Å; A130-K134 PolarHBondContact O-N 3.36Å; A130-L219 HydrophobicContact CB-CD2 3.85Å; A130-L219 HydrophobicContact CB-CG 3.96Å; A130-Q223 HydrophobicContact CB-CG 3.9Å
131V76.5Confident69.2Low1 Ų134.8 Ų34.81%0.00621%0.212CC..Hα-helixtrans-61.8-47.6174.1175.90000110.5V42 L43 H46 L47 A127 A128 K134 L135 V216 V220V42-V131 HydrophobicContact CG1-CG1 4.08Å; V42-V131 HydrophobicContact CG1-CG2 3.76Å; L43-V131 HydrophobicContact CD2-CG1 4.29Å; H46-V131 HydrophobicContact CB-CG2 4.2Å; L47-V131 HydrophobicContact CD1-CG1 3.86Å; L47-V131 HydrophobicContact CD2-CB 4.46Å; L47-V131 HydrophobicContact CD2-CG1 4.46Å; L47-V131 HydrophobicContact CG-CB 4.47Å; L47-V131 HydrophobicContact CG-CG1 3.99Å; A127-V131 WeakPolarHBondContact O-CG2 3.49Å; A127-V131 PolarHBondContact O-N 2.91Å; A128-V131 PolarHBondContact O-N 3.23Å; V131-K134 PolarHBondContact O-N 2.97Å; V131-L135 HydrophobicContact CG1-CD1 3.55Å; V131-L135 HydrophobicContact CG1-CG 4.28Å; V131-L135 WeakPolarHBondContact O-CB 3.49Å; V131-L135 WeakPolarHBondContact O-CG 3.24Å; V131-L135 PolarHBondContact O-N 2.86Å; V131-V216 HydrophobicContact CG1-CG1 4.39Å; V131-V216 HydrophobicContact CG2-CG1 4.42Å; V131-V220 HydrophobicContact CG2-CG2 3.15Å
132A73.8Confident69.5Low0 Ų036 Ų360%022%0.222CC..Hα-helixtrans-60.6-47.8178.200000111.7L47 V83 L87 V113 I117 A128 S129 K134 L135 V136L47-A132 HydrophobicContact CD2-CB 4.13Å; V83-A132 HydrophobicContact CG1-CB 4.3Å; L87-A132 HydrophobicContact CD1-CB 4.48Å; V113-A132 HydrophobicContact CG1-CB 3.95Å; I117-A132 HydrophobicContact CD1-CB 3.92Å; I117-A132 HydrophobicContact CG1-CB 4.38Å; A128-A132 PolarHBondContact O-N 3.44Å; S129-A132 PolarHBondContact O-N 2.95Å; A132-K134 PolarHBondContact O-N 3.14Å; A132-L135 PolarHBondContact O-N 3.15Å; A132-V136 WeakPolarHBondContact O-CA 3.38Å; A132-V136 WeakPolarHBondContact O-CB 3.4Å; A132-V136 WeakPolarHBondContact O-CG2 3.25Å; A132-V136 PolarHBondContact O-N 2.97Å
133V72.1Confident70Confident11 Ų1134.3 Ų34.37%0.06721%0.205CC..Hα-helixtrans-58.9-45.9176.6170.30000111.5K109 I110 V113 S129 A130 G137K109-V133 HydrophobicContact CB-CG1 3.78Å; K109-V133 HydrophobicContact CB-CG2 4.07Å; K109-V133 HydrophobicContact CD-CG1 4.13Å; I110-V133 HydrophobicContact CG1-CG2 4.29Å; V113-V133 HydrophobicContact CB-CG2 3.79Å; V113-V133 HydrophobicContact CG1-CG2 4.22Å; V113-V133 HydrophobicContact CG2-CG2 3.47Å; V113-V133 VanDerWaalsContact CG2-CG2 3.47Å; S129-V133 WeakPolarHBondContact O-CG2 3.22Å; S129-V133 PolarHBondContact O-N 3.15Å; A130-V133 PolarHBondContact O-N 3.22Å; V133-G137 CarbonylContact O-C 3.14Å; V133-G137 WeakPolarHBondContact O-CA 3.4Å; V133-G137 PolarHBondContact O-N 3.25Å
134K77.3Confident70.9Confident42 Ų4227.9 Ų27.918%0.18318%0.176CC..Hα-helixtrans-71.9-36.6-176.3-159.671.7171.5-160.70112.1E106 A130 V131 A132 S138 I140 V216 L219E106-K134 WeakPolarHBondContact OE1-CD 3.18Å; E106-K134 IonicContact OE1-NZ 2.68Å; E106-K134 PolarHBondContact OE1-NZ 3.33Å; A130-K134 WeakPolarHBondContact O-CB 3.45Å; A130-K134 PolarHBondContact O-N 3.36Å; V131-K134 PolarHBondContact O-N 2.97Å; A132-K134 PolarHBondContact O-N 3.14Å; K134-S138 WeakPolarHBondContact O-CB 3.46Å; K134-S138 PolarHBondContact O-OG 2.83Å; K134-I140 HydrophobicContact CG-CD1 3.96Å; K134-V216 HydrophobicContact CB-CG2 4.24Å; K134-V216 HydrophobicContact CG-CG2 3.76Å; K134-L219 HydrophobicContact CB-CD2 3.96Å; K134-L219 HydrophobicContact CD-CD2 4.21Å; K134-L219 HydrophobicContact CG-CD2 4.22Å
135L76Confident72.1Confident0 Ų027.2 Ų27.20%017%0.17CC..Hα-helixtrans-84.7-37.9-178.2-68.3177.5000113.1L39 L43 L80 V131 A132 I140 T141 V216L39-L135 HydrophobicContact CD1-CD1 4.09Å; L39-L135 HydrophobicContact CD1-CD2 4.37Å; L43-L135 HydrophobicContact CD2-CD1 3.52Å; L43-L135 HydrophobicContact CG-CD1 4.49Å; L80-L135 HydrophobicContact CD1-CB 4.21Å; L80-L135 HydrophobicContact CD1-CD1 4.31Å; L80-L135 HydrophobicContact CD2-CB 3.94Å; L80-L135 HydrophobicContact CD2-CD1 3.84Å; V131-L135 HydrophobicContact CG1-CD1 3.55Å; V131-L135 HydrophobicContact CG1-CG 4.28Å; V131-L135 WeakPolarHBondContact O-CB 3.49Å; V131-L135 WeakPolarHBondContact O-CG 3.24Å; V131-L135 PolarHBondContact O-N 2.86Å; A132-L135 PolarHBondContact O-N 3.15Å; L135-I140 HydrophobicContact CD2-CG2 3.97Å; L135-T141 WeakPolarHBondContact O-CB 3.36Å; L135-T141 PolarHBondContact O-OG1 3.41Å; L135-V216 HydrophobicContact CD1-CG1 4.46Å; L135-V216 HydrophobicContact CD2-CG1 4.42Å; L135-V216 HydrophobicContact CD2-CG2 3.76Å; L135-V216 HydrophobicContact CG-CG1 4.33Å; L135-V216 HydrophobicContact CG-CG2 4.28Å
136V71.6Confident72.9Confident35 Ų3526.8 Ų26.821%0.21217%0.165CC..Hα-helixtrans-90.6-43.3-177.4179.60000111.4D84 A132 S138D84-V136 HydrophobicContact CB-CG1 3.56Å; D84-V136 HydrophobicContact CB-CG2 4.37Å; D84-V136 VanDerWaalsContact CG-CG1 3.4Å; D84-V136 WeakPolarHBondContact OD1-CG1 3.46Å; A132-V136 WeakPolarHBondContact O-CA 3.38Å; A132-V136 WeakPolarHBondContact O-CB 3.4Å; A132-V136 WeakPolarHBondContact O-CG2 3.25Å; A132-V136 PolarHBondContact O-N 2.97Å; V136-S138 VanDerWaalsContact C-N 3.32Å; V136-S138 PolarHBondContact O-N 2.71Å
137G64.1Low73.6Confident27 Ų2730.7 Ų30.728%0.27818%0.177SC..SBendtrans-84.22.5-176.500000115V133V133-G137 CarbonylContact O-C 3.14Å; V133-G137 WeakPolarHBondContact O-CA 3.4Å; V133-G137 PolarHBondContact O-N 3.25Å
138S66.7Low74.3Confident36 Ų3630.5 Ų30.525%0.25218%0.176SC..SBendtrans-125.9166179.892.10000113.2K134 V136 I140K134-S138 WeakPolarHBondContact O-CB 3.46Å; K134-S138 PolarHBondContact O-OG 2.83Å; V136-S138 VanDerWaalsContact C-N 3.32Å; V136-S138 PolarHBondContact O-N 2.71Å; S138-I140 PolarHBondContact O-N 2.91Å; S138-I140 WeakPolarHBondContact OG-CB 3.29Å; S138-I140 WeakPolarHBondContact OG-CD1 3.2Å; S138-I140 WeakPolarHBondContact OG-CG1 3.37Å; S138-I140 PolarHBondContact OG-N 2.91Å
139N69.8Low74.8Confident111 Ų11131.6 Ų31.659%0.59418%0.182SC*.Hα-helixtrans-70.88.7178.5-16338000114T142 G143 I144N139-T142 PolarHBondContact OD1-OG1 3.16Å; N139-G143 VanDerWaalsContact O-CA 3.29Å; N139-G143 WeakPolarHBondContact O-CA 3.38Å; N139-G143 PolarHBondContact O-N 3.49Å; N139-G143 PolarHBondContact OD1-N 3.23Å; N139-I144 PolarHBondContact O-N 3.33Å
140I73.1Confident75.4Confident8 Ų834.7 Ų34.74%0.04120%0.201CC..Iπ-helixtrans-63.2-53.9177.9-68.2174.2000110K134 L135 S138 I144 I145 A212 I213 V216K134-I140 HydrophobicContact CG-CD1 3.96Å; L135-I140 HydrophobicContact CD2-CG2 3.97Å; S138-I140 PolarHBondContact O-N 2.91Å; S138-I140 WeakPolarHBondContact OG-CB 3.29Å; S138-I140 WeakPolarHBondContact OG-CD1 3.2Å; S138-I140 WeakPolarHBondContact OG-CG1 3.37Å; S138-I140 PolarHBondContact OG-N 2.91Å; I140-I144 HydrophobicContact CG1-CD1 4.32Å; I140-I144 PolarHBondContact O-N 3.36Å; I140-I144 VanDerWaalsContact O-N 3.13Å; I140-I145 HydrophobicContact CG2-CD1 4.19Å; I140-I145 HydrophobicContact CG2-CG1 4.26Å; I140-I145 WeakPolarHBondContact O-CG1 3.31Å; I140-I145 PolarHBondContact O-N 2.76Å; I140-A212 HydrophobicContact CD1-CB 4.17Å; I140-A212 HydrophobicContact CG1-CB 4.01Å; I140-A212 HydrophobicContact CG2-CB 4.28Å; I140-I213 HydrophobicContact CG2-CD1 4.36Å; I140-V216 HydrophobicContact CD1-CG2 3.87Å
