A0A023I825_HUMAN Loading...

Cytochrome b

Component of the ubiquinol-cytochrome c reductase complex (complex III or cytochrome b-c1 complex) that is part of the mitochondrial respiratory chain. The b-c1 complex mediates electron transfer from ubiquinol to cytochrome c. Contributes to the generation of a proton gradient across the mitochondrial membrane that is then used for ATP synthesis.

AlphaFold DB , UniProt , Accession A0A023I825, Species HUMAN (Homo sapiens, Human), Gene CYTB, Length 380 aa.

Structure Viewer
Loading PAE data...
(Predicted Aligned Error values between residue pairs)
Error loading PAE data: please refresh the page.

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
1M81.9Confident92.6Very high244 Ų244112.5 Ų112.5100%1.20258%0.582SS**  0133.20-71.9175.5170.900108.6
2T88.6Confident92.7Very high101 Ų101111.4 Ų111.462%0.6257%0.57SS**  trans-65.8133173.113.90000109.4I7T2-I7 WeakPolarHBondContact O-CD1 3.44Å
3P93.8Very high92.8Very high59 Ų59112.5 Ų112.538%0.38358%0.576SS.*  trans-70148.3-176.129.3-35.5000111R5 K6P3-R5 HydrophobicContact CB-CG 4.16Å; P3-R5 HydrophobicContact CG-CG 4.09Å; P3-R5 PolarHBondContact O-N 3.35Å; P3-K6 HydrophobicContact CG-CB 4.42Å; P3-K6 HydrophobicContact CG-CD 4.01Å; P3-K6 HydrophobicContact CG-CG 4.01Å; P3-K6 PolarHBondContact O-N 2.97Å
4M93.9Very high92.8Very high142 Ų142111.4 Ų111.470%0.757%0.57SS**Hα-helixtrans-52.8-33.9179.4-76.8-63.8-173.500113.1K6 I7 N8M4-K6 PolarHBondContact O-N 3.48Å; M4-K6 VanDerWaalsContact O-N 3.08Å; M4-I7 PolarHBondContact O-N 2.91Å; M4-N8 PolarHBondContact O-N 3.28Å
5R95Very high93.1Very high96 Ų96104 Ų10436%0.36253%0.533SS..Hα-helixtrans-59.1-19.8177.178.7-176.4-161.9-164.22.2114.6P3 M11 K12 N15 D20P3-R5 HydrophobicContact CB-CG 4.16Å; P3-R5 HydrophobicContact CG-CG 4.09Å; P3-R5 PolarHBondContact O-N 3.35Å; R5-M11 CarbonylContact O-C 3.56Å; R5-K12 VanDerWaalsContact O-CA 3.31Å; R5-K12 WeakPolarHBondContact O-CA 3.1Å; R5-K12 PolarHBondContact O-N 3.21Å; R5-N15 HydrophobicContact CB-CB 4.43Å; R5-N15 WeakPolarHBondContact CD-OD1 3.17Å; R5-N15 HydrophobicContact CG-CB 4.46Å; R5-N15 WeakPolarHBondContact CG-OD1 3.37Å; R5-N15 PolarHBondContact NE-OD1 3.12Å; R5-N15 VanDerWaalsContact O-CB 3.27Å; R5-N15 WeakPolarHBondContact O-CB 3.5Å; R5-D20 IonicContact CZ-OD1 3.59Å; R5-D20 IonicContact NE-OD2 3.88Å; R5-D20 IonicContact NH2-OD1 2.75Å; R5-D20 PolarHBondContact NH2-OD1 3.07Å; R5-D20 IonicContact NH2-OD2 3.44Å; R5-D20 PolarHBondContact NH2-OD2 3.43Å
6K94.1Very high93.1Very high97 Ų97104 Ų10442%0.42253%0.53SS..Hα-helixtrans-100.7-13.3177.2-66.4-173.3178.7-169.60113.4P3 M4 D20P3-K6 HydrophobicContact CG-CB 4.42Å; P3-K6 HydrophobicContact CG-CD 4.01Å; P3-K6 HydrophobicContact CG-CG 4.01Å; P3-K6 PolarHBondContact O-N 2.97Å; M4-K6 PolarHBondContact O-N 3.48Å; M4-K6 VanDerWaalsContact O-N 3.08Å; K6-D20 WeakPolarHBondContact CE-OD2 3.48Å; K6-D20 IonicContact NZ-OD2 3.32Å; K6-D20 PolarHBondContact NZ-OD2 2.79Å
7I94.9Very high93.1Very high95 Ų9599.1 Ų99.149%0.48751%0.507SS..Hα-helixtrans-104.7-49.5-173.3-58.3171.2000110.7T2 M4T2-I7 WeakPolarHBondContact O-CD1 3.44Å; M4-I7 PolarHBondContact O-N 2.91Å
8N95.9Very high93.1Very high64 Ų64100 Ų10034%0.34251%0.507SS..SBendtrans-63.5128-177.4175.4-80.2000110M4 L10 M11 K12M4-N8 PolarHBondContact O-N 3.28Å; N8-L10 VanDerWaalsContact C-N 3.3Å; N8-L10 PolarHBondContact O-N 3.41Å; N8-L10 PolarHBondContact OD1-N 3.13Å; N8-L10 VanDerWaalsContact OD1-N 3.08Å; N8-M11 HydrophobicContact CB-CB 4.06Å; N8-M11 HydrophobicContact CB-CG 4.12Å; N8-M11 HydrophobicContact CB-SD 4.27Å; N8-M11 PolarHBondContact O-N 3.27Å; N8-M11 PolarHBondContact OD1-N 2.93Å; N8-K12 WeakPolarHBondContact O-CB 3.38Å; N8-K12 PolarHBondContact O-N 2.94Å
9P94.1Very high93.3Very high108 Ų10897.1 Ų97.170%0.70149%0.492SS*.Hα-helixtrans-55.7-38.9-173.2-2935.4000114.8
10L92.6Very high93.5Very high135 Ų13594 Ų9471%0.70748%0.477SS*.Hα-helixtrans-75.9-48.4178.8-65.7175.6000111.4N8 K12 L13 I14N8-L10 VanDerWaalsContact C-N 3.3Å; N8-L10 PolarHBondContact O-N 3.41Å; N8-L10 PolarHBondContact OD1-N 3.13Å; N8-L10 VanDerWaalsContact OD1-N 3.08Å; L10-K12 PolarHBondContact O-N 3.48Å; L10-L13 WeakPolarHBondContact O-CB 3.39Å; L10-L13 PolarHBondContact O-N 2.85Å; L10-I14 PolarHBondContact O-N 3.2Å
11M93.8Very high93.7Very high97 Ų9790.8 Ų90.848%0.47846%0.461SS..Hα-helixtrans-64.8-29.2179.2-62.1-176.1170.500112R5 N8 I14 N15R5-M11 CarbonylContact O-C 3.56Å; N8-M11 HydrophobicContact CB-CB 4.06Å; N8-M11 HydrophobicContact CB-CG 4.12Å; N8-M11 HydrophobicContact CB-SD 4.27Å; N8-M11 PolarHBondContact O-N 3.27Å; N8-M11 PolarHBondContact OD1-N 2.93Å; M11-I14 PolarHBondContact O-N 3.1Å; M11-N15 VanDerWaalsContact O-CB 3.26Å; M11-N15 WeakPolarHBondContact O-CB 3.39Å; M11-N15 PolarHBondContact O-N 2.72Å
12K94Very high94.4Very high99 Ų9982.4 Ų82.443%0.4343%0.425SS..Hα-helixtrans-61.5-43.4175.3-179.2175.8179.3-173.70111.2R5 N8 L10 N15 H16R5-K12 VanDerWaalsContact O-CA 3.31Å; R5-K12 WeakPolarHBondContact O-CA 3.1Å; R5-K12 PolarHBondContact O-N 3.21Å; N8-K12 WeakPolarHBondContact O-CB 3.38Å; N8-K12 PolarHBondContact O-N 2.94Å; L10-K12 PolarHBondContact O-N 3.48Å; K12-N15 PolarHBondContact O-N 2.93Å; K12-H16 WeakPolarHBondContact CE-NE2 3.46Å; K12-H16 VanDerWaalsContact CG-CD2 3.5Å; K12-H16 WeakPolarHBondContact CG-CD2 3.36Å; K12-H16 PolarHBondContact O-CD2 3.14Å; K12-H16 PolarHBondContact O-N 3.42Å
13L93.3Very high94.9Very high125 Ų12577.8 Ų77.865%0.65440%0.396SS*.Hα-helixtrans-59.8-48.5175-17866.7000110.9L10 N15 H16 S17L10-L13 WeakPolarHBondContact O-CB 3.39Å; L10-L13 PolarHBondContact O-N 2.85Å; L13-N15 VanDerWaalsContact C-N 3.33Å; L13-N15 PolarHBondContact O-N 3.43Å; L13-H16 PolarHBondContact O-N 3.12Å; L13-S17 WeakPolarHBondContact O-CB 3.37Å; L13-S17 PolarHBondContact O-N 3.01Å; L13-S17 PolarHBondContact O-OG 3.22Å
14I94Very high95.1Very high97 Ų9775 Ų7550%0.49738%0.378SS..Hα-helixtrans-61.4-42.7177.3-61.1172.2000110.6L10 M11 H16 S17 F18L10-I14 PolarHBondContact O-N 3.2Å; M11-I14 PolarHBondContact O-N 3.1Å; I14-H16 PolarHBondContact O-N 2.89Å; I14-S17 PolarHBondContact O-N 3.37Å; I14-S17 PolarHBondContact O-OG 3.11Å; I14-F18 WeakPolarHBondContact O-CB 3.49Å; I14-F18 PolarHBondContact O-N 3.45Å
15N96.2Very high95.3Very high1 Ų170.1 Ų70.11%0.00536%0.358CS..Iπ-helixtrans-62.5-45.7-179.1-175.879.6000111.7R5 M11 K12 L13 I19 D20R5-N15 HydrophobicContact CB-CB 4.43Å; R5-N15 WeakPolarHBondContact CD-OD1 3.17Å; R5-N15 HydrophobicContact CG-CB 4.46Å; R5-N15 WeakPolarHBondContact CG-OD1 3.37Å; R5-N15 PolarHBondContact NE-OD1 3.12Å; R5-N15 VanDerWaalsContact O-CB 3.27Å; R5-N15 WeakPolarHBondContact O-CB 3.5Å; M11-N15 VanDerWaalsContact O-CB 3.26Å; M11-N15 WeakPolarHBondContact O-CB 3.39Å; M11-N15 PolarHBondContact O-N 2.72Å; K12-N15 PolarHBondContact O-N 2.93Å; L13-N15 VanDerWaalsContact C-N 3.33Å; L13-N15 PolarHBondContact O-N 3.43Å; N15-I19 PolarHBondContact O-N 3.31Å; N15-I19 VanDerWaalsContact O-N 3.08Å; N15-D20 PolarHBondContact ND2-OD2 2.69Å; N15-D20 PolarHBondContact O-N 2.98Å; N15-D20 PolarHBondContact OD1-OD2 3.12Å
16H94.4Very high95.5Very high104 Ų10468.2 Ų68.248%0.48136%0.355SS..Iπ-helixtrans-72.8-26.3-179.9-74.3-66.7000113.7K12 L13 I14 L21K12-H16 WeakPolarHBondContact CE-NE2 3.46Å; K12-H16 VanDerWaalsContact CG-CD2 3.5Å; K12-H16 WeakPolarHBondContact CG-CD2 3.36Å; K12-H16 PolarHBondContact O-CD2 3.14Å; K12-H16 PolarHBondContact O-N 3.42Å; L13-H16 PolarHBondContact O-N 3.12Å; I14-H16 PolarHBondContact O-N 2.89Å; H16-L21 WeakPolarHBondContact O-CB 3.16Å
17S92.3Very high95.7Very high21 Ų2164.4 Ų64.415%0.14734%0.34CS..Iπ-helixtrans-94-23.3-178.652.40000114.5L13 I14 L21L13-S17 WeakPolarHBondContact O-CB 3.37Å; L13-S17 PolarHBondContact O-N 3.01Å; L13-S17 PolarHBondContact O-OG 3.22Å; I14-S17 PolarHBondContact O-N 3.37Å; I14-S17 PolarHBondContact O-OG 3.11Å; S17-L21 WeakPolarHBondContact O-CD2 3.37Å
18F92.4Very high95.8Very high115 Ų11561.7 Ų61.750%0.50433%0.329SS..Iπ-helixtrans-133.6-24.6-172.7-84-86.2000115.6I14 F220I14-F18 WeakPolarHBondContact O-CB 3.49Å; I14-F18 PolarHBondContact O-N 3.45Å; F18-F220 WeakPolarHBondContact O-CD1 3.41Å
19I96.8Very high96Very high45 Ų4561.9 Ų61.923%0.23134%0.339CS..Iπ-helixtrans-103.6-68.1-173.2-55.1178000110.6N15 L21 F220 H221N15-I19 PolarHBondContact O-N 3.31Å; N15-I19 VanDerWaalsContact O-N 3.08Å; I19-L21 VanDerWaalsContact C-N 3.28Å; I19-L21 PolarHBondContact O-N 3.49Å; I19-F220 PolarHBondContact O-N 3.46Å; I19-H221 HydrophobicContact CG2-CB 4.11Å; I19-H221 PolarHBondContact O-N 2.89Å
20D97.4Very high96.2Very high34 Ų3461.6 Ų61.618%0.18232%0.324CS..SBendtrans-91.413.1-176.6-67-14.2000111.7R5 K6 N15 P22R5-D20 IonicContact CZ-OD1 3.59Å; R5-D20 IonicContact NE-OD2 3.88Å; R5-D20 IonicContact NH2-OD1 2.75Å; R5-D20 PolarHBondContact NH2-OD1 3.07Å; R5-D20 IonicContact NH2-OD2 3.44Å; R5-D20 PolarHBondContact NH2-OD2 3.43Å; K6-D20 WeakPolarHBondContact CE-OD2 3.48Å; K6-D20 IonicContact NZ-OD2 3.32Å; K6-D20 PolarHBondContact NZ-OD2 2.79Å; N15-D20 PolarHBondContact ND2-OD2 2.69Å; N15-D20 PolarHBondContact O-N 2.98Å; N15-D20 PolarHBondContact OD1-OD2 3.12Å; D20-P22 WeakPolarHBondContact O-CD 3.49Å
21L97.6Very high96.5Very high27 Ų2756.2 Ų56.214%0.14130%0.295CS..  trans-60.1117.3178.5175.567.2000110.3H16 S17 I19 T23 F220H16-L21 WeakPolarHBondContact O-CB 3.16Å; S17-L21 WeakPolarHBondContact O-CD2 3.37Å; I19-L21 VanDerWaalsContact C-N 3.28Å; I19-L21 PolarHBondContact O-N 3.49Å; L21-T23 PolarHBondContact O-N 3.01Å; L21-T23 PolarHBondContact O-OG1 3.28Å; L21-F220 HydrophobicContact CB-CB 3.95Å; L21-F220 HydrophobicContact CD2-CD2 4.23Å; L21-F220 PolarHBondContact O-N 3.42Å
22P97.6Very high96.7Very high69 Ų6952.2 Ų52.245%0.44828%0.275SS..EExtended strand (participates in β ladder)trans-72.4112.6178.1-17.633000110.8D20 K217D20-P22 WeakPolarHBondContact O-CD 3.49Å; P22-K217 HydrophobicContact CB-CB 4.16Å; P22-K217 HydrophobicContact CB-CD 3.62Å