141T68.6Low75.8Confident22 Ų2234.8 Ų34.814%0.13520%0.202CC..Iπ-helixtrans-72.7-42.7-174.5-570000112.6Q77 L80 L135Q77-T141 HydrophobicContact CG-CG2 4.18Å; L80-T141 HydrophobicContact CD1-CG2 4.28Å; L135-T141 WeakPolarHBondContact O-CB 3.36Å; L135-T141 PolarHBondContact O-OG1 3.41Å
142T69.8Low76.1Confident94 Ų9434.8 Ų34.858%0.57720%0.202SC*.Iπ-helixtrans-83.4-29.1-175.549.80000113.5N139 N146N139-T142 PolarHBondContact OD1-OG1 3.16Å; T142-N146 WeakPolarHBondContact O-CB 3.39Å; T142-N146 PolarHBondContact O-ND2 2.93Å
143G75.3Confident76.5Confident23 Ų2337 Ų3724%0.23722%0.22CC..Iπ-helixtrans-103.6-64.9-178.600000113.2N139 K147N139-G143 VanDerWaalsContact O-CA 3.29Å; N139-G143 WeakPolarHBondContact O-CA 3.38Å; N139-G143 PolarHBondContact O-N 3.49Å; N139-G143 PolarHBondContact OD1-N 3.23Å; G143-K147 VanDerWaalsContact O-CB 3.25Å; G143-K147 WeakPolarHBondContact O-CB 3.42Å; G143-K147 PolarHBondContact O-N 3.38Å
144I77.6Confident76.9Confident45 Ų4540.8 Ų40.823%0.23124%0.237CC..Iπ-helixtrans-71.3-49.3-167.6-59.2178.5000111.3N139 I140 K147 L148 K208 A212N139-I144 PolarHBondContact O-N 3.33Å; I140-I144 HydrophobicContact CG1-CD1 4.32Å; I140-I144 PolarHBondContact O-N 3.36Å; I140-I144 VanDerWaalsContact O-N 3.13Å; I144-K147 PolarHBondContact O-N 3.49Å; I144-L148 PolarHBondContact O-N 3.04Å; I144-L148 VanDerWaalsContact O-N 3.09Å; I144-K208 HydrophobicContact CG2-CB 4.31Å; I144-A212 HydrophobicContact CD1-CB 3.66Å; I144-A212 HydrophobicContact CG2-CB 4.25Å
145I81.1Confident76.8Confident1 Ų138.9 Ų38.91%0.00523%0.229CC..Iπ-helixtrans-63.6-46.7179.5-66.6-174000110.8I73 Q77 I140 K147 L148 V149 Y209I73-I145 HydrophobicContact CB-CG2 4.5Å; I73-I145 HydrophobicContact CG2-CG2 3.15Å; Q77-I145 HydrophobicContact CG-CG2 4.17Å; I140-I145 HydrophobicContact CG2-CD1 4.19Å; I140-I145 HydrophobicContact CG2-CG1 4.26Å; I140-I145 WeakPolarHBondContact O-CG1 3.31Å; I140-I145 PolarHBondContact O-N 2.76Å; I145-K147 VanDerWaalsContact C-N 3.3Å; I145-K147 PolarHBondContact O-N 3.29Å; I145-L148 WeakPolarHBondContact O-CB 3.4Å; I145-L148 PolarHBondContact O-N 3.34Å; I145-V149 WeakPolarHBondContact O-CG2 3.35Å; I145-V149 PolarHBondContact O-N 2.99Å; I145-Y209 HydrophobicContact CD1-CE2 4.48Å; I145-Y209 HydrophobicContact CG1-CD2 4.16Å; I145-Y209 HydrophobicContact CG1-CE2 3.98Å
146N81.4Confident76.5Confident65 Ų6539 Ų3935%0.34823%0.231SC..Hα-helixtrans-61.9-36.9177.2-80-22.4000112.9Q77 T142 V149 T150Q77-N146 PolarHBondContact NE2-OD1 3.18Å; T142-N146 WeakPolarHBondContact O-CB 3.39Å; T142-N146 PolarHBondContact O-ND2 2.93Å; N146-V149 PolarHBondContact O-N 3.46Å; N146-T150 WeakPolarHBondContact O-CB 3.26Å; N146-T150 PolarHBondContact O-N 3.2Å; N146-T150 PolarHBondContact O-OG1 2.98Å
147K83.1Confident76.4Confident118 Ų11840.2 Ų40.251%0.51324%0.244SC..Hα-helixtrans-64.2-43175.8-176.361.3177.5176.20111.2G143 I144 I145 T150 V151G143-K147 VanDerWaalsContact O-CB 3.25Å; G143-K147 WeakPolarHBondContact O-CB 3.42Å; G143-K147 PolarHBondContact O-N 3.38Å; I144-K147 PolarHBondContact O-N 3.49Å; I145-K147 VanDerWaalsContact C-N 3.3Å; I145-K147 PolarHBondContact O-N 3.29Å; K147-T150 PolarHBondContact O-N 3.18Å; K147-V151 HydrophobicContact CD-CG2 4.43Å; K147-V151 WeakPolarHBondContact O-CG2 3.1Å; K147-V151 PolarHBondContact O-N 2.97Å
148L83.8Confident76.4Confident0 Ų040.4 Ų40.40%024%0.241CC..Hα-helixtrans-60.8-48.8175.3-178.165.5000111.3I73 I144 I145 T150 V151 L152 F202 A205 Y209I73-L148 HydrophobicContact CD1-CD2 3.79Å; I73-L148 HydrophobicContact CD1-CG 4.41Å; I144-L148 PolarHBondContact O-N 3.04Å; I144-L148 VanDerWaalsContact O-N 3.09Å; I145-L148 WeakPolarHBondContact O-CB 3.4Å; I145-L148 PolarHBondContact O-N 3.34Å; L148-T150 VanDerWaalsContact C-N 3.28Å; L148-T150 PolarHBondContact O-N 2.86Å; L148-V151 PolarHBondContact O-N 3.36Å; L148-L152 HydrophobicContact CD1-CD1 4.25Å; L148-L152 HydrophobicContact CD1-CG 4.32Å; L148-L152 HydrophobicContact CD2-CD1 4.48Å; L148-L152 HydrophobicContact CG-CD1 3.89Å; L148-L152 HydrophobicContact CG-CG 4.39Å; L148-L152 WeakPolarHBondContact O-CB 3.48Å; L148-L152 WeakPolarHBondContact O-CG 3.34Å; L148-L152 PolarHBondContact O-N 3.48Å; L148-F202 HydrophobicContact CD1-CD2 4.19Å; L148-F202 HydrophobicContact CD1-CE2 3.7Å; L148-A205 HydrophobicContact CD1-CB 4.32Å; L148-Y209 HydrophobicContact CD2-CD1 3.54Å; L148-Y209 HydrophobicContact CD2-CD2 3.86Å; L148-Y209 HydrophobicContact CD2-CE1 3.91Å; L148-Y209 HydrophobicContact CD2-CE2 4.23Å; L148-Y209 HydrophobicContact CD2-CG 3.5Å
149V82.9Confident75.9Confident25 Ų2539.4 Ų39.415%0.15223%0.233CC..Hα-helixtrans-56.6-43.6176.5169.90000111.4I70 I73 I145 N146 L152 A153I70-V149 HydrophobicContact CG1-CG1 4.38Å; I70-V149 HydrophobicContact CG2-CG1 4.15Å; I73-V149 HydrophobicContact CB-CG2 4.06Å; I73-V149 HydrophobicContact CD1-CG2 4.12Å; I73-V149 HydrophobicContact CG2-CG2 3.43Å; I73-V149 VanDerWaalsContact CG2-CG2 3.43Å; I145-V149 WeakPolarHBondContact O-CG2 3.35Å; I145-V149 PolarHBondContact O-N 2.99Å; N146-V149 PolarHBondContact O-N 3.46Å; V149-L152 PolarHBondContact O-N 3.03Å; V149-A153 VanDerWaalsContact O-CB 3.27Å; V149-A153 WeakPolarHBondContact O-CB 3.17Å; V149-A153 PolarHBondContact O-N 3.29Å
150T84.4Confident74.7Confident65 Ų6540.7 Ų40.740%0.39924%0.239SC..Hα-helixtrans-63.3-45.1179.5-58.90000111.3N146 K147 L148 A153 Q154N146-T150 WeakPolarHBondContact O-CB 3.26Å; N146-T150 PolarHBondContact O-N 3.2Å; N146-T150 PolarHBondContact O-OG1 2.98Å; K147-T150 PolarHBondContact O-N 3.18Å; L148-T150 VanDerWaalsContact C-N 3.28Å; L148-T150 PolarHBondContact O-N 2.86Å; T150-A153 PolarHBondContact O-N 3Å; T150-Q154 WeakPolarHBondContact O-CB 3.27Å; T150-Q154 VanDerWaalsContact O-CG 3.24Å; T150-Q154 WeakPolarHBondContact O-CG 3.36Å; T150-Q154 PolarHBondContact O-N 2.95Å
151V82.7Confident73.1Confident2 Ų243.4 Ų43.41%0.01227%0.269CS..Hα-helixtrans-67.1-42.2179.11730000110.9K147 L148 A153 Q154 I155 E201 F202 A205K147-V151 HydrophobicContact CD-CG2 4.43Å; K147-V151 WeakPolarHBondContact O-CG2 3.1Å; K147-V151 PolarHBondContact O-N 2.97Å; L148-V151 PolarHBondContact O-N 3.36Å; V151-A153 VanDerWaalsContact C-N 3.34Å; V151-A153 PolarHBondContact O-N 3.34Å; V151-Q154 PolarHBondContact O-N 3.33Å; V151-I155 HydrophobicContact CG1-CD1 4.02Å; V151-I155 WeakPolarHBondContact O-CB 3.35Å; V151-I155 VanDerWaalsContact O-CG1 3.29Å; V151-I155 WeakPolarHBondContact O-CG1 3.48Å; V151-I155 PolarHBondContact O-N 3.18Å; V151-E201 HydrophobicContact CG1-CB 4.41Å; V151-F202 HydrophobicContact CG1-CB 4.06Å; V151-F202 HydrophobicContact CG1-CD2 4.11Å; V151-A205 HydrophobicContact CB-CB 4.4Å; V151-A205 HydrophobicContact CG2-CB 4.14Å
152L82.9Confident71.8Confident0 Ų045.6 Ų45.60%029%0.285CS..Hα-helixtrans-61.7-41.3174.5-73.1170.9000112L29 C66 I69 I70 L148 V149 I155 G156 F202L29-L152 HydrophobicContact CD2-CD2 3.75Å; C66-L152 HydrophobicContact CB-CB 4.34Å; C66-L152 HydrophobicContact CB-CD2 4.16Å; I69-L152 HydrophobicContact CB-CD1 4.01Å; I69-L152 HydrophobicContact CG2-CD1 3.54Å; I70-L152 HydrophobicContact CD1-CB 3.8Å; I70-L152 HydrophobicContact CG1-CB 3.84Å; I70-L152 HydrophobicContact CG1-CD1 4.2Å; L148-L152 HydrophobicContact CD1-CD1 4.25Å; L148-L152 HydrophobicContact CD1-CG 4.32Å; L148-L152 HydrophobicContact CD2-CD1 4.48Å; L148-L152 HydrophobicContact CG-CD1 3.89Å; L148-L152 HydrophobicContact CG-CG 4.39Å; L148-L152 WeakPolarHBondContact O-CB 3.48Å; L148-L152 WeakPolarHBondContact O-CG 3.34Å; L148-L152 PolarHBondContact O-N 3.48Å; V149-L152 PolarHBondContact O-N 3.03Å; L152-I155 PolarHBondContact O-N 3.31Å; L152-G156 PolarHBondContact O-N 2.84Å; L152-F202 HydrophobicContact CD2-CD2 4.12Å; L152-F202 HydrophobicContact CD2-CE2 3.37Å; L152-F202 HydrophobicContact CD2-CZ 3.83Å; L152-F202 HydrophobicContact CG-CE2 3.97Å
153A82.8Confident70.2Confident46 Ų4650.1 Ų50.138%0.3830%0.304SS..Hα-helixtrans-67.9-39.1176.700000111.7I70 V149 T150 V151 G156 A157I70-A153 HydrophobicContact CD1-CB 4.13Å; V149-A153 VanDerWaalsContact O-CB 3.27Å; V149-A153 WeakPolarHBondContact O-CB 3.17Å; V149-A153 PolarHBondContact O-N 3.29Å; T150-A153 PolarHBondContact O-N 3Å; V151-A153 VanDerWaalsContact C-N 3.34Å; V151-A153 PolarHBondContact O-N 3.34Å; A153-G156 PolarHBondContact O-N 2.81Å; A153-A157 VanDerWaalsContact O-CB 3.22Å; A153-A157 WeakPolarHBondContact O-CB 3.42Å; A153-A157 PolarHBondContact O-N 2.86Å
154Q80.1Confident68.5Low91 Ų9151 Ų5143%0.42531%0.313SS..Hα-helixtrans-64.7-41.4174.2-77.5174.1-18.900111.8T150 V151 S158T150-Q154 WeakPolarHBondContact O-CB 3.27Å; T150-Q154 VanDerWaalsContact O-CG 3.24Å; T150-Q154 WeakPolarHBondContact O-CG 3.36Å; T150-Q154 PolarHBondContact O-N 2.95Å; V151-Q154 PolarHBondContact O-N 3.33Å; Q154-S158 WeakPolarHBondContact O-CB 3.04Å; Q154-S158 PolarHBondContact O-N 3.29Å; Q154-S158 PolarHBondContact O-OG 3.13Å
155I74.9Confident67Low2 Ų249.6 Ų49.61%0.0131%0.307CS..Hα-helixtrans-59.4-54.1170.8-71.6169000108.6L25 I62 V151 L152 A157 S158 L159 H198 F202L25-I155 HydrophobicContact CD1-CD1 4.35Å; I62-I155 HydrophobicContact CG2-CG2 3.8Å; V151-I155 HydrophobicContact CG1-CD1 4.02Å; V151-I155 WeakPolarHBondContact O-CB 3.35Å; V151-I155 VanDerWaalsContact O-CG1 3.29Å; V151-I155 WeakPolarHBondContact O-CG1 3.48Å; V151-I155 PolarHBondContact O-N 3.18Å; L152-I155 PolarHBondContact O-N 3.31Å; I155-A157 VanDerWaalsContact C-N 3.3Å; I155-A157 PolarHBondContact O-N 3.41Å; I155-S158 PolarHBondContact O-N 3.03Å; I155-S158 PolarHBondContact O-OG 3.41Å; I155-L159 HydrophobicContact CG2-CD2 4.43Å; I155-L159 WeakPolarHBondContact O-CD2 3.5Å; I155-L159 WeakPolarHBondContact O-CG 3.29Å; I155-H198 HydrophobicContact CD1-CB 4.39Å; I155-H198 HydrophobicContact CG1-CB 3.98Å; I155-F202 HydrophobicContact CD1-CB 3.74Å; I155-F202 HydrophobicContact CD1-CD2 4.13Å; I155-F202 HydrophobicContact CD1-CG 3.92Å
156G69.3Low65.4Low4 Ų452.7 Ų52.74%0.04133%0.332CS..Hα-helixtrans-58.7-36.1-17900000114.4L152 A153L152-G156 PolarHBondContact O-N 2.84Å; A153-G156 PolarHBondContact O-N 2.81Å
157A69Low63.9Low60 Ų6049.9 Ų49.950%0.49632%0.317SS..Hα-helixtrans-79.1-35.4-179.900000113.2A153 I155 L159 L160 G161A153-A157 VanDerWaalsContact O-CB 3.22Å; A153-A157 WeakPolarHBondContact O-CB 3.42Å; A153-A157 PolarHBondContact O-N 2.86Å; I155-A157 VanDerWaalsContact C-N 3.3Å; I155-A157 PolarHBondContact O-N 3.41Å; A157-L159 PolarHBondContact O-N 3.17Å; A157-L160 PolarHBondContact O-N 2.8Å; A157-G161 PolarHBondContact O-N 3.47Å
158S64.8Low62.1Low31 Ų3144.6 Ų44.622%0.21729%0.294CS..Hα-helixtrans-64.3-21.1177.169.80000112.5Q154 I155 L160 H198Q154-S158 WeakPolarHBondContact O-CB 3.04Å; Q154-S158 PolarHBondContact O-N 3.29Å; Q154-S158 PolarHBondContact O-OG 3.13Å; I155-S158 PolarHBondContact O-N 3.03Å; I155-S158 PolarHBondContact O-OG 3.41Å; S158-L160 VanDerWaalsContact C-N 3.34Å; S158-H198 WeakPolarHBondContact CB-NE2 3.16Å; S158-H198 PolarHBondContact OG-NE2 2.85Å
159L57Low60.2Low15 Ų1546.1 Ų46.18%0.07931%0.31CS..Hα-helixtrans-73.7-20.3174-30173.7000113.3I62 K63 I155 A157 L168I62-L159 HydrophobicContact CB-CD1 4.46Å; I62-L159 HydrophobicContact CG2-CD1 4.3Å; K63-L159 HydrophobicContact CB-CD1 3.51Å; K63-L159 HydrophobicContact CG-CD1 4.1Å; I155-L159 HydrophobicContact CG2-CD2 4.43Å; I155-L159 WeakPolarHBondContact O-CD2 3.5Å; I155-L159 WeakPolarHBondContact O-CG 3.29Å; A157-L159 PolarHBondContact O-N 3.17Å; L159-L168 HydrophobicContact CB-CB 4.31Å; L159-L168 HydrophobicContact CD2-CB 3.14Å; L159-L168 HydrophobicContact CD2-CD1 3.54Å; L159-L168 HydrophobicContact CD2-CG 3.95Å; L159-L168 HydrophobicContact CG-CB 4.2Å
160L44.3Very low58.7Low137 Ų13747.1 Ų47.172%0.71732%0.315SS*.Hα-helixtrans-106-24.4-176.7-70.1179000113.8K63 A157 S158K63-L160 HydrophobicContact CD-CD1 4.17Å; K63-L160 HydrophobicContact CD-CG 4.27Å; A157-L160 PolarHBondContact O-N 2.8Å; S158-L160 VanDerWaalsContact C-N 3.34Å
161G39Very low57.1Low66 Ų6646.1 Ų46.168%0.6832%0.317SS*.Hα-helixtrans-103-6.4-161.400000118.2A157A157-G161 PolarHBondContact O-N 3.47Å
162S41Very low55.8Low68 Ų6848.5 Ų48.548%0.47633%0.329SS..  trans-113.2111.8-177.969.10000112.4G164 V165S162-G164 VanDerWaalsContact C-N 3.29Å; S162-G164 PolarHBondContact O-N 3.46Å; S162-V165 PolarHBondContact O-N 3.05Å
163I36.7Very low54.1Low189 Ų18954.2 Ų54.297%0.96936%0.36SS*.THydrogen-bonded Turntrans-57.492.6169.4-60.7166.1000107.2
164G40.5Very low52.6Low41 Ų4157.5 Ų57.542%0.42337%0.369SS..THydrogen-bonded Turntrans146-20.5175.200000116.8S162S162-G164 VanDerWaalsContact C-N 3.29Å; S162-G164 PolarHBondContact O-N 3.46Å
165V46.6Very low51.3Low16 Ų1653.3 Ų53.310%0.09735%0.349CS..  trans-13170.2-179-169.50000110.4S162 V167 A190 A191S162-V165 PolarHBondContact O-N 3.05Å; V165-V167 HydrophobicContact CG1-CB 3.74Å; V165-V167 HydrophobicContact CG1-CG2 3.98Å; V165-V167 PolarHBondContact O-N 3.49Å; V165-V167 VanDerWaalsContact O-N 3.09Å; V165-A190 HydrophobicContact CG2-CB 3.76Å; V165-A191 HydrophobicContact CG1-CB 3.85Å
166A47.2Very low50.2Low65 Ų6555.6 Ų55.654%0.53736%0.363SS..G310 helixtrans-63.8-5166.900000112.9L168 G169 L170A166-L168 VanDerWaalsContact C-N 3.29Å; A166-L168 PolarHBondContact O-N 3.12Å; A166-G169 PolarHBondContact O-N 2.86Å; A166-L170 HydrophobicContact CB-CD1 3.98Å; A166-L170 WeakPolarHBondContact O-CD1 3.43Å; A166-L170 WeakPolarHBondContact O-CG 3.37Å; A166-L170 PolarHBondContact O-N 3.07Å
167V48.9Very low49.3Very low7 Ų764.8 Ų64.84%0.04240%0.397CS..G310 helixtrans-58.8-34.4-172.5175.80000113V18 V165 I175 I179 A191 Y195V18-V167 HydrophobicContact CG1-CG1 3.97Å; V165-V167 HydrophobicContact CG1-CB 3.74Å; V165-V167 HydrophobicContact CG1-CG2 3.98Å; V165-V167 PolarHBondContact O-N 3.49Å; V165-V167 VanDerWaalsContact O-N 3.09Å; V167-I175 HydrophobicContact CG1-CB 4.22Å; V167-I175 HydrophobicContact CG1-CD1 3.9Å; V167-I175 HydrophobicContact CG1-CG1 3.87Å; V167-I175 HydrophobicContact CG1-CG2 3.49Å; V167-I175 VanDerWaalsContact CG1-CG2 3.49Å; V167-I175 WeakPolarHBondContact O-CD1 3.46Å; V167-I175 WeakPolarHBondContact O-CG1 3.04Å; V167-I179 HydrophobicContact CG2-CD1 3.75Å; V167-A191 HydrophobicContact CB-CB 4.1Å; V167-A191 HydrophobicContact CG1-CB 3.9Å; V167-A191 HydrophobicContact CG2-CB 4.22Å; V167-Y195 HydrophobicContact CG1-CE2 4.33Å