23T98.2Very high96.9Very high3 Ų349 Ų492%0.01826%0.261CS..EExtended strand (participates in β ladder)trans-117.9140-174.2-51.60000109.5L21 S25 I27 K217 I218 Y224L21-T23 PolarHBondContact O-N 3.01Å; L21-T23 PolarHBondContact O-OG1 3.28Å; T23-S25 PolarHBondContact O-N 3.46Å; T23-I27 HydrophobicContact CG2-CD1 3.59Å; T23-I27 HydrophobicContact CG2-CG1 4.29Å; T23-K217 WeakPolarHBondContact O-CA 3.32Å; T23-I218 PolarHBondContact N-O 3.22Å; T23-I218 PolarHBondContact O-N 3Å; T23-Y224 HydrophobicContact CG2-CD2 3.49Å; T23-Y224 VanDerWaalsContact CG2-CD2 3.49Å; T23-Y224 HydrophobicContact CG2-CE2 3.29Å; T23-Y224 HydrophobicContact CG2-CG 4.33Å
24P98.4Very high97.2Very high0 Ų044.6 Ų44.60%025%0.246CC..EExtended strand (participates in β ladder)trans-52.6138.9175.5-18.325.8000110.6N26 I27 S205 N207 S213 Y224P24-N26 PolarHBondContact O-N 2.99Å; P24-I27 HydrophobicContact CB-CG2 4.08Å; P24-I27 HydrophobicContact CG-CG2 4.11Å; P24-S205 WeakPolarHBondContact CG-O 3.38Å; P24-N207 HydrophobicContact CB-CB 3.87Å; P24-N207 HydrophobicContact CG-CB 4.19Å; P24-S213 WeakPolarHBondContact CB-OG 3.38Å; P24-S213 WeakPolarHBondContact CG-OG 3.29Å; P24-Y224 PolarHBondContact O-OH 3.46Å
25S98.3Very high97.4Very high41 Ų4142.1 Ų42.129%0.28724%0.237SC..THydrogen-bonded Turntrans-66.5-20.3-17762.90000114.4T23 D216 Y224T23-S25 PolarHBondContact O-N 3.46Å; S25-D216 VanDerWaalsContact CB-OD2 3.27Å; S25-D216 WeakPolarHBondContact CB-OD2 3.26Å; S25-D216 PolarHBondContact N-O 3.08Å; S25-D216 PolarHBondContact OG-OD2 3.45Å; S25-Y224 VanDerWaalsContact C-OH 3.25Å; S25-Y224 PolarHBondContact O-OH 2.95Å; S25-Y224 VanDerWaalsContact O-OH 3.14Å
26N98.4Very high97.5Very high56 Ų5642.7 Ų42.730%0.29924%0.24SC..THydrogen-bonded Turntrans-112.416.6-166.369.5-28.1000114.6P24 S28 N207 P208P24-N26 PolarHBondContact O-N 2.99Å; N26-S28 PolarHBondContact O-N 2.88Å; N26-N207 PolarHBondContact ND2-OD1 2.88Å; N26-N207 WeakPolarHBondContact OD1-CB 3.11Å; N26-P208 VanDerWaalsContact O-CD 3.26Å; N26-P208 WeakPolarHBondContact O-CD 3.42Å; N26-P208 WeakPolarHBondContact O-CG 3.39Å
27I98.5Very high97.7Very high17 Ų1738.9 Ų38.99%0.08722%0.223CC..  trans-67.9129.217756.1165.7000111T23 P24 W31 N206 N207 Y224 K227T23-I27 HydrophobicContact CG2-CD1 3.59Å; T23-I27 HydrophobicContact CG2-CG1 4.29Å; P24-I27 HydrophobicContact CB-CG2 4.08Å; P24-I27 HydrophobicContact CG-CG2 4.11Å; I27-W31 HydrophobicContact CB-CB 4.05Å; I27-W31 HydrophobicContact CB-CD2 3.72Å; I27-W31 HydrophobicContact CB-CE3 4.19Å; I27-W31 HydrophobicContact CB-CG 3.63Å; I27-W31 HydrophobicContact CD1-CB 3.8Å; I27-W31 HydrophobicContact CD1-CG 3.9Å; I27-W31 HydrophobicContact CG1-CB 4.34Å; I27-W31 HydrophobicContact CG1-CG 4.3Å; I27-W31 HydrophobicContact CG2-CD2 3.8Å; I27-W31 HydrophobicContact CG2-CG 3.87Å; I27-W31 HydrophobicContact CG2-CZ2 4.31Å; I27-N206 WeakPolarHBondContact CG2-O 3.44Å; I27-N207 HydrophobicContact CG2-CB 4.14Å; I27-Y224 HydrophobicContact CD1-CD1 3.79Å; I27-Y224 HydrophobicContact CD1-CD2 4.46Å; I27-Y224 HydrophobicContact CD1-CE1 3.51Å; I27-Y224 HydrophobicContact CD1-CE2 4.16Å; I27-Y224 HydrophobicContact CD1-CG 4.3Å; I27-Y224 HydrophobicContact CG1-CD1 4.04Å; I27-Y224 HydrophobicContact CG1-CE1 3.23Å; I27-Y224 HydrophobicContact CG1-CE2 4.14Å; I27-Y224 WeakPolarHBondContact CG1-OH 3.43Å; I27-K227 PolarHBondContact O-NZ 2.69Å
28S98.4Very high98Very high37 Ų3739.5 Ų39.526%0.25923%0.233SC..  trans-82.8-177.6-175.764.60000112.5N26 W30 W31 K227N26-S28 PolarHBondContact O-N 2.88Å; S28-W30 PolarHBondContact O-N 2.75Å; S28-W30 VanDerWaalsContact O-N 3.13Å; S28-W31 PolarHBondContact O-N 2.61Å; S28-W31 VanDerWaalsContact O-N 3.14Å; S28-K227 VanDerWaalsContact C-NZ 3.26Å; S28-K227 PolarHBondContact O-NZ 3Å
29A98.4Very high98.3Very high68 Ų6835.3 Ų35.356%0.56222%0.22SC*.G310 helixtrans-57.4-24.617800000113.5W31 N32A29-W31 PolarHBondContact O-N 3.34Å; A29-W31 VanDerWaalsContact O-N 3.13Å; A29-N32 WeakPolarHBondContact CA-OD1 3.46Å; A29-N32 VanDerWaalsContact O-CB 3.26Å; A29-N32 WeakPolarHBondContact O-CB 3.36Å; A29-N32 PolarHBondContact O-N 3.49Å; A29-N32 PolarHBondContact O-OD1 2.75Å
30W98.7Very high98.4Very high103 Ų10333.2 Ų33.239%0.3921%0.209SC..G310 helixtrans-61.8-21.1177.6-58.9115.6000113.6S28 N32 F33 L96 R100 Y104S28-W30 PolarHBondContact O-N 2.75Å; S28-W30 VanDerWaalsContact O-N 3.13Å; W30-N32 VanDerWaalsContact C-N 3.33Å; W30-F33 HydrophobicContact CE3-CD2 4.19Å; W30-F33 AromaticContact CE3-CE2 3.6Å; W30-F33 HydrophobicContact CE3-CE2 3.6Å; W30-F33 AromaticContact CZ3-CE2 3.94Å; W30-F33 HydrophobicContact CZ3-CE2 3.94Å; W30-F33 WeakPolarHBondContact O-CD2 3.37Å; W30-L96 HydrophobicContact CZ3-CD2 4.14Å; W30-R100 HydrophobicContact CB-CB 4.06Å; W30-R100 HydrophobicContact CB-CG 3.53Å; W30-Y104 HydrophobicContact CB-CE2 4.25Å; W30-Y104 AromaticContact CD1-CE2 3.8Å; W30-Y104 HydrophobicContact CG-CE2 4.18Å
31W98.8Very high98.5Very high22 Ų2232.5 Ų32.58%0.08321%0.205CC..G310 helixtrans-76.6-18.9175.3-86.7-113.3000113.7I27 S28 A29 F33 G34 R100 Y104 N206 P208I27-W31 HydrophobicContact CB-CB 4.05Å; I27-W31 HydrophobicContact CB-CD2 3.72Å; I27-W31 HydrophobicContact CB-CE3 4.19Å; I27-W31 HydrophobicContact CB-CG 3.63Å; I27-W31 HydrophobicContact CD1-CB 3.8Å; I27-W31 HydrophobicContact CD1-CG 3.9Å; I27-W31 HydrophobicContact CG1-CB 4.34Å; I27-W31 HydrophobicContact CG1-CG 4.3Å; I27-W31 HydrophobicContact CG2-CD2 3.8Å; I27-W31 HydrophobicContact CG2-CG 3.87Å; I27-W31 HydrophobicContact CG2-CZ2 4.31Å; S28-W31 PolarHBondContact O-N 2.61Å; S28-W31 VanDerWaalsContact O-N 3.14Å; A29-W31 PolarHBondContact O-N 3.34Å; A29-W31 VanDerWaalsContact O-N 3.13Å; W31-F33 PolarHBondContact O-N 2.98Å; W31-G34 PolarHBondContact O-N 3.48Å; W31-R100 HydrophobicContact CE3-CG 4.34Å; W31-R100 HydrophobicContact CZ3-CG 4.26Å; W31-Y104 HydrophobicContact CH2-CD1 4.15Å; W31-Y104 AromaticContact CH2-CD2 3.57Å; W31-Y104 HydrophobicContact CH2-CD2 3.57Å; W31-Y104 HydrophobicContact CH2-CE2 4.01Å; W31-Y104 AromaticContact CH2-CG 3.63Å; W31-Y104 HydrophobicContact CH2-CG 3.63Å; W31-Y104 AromaticContact CZ3-CD2 3.64Å; W31-Y104 HydrophobicContact CZ3-CD2 3.64Å; W31-Y104 AromaticContact CZ3-CE2 3.61Å; W31-Y104 HydrophobicContact CZ3-CE2 3.61Å; W31-Y104 HydrophobicContact CZ3-CG 4.12Å; W31-N206 VanDerWaalsContact CE2-O 3.28Å; W31-N206 HydrophobicContact CZ2-CB 4.3Å; W31-N206 VanDerWaalsContact CZ2-O 3.26Å; W31-N206 WeakPolarHBondContact CZ2-O 3.38Å; W31-N206 PolarHBondContact NE1-O 3.36Å; W31-P208 HydrophobicContact CH2-CG 4.07Å; W31-P208 HydrophobicContact CZ3-CG 3.82Å
32N98.7Very high98.5Very high12 Ų1236.5 Ų36.56%0.06423%0.225CC..G310 helixtrans-65.9-23.3178.8-67.866.1000112.7A29 W30 G34 S35 L36 K227 D228A29-N32 WeakPolarHBondContact CA-OD1 3.46Å; A29-N32 VanDerWaalsContact O-CB 3.26Å; A29-N32 WeakPolarHBondContact O-CB 3.36Å; A29-N32 PolarHBondContact O-N 3.49Å; A29-N32 PolarHBondContact O-OD1 2.75Å; W30-N32 VanDerWaalsContact C-N 3.33Å; N32-G34 PolarHBondContact O-N 3.29Å; N32-G34 VanDerWaalsContact O-N 3.09Å; N32-S35 PolarHBondContact O-N 3.01Å; N32-S35 VanDerWaalsContact O-N 3.12Å; N32-S35 PolarHBondContact O-OG 2.88Å; N32-L36 WeakPolarHBondContact O-CG 3.41Å; N32-L36 PolarHBondContact O-N 3.38Å; N32-K227 PolarHBondContact ND2-O 3.24Å; N32-K227 VanDerWaalsContact ND2-O 3.09Å; N32-K227 WeakPolarHBondContact OD1-CE 3.01Å; N32-K227 PolarHBondContact OD1-NZ 2.84Å; N32-D228 PolarHBondContact ND2-OD1 2.71Å
33F98.8Very high98.6Very high32 Ų3234.7 Ų34.714%0.1421%0.212CC..Hα-helixtrans-62.5-20.9-179.5-69.5-68.6000113.2W30 W31 L36 L37 C93 L96 H97W30-F33 HydrophobicContact CE3-CD2 4.19Å; W30-F33 AromaticContact CE3-CE2 3.6Å; W30-F33 HydrophobicContact CE3-CE2 3.6Å; W30-F33 AromaticContact CZ3-CE2 3.94Å; W30-F33 HydrophobicContact CZ3-CE2 3.94Å; W30-F33 WeakPolarHBondContact O-CD2 3.37Å; W31-F33 PolarHBondContact O-N 2.98Å; F33-L36 HydrophobicContact CD1-CD1 3.97Å; F33-L36 HydrophobicContact CE1-CD1 4.1Å; F33-L37 WeakPolarHBondContact O-CB 3.47Å; F33-L37 WeakPolarHBondContact O-CD1 3.3Å; F33-L37 WeakPolarHBondContact O-CG 3.43Å; F33-L37 PolarHBondContact O-N 3.15Å; F33-C93 HydrophobicContact CD1-CB 4.08Å; F33-L96 HydrophobicContact CD1-CB 4.06Å; F33-L96 HydrophobicContact CD1-CD1 4.38Å; F33-L96 HydrophobicContact CD2-CB 3.9Å; F33-L96 HydrophobicContact CE1-CB 3.91Å; F33-L96 HydrophobicContact CE1-CD1 3.48Å; F33-L96 VanDerWaalsContact CE1-CD1 3.48Å; F33-L96 HydrophobicContact CE1-CG 4.33Å; F33-L96 HydrophobicContact CE2-CB 3.76Å; F33-L96 HydrophobicContact CE2-CD1 4.07Å; F33-L96 HydrophobicContact CG-CB 4.07Å; F33-L96 HydrophobicContact CZ-CB 3.78Å; F33-L96 HydrophobicContact CZ-CD1 3.3Å; F33-L96 HydrophobicContact CZ-CG 4.15Å; F33-H97 HydrophobicContact CB-CB 3.9Å
34G98.2Very high98.6Very high33 Ų3335.6 Ų35.634%0.3422%0.216SC..Hα-helixtrans-64.4-50.2171.300000112.7W31 N32 L37 G38 H97W31-G34 PolarHBondContact O-N 3.48Å; N32-G34 PolarHBondContact O-N 3.29Å; N32-G34 VanDerWaalsContact O-N 3.09Å; G34-L37 PolarHBondContact O-N 3.4Å; G34-G38 PolarHBondContact O-N 3.23Å; G34-H97 PolarHBondContact N-ND1 3.12Å
35S98.3Very high98.7Very high44 Ų4437.6 Ų37.631%0.30823%0.226SC..Hα-helixtrans-70.9-34.917845.70000112.4N32 L37 G38 A39 D228N32-S35 PolarHBondContact O-N 3.01Å; N32-S35 VanDerWaalsContact O-N 3.12Å; N32-S35 PolarHBondContact O-OG 2.88Å; S35-L37 VanDerWaalsContact C-N 3.34Å; S35-L37 PolarHBondContact O-N 2.97Å; S35-G38 PolarHBondContact O-N 3.49Å; S35-A39 PolarHBondContact O-N 2.88Å; S35-D228 WeakPolarHBondContact CB-OD2 3.43Å; S35-D228 PolarHBondContact OG-OD2 3.33Å
36L98.8Very high98.7Very high14 Ų1438.7 Ų38.77%0.07323%0.231CC..Hα-helixtrans-62.8-37.5173.2-66.2-178.9000112.8N32 F33 G38 A39 C40 L232 F235N32-L36 WeakPolarHBondContact O-CG 3.41Å; N32-L36 PolarHBondContact O-N 3.38Å; F33-L36 HydrophobicContact CD1-CD1 3.97Å; F33-L36 HydrophobicContact CE1-CD1 4.1Å; L36-G38 VanDerWaalsContact C-N 3.34Å; L36-A39 PolarHBondContact O-N 3.19Å; L36-C40 PolarHBondContact O-N 3.34Å; L36-C40 PolarHBondContact O-SG 3.29Å; L36-L232 HydrophobicContact CD2-CB 4.49Å; L36-L232 HydrophobicContact CD2-CD1 4.5Å; L36-F235 HydrophobicContact CD1-CB 4.44Å; L36-F235 HydrophobicContact CD2-CB 3.64Å; L36-F235 HydrophobicContact CD2-CD2 4.38Å; L36-F235 HydrophobicContact CD2-CG 4.02Å