168L46.1Very low48.4Very low6 Ų665.3 Ų65.33%0.03140%0.401CS..G310 helixtrans-85.7-16.2-173.2-46.2-179000114.2L159 A166 Y195L159-L168 HydrophobicContact CB-CB 4.31Å; L159-L168 HydrophobicContact CD2-CB 3.14Å; L159-L168 HydrophobicContact CD2-CD1 3.54Å; L159-L168 HydrophobicContact CD2-CG 3.95Å; L159-L168 HydrophobicContact CG-CB 4.2Å; A166-L168 VanDerWaalsContact C-N 3.29Å; A166-L168 PolarHBondContact O-N 3.12Å; L168-Y195 HydrophobicContact CD2-CD1 3.92Å; L168-Y195 HydrophobicContact CD2-CD2 3.44Å; L168-Y195 VanDerWaalsContact CD2-CD2 3.44Å; L168-Y195 HydrophobicContact CD2-CE1 3.49Å; L168-Y195 VanDerWaalsContact CD2-CE1 3.49Å; L168-Y195 HydrophobicContact CD2-CE2 2.96Å; L168-Y195 HydrophobicContact CD2-CG 3.88Å; L168-Y195 WeakPolarHBondContact CD2-OH 3.23Å; L168-Y195 HydrophobicContact CG-CE2 4.44Å
169G44.1Very low47.8Very low32 Ų3264.1 Ų64.133%0.3339%0.392SS..G310 helixtrans-97.7-2.7177.700000114T61 A166T61-G169 WeakPolarHBondContact CG2-O 3.28Å; A166-G169 PolarHBondContact O-N 2.86Å
170L51.6Low47.5Very low47 Ų4769.4 Ų69.425%0.24642%0.42CS..SBendtrans-102.1142.5179.3-66.1171.3000109.2A166 M174 I175A166-L170 HydrophobicContact CB-CD1 3.98Å; A166-L170 WeakPolarHBondContact O-CD1 3.43Å; A166-L170 WeakPolarHBondContact O-CG 3.37Å; A166-L170 PolarHBondContact O-N 3.07Å; L170-M174 HydrophobicContact CB-CB 3.73Å; L170-M174 HydrophobicContact CD1-CB 4.26Å; L170-M174 HydrophobicContact CD2-CB 4.14Å; L170-M174 HydrophobicContact CD2-SD 3.61Å; L170-M174 HydrophobicContact CG-CB 4.24Å; L170-I175 HydrophobicContact CB-CG1 4.14Å
171G50.8Low47.9Very low44 Ų4463.8 Ų63.845%0.45440%0.395SS..  trans-58.3155.2168.600000111.1D173 M174 I175G171-D173 PolarHBondContact O-N 3.24Å; G171-M174 PolarHBondContact O-N 3.29Å; G171-I175 PolarHBondContact O-N 3.1Å; G171-I175 VanDerWaalsContact O-N 3.13Å
172I53.8Low48.2Very low51 Ų5163.5 Ų63.526%0.26239%0.387SS..Hα-helixtrans-47.4-40.3-175.8-70.6176.5000112.6M174 I175 V176I172-M174 VanDerWaalsContact C-N 3.34Å; I172-M174 PolarHBondContact O-N 3.07Å; I172-I175 WeakPolarHBondContact O-CB 3.15Å; I172-I175 PolarHBondContact O-N 3.35Å; I172-V176 WeakPolarHBondContact O-CG2 3.39Å; I172-V176 PolarHBondContact O-N 3.45Å
173D48.1Very low48.8Very low120 Ų12064.7 Ų64.764%0.64239%0.39SS*.Hα-helixtrans-65.4-33.4179.3-82.6-27000113.7G171 R177G171-D173 PolarHBondContact O-N 3.24Å; D173-R177 VanDerWaalsContact O-CB 3.27Å; D173-R177 WeakPolarHBondContact O-CB 3.41Å; D173-R177 WeakPolarHBondContact O-CD 2.93Å; D173-R177 WeakPolarHBondContact O-CG 3.45Å; D173-R177 PolarHBondContact O-N 3.09Å
174M50.2Low50Low116 Ų11655.7 Ų55.757%0.57135%0.345SS*.Hα-helixtrans-79.1-31.5175.9-90.6-179.2-171.800112.1L170 G171 I172 V176 R177 A178L170-M174 HydrophobicContact CB-CB 3.73Å; L170-M174 HydrophobicContact CD1-CB 4.26Å; L170-M174 HydrophobicContact CD2-CB 4.14Å; L170-M174 HydrophobicContact CD2-SD 3.61Å; L170-M174 HydrophobicContact CG-CB 4.24Å; G171-M174 PolarHBondContact O-N 3.29Å; I172-M174 VanDerWaalsContact C-N 3.34Å; I172-M174 PolarHBondContact O-N 3.07Å; M174-V176 VanDerWaalsContact C-N 3.31Å; M174-V176 PolarHBondContact O-N 3.09Å; M174-R177 PolarHBondContact O-N 2.84Å; M174-A178 WeakPolarHBondContact O-CB 3.4Å; M174-A178 PolarHBondContact O-N 2.75Å
175I54.7Low51.2Low3 Ų358.6 Ų58.62%0.01535%0.346CS..Hα-helixtrans-58.9-45.5172.5-63.6177.5000110.8V18 V167 L170 G171 I172 I179V18-I175 HydrophobicContact CG1-CG2 3.74Å; V167-I175 HydrophobicContact CG1-CB 4.22Å; V167-I175 HydrophobicContact CG1-CD1 3.9Å; V167-I175 HydrophobicContact CG1-CG1 3.87Å; V167-I175 HydrophobicContact CG1-CG2 3.49Å; V167-I175 VanDerWaalsContact CG1-CG2 3.49Å; V167-I175 WeakPolarHBondContact O-CD1 3.46Å; V167-I175 WeakPolarHBondContact O-CG1 3.04Å; L170-I175 HydrophobicContact CB-CG1 4.14Å; G171-I175 PolarHBondContact O-N 3.1Å; G171-I175 VanDerWaalsContact O-N 3.13Å; I172-I175 WeakPolarHBondContact O-CB 3.15Å; I172-I175 PolarHBondContact O-N 3.35Å; I175-I179 VanDerWaalsContact O-CD1 3.23Å; I175-I179 WeakPolarHBondContact O-CD1 3.09Å; I175-I179 VanDerWaalsContact O-CG1 3.28Å; I175-I179 WeakPolarHBondContact O-CG1 3.27Å
176V50.9Low52.1Low50 Ų5063 Ų6330%0.30337%0.372SS..Hα-helixtrans-76.4-30.2-177177.10000111.7I172 M174I172-V176 WeakPolarHBondContact O-CG2 3.39Å; I172-V176 PolarHBondContact O-N 3.45Å; M174-V176 VanDerWaalsContact C-N 3.31Å; M174-V176 PolarHBondContact O-N 3.09Å
177R50.5Low53Low196 Ų19662.9 Ų62.974%0.7436%0.361SS*.Hα-helixtrans-90.2-31.2-177.1-71175.3-176.1-135.33.9115D173 M174 I179D173-R177 VanDerWaalsContact O-CB 3.27Å; D173-R177 WeakPolarHBondContact O-CB 3.41Å; D173-R177 WeakPolarHBondContact O-CD 2.93Å; D173-R177 WeakPolarHBondContact O-CG 3.45Å; D173-R177 PolarHBondContact O-N 3.09Å; M174-R177 PolarHBondContact O-N 2.84Å; R177-I179 PolarHBondContact O-N 3.15Å
178A49.4Very low53.9Low72 Ų7262.6 Ų62.660%0.59536%0.359SS*.SBendtrans-75.3-11.7-175.700000113.5M174M174-A178 WeakPolarHBondContact O-CB 3.4Å; M174-A178 PolarHBondContact O-N 2.75Å
179I52Low55.1Low5 Ų566.4 Ų66.43%0.02638%0.377CS..  trans-114.496.9-171.5-41.6174.1000109.2V167 I175 R177 E184 L188V167-I179 HydrophobicContact CG2-CD1 3.75Å; I175-I179 VanDerWaalsContact O-CD1 3.23Å; I175-I179 WeakPolarHBondContact O-CD1 3.09Å; I175-I179 VanDerWaalsContact O-CG1 3.28Å; I175-I179 WeakPolarHBondContact O-CG1 3.27Å; R177-I179 PolarHBondContact O-N 3.15Å; I179-E184 HydrophobicContact CB-CG 4.25Å; I179-E184 HydrophobicContact CG2-CB 3.49Å; I179-E184 VanDerWaalsContact CG2-CB 3.49Å; I179-E184 HydrophobicContact CG2-CG 3.39Å; I179-L188 HydrophobicContact CD1-CD2 3.58Å; I179-L188 HydrophobicContact CD1-CG 4.26Å; I179-L188 HydrophobicContact CG2-CG 4.4Å
180L51.1Low56.4Low126 Ų12666.8 Ų66.866%0.6638%0.377SS*.  trans-127.8125174.8-123.892.3000110.9
181G52.5Low57.2Low19 Ų1964.5 Ų64.520%0.19637%0.365CS..SBendtrans105.1-158.916600000115.8V183 E184G181-V183 VanDerWaalsContact C-N 3.25Å; G181-V183 PolarHBondContact O-N 3.1Å; G181-E184 PolarHBondContact N-OE2 2.88Å; G181-E184 WeakPolarHBondContact O-CB 3.39Å; G181-E184 PolarHBondContact O-N 3.41Å
182A46.6Very low58.3Low61 Ų6163.5 Ų63.550%0.50435%0.349SS..THydrogen-bonded Turntrans-61.2-30.7-17400000114.5Y8 E184Y8-A182 HydrophobicContact CE1-CB 4.48Å; Y8-A182 VanDerWaalsContact OH-CB 3.27Å; Y8-A182 WeakPolarHBondContact OH-CB 3.47Å; A182-E184 PolarHBondContact O-N 3.43Å
183V53.4Low59.5Low92 Ų9267.4 Ų67.456%0.55836%0.364SS*.Hα-helixtrans-65.2-22.8176.7178.70000111.4G181 K185 Q187G181-V183 VanDerWaalsContact C-N 3.25Å; G181-V183 PolarHBondContact O-N 3.1Å; V183-K185 PolarHBondContact O-N 3.39Å; V183-Q187 HydrophobicContact CG1-CG 4.15Å; V183-Q187 WeakPolarHBondContact O-CG 3.48Å; V183-Q187 PolarHBondContact O-N 3.39Å
184E61.3Low60.8Low1 Ų163.1 Ų63.11%0.00534%0.343CS..Hα-helixtrans-63.5-37.8-178.5-178.2167.5-166.600113.8N11 R15 I179 G181 A182 L188N11-E184 HydrophobicContact CB-CG 4.28Å; N11-E184 VanDerWaalsContact ND2-CG 3.34Å; N11-E184 WeakPolarHBondContact ND2-CG 3.33Å; N11-E184 PolarHBondContact ND2-OE2 3.36Å; R15-E184 WeakPolarHBondContact CD-OE1 3.4Å; R15-E184 IonicContact CZ-OE1 3.46Å; R15-E184 IonicContact NE-OE1 3.68Å; R15-E184 IonicContact NH1-OE1 3.15Å; R15-E184 PolarHBondContact NH1-OE1 3.17Å; R15-E184 IonicContact NH1-OE2 2.72Å; I179-E184 HydrophobicContact CB-CG 4.25Å; I179-E184 HydrophobicContact CG2-CB 3.49Å; I179-E184 VanDerWaalsContact CG2-CB 3.49Å; I179-E184 HydrophobicContact CG2-CG 3.39Å; G181-E184 PolarHBondContact N-OE2 2.88Å; G181-E184 WeakPolarHBondContact O-CB 3.39Å; G181-E184 PolarHBondContact O-N 3.41Å; A182-E184 PolarHBondContact O-N 3.43Å; E184-L188 HydrophobicContact CG-CD1 3.35Å; E184-L188 HydrophobicContact CG-CG 3.86Å; E184-L188 WeakPolarHBondContact O-CB 3.4Å; E184-L188 WeakPolarHBondContact O-CG 3.21Å; E184-L188 PolarHBondContact O-N 2.78Å
185K65.1Low61.9Low102 Ų10257.7 Ų57.744%0.44332%0.316SS..Hα-helixtrans-63.2-50.2-176.6-179.7-177.8174.1-173.70111.5V183 Q189V183-K185 PolarHBondContact O-N 3.39Å; K185-Q189 WeakPolarHBondContact O-CB 3.29Å; K185-Q189 PolarHBondContact O-N 2.85Å
186T66.1Low63.2Low108 Ų10861.7 Ų61.766%0.66334%0.335SS*.Hα-helixtrans-69.9-39.1-176.3-51.40000111A190T186-A190 VanDerWaalsContact O-CB 3.27Å; T186-A190 WeakPolarHBondContact O-CB 3.43Å; T186-A190 PolarHBondContact O-N 3.39Å
187Q65.7Low64.7Low62 Ų6265.3 Ų65.329%0.2935%0.347SS..Hα-helixtrans-69.7-44.9177.7-71.1-178.1-14.700112.6V183 Q189 A190 A191V183-Q187 HydrophobicContact CG1-CG 4.15Å; V183-Q187 WeakPolarHBondContact O-CG 3.48Å; V183-Q187 PolarHBondContact O-N 3.39Å; Q187-Q189 VanDerWaalsContact C-N 3.34Å; Q187-Q189 PolarHBondContact O-N 3.07Å; Q187-A190 PolarHBondContact O-N 3.46Å; Q187-A191 WeakPolarHBondContact O-CB 3.19Å; Q187-A191 PolarHBondContact O-N 3.49Å
188L67Low66.1Low1 Ų157 Ų571%0.00532%0.316CS..Hα-helixtrans-63.3-41.1175.1-72.6177.5000111.3R14 R15 V18 I179 E184 A191 I192R14-L188 HydrophobicContact CB-CB 4.06Å; R14-L188 HydrophobicContact CB-CD1 3.68Å; R14-L188 HydrophobicContact CB-CG 4.45Å; R15-L188 HydrophobicContact CG-CD1 3.78Å; R15-L188 HydrophobicContact CG-CD2 4.09Å; V18-L188 HydrophobicContact CG2-CD2 3.96Å; I179-L188 HydrophobicContact CD1-CD2 3.58Å; I179-L188 HydrophobicContact CD1-CG 4.26Å; I179-L188 HydrophobicContact CG2-CG 4.4Å; E184-L188 HydrophobicContact CG-CD1 3.35Å; E184-L188 HydrophobicContact CG-CG 3.86Å; E184-L188 WeakPolarHBondContact O-CB 3.4Å; E184-L188 WeakPolarHBondContact O-CG 3.21Å; E184-L188 PolarHBondContact O-N 2.78Å; L188-A191 PolarHBondContact O-N 2.98Å; L188-I192 VanDerWaalsContact O-CG1 3.25Å; L188-I192 WeakPolarHBondContact O-CG1 3.43Å; L188-I192 PolarHBondContact O-N 3.13Å
189Q72.4Confident67.6Low86 Ų8654.2 Ų54.240%0.40229%0.291SS..Hα-helixtrans-69.6-35.4179.1-169.5163.92.500112.4K185 Q187 K193K185-Q189 WeakPolarHBondContact O-CB 3.29Å; K185-Q189 PolarHBondContact O-N 2.85Å; Q187-Q189 VanDerWaalsContact C-N 3.34Å; Q187-Q189 PolarHBondContact O-N 3.07Å; Q189-K193 WeakPolarHBondContact O-CG 3.32Å; Q189-K193 PolarHBondContact O-N 3.16Å; Q189-K193 VanDerWaalsContact O-N 3.11Å
190A71.8Confident69.1Low40 Ų4058.8 Ų58.833%0.33132%0.319SS..Hα-helixtrans-66.1-41.5171.200000111.6V165 T186 Q187 K193 S194V165-A190 HydrophobicContact CG2-CB 3.76Å; T186-A190 VanDerWaalsContact O-CB 3.27Å; T186-A190 WeakPolarHBondContact O-CB 3.43Å; T186-A190 PolarHBondContact O-N 3.39Å; Q187-A190 PolarHBondContact O-N 3.46Å; A190-K193 PolarHBondContact O-N 3.13Å; A190-S194 WeakPolarHBondContact O-CB 3.5Å; A190-S194 PolarHBondContact O-N 3.3Å
191A68.3Low70.6Confident0 Ų056.2 Ų56.20%030%0.304CS..Hα-helixtrans-62.2-47.3175.800000111.9V18 V165 V167 Q187 L188 K193 S194 Y195V18-A191 HydrophobicContact CG2-CB 4.27Å; V165-A191 HydrophobicContact CG1-CB 3.85Å; V167-A191 HydrophobicContact CB-CB 4.1Å; V167-A191 HydrophobicContact CG1-CB 3.9Å; V167-A191 HydrophobicContact CG2-CB 4.22Å; Q187-A191 WeakPolarHBondContact O-CB 3.19Å; Q187-A191 PolarHBondContact O-N 3.49Å; L188-A191 PolarHBondContact O-N 2.98Å; A191-K193 PolarHBondContact O-N 3.34Å; A191-S194 PolarHBondContact O-N 3.45Å; A191-Y195 WeakPolarHBondContact O-CB 3.13Å; A191-Y195 WeakPolarHBondContact O-CD2 3.38Å; A191-Y195 PolarHBondContact O-N 3.47Å
192I74.4Confident72.1Confident22 Ų2255.3 Ų55.311%0.11330%0.295CS..Hα-helixtrans-56.1-52.4175.7-70.8166.6000110.1R14 E17 V18 L21 L188 S194 Y195 E196R14-I192 HydrophobicContact CB-CD1 4.08Å; R14-I192 HydrophobicContact CG-CD1 4.19Å; E17-I192 HydrophobicContact CB-CD1 4.12Å; E17-I192 HydrophobicContact CB-CG1 4.5Å; E17-I192 HydrophobicContact CG-CD1 4.04Å; E17-I192 HydrophobicContact CG-CG1 4.15Å; E17-I192 HydrophobicContact CG-CG2 4.33Å; V18-I192 HydrophobicContact CG2-CD1 4.25Å; V18-I192 HydrophobicContact CG2-CG1 3.58Å; L21-I192 HydrophobicContact CD1-CB 4.36Å; L21-I192 HydrophobicContact CD1-CG1 4.43Å; L21-I192 HydrophobicContact CD1-CG2 3.96Å; L188-I192 VanDerWaalsContact O-CG1 3.25Å; L188-I192 WeakPolarHBondContact O-CG1 3.43Å; L188-I192 PolarHBondContact O-N 3.13Å; I192-S194 VanDerWaalsContact C-N 3.31Å; I192-S194 PolarHBondContact O-N 3.02Å; I192-Y195 PolarHBondContact O-N 2.89Å; I192-E196 HydrophobicContact CG2-CG 4.27Å; I192-E196 WeakPolarHBondContact O-CB 3.33Å; I192-E196 WeakPolarHBondContact O-CG 3.13Å; I192-E196 PolarHBondContact O-N 3.48Å
193K78.9Confident74Confident133 Ų13355.4 Ų55.458%0.57828%0.284SS*.Hα-helixtrans-60.4-39.8179.5-76.6-176.9175.7-1740113Q189 A190 A191 K197Q189-K193 WeakPolarHBondContact O-CG 3.32Å; Q189-K193 PolarHBondContact O-N 3.16Å; Q189-K193 VanDerWaalsContact O-N 3.11Å; A190-K193 PolarHBondContact O-N 3.13Å; A191-K193 PolarHBondContact O-N 3.34Å; K193-K197 WeakPolarHBondContact O-CB 3.38Å; K193-K197 PolarHBondContact O-N 3.31Å
194S74.9Confident75.6Confident31 Ų3153.6 Ų53.622%0.21728%0.275CS..Hα-helixtrans-65.5-47.7177.6-178.30000110.8A190 A191 I192 K197 H198A190-S194 WeakPolarHBondContact O-CB 3.5Å; A190-S194 PolarHBondContact O-N 3.3Å; A191-S194 PolarHBondContact O-N 3.45Å; I192-S194 VanDerWaalsContact C-N 3.31Å; I192-S194 PolarHBondContact O-N 3.02Å; S194-K197 PolarHBondContact O-N 3.4Å; S194-H198 WeakPolarHBondContact O-CB 3.47Å; S194-H198 PolarHBondContact O-CD2 3.49Å; S194-H198 PolarHBondContact O-N 2.98Å; S194-H198 PolarHBondContact OG-CD2 2.92Å
195Y73.6Confident76.7Confident1 Ų153.9 Ų53.90%0.00428%0.277CS..Hα-helixtrans-58.2-50.5174.3-91.4-63000112V18 L21 H22 L25 I62 V167 L168 A191 I192 K197 H198 L199V18-Y195 HydrophobicContact CG1-CD2 4.38Å; V18-Y195 HydrophobicContact CG1-CE2 3.88Å; L21-Y195 HydrophobicContact CB-CD1 4.33Å; L21-Y195 HydrophobicContact CB-CD2 4.4Å; L21-Y195 HydrophobicContact CB-CG 3.96Å; H22-Y195 HydrophobicContact CB-CE1 4.14Å; H22-Y195 AromaticContact ND1-CZ 3.72Å; H22-Y195 PolarHBondContact ND1-OH 2.92Å; L25-Y195 HydrophobicContact CD2-CD1 4.22Å; L25-Y195 HydrophobicContact CD2-CE1 3.99Å; I62-Y195 HydrophobicContact CD1-CE1 4.07Å; V167-Y195 HydrophobicContact CG1-CE2 4.33Å; L168-Y195 HydrophobicContact CD2-CD1 3.92Å; L168-Y195 HydrophobicContact CD2-CD2 3.44Å; L168-Y195 VanDerWaalsContact CD2-CD2 3.44Å; L168-Y195 HydrophobicContact CD2-CE1 3.49Å; L168-Y195 VanDerWaalsContact CD2-CE1 3.49Å; L168-Y195 HydrophobicContact CD2-CE2 2.96Å; L168-Y195 HydrophobicContact CD2-CG 3.88Å; L168-Y195 WeakPolarHBondContact CD2-OH 3.23Å; L168-Y195 HydrophobicContact CG-CE2 4.44Å; A191-Y195 WeakPolarHBondContact O-CB 3.13Å; A191-Y195 WeakPolarHBondContact O-CD2 3.38Å; A191-Y195 PolarHBondContact O-N 3.47Å; I192-Y195 PolarHBondContact O-N 2.89Å; Y195-K197 VanDerWaalsContact C-N 3.33Å; Y195-K197 PolarHBondContact O-N 3.36Å; Y195-H198 PolarHBondContact O-N 3.4Å; Y195-L199 WeakPolarHBondContact O-CB 3.4Å; Y195-L199 PolarHBondContact O-N 3.05Å