37L98.9Very high98.7Very high24 Ų2436.5 Ų36.513%0.12622%0.22CC..Hα-helixtrans-64.5-39.1173.6-74.1169.1000112.1F33 G34 S35 A39 C40 L41 F90 C93 L94 H97F33-L37 WeakPolarHBondContact O-CB 3.47Å; F33-L37 WeakPolarHBondContact O-CD1 3.3Å; F33-L37 WeakPolarHBondContact O-CG 3.43Å; F33-L37 PolarHBondContact O-N 3.15Å; G34-L37 PolarHBondContact O-N 3.4Å; S35-L37 VanDerWaalsContact C-N 3.34Å; S35-L37 PolarHBondContact O-N 2.97Å; L37-A39 VanDerWaalsContact C-N 3.35Å; L37-C40 PolarHBondContact O-N 3Å; L37-L41 PolarHBondContact O-N 2.86Å; L37-F90 HydrophobicContact CD2-CD1 3.5Å; L37-F90 VanDerWaalsContact CD2-CD1 3.5Å; L37-F90 HydrophobicContact CD2-CE1 3.51Å; L37-C93 HydrophobicContact CD2-CB 3.62Å; L37-C93 HydrophobicContact CG-CB 3.98Å; L37-L94 HydrophobicContact CD1-CD2 4.02Å; L37-L94 HydrophobicContact CD2-CB 4.32Å; L37-L94 HydrophobicContact CD2-CD2 3.79Å; L37-L94 HydrophobicContact CD2-CG 3.59Å; L37-H97 HydrophobicContact CD1-CB 3.78Å
38G98.7Very high98.7Very high34 Ų3436.5 Ų36.535%0.35122%0.223SC..Hα-helixtrans-60.1-44171.100000112.3G34 S35 L36 L41 I42G34-G38 PolarHBondContact O-N 3.23Å; S35-G38 PolarHBondContact O-N 3.49Å; L36-G38 VanDerWaalsContact C-N 3.34Å; G38-L41 PolarHBondContact O-N 3.3Å; G38-I42 WeakPolarHBondContact O-CG1 3.4Å; G38-I42 PolarHBondContact O-N 3.38Å; G38-I42 VanDerWaalsContact O-N 3.08Å
39A98.7Very high98.7Very high27 Ų2738.4 Ų38.422%0.22323%0.23CC..Hα-helixtrans-63.9-41.6175.400000112.4S35 L36 L37 L41 I42 L43 L232S35-A39 PolarHBondContact O-N 2.88Å; L36-A39 PolarHBondContact O-N 3.19Å; L37-A39 VanDerWaalsContact C-N 3.35Å; A39-L41 PolarHBondContact O-N 3.47Å; A39-I42 PolarHBondContact O-N 3.47Å; A39-L43 WeakPolarHBondContact O-CB 3.34Å; A39-L43 PolarHBondContact O-N 3.1Å; A39-L232 HydrophobicContact CB-CD1 3.72Å
40C98.9Very high98.8Very high0 Ų040.5 Ų40.50%023%0.227CC..Hα-helixtrans-59.2-46.3174-67.10000111L36 L37 I42 L43 Q44 F90 F235L36-C40 PolarHBondContact O-N 3.34Å; L36-C40 PolarHBondContact O-SG 3.29Å; L37-C40 PolarHBondContact O-N 3Å; C40-I42 PolarHBondContact O-N 3.38Å; C40-L43 WeakPolarHBondContact O-CB 3.37Å; C40-L43 PolarHBondContact O-N 3.12Å; C40-Q44 WeakPolarHBondContact O-CG 3.5Å; C40-Q44 PolarHBondContact O-N 2.7Å; C40-F90 HydrophobicContact CB-CB 4.05Å; C40-F90 HydrophobicContact CB-CD1 4.22Å; C40-F90 HydrophobicContact CB-CD2 3.64Å; C40-F90 HydrophobicContact CB-CE2 4.11Å; C40-F90 HydrophobicContact CB-CG 3.69Å; C40-F235 WeakPolarHBondContact SG-CE2 3.49Å; C40-F235 WeakPolarHBondContact SG-CZ 3.5Å
41L98.9Very high98.8Very high19 Ų1936.8 Ų36.810%0.09922%0.215CC..Hα-helixtrans-61.2-44.8179.5-177.361.6000112L37 G38 A39 Q44 I45 F90 I189 A190L37-L41 PolarHBondContact O-N 2.86Å; G38-L41 PolarHBondContact O-N 3.3Å; A39-L41 PolarHBondContact O-N 3.47Å; L41-Q44 PolarHBondContact O-N 2.81Å; L41-I45 HydrophobicContact CD1-CD1 3.94Å; L41-I45 HydrophobicContact CD1-CG1 4.28Å; L41-I45 HydrophobicContact CG-CD1 3.91Å; L41-I45 VanDerWaalsContact O-CG1 3.31Å; L41-I45 WeakPolarHBondContact O-CG1 3.29Å; L41-I45 PolarHBondContact O-N 2.89Å; L41-F90 HydrophobicContact CB-CE2 4.13Å; L41-F90 HydrophobicContact CB-CZ 4.24Å; L41-F90 HydrophobicContact CD1-CE2 4.24Å; L41-F90 HydrophobicContact CD1-CZ 4.48Å; L41-I189 HydrophobicContact CD1-CB 4.35Å; L41-I189 HydrophobicContact CD1-CG2 3.87Å; L41-I189 HydrophobicContact CD2-CG2 3.98Å; L41-A190 HydrophobicContact CD2-CB 3.96Å
42I98.8Very high98.8Very high111 Ų11136.8 Ų36.857%0.56922%0.22SC*.Hα-helixtrans-62.9-43.8176.1-66.5167.7000110.6G38 A39 C40 Q44 I45 T46G38-I42 WeakPolarHBondContact O-CG1 3.4Å; G38-I42 PolarHBondContact O-N 3.38Å; G38-I42 VanDerWaalsContact O-N 3.08Å; A39-I42 PolarHBondContact O-N 3.47Å; C40-I42 PolarHBondContact O-N 3.38Å; I42-Q44 PolarHBondContact O-N 3.43Å; I42-I45 PolarHBondContact O-N 2.91Å; I42-T46 HydrophobicContact CG2-CG2 4.25Å; I42-T46 WeakPolarHBondContact O-CB 3.47Å; I42-T46 VanDerWaalsContact O-CG2 3.27Å; I42-T46 WeakPolarHBondContact O-CG2 3.14Å; I42-T46 PolarHBondContact O-N 3.5Å; I42-T46 PolarHBondContact O-OG1 2.86Å
43L98.9Very high98.8Very high31 Ų3141.9 Ų41.916%0.16224%0.244CC..Hα-helixtrans-58.8-47.3176.3178.674.9000111.2A39 C40 T46 T47 L239A39-L43 WeakPolarHBondContact O-CB 3.34Å; A39-L43 PolarHBondContact O-N 3.1Å; C40-L43 WeakPolarHBondContact O-CB 3.37Å; C40-L43 PolarHBondContact O-N 3.12Å; L43-T46 PolarHBondContact O-N 2.88Å; L43-T46 PolarHBondContact O-OG1 2.92Å; L43-T47 HydrophobicContact CD1-CG2 4.1Å; L43-T47 WeakPolarHBondContact O-CB 3.43Å; L43-T47 WeakPolarHBondContact O-CG2 3.23Å; L43-T47 PolarHBondContact O-N 3.47Å; L43-T47 PolarHBondContact O-OG1 2.91Å; L43-L239 HydrophobicContact CD2-CD2 3.44Å; L43-L239 VanDerWaalsContact CD2-CD2 3.44Å
44Q98.9Very high98.8Very high23 Ų2344.3 Ų44.311%0.10726%0.256CS..Hα-helixtrans-66.2-43.3-179.3-67.7-48.3107.800112C40 L41 I42 T47 G48 H83 G86 F90C40-Q44 WeakPolarHBondContact O-CG 3.5Å; C40-Q44 PolarHBondContact O-N 2.7Å; L41-Q44 PolarHBondContact O-N 2.81Å; I42-Q44 PolarHBondContact O-N 3.43Å; Q44-T47 PolarHBondContact O-OG1 2.81Å; Q44-G48 WeakPolarHBondContact O-CA 3.48Å; Q44-G48 PolarHBondContact O-N 3.27Å; Q44-H83 PolarHBondContact NE2-O 3.48Å; Q44-H83 PolarHBondContact O-CE1 2.84Å; Q44-H83 VanDerWaalsContact O-CE1 3.26Å; Q44-H83 PolarHBondContact O-ND1 3.46Å; Q44-H83 PolarHBondContact OE1-O 3.36Å; Q44-G86 VanDerWaalsContact OE1-CA 3.3Å; Q44-F90 HydrophobicContact CG-CD2 3.94Å; Q44-F90 HydrophobicContact CG-CE2 4.46Å
45I98.9Very high98.8Very high41 Ų4143.9 Ų43.921%0.2124%0.244CC..Hα-helixtrans-63.5-45.7177.9-69.6169.8000110.5L41 I42 L49 P186 F187L41-I45 HydrophobicContact CD1-CD1 3.94Å; L41-I45 HydrophobicContact CD1-CG1 4.28Å; L41-I45 HydrophobicContact CG-CD1 3.91Å; L41-I45 VanDerWaalsContact O-CG1 3.31Å; L41-I45 WeakPolarHBondContact O-CG1 3.29Å; L41-I45 PolarHBondContact O-N 2.89Å; I42-I45 PolarHBondContact O-N 2.91Å; I45-L49 VanDerWaalsContact O-CB 3.26Å; I45-L49 WeakPolarHBondContact O-CB 3.41Å; I45-L49 PolarHBondContact O-N 3.04Å; I45-P186 HydrophobicContact CD1-CB 4.2Å; I45-P186 HydrophobicContact CG1-CB 3.7Å; I45-F187 HydrophobicContact CG2-CE1 4.02Å; I45-F187 HydrophobicContact CG2-CZ 4.21Å
46T98.9Very high98.8Very high64 Ų6444 Ų4439%0.39325%0.245SC..Hα-helixtrans-66.8-55-177.851.60000111.2I42 L43 G48 L49 F50I42-T46 HydrophobicContact CG2-CG2 4.25Å; I42-T46 WeakPolarHBondContact O-CB 3.47Å; I42-T46 VanDerWaalsContact O-CG2 3.27Å; I42-T46 WeakPolarHBondContact O-CG2 3.14Å; I42-T46 PolarHBondContact O-N 3.5Å; I42-T46 PolarHBondContact O-OG1 2.86Å; L43-T46 PolarHBondContact O-N 2.88Å; L43-T46 PolarHBondContact O-OG1 2.92Å; T46-G48 VanDerWaalsContact C-N 3.33Å; T46-G48 PolarHBondContact O-N 2.96Å; T46-L49 PolarHBondContact O-N 2.82Å; T46-F50 VanDerWaalsContact O-CD2 3.27Å; T46-F50 WeakPolarHBondContact O-CD2 3.48Å; T46-F50 PolarHBondContact O-N 3.48Å
47T98.9Very high98.7Very high11 Ų1144.9 Ų44.97%0.06725%0.251CS..Hα-helixtrans-61.4-41177.854.90000112.1L43 Q44 L49 F50 L51 I79 L82 H83L43-T47 HydrophobicContact CD1-CG2 4.1Å; L43-T47 WeakPolarHBondContact O-CB 3.43Å; L43-T47 WeakPolarHBondContact O-CG2 3.23Å; L43-T47 PolarHBondContact O-N 3.47Å; L43-T47 PolarHBondContact O-OG1 2.91Å; Q44-T47 PolarHBondContact O-OG1 2.81Å; T47-L49 PolarHBondContact O-N 3.4Å; T47-F50 PolarHBondContact O-N 3.37Å; T47-L51 VanDerWaalsContact O-CG 3.29Å; T47-L51 WeakPolarHBondContact O-CG 3.5Å; T47-L51 PolarHBondContact O-N 3.03Å; T47-I79 HydrophobicContact CG2-CG2 4.27Å; T47-L82 HydrophobicContact CG2-CB 4.1Å; T47-H83 PolarHBondContact OG1-ND1 2.91Å
48G98.8Very high98.6Very high16 Ų1646.3 Ų46.317%0.16526%0.259CS..Hα-helixtrans-62.8-39.9178.100000112.8Q44 T46 L51 A52 H83Q44-G48 WeakPolarHBondContact O-CA 3.48Å; Q44-G48 PolarHBondContact O-N 3.27Å; T46-G48 VanDerWaalsContact C-N 3.33Å; T46-G48 PolarHBondContact O-N 2.96Å; G48-L51 PolarHBondContact O-N 2.94Å; G48-A52 VanDerWaalsContact O-CB 3.32Å; G48-A52 WeakPolarHBondContact O-CB 3.39Å; G48-A52 PolarHBondContact O-N 3.28Å; G48-H83 VanDerWaalsContact CA-CE1 3.44Å; G48-H83 WeakPolarHBondContact CA-CE1 3.48Å; G48-H83 PolarHBondContact N-ND1 3.47Å
49L98.8Very high98.5Very high77 Ų7745.6 Ų45.640%0.40325%0.25SS..Hα-helixtrans-61.6-45.5174.8-178.665.5000111.6I45 T46 T47 A52 M53 F183I45-L49 VanDerWaalsContact O-CB 3.26Å; I45-L49 WeakPolarHBondContact O-CB 3.41Å; I45-L49 PolarHBondContact O-N 3.04Å; T46-L49 PolarHBondContact O-N 2.82Å; T47-L49 PolarHBondContact O-N 3.4Å; L49-A52 PolarHBondContact O-N 3.47Å; L49-M53 HydrophobicContact CD2-CE 4.42Å; L49-M53 HydrophobicContact CG-CE 3.99Å; L49-M53 WeakPolarHBondContact O-CG 3.46Å; L49-M53 PolarHBondContact O-N 3.45Å; L49-F183 HydrophobicContact CD1-CE2 4.25Å; L49-F183 HydrophobicContact CD1-CZ 4.04Å
50F98.8Very high98.5Very high113 Ų11348.9 Ų48.950%0.49627%0.272SS..Hα-helixtrans-64.8-38.6176.7-81.4-79.3000112.4T46 T47 M53 H54 I79T46-F50 VanDerWaalsContact O-CD2 3.27Å; T46-F50 WeakPolarHBondContact O-CD2 3.48Å; T46-F50 PolarHBondContact O-N 3.48Å; T47-F50 PolarHBondContact O-N 3.37Å; F50-M53 HydrophobicContact CD1-SD 4.42Å; F50-M53 PolarHBondContact O-N 3.46Å; F50-H54 PolarHBondContact O-CD2 3.41Å; F50-I79 HydrophobicContact CB-CD1 4.35Å; F50-I79 HydrophobicContact CB-CG2 4.19Å
51L98.9Very high98.4Very high24 Ų2451.2 Ų51.213%0.12629%0.286CS..Hα-helixtrans-64.3-42174.3-67.5170.9000111.7T47 G48 M53 H54 Y55 I69 I79 R80 H83T47-L51 VanDerWaalsContact O-CG 3.29Å; T47-L51 WeakPolarHBondContact O-CG 3.5Å; T47-L51 PolarHBondContact O-N 3.03Å; G48-L51 PolarHBondContact O-N 2.94Å; L51-M53 PolarHBondContact O-N 3.4Å; L51-H54 PolarHBondContact O-N 3.06Å; L51-Y55 WeakPolarHBondContact O-CB 3.27Å; L51-Y55 PolarHBondContact O-N 2.84Å; L51-Y55 VanDerWaalsContact O-N 3.11Å; L51-I69 HydrophobicContact CD2-CD1 4.27Å; L51-I69 HydrophobicContact CD2-CG2 3.57Å; L51-I79 HydrophobicContact CD2-CG2 3.97Å; L51-I79 HydrophobicContact CG-CG2 3.89Å; L51-R80 HydrophobicContact CD2-CB 4.1Å; L51-H83 HydrophobicContact CD1-CB 3.51Å