196E81.1Confident77.6Confident88 Ų8849.2 Ų49.241%0.41126%0.258SS..Hα-helixtrans-56.3-48179.9-74.3174.4151.100111.5L21 I192 L199 V200L21-E196 HydrophobicContact CD1-CG 3.98Å; L21-E196 HydrophobicContact CD2-CG 4.18Å; I192-E196 HydrophobicContact CG2-CG 4.27Å; I192-E196 WeakPolarHBondContact O-CB 3.33Å; I192-E196 WeakPolarHBondContact O-CG 3.13Å; I192-E196 PolarHBondContact O-N 3.48Å; E196-L199 PolarHBondContact O-N 3.19Å; E196-V200 VanDerWaalsContact O-CG2 3.31Å; E196-V200 WeakPolarHBondContact O-CG2 3.28Å; E196-V200 PolarHBondContact O-N 2.89Å; E196-V200 VanDerWaalsContact O-N 3.09Å
197K82.5Confident78.6Confident126 Ų12650 Ų5055%0.54825%0.254SS..Hα-helixtrans-59.7-52.8177.9-179.7-177.8175.3-174.90111.4K193 S194 Y195 L199 V200 E201K193-K197 WeakPolarHBondContact O-CB 3.38Å; K193-K197 PolarHBondContact O-N 3.31Å; S194-K197 PolarHBondContact O-N 3.4Å; Y195-K197 VanDerWaalsContact C-N 3.33Å; Y195-K197 PolarHBondContact O-N 3.36Å; K197-L199 VanDerWaalsContact C-N 3.33Å; K197-L199 PolarHBondContact O-N 3.21Å; K197-V200 PolarHBondContact O-N 3.45Å; K197-E201 WeakPolarHBondContact CE-OE1 3.44Å; K197-E201 PolarHBondContact O-N 3.32Å; K197-E201 VanDerWaalsContact O-N 3.16Å
198H79Confident79.5Confident21 Ų2153.3 Ų53.310%0.09727%0.268CS..Hα-helixtrans-67.1-35.4-176.7-74.1-53.1000112.4I155 S158 S194 Y195 F202I155-H198 HydrophobicContact CD1-CB 4.39Å; I155-H198 HydrophobicContact CG1-CB 3.98Å; S158-H198 WeakPolarHBondContact CB-NE2 3.16Å; S158-H198 PolarHBondContact OG-NE2 2.85Å; S194-H198 WeakPolarHBondContact O-CB 3.47Å; S194-H198 PolarHBondContact O-CD2 3.49Å; S194-H198 PolarHBondContact O-N 2.98Å; S194-H198 PolarHBondContact OG-CD2 2.92Å; Y195-H198 PolarHBondContact O-N 3.4Å; H198-F202 WeakPolarHBondContact O-CB 3.33Å; H198-F202 PolarHBondContact O-N 3.41Å
199L80.9Confident80.4Confident13 Ų1353.3 Ų53.37%0.06827%0.267CS..Hα-helixtrans-64.5-43177-166.898.5000111.3L21 Q24 L25 Y195 E196 K197 F202 K203L21-L199 HydrophobicContact CD2-CD2 4.49Å; Q24-L199 HydrophobicContact CB-CD1 3.67Å; Q24-L199 HydrophobicContact CB-CD2 4.42Å; L25-L199 HydrophobicContact CB-CD1 3.99Å; L25-L199 HydrophobicContact CD1-CD1 4.34Å; Y195-L199 WeakPolarHBondContact O-CB 3.4Å; Y195-L199 PolarHBondContact O-N 3.05Å; E196-L199 PolarHBondContact O-N 3.19Å; K197-L199 VanDerWaalsContact C-N 3.33Å; K197-L199 PolarHBondContact O-N 3.21Å; L199-F202 PolarHBondContact O-N 3.48Å; L199-K203 HydrophobicContact CD2-CD 4.07Å; L199-K203 HydrophobicContact CG-CD 4.11Å; L199-K203 HydrophobicContact CG-CG 4.44Å; L199-K203 VanDerWaalsContact O-CB 3.27Å; L199-K203 WeakPolarHBondContact O-CB 3.27Å; L199-K203 VanDerWaalsContact O-CG 3.29Å; L199-K203 WeakPolarHBondContact O-CG 3.42Å; L199-K203 PolarHBondContact O-N 3.11Å
200V84.9Confident81.1Confident101 Ų10150.8 Ų50.861%0.61226%0.257SS*.Hα-helixtrans-64.2-48.2177.7170.20000110.9E196 K197 F202 S204E196-V200 VanDerWaalsContact O-CG2 3.31Å; E196-V200 WeakPolarHBondContact O-CG2 3.28Å; E196-V200 PolarHBondContact O-N 2.89Å; E196-V200 VanDerWaalsContact O-N 3.09Å; K197-V200 PolarHBondContact O-N 3.45Å; V200-F202 VanDerWaalsContact C-N 3.32Å; V200-F202 PolarHBondContact O-N 2.86Å; V200-S204 WeakPolarHBondContact O-CB 3.35Å; V200-S204 PolarHBondContact O-N 2.85Å; V200-S204 VanDerWaalsContact O-N 3.13Å
201E82.7Confident81.8Confident72 Ų7254.4 Ų54.434%0.33627%0.267SS..Hα-helixtrans-62.8-40.6178.6-71.2176.4-173.700111.5V151 K197 A205V151-E201 HydrophobicContact CG1-CB 4.41Å; K197-E201 WeakPolarHBondContact CE-OE1 3.44Å; K197-E201 PolarHBondContact O-N 3.32Å; K197-E201 VanDerWaalsContact O-N 3.16Å; E201-A205 WeakPolarHBondContact O-CB 3.39Å; E201-A205 PolarHBondContact O-N 2.84Å; E201-A205 VanDerWaalsContact O-N 3.13Å
202F84.5Confident82.5Confident0 Ų054.6 Ų54.60%027%0.268CS..Hα-helixtrans-70.9-47.4179.6-174.7-127.8000113.1L25 C28 L29 L148 V151 L152 I155 H198 L199 V200 S204 A205 S206L25-F202 HydrophobicContact CD1-CB 4.47Å; L25-F202 HydrophobicContact CD1-CD1 3.6Å; L25-F202 HydrophobicContact CD1-CE1 4.2Å; L25-F202 HydrophobicContact CD1-CG 4.32Å; C28-F202 HydrophobicContact CB-CD1 3.61Å; C28-F202 HydrophobicContact CB-CE1 3.37Å; C28-F202 HydrophobicContact CB-CZ 4.47Å; L29-F202 HydrophobicContact CD2-CE1 4.08Å; L29-F202 HydrophobicContact CD2-CZ 3.73Å; L29-F202 HydrophobicContact CG-CE1 4Å; L29-F202 HydrophobicContact CG-CZ 4.15Å; L148-F202 HydrophobicContact CD1-CD2 4.19Å; L148-F202 HydrophobicContact CD1-CE2 3.7Å; V151-F202 HydrophobicContact CG1-CB 4.06Å; V151-F202 HydrophobicContact CG1-CD2 4.11Å; L152-F202 HydrophobicContact CD2-CD2 4.12Å; L152-F202 HydrophobicContact CD2-CE2 3.37Å; L152-F202 HydrophobicContact CD2-CZ 3.83Å; L152-F202 HydrophobicContact CG-CE2 3.97Å; I155-F202 HydrophobicContact CD1-CB 3.74Å; I155-F202 HydrophobicContact CD1-CD2 4.13Å; I155-F202 HydrophobicContact CD1-CG 3.92Å; H198-F202 WeakPolarHBondContact O-CB 3.33Å; H198-F202 PolarHBondContact O-N 3.41Å; L199-F202 PolarHBondContact O-N 3.48Å; V200-F202 VanDerWaalsContact C-N 3.32Å; V200-F202 PolarHBondContact O-N 2.86Å; F202-S204 VanDerWaalsContact C-N 3.29Å; F202-S204 PolarHBondContact O-N 3.37Å; F202-A205 CarbonylContact O-C 3.43Å; F202-A205 PolarHBondContact O-N 2.93Å; F202-A205 VanDerWaalsContact O-N 3.1Å; F202-S206 WeakPolarHBondContact O-CB 3.11Å; F202-S206 PolarHBondContact O-N 3.48Å; F202-S206 PolarHBondContact O-OG 3.43Å
203K85.7Confident83Confident64 Ų6453.5 Ų53.528%0.27826%0.262SS..Hα-helixtrans-55.1-46.5175.7-79.9180175.8-176.30111.4C28 L199 A205 S206 E207C28-K203 VanDerWaalsContact SG-CE 3.53Å; C28-K203 VanDerWaalsContact SG-CG 3.52Å; L199-K203 HydrophobicContact CD2-CD 4.07Å; L199-K203 HydrophobicContact CG-CD 4.11Å; L199-K203 HydrophobicContact CG-CG 4.44Å; L199-K203 VanDerWaalsContact O-CB 3.27Å; L199-K203 WeakPolarHBondContact O-CB 3.27Å; L199-K203 VanDerWaalsContact O-CG 3.29Å; L199-K203 WeakPolarHBondContact O-CG 3.42Å; L199-K203 PolarHBondContact O-N 3.11Å; K203-A205 VanDerWaalsContact C-N 3.32Å; K203-A205 PolarHBondContact O-N 2.87Å; K203-S206 WeakPolarHBondContact CA-OG 3.29Å; K203-S206 PolarHBondContact O-N 3.26Å; K203-S206 PolarHBondContact O-OG 3.39Å; K203-S206 VanDerWaalsContact O-OG 3.1Å; K203-E207 VanDerWaalsContact O-CB 3.29Å; K203-E207 WeakPolarHBondContact O-CB 3.32Å; K203-E207 WeakPolarHBondContact O-CG 3.48Å; K203-E207 PolarHBondContact O-N 3.24Å
204S86.2Confident83.3Confident53 Ų5350.2 Ų50.237%0.37125%0.253SS..Hα-helixtrans-63.6-38.4178.5-172.10000112.7V200 F202 K208V200-S204 WeakPolarHBondContact O-CB 3.35Å; V200-S204 PolarHBondContact O-N 2.85Å; V200-S204 VanDerWaalsContact O-N 3.13Å; F202-S204 VanDerWaalsContact C-N 3.29Å; F202-S204 PolarHBondContact O-N 3.37Å; S204-K208 WeakPolarHBondContact O-CG 3.27Å; S204-K208 PolarHBondContact O-N 3.43Å