52A98.7Very high98.4Very high23 Ų2350.3 Ų50.319%0.1928%0.281CS..Hα-helixtrans-62.2-27.4-179.500000113.2G48 L49 H54 F179 F183G48-A52 VanDerWaalsContact O-CB 3.32Å; G48-A52 WeakPolarHBondContact O-CB 3.39Å; G48-A52 PolarHBondContact O-N 3.28Å; L49-A52 PolarHBondContact O-N 3.47Å; A52-H54 PolarHBondContact O-N 2.91Å; A52-F179 HydrophobicContact CB-CE2 4.22Å; A52-F179 HydrophobicContact CB-CZ 4.1Å; A52-F183 HydrophobicContact CB-CD2 4.26Å; A52-F183 HydrophobicContact CB-CE2 3.96Å
53M98.7Very high98.4Very high118 Ų11847.6 Ų47.658%0.58127%0.265SS*.THydrogen-bonded Turntrans-64.6-17.4174.9-63.9-179.5-166.800113.5L49 F50 L51L49-M53 HydrophobicContact CD2-CE 4.42Å; L49-M53 HydrophobicContact CG-CE 3.99Å; L49-M53 WeakPolarHBondContact O-CG 3.46Å; L49-M53 PolarHBondContact O-N 3.45Å; F50-M53 HydrophobicContact CD1-SD 4.42Å; F50-M53 PolarHBondContact O-N 3.46Å; L51-M53 PolarHBondContact O-N 3.4Å
54H98.6Very high98.4Very high84 Ų8449.2 Ų49.239%0.38928%0.279SS..THydrogen-bonded Turntrans-123.7-3.8-174.8-61.5-68.1000113.7F50 L51 A52 I69 V73F50-H54 PolarHBondContact O-CD2 3.41Å; L51-H54 PolarHBondContact O-N 3.06Å; A52-H54 PolarHBondContact O-N 2.91Å; H54-I69 HydrophobicContact CB-CD1 3.87Å; H54-I69 HydrophobicContact CB-CG1 3.51Å; H54-V73 HydrophobicContact CB-CG2 4.35Å
55Y98.8Very high98.4Very high24 Ų2448.7 Ų48.79%0.09428%0.278CS..  trans-91.9144.7-177.2175.5-107.9000112L51 P57 A62 S65 I66 L133 F179L51-Y55 WeakPolarHBondContact O-CB 3.27Å; L51-Y55 PolarHBondContact O-N 2.84Å; L51-Y55 VanDerWaalsContact O-N 3.11Å; Y55-P57 HydrophobicContact CD1-CB 4.42Å; Y55-P57 HydrophobicContact CE1-CB 3.71Å; Y55-A62 HydrophobicContact CE2-CB 3.98Å; Y55-S65 VanDerWaalsContact CD2-OG 3.23Å; Y55-S65 WeakPolarHBondContact CD2-OG 3.45Å; Y55-I66 HydrophobicContact CD2-CD1 3.7Å; Y55-I66 HydrophobicContact CD2-CG1 4.19Å; Y55-I66 HydrophobicContact CE2-CD1 4.13Å; Y55-I66 HydrophobicContact CE2-CG1 4.26Å; Y55-L133 HydrophobicContact CE1-CB 4.44Å; Y55-L133 HydrophobicContact CE2-CB 4.43Å; Y55-L133 WeakPolarHBondContact CE2-O 3.35Å; Y55-L133 PolarHBondContact OH-O 3.34Å; Y55-F179 AromaticContact CD1-CD2 3.62Å; Y55-F179 HydrophobicContact CD1-CD2 3.62Å; Y55-F179 AromaticContact CD1-CE2 3.62Å; Y55-F179 HydrophobicContact CD1-CE2 3.62Å; Y55-F179 HydrophobicContact CD1-CG 4.33Å; Y55-F179 HydrophobicContact CD1-CZ 4.32Å; Y55-F179 HydrophobicContact CE1-CB 4.33Å; Y55-F179 AromaticContact CE1-CD2 3.57Å; Y55-F179 HydrophobicContact CE1-CD2 3.57Å; Y55-F179 HydrophobicContact CE1-CE2 4.08Å; Y55-F179 HydrophobicContact CE1-CG 4.02Å
56S98.3Very high98.4Very high45 Ų4547.9 Ų47.932%0.31527%0.274SS..  trans-120.3113.4177.5-172.40000110.6D58 T61 A62 S65S56-D58 PolarHBondContact O-N 3.38Å; S56-T61 WeakPolarHBondContact CB-OG1 3.28Å; S56-T61 PolarHBondContact OG-OG1 3.3Å; S56-A62 VanDerWaalsContact O-CA 3.26Å; S56-A62 WeakPolarHBondContact O-CA 3.33Å; S56-S65 PolarHBondContact N-OG 3.32Å
57P97Very high98.3Very high33 Ų3346.5 Ų46.521%0.21427%0.269CS..  trans-85.253.6-173.336.1-38.1000113.2Y55 T176 F179Y55-P57 HydrophobicContact CD1-CB 4.42Å; Y55-P57 HydrophobicContact CE1-CB 3.71Å; P57-T176 PolarHBondContact O-OG1 2.93Å; P57-F179 HydrophobicContact CB-CB 3.78Å; P57-F179 HydrophobicContact CB-CD1 3.96Å; P57-F179 HydrophobicContact CB-CG 3.89Å; P57-F179 HydrophobicContact CG-CD1 3.93Å; P57-F179 HydrophobicContact CG-CE1 4.42Å; P57-F179 HydrophobicContact CG-CG 4.36Å
58D97.4Very high98.3Very high55 Ų5549.9 Ų49.929%0.29428%0.284SS..SBendtrans-126.6141.1173.3178.5-96.7000110.8S56 S60 T61 A62 S172S56-D58 PolarHBondContact O-N 3.38Å; D58-S60 PolarHBondContact O-N 2.95Å; D58-S60 VanDerWaalsContact O-N 3.11Å; D58-S60 VanDerWaalsContact OD1-CB 3.27Å; D58-S60 WeakPolarHBondContact OD1-CB 3.36Å; D58-S60 PolarHBondContact OD1-N 3.48Å; D58-S60 PolarHBondContact OD1-OG 3.22Å; D58-T61 PolarHBondContact O-N 3.07Å; D58-A62 WeakPolarHBondContact O-CB 3.37Å; D58-A62 PolarHBondContact O-N 3.21Å; D58-S172 PolarHBondContact OD2-OG 3.18Å
59A96.3Very high98.3Very high19 Ų1949.2 Ų49.216%0.15728%0.276CS..THydrogen-bonded Turntrans-59.4-26.6-174.700000113.4W135 S172A59-W135 HydrophobicContact CB-CZ2 3.73Å; A59-S172 VanDerWaalsContact CB-OG 3.22Å; A59-S172 WeakPolarHBondContact CB-OG 3.46Å; A59-S172 PolarHBondContact N-OG 3.47Å
60S97.6Very high98.3Very high96 Ų9647.1 Ų47.167%0.67127%0.267SS*.THydrogen-bonded Turntrans-79.6-24.5177.9730000113.8D58D58-S60 PolarHBondContact O-N 2.95Å; D58-S60 VanDerWaalsContact O-N 3.11Å; D58-S60 VanDerWaalsContact OD1-CB 3.27Å; D58-S60 WeakPolarHBondContact OD1-CB 3.36Å; D58-S60 PolarHBondContact OD1-N 3.48Å; D58-S60 PolarHBondContact OD1-OG 3.22Å
61T98.3Very high98.3Very high48 Ų4851.6 Ų51.629%0.29428%0.28SS..THydrogen-bonded Turntrans-120.8-12.8-17356.40000114.7S56 D58 S64 S65S56-T61 WeakPolarHBondContact CB-OG1 3.28Å; S56-T61 PolarHBondContact OG-OG1 3.3Å; D58-T61 PolarHBondContact O-N 3.07Å; T61-S64 WeakPolarHBondContact CA-OG 3.27Å; T61-S64 PolarHBondContact O-N 2.85Å; T61-S64 PolarHBondContact O-OG 3.16Å; T61-S65 VanDerWaalsContact O-CB 3.26Å; T61-S65 WeakPolarHBondContact O-CB 3.37Å; T61-S65 PolarHBondContact O-N 3.3Å; T61-S65 PolarHBondContact O-OG 3.32Å
62A98.6Very high98.3Very high0 Ų055.7 Ų55.70%030%0.302CS..Hα-helixtrans-60.5-53.5-174.100000112.4Y55 S56 D58 S64 S65 I66 W135 L175Y55-A62 HydrophobicContact CE2-CB 3.98Å; S56-A62 VanDerWaalsContact O-CA 3.26Å; S56-A62 WeakPolarHBondContact O-CA 3.33Å; D58-A62 WeakPolarHBondContact O-CB 3.37Å; D58-A62 PolarHBondContact O-N 3.21Å; A62-S64 PolarHBondContact O-N 3.47Å; A62-S65 PolarHBondContact O-N 3.4Å; A62-S65 PolarHBondContact O-OG 3.04Å; A62-I66 PolarHBondContact O-N 3.31Å; A62-I66 VanDerWaalsContact O-N 3.12Å; A62-W135 HydrophobicContact CB-CB 3.85Å; A62-W135 HydrophobicContact CB-CG 4.38Å; A62-L175 HydrophobicContact CB-CD2 3.52Å
63F98.6Very high98.3Very high55 Ų5555.9 Ų55.924%0.24130%0.301CS..Hα-helixtrans-60.1-44.5179-173.4-90.8000112.2I66 A67 P134 W135 Y256 L258F63-I66 PolarHBondContact O-N 3.43Å; F63-A67 PolarHBondContact O-N 3.07Å; F63-A67 VanDerWaalsContact O-N 3.11Å; F63-P134 WeakPolarHBondContact CA-O 3.19Å; F63-P134 WeakPolarHBondContact CD2-O 3.28Å; F63-W135 HydrophobicContact CB-CB 4.45Å; F63-Y256 WeakPolarHBondContact CZ-O 3.29Å; F63-L258 HydrophobicContact CB-CD1 3.44Å; F63-L258 VanDerWaalsContact CB-CD1 3.44Å; F63-L258 HydrophobicContact CD1-CB 4.21Å; F63-L258 HydrophobicContact CD1-CD1 4.11Å; F63-L258 HydrophobicContact CD2-CB 4.47Å; F63-L258 HydrophobicContact CD2-CD1 4.21Å; F63-L258 HydrophobicContact CE1-CB 4.34Å; F63-L258 HydrophobicContact CG-CB 4.29Å; F63-L258 HydrophobicContact CG-CD1 3.66Å
64S98.6Very high98.3Very high65 Ų6557.1 Ų57.146%0.45531%0.31SS..Hα-helixtrans-69.8-31.7178.958.10000112.5T61 A62 A67 H68T61-S64 WeakPolarHBondContact CA-OG 3.27Å; T61-S64 PolarHBondContact O-N 2.85Å; T61-S64 PolarHBondContact O-OG 3.16Å; A62-S64 PolarHBondContact O-N 3.47Å; S64-A67 WeakPolarHBondContact O-CB 3.48Å; S64-A67 PolarHBondContact O-N 3.41Å; S64-H68 WeakPolarHBondContact O-CB 3.31Å; S64-H68 PolarHBondContact O-N 2.89Å
65S98.7Very high98.3Very high11 Ų1161.4 Ų61.48%0.07732%0.324CS..Hα-helixtrans-66.6-37174.375.80000112.2Y55 S56 T61 A62 H68 I69Y55-S65 VanDerWaalsContact CD2-OG 3.23Å; Y55-S65 WeakPolarHBondContact CD2-OG 3.45Å; S56-S65 PolarHBondContact N-OG 3.32Å; T61-S65 VanDerWaalsContact O-CB 3.26Å; T61-S65 WeakPolarHBondContact O-CB 3.37Å; T61-S65 PolarHBondContact O-N 3.3Å; T61-S65 PolarHBondContact O-OG 3.32Å; A62-S65 PolarHBondContact O-N 3.4Å; A62-S65 PolarHBondContact O-OG 3.04Å; S65-H68 PolarHBondContact O-N 3.43Å; S65-I69 VanDerWaalsContact O-CG1 3.32Å; S65-I69 WeakPolarHBondContact O-CG1 3.27Å; S65-I69 PolarHBondContact O-N 3.35Å
66I98.6Very high98.3Very high25 Ų2560.3 Ų60.313%0.12832%0.32CS..Hα-helixtrans-65.8-40.2171.3-65.5-55.9000111.4Y55 A62 F63 I69 T70 P134Y55-I66 HydrophobicContact CD2-CD1 3.7Å; Y55-I66 HydrophobicContact CD2-CG1 4.19Å; Y55-I66 HydrophobicContact CE2-CD1 4.13Å; Y55-I66 HydrophobicContact CE2-CG1 4.26Å; A62-I66 PolarHBondContact O-N 3.31Å; A62-I66 VanDerWaalsContact O-N 3.12Å; F63-I66 PolarHBondContact O-N 3.43Å; I66-I69 HydrophobicContact CD1-CD1 4.19Å; I66-I69 PolarHBondContact O-N 3.49Å; I66-T70 PolarHBondContact O-N 3.37Å; I66-T70 PolarHBondContact O-OG1 2.91Å; I66-P134 HydrophobicContact CG1-CB 4.46Å
67A98.4Very high98.3Very high35 Ų3563.2 Ų63.229%0.28932%0.324SS..Hα-helixtrans-62.7-43.6174.500000111.5F63 S64 T70 R71F63-A67 PolarHBondContact O-N 3.07Å; F63-A67 VanDerWaalsContact O-N 3.11Å; S64-A67 WeakPolarHBondContact O-CB 3.48Å; S64-A67 PolarHBondContact O-N 3.41Å; A67-T70 PolarHBondContact O-N 2.85Å; A67-T70 VanDerWaalsContact O-N 3.16Å; A67-R71 WeakPolarHBondContact O-CB 3.5Å; A67-R71 WeakPolarHBondContact O-CG 3.48Å; A67-R71 PolarHBondContact O-N 3.01Å
68H98.8Very high98.4Very high81 Ų8163.2 Ų63.238%0.37532%0.322SS..Hα-helixtrans-60.1-46.2174.5166.3-92.1000112S64 S65 T70 R71 D72 V73S64-H68 WeakPolarHBondContact O-CB 3.31Å; S64-H68 PolarHBondContact O-N 2.89Å; S65-H68 PolarHBondContact O-N 3.43Å; H68-T70 PolarHBondContact O-N 3.29Å; H68-R71 PolarHBondContact O-N 3.41Å; H68-D72 IonicContact CD2-OD2 3.31Å; H68-D72 PolarHBondContact CD2-OD2 2.97Å; H68-D72 VanDerWaalsContact CD2-OD2 3.31Å; H68-D72 IonicContact CG-OD2 3.91Å; H68-D72 WeakPolarHBondContact O-CB 3.34Å; H68-D72 PolarHBondContact O-N 3.39Å; H68-V73 PolarHBondContact O-N 2.89Å
69I98.8Very high98.5Very high2 Ų262.4 Ų62.41%0.0132%0.317CS..Hα-helixtrans-54.6-44.8173.2-73.5167.6000110.7L51 H54 S65 I66 G76 R80L51-I69 HydrophobicContact CD2-CD1 4.27Å; L51-I69 HydrophobicContact CD2-CG2 3.57Å; H54-I69 HydrophobicContact CB-CD1 3.87Å; H54-I69 HydrophobicContact CB-CG1 3.51Å; S65-I69 VanDerWaalsContact O-CG1 3.32Å; S65-I69 WeakPolarHBondContact O-CG1 3.27Å; S65-I69 PolarHBondContact O-N 3.35Å; I66-I69 HydrophobicContact CD1-CD1 4.19Å; I66-I69 PolarHBondContact O-N 3.49Å; I69-G76 CarbonylContact O-C 3.37Å; I69-G76 WeakPolarHBondContact O-CA 3.37Å; I69-R80 HydrophobicContact CG2-CB 4.47Å
70T98.5Very high98.6Very high33 Ų3363.5 Ų63.520%0.20232%0.317CS..Hα-helixtrans-72.1-33.5-175-50.90000112.1I66 A67 H68 W77 R80I66-T70 PolarHBondContact O-N 3.37Å; I66-T70 PolarHBondContact O-OG1 2.91Å; A67-T70 PolarHBondContact O-N 2.85Å; A67-T70 VanDerWaalsContact O-N 3.16Å; H68-T70 PolarHBondContact O-N 3.29Å; T70-W77 HydrophobicContact CG2-CB 3.94Å; T70-W77 WeakPolarHBondContact O-CB 3.39Å; T70-R80 WeakPolarHBondContact OG1-CD 3.31Å
71R98.6Very high98.6Very high208 Ų20860.4 Ų60.479%0.78529%0.291SS*.Hα-helixtrans-103.6-35.6-168.6-66.1178.6176.7-156.5-1114.3A67 H68A67-R71 WeakPolarHBondContact O-CB 3.5Å; A67-R71 WeakPolarHBondContact O-CG 3.48Å; A67-R71 PolarHBondContact O-N 3.01Å; H68-R71 PolarHBondContact O-N 3.41Å
72D98.7Very high98.7Very high110 Ų11059.5 Ų59.559%0.58828%0.284SS*.THydrogen-bonded Turntrans-115.3-26.7-165.4-52.6-42.1000112.7H68H68-D72 IonicContact CD2-OD2 3.31Å; H68-D72 PolarHBondContact CD2-OD2 2.97Å; H68-D72 VanDerWaalsContact CD2-OD2 3.31Å; H68-D72 IonicContact CG-OD2 3.91Å; H68-D72 WeakPolarHBondContact O-CB 3.34Å; H68-D72 PolarHBondContact O-N 3.39Å
73V98.8Very high98.7Very high26 Ų2661 Ų6116%0.15829%0.292CS..SBendtrans-78.7129.5176.2179.20000110.1H54 H68 Y75 G76H54-V73 HydrophobicContact CB-CG2 4.35Å; H68-V73 PolarHBondContact O-N 2.89Å; V73-Y75 PolarHBondContact O-N 2.81Å; V73-Y75 VanDerWaalsContact O-N 3.14Å; V73-G76 PolarHBondContact O-N 3.46Å
74N98.6Very high98.7Very high144 Ų14460.9 Ų60.977%0.7730%0.3SS*.THydrogen-bonded Turntrans-54.5120.1176.2-68.7-41.1000110.9G76N74-G76 PolarHBondContact O-N 3.05Å; N74-G76 VanDerWaalsContact O-N 3.1Å
75Y98.6Very high98.7Very high174 Ų17458 Ų5868%0.68228%0.28SS*.THydrogen-bonded Turntrans57.515-174.6-54.8-78.6000114.7V73 W77 I78 I79V73-Y75 PolarHBondContact O-N 2.81Å; V73-Y75 VanDerWaalsContact O-N 3.14Å; Y75-W77 VanDerWaalsContact C-N 3.3Å; Y75-W77 PolarHBondContact O-N 2.96Å; Y75-I78 HydrophobicContact CD1-CG2 4.37Å; Y75-I78 WeakPolarHBondContact O-CG2 3.4Å; Y75-I78 PolarHBondContact O-N 3.35Å; Y75-I79 WeakPolarHBondContact O-CG1 3.41Å; Y75-I79 PolarHBondContact O-N 2.68Å; Y75-I79 VanDerWaalsContact O-N 3.17Å
76G98.8Very high98.7Very high1 Ų157.5 Ų57.51%0.0128%0.276CS..Hα-helixtrans-65.3-32.7-17900000112.9I69 V73 N74 I78 I79 R80I69-G76 CarbonylContact O-C 3.37Å; I69-G76 WeakPolarHBondContact O-CA 3.37Å; V73-G76 PolarHBondContact O-N 3.46Å; N74-G76 PolarHBondContact O-N 3.05Å; N74-G76 VanDerWaalsContact O-N 3.1Å; G76-I78 PolarHBondContact O-N 3.39Å; G76-I79 PolarHBondContact O-N 3.1Å; G76-R80 WeakPolarHBondContact O-CB 3.32Å; G76-R80 PolarHBondContact O-N 2.88Å
77W98.6Very high98.7Very high106 Ų10657.2 Ų57.240%0.40228%0.278SS..Hα-helixtrans-58-47.4173.169.3-90.5000112.5T70 Y75 R80 Y81 L244T70-W77 HydrophobicContact CG2-CB 3.94Å; T70-W77 WeakPolarHBondContact O-CB 3.39Å; Y75-W77 VanDerWaalsContact C-N 3.3Å; Y75-W77 PolarHBondContact O-N 2.96Å; W77-R80 PolarHBondContact O-N 2.81Å; W77-Y81 HydrophobicContact CE3-CD2 4.09Å; W77-Y81 WeakPolarHBondContact O-CD2 3.36Å; W77-Y81 PolarHBondContact O-N 3.43Å; W77-L244 HydrophobicContact CH2-CD2 3.9Å; W77-L244 HydrophobicContact CZ3-CD2 4.23Å
78I98.7Very high98.7Very high33 Ų3355.8 Ų55.817%0.16927%0.265CS..Hα-helixtrans-71.8-37-177.5-172.4168.7000110.7Y75 G76 R80 Y81 L82 M240 T243 L244Y75-I78 HydrophobicContact CD1-CG2 4.37Å; Y75-I78 WeakPolarHBondContact O-CG2 3.4Å; Y75-I78 PolarHBondContact O-N 3.35Å; G76-I78 PolarHBondContact O-N 3.39Å; I78-R80 VanDerWaalsContact C-N 3.35Å; I78-R80 PolarHBondContact O-N 3.38Å; I78-Y81 PolarHBondContact O-N 3.47Å; I78-L82 HydrophobicContact CG1-CD1 4.1Å; I78-L82 HydrophobicContact CG1-CG 4.21Å; I78-L82 VanDerWaalsContact O-CB 3.27Å; I78-L82 WeakPolarHBondContact O-CB 3.34Å; I78-L82 WeakPolarHBondContact O-CG 3.33Å; I78-L82 PolarHBondContact O-N 2.93Å; I78-M240 HydrophobicContact CD1-CE 4.23Å; I78-T243 HydrophobicContact CG1-CG2 4.26Å; I78-L244 HydrophobicContact CD1-CD2 3.98Å
79I98.8Very high98.7Very high39 Ų3952.8 Ų52.820%0.225%0.252CS..Hα-helixtrans-62.2-44.4174.1-61.7169.9000110.3T47 F50 L51 Y75 G76 L82 H83T47-I79 HydrophobicContact CG2-CG2 4.27Å; F50-I79 HydrophobicContact CB-CD1 4.35Å; F50-I79 HydrophobicContact CB-CG2 4.19Å; L51-I79 HydrophobicContact CD2-CG2 3.97Å; L51-I79 HydrophobicContact CG-CG2 3.89Å; Y75-I79 WeakPolarHBondContact O-CG1 3.41Å; Y75-I79 PolarHBondContact O-N 2.68Å; Y75-I79 VanDerWaalsContact O-N 3.17Å; G76-I79 PolarHBondContact O-N 3.1Å; I79-L82 PolarHBondContact O-N 3.27Å; I79-H83 WeakPolarHBondContact O-CB 3.49Å; I79-H83 PolarHBondContact O-N 3.39Å
80R98.8Very high98.8Very high42 Ų4253.6 Ų53.616%0.15826%0.255CS..Hα-helixtrans-59.5-49.8176.5179.4-176175.7-100.32.6111.4L51 I69 T70 G76 W77 I78 H83 A84 Y256L51-R80 HydrophobicContact CD2-CB 4.1Å; I69-R80 HydrophobicContact CG2-CB 4.47Å; T70-R80 WeakPolarHBondContact OG1-CD 3.31Å; G76-R80 WeakPolarHBondContact O-CB 3.32Å; G76-R80 PolarHBondContact O-N 2.88Å; W77-R80 PolarHBondContact O-N 2.81Å; I78-R80 VanDerWaalsContact C-N 3.35Å; I78-R80 PolarHBondContact O-N 3.38Å; R80-H83 WeakPolarHBondContact O-CB 3.32Å; R80-H83 PolarHBondContact O-N 2.96Å; R80-A84 PolarHBondContact O-N 3.38Å; R80-Y256 PolarHBondContact NH1-OH 3Å; R80-Y256 VanDerWaalsContact NH1-OH 3.16Å
81Y98.8Very high98.8Very high30 Ų3052.1 Ų52.112%0.11825%0.246CC..Hα-helixtrans-72.5-31.9-178-70.7-60.2000113.1W77 I78 H83 A84 N85 P247 Y256W77-Y81 HydrophobicContact CE3-CD2 4.09Å; W77-Y81 WeakPolarHBondContact O-CD2 3.36Å; W77-Y81 PolarHBondContact O-N 3.43Å; I78-Y81 PolarHBondContact O-N 3.47Å; Y81-H83 VanDerWaalsContact C-N 3.3Å; Y81-A84 PolarHBondContact O-N 2.88Å; Y81-N85 VanDerWaalsContact O-CB 3.24Å; Y81-N85 WeakPolarHBondContact O-CB 3.33Å; Y81-N85 PolarHBondContact O-N 3.49Å; Y81-N85 PolarHBondContact O-ND2 2.73Å; Y81-P247 HydrophobicContact CD1-CB 3.55Å; Y81-P247 HydrophobicContact CD2-CB 4.04Å; Y81-P247 HydrophobicContact CE1-CB 3.75Å; Y81-P247 HydrophobicContact CE2-CB 4.21Å; Y81-P247 HydrophobicContact CG-CB 3.71Å; Y81-Y256 PolarHBondContact OH-OH 2.57Å
82L98.9Very high98.8Very high29 Ų2945 Ų4515%0.15222%0.223CC..Hα-helixtrans-61.1-41.4168.7-78172.9000111.1T47 I78 I79 G86 L239 M240 T243T47-L82 HydrophobicContact CG2-CB 4.1Å; I78-L82 HydrophobicContact CG1-CD1 4.1Å; I78-L82 HydrophobicContact CG1-CG 4.21Å; I78-L82 VanDerWaalsContact O-CB 3.27Å; I78-L82 WeakPolarHBondContact O-CB 3.34Å; I78-L82 WeakPolarHBondContact O-CG 3.33Å; I78-L82 PolarHBondContact O-N 2.93Å; I79-L82 PolarHBondContact O-N 3.27Å; L82-G86 WeakPolarHBondContact O-CA 3.5Å; L82-G86 PolarHBondContact O-N 2.99Å; L82-L239 HydrophobicContact CD2-CD2 3.91Å; L82-L239 HydrophobicContact CD2-CG 4.04Å; L82-M240 HydrophobicContact CD2-SD 3.83Å; L82-T243 HydrophobicContact CD2-CG2 4.17Å; L82-T243 HydrophobicContact CG-CG2 4.16Å
83H98.9Very high98.8Very high33 Ų3339.9 Ų39.915%0.15320%0.196CC..Hα-helixtrans-67.9-44.2177.7-164.982.7000112.3Q44 T47 G48 L51 I79 R80 Y81 A87 H182Q44-H83 PolarHBondContact NE2-O 3.48Å; Q44-H83 PolarHBondContact O-CE1 2.84Å; Q44-H83 VanDerWaalsContact O-CE1 3.26Å; Q44-H83 PolarHBondContact O-ND1 3.46Å; Q44-H83 PolarHBondContact OE1-O 3.36Å; T47-H83 PolarHBondContact OG1-ND1 2.91Å; G48-H83 VanDerWaalsContact CA-CE1 3.44Å; G48-H83 WeakPolarHBondContact CA-CE1 3.48Å; G48-H83 PolarHBondContact N-ND1 3.47Å; L51-H83 HydrophobicContact CD1-CB 3.51Å; I79-H83 WeakPolarHBondContact O-CB 3.49Å; I79-H83 PolarHBondContact O-N 3.39Å; R80-H83 WeakPolarHBondContact O-CB 3.32Å; R80-H83 PolarHBondContact O-N 2.96Å; Y81-H83 VanDerWaalsContact C-N 3.3Å; H83-A87 PolarHBondContact O-N 3.13Å; H83-A87 VanDerWaalsContact O-N 3.14Å; H83-H182 AromaticContact NE2-NE2 3.96Å
84A98.8Very high98.8Very high51 Ų5139.4 Ų39.442%0.42119%0.192SC..Hα-helixtrans-68.9-51.6-179.800000112.3R80 Y81 G86 A87 S88R80-A84 PolarHBondContact O-N 3.38Å; Y81-A84 PolarHBondContact O-N 2.88Å; A84-G86 VanDerWaalsContact C-N 3.35Å; A84-A87 WeakPolarHBondContact O-CB 3.47Å; A84-A87 PolarHBondContact O-N 3.1Å; A84-S88 PolarHBondContact O-N 3.07Å
85N98.9Very high98.8Very high5 Ų535.6 Ų35.63%0.02717%0.169CC..Hα-helixtrans-71.9-31.4178.3-71-52.7000111.9Y81 A87 S88 M89 L239 L242 P247Y81-N85 VanDerWaalsContact O-CB 3.24Å; Y81-N85 WeakPolarHBondContact O-CB 3.33Å; Y81-N85 PolarHBondContact O-N 3.49Å; Y81-N85 PolarHBondContact O-ND2 2.73Å; N85-A87 VanDerWaalsContact C-N 3.29Å; N85-A87 PolarHBondContact O-N 3.48Å; N85-S88 WeakPolarHBondContact O-CB 3.38Å; N85-S88 PolarHBondContact O-N 3.45Å; N85-S88 VanDerWaalsContact O-N 3.15Å; N85-M89 WeakPolarHBondContact O-CG 3.23Å; N85-M89 PolarHBondContact O-N 3.41Å; N85-L239 HydrophobicContact CB-CD1 3.9Å; N85-L242 HydrophobicContact CB-CD2 3.75Å; N85-L242 HydrophobicContact CB-CG 4.13Å; N85-L242 WeakPolarHBondContact OD1-CD2 2.98Å; N85-P247 PolarHBondContact ND2-O 2.85Å; N85-P247 PolarHBondContact OD1-O 3.44Å
86G98.9Very high98.8Very high0 Ų030.4 Ų30.40%015%0.153CC..Hα-helixtrans-60.3-36.4172.100000112.6Q44 L82 A84 M89 F90Q44-G86 VanDerWaalsContact OE1-CA 3.3Å; L82-G86 WeakPolarHBondContact O-CA 3.5Å; L82-G86 PolarHBondContact O-N 2.99Å; A84-G86 VanDerWaalsContact C-N 3.35Å; G86-M89 PolarHBondContact O-N 2.91Å; G86-F90 WeakPolarHBondContact O-CB 3.41Å; G86-F90 PolarHBondContact O-N 3.37Å
87A98.8Very high98.8Very high20 Ų2032.1 Ų32.117%0.16516%0.16CC..Hα-helixtrans-62.3-43.7172.300000111.9H83 A84 N85 F90 F91H83-A87 PolarHBondContact O-N 3.13Å; H83-A87 VanDerWaalsContact O-N 3.14Å; A84-A87 WeakPolarHBondContact O-CB 3.47Å; A84-A87 PolarHBondContact O-N 3.1Å; N85-A87 VanDerWaalsContact C-N 3.29Å; N85-A87 PolarHBondContact O-N 3.48Å; A87-F90 VanDerWaalsContact O-CB 3.26Å; A87-F90 WeakPolarHBondContact O-CB 3.44Å; A87-F90 PolarHBondContact O-N 3.48Å; A87-F91 WeakPolarHBondContact O-CD2 3.37Å; A87-F91 PolarHBondContact O-N 3.06Å; A87-F91 VanDerWaalsContact O-N 3.15Å