205A84.5Confident83.8Confident7 Ų752.6 Ų52.66%0.05826%0.261CS..Hα-helixtrans-72.2-43.2177.400000112.4L148 V151 E201 F202 K203 K208 Y209L148-A205 HydrophobicContact CD1-CB 4.32Å; V151-A205 HydrophobicContact CB-CB 4.4Å; V151-A205 HydrophobicContact CG2-CB 4.14Å; E201-A205 WeakPolarHBondContact O-CB 3.39Å; E201-A205 PolarHBondContact O-N 2.84Å; E201-A205 VanDerWaalsContact O-N 3.13Å; F202-A205 CarbonylContact O-C 3.43Å; F202-A205 PolarHBondContact O-N 2.93Å; F202-A205 VanDerWaalsContact O-N 3.1Å; K203-A205 VanDerWaalsContact C-N 3.32Å; K203-A205 PolarHBondContact O-N 2.87Å; A205-K208 PolarHBondContact O-N 3.33Å; A205-Y209 WeakPolarHBondContact O-CB 3.31Å; A205-Y209 PolarHBondContact O-N 3.07Å
206S85.1Confident84.1Confident5 Ų552.5 Ų52.54%0.03526%0.261CS..Hα-helixtrans-67.9-38.8179.767.30000111.5F202 K203 K208 Y209 N210F202-S206 WeakPolarHBondContact O-CB 3.11Å; F202-S206 PolarHBondContact O-N 3.48Å; F202-S206 PolarHBondContact O-OG 3.43Å; K203-S206 WeakPolarHBondContact CA-OG 3.29Å; K203-S206 PolarHBondContact O-N 3.26Å; K203-S206 PolarHBondContact O-OG 3.39Å; K203-S206 VanDerWaalsContact O-OG 3.1Å; S206-K208 PolarHBondContact O-N 3.31Å; S206-Y209 PolarHBondContact O-N 2.92Å; S206-N210 VanDerWaalsContact O-CB 3.27Å; S206-N210 WeakPolarHBondContact O-CB 3.44Å; S206-N210 PolarHBondContact O-N 2.83Å; S206-N210 PolarHBondContact O-OD1 3.15Å
207E86.4Confident84.1Confident125 Ų12549.7 Ų49.758%0.58425%0.248SC*.Hα-helixtrans-60.4-46.5174.1-78170.6-17800112K203 Y209 N210 H211K203-E207 VanDerWaalsContact O-CB 3.29Å; K203-E207 WeakPolarHBondContact O-CB 3.32Å; K203-E207 WeakPolarHBondContact O-CG 3.48Å; K203-E207 PolarHBondContact O-N 3.24Å; E207-Y209 VanDerWaalsContact C-N 3.33Å; E207-Y209 PolarHBondContact O-N 3.38Å; E207-N210 PolarHBondContact O-N 3.09Å; E207-H211 VanDerWaalsContact O-CB 3.32Å; E207-H211 WeakPolarHBondContact O-CB 3.47Å; E207-H211 PolarHBondContact O-N 2.65Å
208K85.9Confident84.2Confident131 Ų13147.1 Ų47.157%0.5724%0.24SC*.Hα-helixtrans-63.7-40.5177-73.2176.2-177.31750111.8I144 S204 A205 S206 A212I144-K208 HydrophobicContact CG2-CB 4.31Å; S204-K208 WeakPolarHBondContact O-CG 3.27Å; S204-K208 PolarHBondContact O-N 3.43Å; A205-K208 PolarHBondContact O-N 3.33Å; S206-K208 PolarHBondContact O-N 3.31Å; K208-A212 WeakPolarHBondContact O-CB 3.37Å; K208-A212 PolarHBondContact O-N 3.39Å
209Y85.2Confident84.2Confident0 Ų047.1 Ų47.10%024%0.241CC..Hα-helixtrans-61.6-52.2173.9175.2-108.8000111.3V35 T36 I145 L148 A205 S206 E207 H211 A212 I213V35-Y209 HydrophobicContact CB-CD1 4.48Å; V35-Y209 HydrophobicContact CB-CE1 4Å; V35-Y209 HydrophobicContact CG1-CD1 3.91Å; V35-Y209 HydrophobicContact CG1-CE1 3.46Å; V35-Y209 VanDerWaalsContact CG1-CE1 3.46Å; T36-Y209 PolarHBondContact OG1-OH 3Å; I145-Y209 HydrophobicContact CD1-CE2 4.48Å; I145-Y209 HydrophobicContact CG1-CD2 4.16Å; I145-Y209 HydrophobicContact CG1-CE2 3.98Å; L148-Y209 HydrophobicContact CD2-CD1 3.54Å; L148-Y209 HydrophobicContact CD2-CD2 3.86Å; L148-Y209 HydrophobicContact CD2-CE1 3.91Å; L148-Y209 HydrophobicContact CD2-CE2 4.23Å; L148-Y209 HydrophobicContact CD2-CG 3.5Å; A205-Y209 WeakPolarHBondContact O-CB 3.31Å; A205-Y209 PolarHBondContact O-N 3.07Å; S206-Y209 PolarHBondContact O-N 2.92Å; E207-Y209 VanDerWaalsContact C-N 3.33Å; E207-Y209 PolarHBondContact O-N 3.38Å; Y209-H211 VanDerWaalsContact C-N 3.31Å; Y209-H211 PolarHBondContact O-N 2.9Å; Y209-A212 PolarHBondContact O-N 3.49Å; Y209-I213 HydrophobicContact CD2-CD1 4.31Å; Y209-I213 HydrophobicContact CD2-CG1 4Å; Y209-I213 HydrophobicContact CE1-CG1 4.2Å; Y209-I213 HydrophobicContact CE2-CD1 3.83Å; Y209-I213 HydrophobicContact CE2-CG1 3.59Å; Y209-I213 HydrophobicContact CG-CG1 4.44Å; Y209-I213 WeakPolarHBondContact O-CG1 3.34Å; Y209-I213 PolarHBondContact O-N 3.31Å
210N86.9Confident84Confident33 Ų3346.9 Ų46.918%0.17624%0.24CC..Hα-helixtrans-58.2-43.5179.7-70.5-2.3000111.8V35 S206 E207 T214V35-N210 WeakPolarHBondContact CB-OD1 3.43Å; V35-N210 HydrophobicContact CG2-CB 4.15Å; V35-N210 VanDerWaalsContact CG2-CG 3.48Å; V35-N210 WeakPolarHBondContact CG2-OD1 3.44Å; S206-N210 VanDerWaalsContact O-CB 3.27Å; S206-N210 WeakPolarHBondContact O-CB 3.44Å; S206-N210 PolarHBondContact O-N 2.83Å; S206-N210 PolarHBondContact O-OD1 3.15Å; E207-N210 PolarHBondContact O-N 3.09Å; N210-T214 VanDerWaalsContact O-CB 3.26Å; N210-T214 WeakPolarHBondContact O-CB 3.4Å; N210-T214 PolarHBondContact O-N 2.72Å; N210-T214 PolarHBondContact O-OG1 3.03Å
211H87.1Confident83.7Confident117 Ų11747.9 Ų47.954%0.54224%0.236SC..Hα-helixtrans-61.6-50.7176.4-17368.6000111.4E207 Y209 I213 T214 E215E207-H211 VanDerWaalsContact O-CB 3.32Å; E207-H211 WeakPolarHBondContact O-CB 3.47Å; E207-H211 PolarHBondContact O-N 2.65Å; Y209-H211 VanDerWaalsContact C-N 3.31Å; Y209-H211 PolarHBondContact O-N 2.9Å; H211-I213 PolarHBondContact O-N 3.15Å; H211-T214 WeakPolarHBondContact O-CB 3.21Å; H211-T214 PolarHBondContact O-N 3.26Å; H211-T214 VanDerWaalsContact O-N 3.16Å; H211-E215 IonicContact NE2-OE1 2.67Å; H211-E215 PolarHBondContact NE2-OE1 3.28Å; H211-E215 WeakPolarHBondContact O-CG 3.17Å; H211-E215 PolarHBondContact O-N 3.42Å
212A83Confident83.4Confident3 Ų350.3 Ų50.33%0.02525%0.247CC..Hα-helixtrans-58.8-43.8178.900000113I140 I144 K208 Y209 T214 E215 V216I140-A212 HydrophobicContact CD1-CB 4.17Å; I140-A212 HydrophobicContact CG1-CB 4.01Å; I140-A212 HydrophobicContact CG2-CB 4.28Å; I144-A212 HydrophobicContact CD1-CB 3.66Å; I144-A212 HydrophobicContact CG2-CB 4.25Å; K208-A212 WeakPolarHBondContact O-CB 3.37Å; K208-A212 PolarHBondContact O-N 3.39Å; Y209-A212 PolarHBondContact O-N 3.49Å; A212-T214 VanDerWaalsContact C-N 3.35Å; A212-E215 PolarHBondContact O-N 2.82Å; A212-V216 WeakPolarHBondContact O-CG2 3.25Å; A212-V216 PolarHBondContact O-N 3.2Å
213I84Confident82.6Confident0 Ų053.2 Ų53.20%026%0.261CS..Hα-helixtrans-69.1-37.3178.2-59.8-37.5000110.9V35 L39 I140 Y209 H211 E215 V216 I217V35-I213 HydrophobicContact CG1-CB 3.58Å; V35-I213 HydrophobicContact CG1-CG1 3.76Å; V35-I213 HydrophobicContact CG1-CG2 3.69Å; L39-I213 HydrophobicContact CB-CG2 3.85Å; L39-I213 HydrophobicContact CD1-CD1 4.17Å; L39-I213 HydrophobicContact CD1-CG2 4.4Å; L39-I213 HydrophobicContact CD2-CD1 3.69Å; L39-I213 HydrophobicContact CD2-CG1 4.28Å; L39-I213 HydrophobicContact CG-CD1 4.39Å; I140-I213 HydrophobicContact CG2-CD1 4.36Å; Y209-I213 HydrophobicContact CD2-CD1 4.31Å; Y209-I213 HydrophobicContact CD2-CG1 4Å; Y209-I213 HydrophobicContact CE1-CG1 4.2Å; Y209-I213 HydrophobicContact CE2-CD1 3.83Å; Y209-I213 HydrophobicContact CE2-CG1 3.59Å; Y209-I213 HydrophobicContact CG-CG1 4.44Å; Y209-I213 WeakPolarHBondContact O-CG1 3.34Å; Y209-I213 PolarHBondContact O-N 3.31Å; H211-I213 PolarHBondContact O-N 3.15Å; I213-E215 VanDerWaalsContact C-N 3.31Å; I213-E215 PolarHBondContact O-N 3.44Å; I213-V216 WeakPolarHBondContact O-CB 2.91Å; I213-V216 PolarHBondContact O-N 2.94Å; I213-I217 HydrophobicContact CG2-CD1 3.9Å; I213-I217 HydrophobicContact CG2-CG1 4.46Å; I213-I217 WeakPolarHBondContact O-CG1 3.2Å; I213-I217 PolarHBondContact O-N 2.98Å