88S98.8Very high98.8Very high4 Ų428.5 Ų28.53%0.02815%0.149CC..Hα-helixtrans-61.9-45173.6-73.60000112A84 N85 F90 F91 I92 W272A84-S88 PolarHBondContact O-N 3.07Å; N85-S88 WeakPolarHBondContact O-CB 3.38Å; N85-S88 PolarHBondContact O-N 3.45Å; N85-S88 VanDerWaalsContact O-N 3.15Å; S88-F90 PolarHBondContact O-N 2.82Å; S88-F91 PolarHBondContact O-N 3.5Å; S88-F91 VanDerWaalsContact O-N 3.13Å; S88-I92 WeakPolarHBondContact O-CG1 3.29Å; S88-I92 PolarHBondContact O-N 3.26Å; S88-W272 WeakPolarHBondContact O-CZ2 3.2Å; S88-W272 PolarHBondContact OG-NE1 2.97Å
89M98.8Very high98.9Very high19 Ų1927.4 Ų27.49%0.09415%0.145CC..Hα-helixtrans-62.6-32.8176.7-67.9-58.2-64.300112.4N85 G86 I92 C93 F235 S238 L239N85-M89 WeakPolarHBondContact O-CG 3.23Å; N85-M89 PolarHBondContact O-N 3.41Å; G86-M89 PolarHBondContact O-N 2.91Å; M89-I92 PolarHBondContact O-N 3.41Å; M89-I92 HydrophobicContact SD-CD1 3.92Å; M89-C93 WeakPolarHBondContact O-CB 3.36Å; M89-C93 PolarHBondContact O-N 2.86Å; M89-C93 PolarHBondContact O-SG 2.87Å; M89-F235 HydrophobicContact CB-CE2 3.69Å; M89-F235 HydrophobicContact CB-CZ 4.07Å; M89-F235 HydrophobicContact CE-CD2 3.87Å; M89-F235 HydrophobicContact CE-CE2 3.97Å; M89-F235 HydrophobicContact CG-CE2 4.42Å; M89-S238 WeakPolarHBondContact CE-OG 3.36Å; M89-L239 HydrophobicContact CG-CB 4.35Å; M89-L239 HydrophobicContact CG-CD1 3.9Å
90F98.9Very high98.9Very high18 Ų1826.7 Ų26.78%0.07914%0.14CC..Hα-helixtrans-59.9-50.5171.8-154-38000110.3L37 C40 L41 Q44 G86 A87 S88 I92 C93 L94 T123L37-F90 HydrophobicContact CD2-CD1 3.5Å; L37-F90 VanDerWaalsContact CD2-CD1 3.5Å; L37-F90 HydrophobicContact CD2-CE1 3.51Å; C40-F90 HydrophobicContact CB-CB 4.05Å; C40-F90 HydrophobicContact CB-CD1 4.22Å; C40-F90 HydrophobicContact CB-CD2 3.64Å; C40-F90 HydrophobicContact CB-CE2 4.11Å; C40-F90 HydrophobicContact CB-CG 3.69Å; L41-F90 HydrophobicContact CB-CE2 4.13Å; L41-F90 HydrophobicContact CB-CZ 4.24Å; L41-F90 HydrophobicContact CD1-CE2 4.24Å; L41-F90 HydrophobicContact CD1-CZ 4.48Å; Q44-F90 HydrophobicContact CG-CD2 3.94Å; Q44-F90 HydrophobicContact CG-CE2 4.46Å; G86-F90 WeakPolarHBondContact O-CB 3.41Å; G86-F90 PolarHBondContact O-N 3.37Å; A87-F90 VanDerWaalsContact O-CB 3.26Å; A87-F90 WeakPolarHBondContact O-CB 3.44Å; A87-F90 PolarHBondContact O-N 3.48Å; S88-F90 PolarHBondContact O-N 2.82Å; F90-I92 PolarHBondContact O-N 2.88Å; F90-C93 PolarHBondContact O-N 3.3Å; F90-L94 HydrophobicContact CD1-CD1 3.8Å; F90-L94 HydrophobicContact CD1-CG 3.89Å; F90-L94 HydrophobicContact CE1-CD1 4Å; F90-L94 HydrophobicContact CE1-CD2 4.4Å; F90-L94 HydrophobicContact CE1-CG 4.05Å; F90-L94 PolarHBondContact O-N 2.88Å; F90-T123 HydrophobicContact CD1-CG2 4.19Å; F90-T123 HydrophobicContact CE1-CG2 4.02Å; F90-T123 HydrophobicContact CE2-CG2 4.47Å; F90-T123 HydrophobicContact CG-CG2 4.5Å; F90-T123 HydrophobicContact CZ-CG2 4.18Å
91F98.9Very high98.9Very high2 Ų224.9 Ų24.91%0.00914%0.135CC..Hα-helixtrans-66.2-37.1178.9-82.5-80.4000113.5A87 S88 C93 L94 F95 T123 M124 A127 W272 Y273A87-F91 WeakPolarHBondContact O-CD2 3.37Å; A87-F91 PolarHBondContact O-N 3.06Å; A87-F91 VanDerWaalsContact O-N 3.15Å; S88-F91 PolarHBondContact O-N 3.5Å; S88-F91 VanDerWaalsContact O-N 3.13Å; F91-C93 VanDerWaalsContact C-N 3.33Å; F91-C93 PolarHBondContact O-N 3.2Å; F91-L94 HydrophobicContact CD1-CD1 4.16Å; F91-L94 HydrophobicContact CE1-CD1 4.25Å; F91-L94 PolarHBondContact O-N 2.88Å; F91-F95 HydrophobicContact CB-CD2 4.46Å; F91-F95 HydrophobicContact CB-CE2 4Å; F91-F95 HydrophobicContact CB-CZ 4.42Å; F91-F95 HydrophobicContact CD1-CE1 4.31Å; F91-F95 HydrophobicContact CD1-CE2 4.24Å; F91-F95 AromaticContact CD1-CZ 3.8Å; F91-F95 HydrophobicContact CD1-CZ 3.8Å; F91-F95 WeakPolarHBondContact O-CD2 3.29Å; F91-F95 VanDerWaalsContact O-CG 3.28Å; F91-F95 WeakPolarHBondContact O-CG 3.36Å; F91-F95 PolarHBondContact O-N 3.2Å; F91-T123 HydrophobicContact CE2-CG2 4.39Å; F91-T123 HydrophobicContact CZ-CG2 4.13Å; F91-M124 HydrophobicContact CE1-CG 3.81Å; F91-M124 HydrophobicContact CZ-CG 4.14Å; F91-A127 HydrophobicContact CE2-CB 3.48Å; F91-A127 VanDerWaalsContact CE2-CB 3.48Å; F91-A127 HydrophobicContact CZ-CB 3.86Å; F91-W272 HydrophobicContact CB-CH2 4.1Å; F91-W272 HydrophobicContact CB-CZ2 4.13Å; F91-Y273 HydrophobicContact CB-CD1 4.22Å; F91-Y273 HydrophobicContact CB-CG 3.95Å; F91-Y273 AromaticContact CD1-CD2 3.95Å; F91-Y273 HydrophobicContact CD1-CD2 3.95Å; F91-Y273 AromaticContact CD1-CG 4Å; F91-Y273 HydrophobicContact CD1-CG 4Å; F91-Y273 AromaticContact CD2-CD1 3.76Å; F91-Y273 HydrophobicContact CD2-CD1 3.76Å; F91-Y273 AromaticContact CD2-CD2 3.51Å; F91-Y273 HydrophobicContact CD2-CD2 3.51Å; F91-Y273 HydrophobicContact CD2-CE1 4.06Å; F91-Y273 AromaticContact CD2-CE2 3.77Å; F91-Y273 HydrophobicContact CD2-CE2 3.77Å; F91-Y273 AromaticContact CD2-CG 3.5Å; F91-Y273 HydrophobicContact CD2-CG 3.5Å; F91-Y273 AromaticContact CE1-CD2 3.9Å; F91-Y273 HydrophobicContact CE1-CD2 3.9Å; F91-Y273 HydrophobicContact CE1-CG 4.42Å; F91-Y273 HydrophobicContact CE2-CD1 4.42Å; F91-Y273 AromaticContact CE2-CD2 3.47Å; F91-Y273 HydrophobicContact CE2-CD2 3.47Å; F91-Y273 VanDerWaalsContact CE2-CD2 3.47Å; F91-Y273 HydrophobicContact CE2-CE1 4.44Å; F91-Y273 AromaticContact CE2-CE2 3.43Å; F91-Y273 HydrophobicContact CE2-CE2 3.43Å; F91-Y273 VanDerWaalsContact CE2-CE2 3.43Å; F91-Y273 AromaticContact CE2-CG 3.99Å; F91-Y273 HydrophobicContact CE2-CG 3.99Å; F91-Y273 AromaticContact CE2-CZ 3.98Å; F91-Y273 HydrophobicContact CG-CD1 4.06Å; F91-Y273 AromaticContact CG-CD2 3.77Å; F91-Y273 HydrophobicContact CG-CD2 3.77Å; F91-Y273 HydrophobicContact CG-CE2 4.47Å; F91-Y273 AromaticContact CG-CG 3.52Å; F91-Y273 HydrophobicContact CG-CG 3.52Å; F91-Y273 AromaticContact CZ-CD2 3.67Å; F91-Y273 HydrophobicContact CZ-CD2 3.67Å; F91-Y273 AromaticContact CZ-CE2 3.87Å; F91-Y273 HydrophobicContact CZ-CE2 3.87Å; F91-Y273 HydrophobicContact CZ-CG 4.42Å
92I98.9Very high98.9Very high60 Ų6024.7 Ų24.731%0.30814%0.136SC..Hα-helixtrans-57.3-50.1171.3-66.9169.1000109.6S88 M89 F90 L94 F95 L96 W272S88-I92 WeakPolarHBondContact O-CG1 3.29Å; S88-I92 PolarHBondContact O-N 3.26Å; M89-I92 PolarHBondContact O-N 3.41Å; M89-I92 HydrophobicContact SD-CD1 3.92Å; F90-I92 PolarHBondContact O-N 2.88Å; I92-L94 VanDerWaalsContact C-N 3.33Å; I92-L94 PolarHBondContact O-N 3.44Å; I92-F95 PolarHBondContact O-N 3.16Å; I92-L96 HydrophobicContact CG2-CD1 3.9Å; I92-L96 VanDerWaalsContact O-CG 3.27Å; I92-L96 WeakPolarHBondContact O-CG 3.49Å; I92-L96 PolarHBondContact O-N 3.39Å; I92-L96 VanDerWaalsContact O-N 3.08Å; I92-W272 HydrophobicContact CD1-CH2 4.49Å; I92-W272 HydrophobicContact CD1-CZ2 4.29Å; I92-W272 HydrophobicContact CG1-CH2 3.55Å; I92-W272 HydrophobicContact CG1-CZ2 3.71Å
93C98.9Very high98.9Very high2 Ų225 Ų251%0.01414%0.135CC..Hα-helixtrans-62-39.1177.7-66.90000112.2F33 L37 M89 F90 F91 H97F33-C93 HydrophobicContact CD1-CB 4.08Å; L37-C93 HydrophobicContact CD2-CB 3.62Å; L37-C93 HydrophobicContact CG-CB 3.98Å; M89-C93 WeakPolarHBondContact O-CB 3.36Å; M89-C93 PolarHBondContact O-N 2.86Å; M89-C93 PolarHBondContact O-SG 2.87Å; F90-C93 PolarHBondContact O-N 3.3Å; F91-C93 VanDerWaalsContact C-N 3.33Å; F91-C93 PolarHBondContact O-N 3.2Å; C93-H97 WeakPolarHBondContact O-CB 3.45Å; C93-H97 PolarHBondContact O-N 3.45Å
94L98.8Very high98.9Very high15 Ų1524.5 Ų24.58%0.07913%0.132CC..Hα-helixtrans-63.4-50.4178.6-84.7170.9000111L37 F90 F91 I92 L96 H97 I98 L120 T123L37-L94 HydrophobicContact CD1-CD2 4.02Å; L37-L94 HydrophobicContact CD2-CB 4.32Å; L37-L94 HydrophobicContact CD2-CD2 3.79Å; L37-L94 HydrophobicContact CD2-CG 3.59Å; F90-L94 HydrophobicContact CD1-CD1 3.8Å; F90-L94 HydrophobicContact CD1-CG 3.89Å; F90-L94 HydrophobicContact CE1-CD1 4Å; F90-L94 HydrophobicContact CE1-CD2 4.4Å; F90-L94 HydrophobicContact CE1-CG 4.05Å; F90-L94 PolarHBondContact O-N 2.88Å; F91-L94 HydrophobicContact CD1-CD1 4.16Å; F91-L94 HydrophobicContact CE1-CD1 4.25Å; F91-L94 PolarHBondContact O-N 2.88Å; I92-L94 VanDerWaalsContact C-N 3.33Å; I92-L94 PolarHBondContact O-N 3.44Å; L94-L96 VanDerWaalsContact C-N 3.33Å; L94-L96 PolarHBondContact O-N 3.33Å; L94-H97 WeakPolarHBondContact O-CB 3.36Å; L94-H97 PolarHBondContact O-N 3.16Å; L94-I98 VanDerWaalsContact O-CG1 3.27Å; L94-I98 WeakPolarHBondContact O-CG1 3.2Å; L94-I98 PolarHBondContact O-N 3.37Å; L94-L120 HydrophobicContact CD1-CD1 4.36Å; L94-T123 HydrophobicContact CD1-CG2 3.72Å
95F98.9Very high98.8Very high64 Ų6422 Ų2228%0.28111%0.112SC..Hα-helixtrans-63.8-39.4-178.8-62.4-38.2000111.8F91 I92 I98 G99 W272 Y273 F276F91-F95 HydrophobicContact CB-CD2 4.46Å; F91-F95 HydrophobicContact CB-CE2 4Å; F91-F95 HydrophobicContact CB-CZ 4.42Å; F91-F95 HydrophobicContact CD1-CE1 4.31Å; F91-F95 HydrophobicContact CD1-CE2 4.24Å; F91-F95 AromaticContact CD1-CZ 3.8Å; F91-F95 HydrophobicContact CD1-CZ 3.8Å; F91-F95 WeakPolarHBondContact O-CD2 3.29Å; F91-F95 VanDerWaalsContact O-CG 3.28Å; F91-F95 WeakPolarHBondContact O-CG 3.36Å; F91-F95 PolarHBondContact O-N 3.2Å; I92-F95 PolarHBondContact O-N 3.16Å; F95-I98 PolarHBondContact O-N 3.19Å; F95-G99 PolarHBondContact O-N 2.95Å; F95-W272 HydrophobicContact CD2-CH2 4.17Å; F95-W272 HydrophobicContact CD2-CZ3 4.12Å; F95-W272 HydrophobicContact CE2-CH2 4Å; F95-W272 AromaticContact CE2-CZ3 3.81Å; F95-W272 HydrophobicContact CE2-CZ3 3.81Å; F95-Y273 WeakPolarHBondContact CZ-O 3.33Å; F95-F276 HydrophobicContact CE1-CE1 4.41Å; F95-F276 HydrophobicContact CZ-CE1 4.31Å
96L98.9Very high98.8Very high65 Ų6522.9 Ų22.934%0.3412%0.118SC..Hα-helixtrans-69.2-36.3175-62.7176000112.1W30 F33 I92 L94 G99 R100W30-L96 HydrophobicContact CZ3-CD2 4.14Å; F33-L96 HydrophobicContact CD1-CB 4.06Å; F33-L96 HydrophobicContact CD1-CD1 4.38Å; F33-L96 HydrophobicContact CD2-CB 3.9Å; F33-L96 HydrophobicContact CE1-CB 3.91Å; F33-L96 HydrophobicContact CE1-CD1 3.48Å; F33-L96 VanDerWaalsContact CE1-CD1 3.48Å; F33-L96 HydrophobicContact CE1-CG 4.33Å; F33-L96 HydrophobicContact CE2-CB 3.76Å; F33-L96 HydrophobicContact CE2-CD1 4.07Å; F33-L96 HydrophobicContact CG-CB 4.07Å; F33-L96 HydrophobicContact CZ-CB 3.78Å; F33-L96 HydrophobicContact CZ-CD1 3.3Å; F33-L96 HydrophobicContact CZ-CG 4.15Å; I92-L96 HydrophobicContact CG2-CD1 3.9Å; I92-L96 VanDerWaalsContact O-CG 3.27Å; I92-L96 WeakPolarHBondContact O-CG 3.49Å; I92-L96 PolarHBondContact O-N 3.39Å; I92-L96 VanDerWaalsContact O-N 3.08Å; L94-L96 VanDerWaalsContact C-N 3.33Å; L94-L96 PolarHBondContact O-N 3.33Å; L96-G99 PolarHBondContact O-N 2.83Å; L96-R100 WeakPolarHBondContact O-CB 3.41Å; L96-R100 PolarHBondContact O-N 3.41Å
97H98.9Very high98.8Very high37 Ų3723.4 Ų23.417%0.17112%0.12CC..Hα-helixtrans-64.9-43.2174.7-168.199.7000112.3F33 G34 L37 C93 L94 R100 G101F33-H97 HydrophobicContact CB-CB 3.9Å; G34-H97 PolarHBondContact N-ND1 3.12Å; L37-H97 HydrophobicContact CD1-CB 3.78Å; C93-H97 WeakPolarHBondContact O-CB 3.45Å; C93-H97 PolarHBondContact O-N 3.45Å; L94-H97 WeakPolarHBondContact O-CB 3.36Å; L94-H97 PolarHBondContact O-N 3.16Å; H97-R100 PolarHBondContact CE1-NH2 2.89Å; H97-R100 PolarHBondContact ND1-NH2 2.88Å; H97-R100 PolarHBondContact NE2-NH2 3.19Å; H97-G101 PolarHBondContact O-N 2.76Å; H97-G101 VanDerWaalsContact O-N 3.09Å
98I98.9Very high98.8Very high30 Ų3025.7 Ų25.715%0.15413%0.129CC..Hα-helixtrans-65.9-47.1175.1-66.9163.7000109.9L94 F95 R100 G101 L102 W113 L120 L301L94-I98 VanDerWaalsContact O-CG1 3.27Å; L94-I98 WeakPolarHBondContact O-CG1 3.2Å; L94-I98 PolarHBondContact O-N 3.37Å; F95-I98 PolarHBondContact O-N 3.19Å; I98-R100 VanDerWaalsContact C-N 3.33Å; I98-R100 PolarHBondContact O-N 3.39Å; I98-G101 CarbonylContact O-C 3.57Å; I98-G101 WeakPolarHBondContact O-CA 3.41Å; I98-G101 PolarHBondContact O-N 3.39Å; I98-L102 HydrophobicContact CG2-CD1 4.17Å; I98-L102 HydrophobicContact CG2-CG 4.37Å; I98-L102 WeakPolarHBondContact O-CG 3.43Å; I98-L102 PolarHBondContact O-N 2.99Å; I98-W113 HydrophobicContact CG2-CH2 4.17Å; I98-L120 HydrophobicContact CD1-CD1 4.09Å; I98-L120 HydrophobicContact CD1-CD2 3.86Å; I98-L120 HydrophobicContact CD1-CG 4.44Å; I98-L301 HydrophobicContact CG2-CD1 4.43Å; I98-L301 HydrophobicContact CG2-CD2 4.15Å
99G98.9Very high98.8Very high10 Ų1028 Ų2810%0.10314%0.138CC..Hα-helixtrans-57-44.7177.600000112.3F95 L96 G101 L102 Y103 Y325F95-G99 PolarHBondContact O-N 2.95Å; L96-G99 PolarHBondContact O-N 2.83Å; G99-G101 VanDerWaalsContact C-N 3.3Å; G99-G101 PolarHBondContact O-N 3.36Å; G99-L102 PolarHBondContact O-N 3.44Å; G99-Y103 WeakPolarHBondContact O-CB 3.43Å; G99-Y103 PolarHBondContact O-N 2.84Å; G99-Y325 WeakPolarHBondContact O-CE2 3.43Å; G99-Y325 PolarHBondContact O-OH 3.03Å
100R98.9Very high98.7Very high24 Ų2429.5 Ų29.59%0.09115%0.15CC..Hα-helixtrans-54.1-48.1169.4178.4-77.5-67.4-97-5.4111W30 W31 L96 H97 I98 L102 Y103 Y104W30-R100 HydrophobicContact CB-CB 4.06Å; W30-R100 HydrophobicContact CB-CG 3.53Å; W31-R100 HydrophobicContact CE3-CG 4.34Å; W31-R100 HydrophobicContact CZ3-CG 4.26Å; L96-R100 WeakPolarHBondContact O-CB 3.41Å; L96-R100 PolarHBondContact O-N 3.41Å; H97-R100 PolarHBondContact CE1-NH2 2.89Å; H97-R100 PolarHBondContact ND1-NH2 2.88Å; H97-R100 PolarHBondContact NE2-NH2 3.19Å; I98-R100 VanDerWaalsContact C-N 3.33Å; I98-R100 PolarHBondContact O-N 3.39Å; R100-L102 VanDerWaalsContact C-N 3.33Å; R100-L102 PolarHBondContact O-N 3.04Å; R100-Y103 PolarHBondContact O-N 3.15Å; R100-Y104 HydrophobicContact CG-CD2 3.77Å; R100-Y104 HydrophobicContact CG-CE2 4.14Å; R100-Y104 WeakPolarHBondContact O-CD2 3.2Å; R100-Y104 PolarHBondContact O-N 3.3Å
101G98.8Very high98.6Very high4 Ų433.4 Ų33.44%0.04117%0.169CC..Hα-helixtrans-61.8-39.4-178.700000113.3H97 I98 G99 G105 S106 F107H97-G101 PolarHBondContact O-N 2.76Å; H97-G101 VanDerWaalsContact O-N 3.09Å; I98-G101 CarbonylContact O-C 3.57Å; I98-G101 WeakPolarHBondContact O-CA 3.41Å; I98-G101 PolarHBondContact O-N 3.39Å; G99-G101 VanDerWaalsContact C-N 3.3Å; G99-G101 PolarHBondContact O-N 3.36Å; G101-G105 CarbonylContact O-C 3.5Å; G101-G105 PolarHBondContact O-N 3.04Å; G101-S106 PolarHBondContact O-N 3.44Å; G101-F107 WeakPolarHBondContact O-CD1 3.43Å
102L98.8Very high98.6Very high27 Ų2734 Ų3414%0.14117%0.173CC..Hα-helixtrans-66.8-49.1174-65.9174.5000111.8I98 G99 R100 G105 F107 W113 L301 I304 Y325I98-L102 HydrophobicContact CG2-CD1 4.17Å; I98-L102 HydrophobicContact CG2-CG 4.37Å; I98-L102 WeakPolarHBondContact O-CG 3.43Å; I98-L102 PolarHBondContact O-N 2.99Å; G99-L102 PolarHBondContact O-N 3.44Å; R100-L102 VanDerWaalsContact C-N 3.33Å; R100-L102 PolarHBondContact O-N 3.04Å; L102-G105 PolarHBondContact O-N 2.95Å; L102-F107 HydrophobicContact CD2-CD1 4.31Å; L102-W113 HydrophobicContact CD2-CH2 3.8Å; L102-W113 HydrophobicContact CD2-CZ2 4Å; L102-W113 HydrophobicContact CG-CH2 4.12Å; L102-L301 HydrophobicContact CD2-CD2 4.4Å; L102-I304 HydrophobicContact CD2-CB 4.47Å; L102-I304 HydrophobicContact CD2-CD1 4.23Å; L102-I304 HydrophobicContact CD2-CG1 4.01Å; L102-I304 HydrophobicContact CD2-CG2 3.88Å; L102-Y325 HydrophobicContact CB-CE2 4.23Å
103Y98.9Very high98.6Very high34 Ų3432.5 Ų32.513%0.13316%0.163CC..Hα-helixtrans-66-42.7-175.4-171.3-89.3000112.8G99 R100 M315 Q322 Y325G99-Y103 WeakPolarHBondContact O-CB 3.43Å; G99-Y103 PolarHBondContact O-N 2.84Å; R100-Y103 PolarHBondContact O-N 3.15Å; Y103-M315 HydrophobicContact CD2-CB 4.27Å; Y103-M315 HydrophobicContact CD2-SD 4.3Å; Y103-M315 HydrophobicContact CE1-CB 4.41Å; Y103-M315 HydrophobicContact CE2-CB 4.18Å; Y103-M315 HydrophobicContact CG-CB 4.45Å; Y103-M315 VanDerWaalsContact O-CB 3.27Å; Y103-M315 WeakPolarHBondContact O-CB 3.44Å; Y103-M315 VanDerWaalsContact O-CG 3.31Å; Y103-M315 WeakPolarHBondContact O-CG 3.46Å; Y103-M315 PolarHBondContact O-N 3.49Å; Y103-Q322 HydrophobicContact CE2-CG 3.94Å; Y103-Q322 VanDerWaalsContact OH-CD 3.23Å; Y103-Q322 WeakPolarHBondContact OH-CG 3.44Å; Y103-Q322 PolarHBondContact OH-OE1 2.98Å; Y103-Y325 AromaticContact CD2-CD1 3.52Å; Y103-Y325 HydrophobicContact CD2-CD1 3.52Å; Y103-Y325 HydrophobicContact CD2-CD2 4.07Å; Y103-Y325 AromaticContact CD2-CE1 3.73Å; Y103-Y325 HydrophobicContact CD2-CE1 3.73Å; Y103-Y325 HydrophobicContact CD2-CE2 4.26Å; Y103-Y325 AromaticContact CD2-CG 3.7Å; Y103-Y325 HydrophobicContact CD2-CG 3.7Å; Y103-Y325 HydrophobicContact CE2-CD1 4.05Å; Y103-Y325 HydrophobicContact CE2-CE1 4.46Å; Y103-Y325 HydrophobicContact CE2-CG 4.43Å
104Y98.8Very high98.6Very high23 Ų2335.8 Ų35.89%0.0918%0.181CC..THydrogen-bonded Turntrans-943.7-176.9-63.9-69000113.8W30 W31 R100 S106 N206 P208 S314W30-Y104 HydrophobicContact CB-CE2 4.25Å; W30-Y104 AromaticContact CD1-CE2 3.8Å; W30-Y104 HydrophobicContact CG-CE2 4.18Å; W31-Y104 HydrophobicContact CH2-CD1 4.15Å; W31-Y104 AromaticContact CH2-CD2 3.57Å; W31-Y104 HydrophobicContact CH2-CD2 3.57Å; W31-Y104 HydrophobicContact CH2-CE2 4.01Å; W31-Y104 AromaticContact CH2-CG 3.63Å; W31-Y104 HydrophobicContact CH2-CG 3.63Å; W31-Y104 AromaticContact CZ3-CD2 3.64Å; W31-Y104 HydrophobicContact CZ3-CD2 3.64Å; W31-Y104 AromaticContact CZ3-CE2 3.61Å; W31-Y104 HydrophobicContact CZ3-CE2 3.61Å; W31-Y104 HydrophobicContact CZ3-CG 4.12Å; R100-Y104 HydrophobicContact CG-CD2 3.77Å; R100-Y104 HydrophobicContact CG-CE2 4.14Å; R100-Y104 WeakPolarHBondContact O-CD2 3.2Å; R100-Y104 PolarHBondContact O-N 3.3Å; Y104-S106 VanDerWaalsContact C-N 3.32Å; Y104-S106 PolarHBondContact O-N 2.91Å; Y104-N206 PolarHBondContact O-ND2 3.49Å; Y104-P208 VanDerWaalsContact CD1-CA 3.48Å; Y104-P208 HydrophobicContact CD1-CB 4.21Å; Y104-P208 WeakPolarHBondContact CD1-O 3.47Å; Y104-P208 VanDerWaalsContact CE1-CA 3.46Å; Y104-P208 HydrophobicContact CE1-CB 3.65Å; Y104-P208 HydrophobicContact CE1-CG 4.4Å; Y104-S314 WeakPolarHBondContact CD1-OG 3.46Å
105G98.6Very high98.6Very high0 Ų036.1 Ų36.10%018%0.182CC..THydrogen-bonded Turntrans67.529.9179.100000113.7G101 L102 F107 L108 Q313G101-G105 CarbonylContact O-C 3.5Å; G101-G105 PolarHBondContact O-N 3.04Å; L102-G105 PolarHBondContact O-N 2.95Å; G105-F107 PolarHBondContact O-N 3.11Å; G105-L108 PolarHBondContact O-N 3.12Å; G105-Q313 PolarHBondContact O-NE2 3Å
106S98.6Very high98.6Very high22 Ų2234.2 Ų34.215%0.15418%0.181CC..G310 helixtrans-72.2-15.1177.3-61.80000112.9G101 Y104 L108 Y109 N206G101-S106 PolarHBondContact O-N 3.44Å; Y104-S106 VanDerWaalsContact C-N 3.32Å; Y104-S106 PolarHBondContact O-N 2.91Å; S106-L108 PolarHBondContact O-N 2.85Å; S106-L108 VanDerWaalsContact O-N 3.15Å; S106-Y109 PolarHBondContact O-N 3.44Å; S106-Y109 VanDerWaalsContact O-N 3.11Å; S106-N206 PolarHBondContact OG-ND2 2.95Å
107F98.6Very high98.6Very high11 Ų1131.8 Ų31.85%0.04817%0.168CC..G310 helixtrans-62.3-14.7173.157.4-106.7000113.5G101 L102 G105 Y109 W113 I304 P305 H308G101-F107 WeakPolarHBondContact O-CD1 3.43Å; L102-F107 HydrophobicContact CD2-CD1 4.31Å; G105-F107 PolarHBondContact O-N 3.11Å; F107-Y109 PolarHBondContact O-N 3.2Å; F107-W113 HydrophobicContact CB-CB 4.44Å; F107-W113 HydrophobicContact CB-CD2 3.33Å; F107-W113 VanDerWaalsContact CB-CE2 3.49Å; F107-W113 HydrophobicContact CB-CE3 3.62Å; F107-W113 HydrophobicContact CB-CG 3.72Å; F107-W113 HydrophobicContact CB-CH2 4.16Å; F107-W113 HydrophobicContact CB-CZ2 3.91Å; F107-W113 HydrophobicContact CB-CZ3 4.03Å; F107-I304 HydrophobicContact CB-CG2 4.32Å; F107-I304 HydrophobicContact CD1-CG2 3.46Å; F107-I304 VanDerWaalsContact CD1-CG2 3.46Å; F107-I304 HydrophobicContact CD2-CG2 3.81Å; F107-I304 HydrophobicContact CE1-CG2 3.56Å; F107-I304 HydrophobicContact CE2-CG2 3.94Å; F107-I304 HydrophobicContact CG-CG2 3.59Å; F107-I304 HydrophobicContact CZ-CG2 3.81Å; F107-P305 HydrophobicContact CB-CG 4.3Å; F107-P305 HydrophobicContact CD2-CB 4.26Å; F107-P305 HydrophobicContact CD2-CG 4.18Å; F107-P305 WeakPolarHBondContact O-CG 3.31Å; F107-H308 HydrophobicContact CE2-CB 3.81Å; F107-H308 AromaticContact CE2-CG 3.92Å; F107-H308 AromaticContact CE2-ND1 3.82Å; F107-H308 HydrophobicContact CZ-CB 4.28Å; F107-H308 AromaticContact CZ-ND1 3.58Å