214T85.8Confident81.7Confident63 Ų6356.5 Ų56.539%0.38728%0.279SS..Hα-helixtrans-63.1-38.5175.1-60.10000111.6N210 H211 A212 I217 N218N210-T214 VanDerWaalsContact O-CB 3.26Å; N210-T214 WeakPolarHBondContact O-CB 3.4Å; N210-T214 PolarHBondContact O-N 2.72Å; N210-T214 PolarHBondContact O-OG1 3.03Å; H211-T214 WeakPolarHBondContact O-CB 3.21Å; H211-T214 PolarHBondContact O-N 3.26Å; H211-T214 VanDerWaalsContact O-N 3.16Å; A212-T214 VanDerWaalsContact C-N 3.35Å; T214-I217 PolarHBondContact O-N 3.38Å; T214-N218 WeakPolarHBondContact O-CB 3.18Å; T214-N218 VanDerWaalsContact O-CG 3.29Å; T214-N218 PolarHBondContact O-N 2.67Å; T214-N218 PolarHBondContact O-ND2 3.3Å
215E84.3Confident80.2Confident81 Ų8164.7 Ų64.738%0.37931%0.308SS..Hα-helixtrans-61.1-43.9173-71.7-168.8149.600112H211 A212 I213 I217 N218 L219H211-E215 IonicContact NE2-OE1 2.67Å; H211-E215 PolarHBondContact NE2-OE1 3.28Å; H211-E215 WeakPolarHBondContact O-CG 3.17Å; H211-E215 PolarHBondContact O-N 3.42Å; A212-E215 PolarHBondContact O-N 2.82Å; I213-E215 VanDerWaalsContact C-N 3.31Å; I213-E215 PolarHBondContact O-N 3.44Å; E215-I217 PolarHBondContact O-N 2.84Å; E215-N218 PolarHBondContact O-N 3.31Å; E215-L219 WeakPolarHBondContact O-CB 3.42Å; E215-L219 PolarHBondContact O-N 3.12Å
216V80.4Confident80Confident0 Ų067.6 Ų67.60%032%0.32CS..Hα-helixtrans-60-46.21761750000110.7V42 V131 K134 L135 I140 A212 I213 N218 L219 V220V42-V216 HydrophobicContact CG1-CG1 4.37Å; V131-V216 HydrophobicContact CG1-CG1 4.39Å; V131-V216 HydrophobicContact CG2-CG1 4.42Å; K134-V216 HydrophobicContact CB-CG2 4.24Å; K134-V216 HydrophobicContact CG-CG2 3.76Å; L135-V216 HydrophobicContact CD1-CG1 4.46Å; L135-V216 HydrophobicContact CD2-CG1 4.42Å; L135-V216 HydrophobicContact CD2-CG2 3.76Å; L135-V216 HydrophobicContact CG-CG1 4.33Å; L135-V216 HydrophobicContact CG-CG2 4.28Å; I140-V216 HydrophobicContact CD1-CG2 3.87Å; A212-V216 WeakPolarHBondContact O-CG2 3.25Å; A212-V216 PolarHBondContact O-N 3.2Å; I213-V216 WeakPolarHBondContact O-CB 2.91Å; I213-V216 PolarHBondContact O-N 2.94Å; V216-N218 PolarHBondContact O-N 2.98Å; V216-L219 PolarHBondContact O-N 3.21Å; V216-V220 WeakPolarHBondContact O-CG2 3.43Å; V216-V220 PolarHBondContact O-N 3.48Å; V216-V220 VanDerWaalsContact O-N 3.1Å
217I82.1Confident79.8Confident29 Ų2970.9 Ų70.915%0.14934%0.335CS..Hα-helixtrans-62.9-43.6178.1-67.1162.1000111.2K38 V42 I213 T214 E215 L219 V220 K221K38-I217 HydrophobicContact CB-CD1 3.88Å; K38-I217 HydrophobicContact CD-CD1 4.46Å; V42-I217 HydrophobicContact CG2-CG1 3.9Å; I213-I217 HydrophobicContact CG2-CD1 3.9Å; I213-I217 HydrophobicContact CG2-CG1 4.46Å; I213-I217 WeakPolarHBondContact O-CG1 3.2Å; I213-I217 PolarHBondContact O-N 2.98Å; T214-I217 PolarHBondContact O-N 3.38Å; E215-I217 PolarHBondContact O-N 2.84Å; I217-L219 VanDerWaalsContact C-N 3.34Å; I217-V220 WeakPolarHBondContact O-CB 3.27Å; I217-V220 PolarHBondContact O-N 2.94Å; I217-K221 HydrophobicContact CG2-CD 4.46Å; I217-K221 WeakPolarHBondContact O-CG 3.36Å; I217-K221 PolarHBondContact O-N 3.45Å; I217-K221 VanDerWaalsContact O-N 3.09Å
218N82.8Confident79.4Confident71 Ų7167.9 Ų67.938%0.3832%0.321SS..Hα-helixtrans-67.1-37.6179.6-75.6-21.7000111.6T214 E215 V216 K221 H222T214-N218 WeakPolarHBondContact O-CB 3.18Å; T214-N218 VanDerWaalsContact O-CG 3.29Å; T214-N218 PolarHBondContact O-N 2.67Å; T214-N218 PolarHBondContact O-ND2 3.3Å; E215-N218 PolarHBondContact O-N 3.31Å; V216-N218 PolarHBondContact O-N 2.98Å; N218-K221 PolarHBondContact O-N 3.48Å; N218-H222 PolarHBondContact O-N 3.02Å; N218-H222 PolarHBondContact O-ND1 2.97Å
219L79.8Confident79Confident22 Ų2264.2 Ų64.212%0.11531%0.307CS..Hα-helixtrans-59.7-47.8174.6-17964.2000110.7A130 K134 E215 V216 I217 K221 H222 Q223A130-L219 HydrophobicContact CB-CD2 3.85Å; A130-L219 HydrophobicContact CB-CG 3.96Å; K134-L219 HydrophobicContact CB-CD2 3.96Å; K134-L219 HydrophobicContact CD-CD2 4.21Å; K134-L219 HydrophobicContact CG-CD2 4.22Å; E215-L219 WeakPolarHBondContact O-CB 3.42Å; E215-L219 PolarHBondContact O-N 3.12Å; V216-L219 PolarHBondContact O-N 3.21Å; I217-L219 VanDerWaalsContact C-N 3.34Å; L219-K221 VanDerWaalsContact C-N 3.33Å; L219-K221 PolarHBondContact O-N 3.3Å; L219-H222 PolarHBondContact O-N 3.36Å; L219-H222 VanDerWaalsContact O-N 3.12Å; L219-Q223 WeakPolarHBondContact O-CG 3.46Å; L219-Q223 PolarHBondContact O-N 3.04Å; L219-Q223 VanDerWaalsContact O-N 3.08Å
220V77.1Confident78.6Confident7 Ų768.2 Ų68.24%0.04233%0.326CS..Hα-helixtrans-53.5-50.1174167.50000111.3V42 H46 A127 V131 V216 I217 H222 Q223 M224V42-V220 HydrophobicContact CG1-CG2 4.17Å; H46-V220 WeakPolarHBondContact NE2-CG1 3.5Å; A127-V220 HydrophobicContact CB-CG1 4.35Å; V131-V220 HydrophobicContact CG2-CG2 3.15Å; V216-V220 WeakPolarHBondContact O-CG2 3.43Å; V216-V220 PolarHBondContact O-N 3.48Å; V216-V220 VanDerWaalsContact O-N 3.1Å; I217-V220 WeakPolarHBondContact O-CB 3.27Å; I217-V220 PolarHBondContact O-N 2.94Å; V220-H222 PolarHBondContact O-N 3.04Å; V220-Q223 PolarHBondContact O-N 3.03Å; V220-M224 HydrophobicContact CG1-SD 3.9Å; V220-M224 WeakPolarHBondContact O-CG 3.43Å; V220-M224 PolarHBondContact O-N 3.24Å
221K78.6Confident78.1Confident123 Ų12370.5 Ų70.554%0.53534%0.336SS..Hα-helixtrans-60.2-32.8179.9-71.7177-179.2178.10113.3I217 N218 L219I217-K221 HydrophobicContact CG2-CD 4.46Å; I217-K221 WeakPolarHBondContact O-CG 3.36Å; I217-K221 PolarHBondContact O-N 3.45Å; I217-K221 VanDerWaalsContact O-N 3.09Å; N218-K221 PolarHBondContact O-N 3.48Å; L219-K221 VanDerWaalsContact C-N 3.33Å; L219-K221 PolarHBondContact O-N 3.3Å
222H75.6Confident77.4Confident123 Ų12367.2 Ų67.257%0.56932%0.321SS*.Hα-helixtrans-74.2-33.1176.2-7778.7000112.4N218 L219 V220 M224N218-H222 PolarHBondContact O-N 3.02Å; N218-H222 PolarHBondContact O-ND1 2.97Å; L219-H222 PolarHBondContact O-N 3.36Å; L219-H222 VanDerWaalsContact O-N 3.12Å; V220-H222 PolarHBondContact O-N 3.04Å; H222-M224 VanDerWaalsContact C-N 3.27Å; H222-M224 PolarHBondContact O-N 2.87Å
223Q69.3Low77Confident60 Ų6072.2 Ų72.228%0.2834%0.344SS..Hα-helixtrans-78-11.5178.8-63.2-59.6-37.200113.8S126 A127 A130 L219 V220S126-Q223 PolarHBondContact OG-O 3.14Å; S126-Q223 VanDerWaalsContact OG-O 3.05Å; A127-Q223 HydrophobicContact CB-CB 4.33Å; A130-Q223 HydrophobicContact CB-CG 3.9Å; L219-Q223 WeakPolarHBondContact O-CG 3.46Å; L219-Q223 PolarHBondContact O-N 3.04Å; L219-Q223 VanDerWaalsContact O-N 3.08Å; V220-Q223 PolarHBondContact O-N 3.03Å
224M66Low76.4Confident133 Ų13378.2 Ų78.266%0.65537%0.373SS*.THydrogen-bonded Turntrans-96-1.7176-66.718071.500113.8A127 V220 H222A127-M224 HydrophobicContact CB-CG 4.19Å; V220-M224 HydrophobicContact CG1-SD 3.9Å; V220-M224 WeakPolarHBondContact O-CG 3.43Å; V220-M224 PolarHBondContact O-N 3.24Å; H222-M224 VanDerWaalsContact C-N 3.27Å; H222-M224 PolarHBondContact O-N 2.87Å
225K55.5Low75.6Confident226 Ų22679.5 Ų79.598%0.98337%0.372SS*.  trans-96.30174.7-73.4-179.3179.1-178.80110.4

Retrieved 225 of 225 residues in 52.5 ms (Link to these results)

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