108L98.3Very high98.6Very high69 Ų6933.9 Ų33.936%0.36118%0.179SC..G310 helixtrans-66.3-17.4173-65.5-177.8000112.9G105 S106 S110 H308 Q313G105-L108 PolarHBondContact O-N 3.12Å; S106-L108 PolarHBondContact O-N 2.85Å; S106-L108 VanDerWaalsContact O-N 3.15Å; L108-S110 VanDerWaalsContact C-N 3.3Å; L108-S110 PolarHBondContact O-N 3.05Å; L108-S110 VanDerWaalsContact O-N 3.12Å; L108-H308 HydrophobicContact CD2-CB 4.31Å; L108-Q313 HydrophobicContact CD1-CB 4.15Å; L108-Q313 HydrophobicContact CD1-CG 3.73Å
109Y98.1Very high98.6Very high51 Ų5133.4 Ų33.420%0.218%0.177CC..SBendtrans-81.581.4165.6-54.9-40.6000109S106 F107 E111 T112 W113 T203 N206S106-Y109 PolarHBondContact O-N 3.44Å; S106-Y109 VanDerWaalsContact O-N 3.11Å; F107-Y109 PolarHBondContact O-N 3.2Å; Y109-E111 PolarHBondContact O-N 2.86Å; Y109-T112 PolarHBondContact O-N 3.07Å; Y109-W113 WeakPolarHBondContact O-CB 3.47Å; Y109-W113 PolarHBondContact O-N 2.95Å; Y109-T203 HydrophobicContact CD1-CG2 4.17Å; Y109-T203 HydrophobicContact CE1-CG2 4.43Å; Y109-N206 HydrophobicContact CE2-CB 3.68Å
110S96.9Very high98.6Very high51 Ų5133.3 Ų33.336%0.35717%0.174SC..Hα-helixtrans-52.5-46.2-167.234.40000114.6L108 W113 N114L108-S110 VanDerWaalsContact C-N 3.3Å; L108-S110 PolarHBondContact O-N 3.05Å; L108-S110 VanDerWaalsContact O-N 3.12Å; S110-W113 PolarHBondContact O-N 3.27Å; S110-N114 VanDerWaalsContact O-CB 3.28Å; S110-N114 WeakPolarHBondContact O-CB 3.41Å; S110-N114 PolarHBondContact O-N 3.27Å; S110-N114 PolarHBondContact O-ND2 2.85Å
111E98.1Very high98.6Very high101 Ų10135 Ų3547%0.47219%0.185SC..Hα-helixtrans-67.1-51.4-176.6-66.181.2170.300109.6Y109 W113 N114 I115 F199Y109-E111 PolarHBondContact O-N 2.86Å; E111-W113 VanDerWaalsContact C-N 3.31Å; E111-W113 PolarHBondContact O-N 2.95Å; E111-N114 PolarHBondContact O-N 2.82Å; E111-I115 WeakPolarHBondContact O-CG1 3.35Å; E111-I115 PolarHBondContact O-N 3.18Å; E111-F199 HydrophobicContact CB-CB 4.04Å; E111-F199 HydrophobicContact CB-CD1 3.64Å; E111-F199 HydrophobicContact CB-CD2 3.98Å; E111-F199 HydrophobicContact CB-CE1 4.01Å; E111-F199 HydrophobicContact CB-CE2 4.3Å; E111-F199 HydrophobicContact CB-CG 3.63Å; E111-F199 HydrophobicContact CB-CZ 4.32Å; E111-F199 HydrophobicContact CG-CD1 4.05Å; E111-F199 HydrophobicContact CG-CE1 4.04Å; E111-F199 HydrophobicContact CG-CZ 4.49Å
112T98.7Very high98.6Very high15 Ų1535.5 Ų35.59%0.09219%0.189CC..Hα-helixtrans-56.5-46.3175.1-53.70000110.7Y109 G116 H196 F199 L200Y109-T112 PolarHBondContact O-N 3.07Å; T112-G116 PolarHBondContact O-N 3.34Å; T112-H196 WeakPolarHBondContact CG2-CE1 3.23Å; T112-H196 PolarHBondContact O-CE1 3.21Å; T112-H196 PolarHBondContact O-ND1 3.15Å; T112-F199 WeakPolarHBondContact OG1-CB 3.37Å; T112-L200 HydrophobicContact CG2-CB 4.17Å; T112-L200 HydrophobicContact CG2-CD1 4.47Å; T112-L200 PolarHBondContact OG1-N 3.28Å
113W98.8Very high98.6Very high27 Ų2734.6 Ų34.610%0.10218%0.184CC..Hα-helixtrans-63.2-48.3179.5-175.9-108.3000112.8I98 L102 F107 Y109 S110 E111 G116 I117 L301I98-W113 HydrophobicContact CG2-CH2 4.17Å; L102-W113 HydrophobicContact CD2-CH2 3.8Å; L102-W113 HydrophobicContact CD2-CZ2 4Å; L102-W113 HydrophobicContact CG-CH2 4.12Å; F107-W113 HydrophobicContact CB-CB 4.44Å; F107-W113 HydrophobicContact CB-CD2 3.33Å; F107-W113 VanDerWaalsContact CB-CE2 3.49Å; F107-W113 HydrophobicContact CB-CE3 3.62Å; F107-W113 HydrophobicContact CB-CG 3.72Å; F107-W113 HydrophobicContact CB-CH2 4.16Å; F107-W113 HydrophobicContact CB-CZ2 3.91Å; F107-W113 HydrophobicContact CB-CZ3 4.03Å; Y109-W113 WeakPolarHBondContact O-CB 3.47Å; Y109-W113 PolarHBondContact O-N 2.95Å; S110-W113 PolarHBondContact O-N 3.27Å; E111-W113 VanDerWaalsContact C-N 3.31Å; E111-W113 PolarHBondContact O-N 2.95Å; W113-G116 CarbonylContact O-C 3.59Å; W113-G116 VanDerWaalsContact O-CA 3.27Å; W113-G116 WeakPolarHBondContact O-CA 3.33Å; W113-G116 PolarHBondContact O-N 3.14Å; W113-I117 PolarHBondContact O-N 2.91Å; W113-L301 HydrophobicContact CH2-CD2 4.43Å; W113-L301 HydrophobicContact CZ2-CB 4.19Å; W113-L301 HydrophobicContact CZ2-CD2 4Å; W113-L301 PolarHBondContact NE1-O 2.92Å
114N98.6Very high98.6Very high72 Ų7233.8 Ų33.839%0.38518%0.182SC..Hα-helixtrans-67.2-39.6-178.7-72.2-33.6000112S110 E111 G116 I117 I118S110-N114 VanDerWaalsContact O-CB 3.28Å; S110-N114 WeakPolarHBondContact O-CB 3.41Å; S110-N114 PolarHBondContact O-N 3.27Å; S110-N114 PolarHBondContact O-ND2 2.85Å; E111-N114 PolarHBondContact O-N 2.82Å; N114-G116 PolarHBondContact O-N 2.95Å; N114-I117 PolarHBondContact O-N 3.37Å; N114-I118 WeakPolarHBondContact O-CG1 3.41Å; N114-I118 PolarHBondContact O-N 2.65Å; N114-I118 VanDerWaalsContact O-N 3.08Å
115I98.8Very high98.6Very high22 Ų2234.6 Ų34.611%0.11319%0.193CC..Hα-helixtrans-62.3-36.2169.4-63.3-59.6000110.5E111 I117 I118 L119 L195 H196 F199E111-I115 WeakPolarHBondContact O-CG1 3.35Å; E111-I115 PolarHBondContact O-N 3.18Å; I115-I117 VanDerWaalsContact C-N 3.34Å; I115-I117 PolarHBondContact O-N 3.19Å; I115-I118 HydrophobicContact CD1-CD1 4.23Å; I115-I118 PolarHBondContact O-N 3.2Å; I115-L119 HydrophobicContact CG2-CD1 4.17Å; I115-L119 HydrophobicContact CG2-CG 4.42Å; I115-L119 WeakPolarHBondContact O-CB 3.28Å; I115-L119 WeakPolarHBondContact O-CG 3.29Å; I115-L119 PolarHBondContact O-N 2.89Å; I115-L195 HydrophobicContact CD1-CD2 3.8Å; I115-L195 HydrophobicContact CD1-CG 4.38Å; I115-L195 HydrophobicContact CG1-CD2 4.41Å; I115-L195 HydrophobicContact CG1-CG 4.47Å; I115-H196 HydrophobicContact CB-CB 4.48Å; I115-H196 HydrophobicContact CG2-CB 3.67Å; I115-F199 HydrophobicContact CG1-CD2 4.01Å; I115-F199 HydrophobicContact CG1-CE2 4.07Å
116G98.8Very high98.6Very high24 Ų2435.2 Ų35.225%0.24720%0.197CC..Hα-helixtrans-58.9-40.3172.700000113.4T112 W113 N114 L119 L120T112-G116 PolarHBondContact O-N 3.34Å; W113-G116 CarbonylContact O-C 3.59Å; W113-G116 VanDerWaalsContact O-CA 3.27Å; W113-G116 WeakPolarHBondContact O-CA 3.33Å; W113-G116 PolarHBondContact O-N 3.14Å; N114-G116 PolarHBondContact O-N 2.95Å; G116-L119 WeakPolarHBondContact O-CB 3.48Å; G116-L119 PolarHBondContact O-N 3.33Å; G116-L120 PolarHBondContact O-N 3.5Å
117I98.8Very high98.6Very high13 Ų1334.8 Ų34.87%0.06720%0.195CC..Hα-helixtrans-65.6-41.9174.4-62.8168.6000110.7W113 N114 I115 L119 L120 L121 L301 A302W113-I117 PolarHBondContact O-N 2.91Å; N114-I117 PolarHBondContact O-N 3.37Å; I115-I117 VanDerWaalsContact C-N 3.34Å; I115-I117 PolarHBondContact O-N 3.19Å; I117-L119 VanDerWaalsContact C-N 3.34Å; I117-L119 PolarHBondContact O-N 2.98Å; I117-L120 WeakPolarHBondContact O-CB 3.34Å; I117-L120 PolarHBondContact O-N 2.85Å; I117-L121 HydrophobicContact CG2-CD1 4.26Å; I117-L121 WeakPolarHBondContact O-CG 3.47Å; I117-L121 PolarHBondContact O-N 3.23Å; I117-L301 HydrophobicContact CD1-CB 3.82Å; I117-L301 HydrophobicContact CG1-CB 3.97Å; I117-A302 HydrophobicContact CD1-CB 3.89Å
118I98.9Very high98.6Very high81 Ų8136.3 Ų36.342%0.41520%0.201SC..Hα-helixtrans-63.5-41.8176.1-63.2169.6000110.6N114 I115 L120 L121 A122 L192N114-I118 WeakPolarHBondContact O-CG1 3.41Å; N114-I118 PolarHBondContact O-N 2.65Å; N114-I118 VanDerWaalsContact O-N 3.08Å; I115-I118 HydrophobicContact CD1-CD1 4.23Å; I115-I118 PolarHBondContact O-N 3.2Å; I118-L120 PolarHBondContact O-N 2.76Å; I118-L121 PolarHBondContact O-N 3.15Å; I118-A122 WeakPolarHBondContact O-CB 3.32Å; I118-A122 PolarHBondContact O-N 3.39Å; I118-L192 HydrophobicContact CG2-CD1 3.85Å; I118-L192 HydrophobicContact CG2-CD2 4.32Å
119L98.9Very high98.6Very high20 Ų2033.9 Ų33.911%0.10519%0.189CC..Hα-helixtrans-59.9-43.7174.2-80167.3000111.9I115 G116 I117 A122 T123 I189 L192 A193 H196I115-L119 HydrophobicContact CG2-CD1 4.17Å; I115-L119 HydrophobicContact CG2-CG 4.42Å; I115-L119 WeakPolarHBondContact O-CB 3.28Å; I115-L119 WeakPolarHBondContact O-CG 3.29Å; I115-L119 PolarHBondContact O-N 2.89Å; G116-L119 WeakPolarHBondContact O-CB 3.48Å; G116-L119 PolarHBondContact O-N 3.33Å; I117-L119 VanDerWaalsContact C-N 3.34Å; I117-L119 PolarHBondContact O-N 2.98Å; L119-A122 PolarHBondContact O-N 2.96Å; L119-T123 WeakPolarHBondContact O-CB 3.45Å; L119-T123 PolarHBondContact O-N 3.46Å; L119-T123 PolarHBondContact O-OG1 2.94Å; L119-I189 HydrophobicContact CD2-CG2 3.82Å; L119-L192 HydrophobicContact CD2-CB 3.55Å; L119-L192 HydrophobicContact CG-CB 4.07Å; L119-A193 HydrophobicContact CD2-CB 4.38Å; L119-H196 HydrophobicContact CD1-CB 3.8Å
120L98.9Very high98.7Very high8 Ų832.2 Ų32.24%0.04219%0.187CC..Hα-helixtrans-58.1-52.4175174.264000110.9L94 I98 G116 I117 I118 A122 T123 M124 I298 L301L94-L120 HydrophobicContact CD1-CD1 4.36Å; I98-L120 HydrophobicContact CD1-CD1 4.09Å; I98-L120 HydrophobicContact CD1-CD2 3.86Å; I98-L120 HydrophobicContact CD1-CG 4.44Å; G116-L120 PolarHBondContact O-N 3.5Å; I117-L120 WeakPolarHBondContact O-CB 3.34Å; I117-L120 PolarHBondContact O-N 2.85Å; I118-L120 PolarHBondContact O-N 2.76Å; L120-A122 PolarHBondContact O-N 3.2Å; L120-T123 PolarHBondContact O-N 3.17Å; L120-M124 HydrophobicContact CD1-CG 4.18Å; L120-M124 HydrophobicContact CD1-SD 3.96Å; L120-M124 HydrophobicContact CG-SD 3.9Å; L120-M124 WeakPolarHBondContact O-CB 3.48Å; L120-M124 VanDerWaalsContact O-CG 3.25Å; L120-M124 WeakPolarHBondContact O-CG 3.44Å; L120-M124 PolarHBondContact O-N 3.37Å; L120-I298 HydrophobicContact CD2-CG2 3.9Å; L120-L301 HydrophobicContact CD2-CD1 3.76Å
121L98.8Very high98.7Very high61 Ų6131.8 Ų31.832%0.31918%0.178SC..Hα-helixtrans-61.1-42.7179.8-70.5170.5000112.3I117 I118 T123 M124 A125 I298 L299I117-L121 HydrophobicContact CG2-CD1 4.26Å; I117-L121 WeakPolarHBondContact O-CG 3.47Å; I117-L121 PolarHBondContact O-N 3.23Å; I118-L121 PolarHBondContact O-N 3.15Å; L121-T123 VanDerWaalsContact C-N 3.34Å; L121-T123 PolarHBondContact O-N 3.13Å; L121-M124 PolarHBondContact O-N 3.27Å; L121-A125 WeakPolarHBondContact O-CB 3.44Å; L121-A125 PolarHBondContact O-N 3.39Å; L121-I298 HydrophobicContact CD2-CD1 4.47Å; L121-I298 HydrophobicContact CD2-CG2 3.8Å; L121-I298 HydrophobicContact CG-CG2 4.46Å; L121-L299 HydrophobicContact CD1-CD2 4.14Å
122A98.9Very high98.8Very high14 Ų1427 Ų2712%0.11616%0.156CC..Hα-helixtrans-64-39.5176.700000111.8I118 L119 L120 A125 T126 I189I118-A122 WeakPolarHBondContact O-CB 3.32Å; I118-A122 PolarHBondContact O-N 3.39Å; L119-A122 PolarHBondContact O-N 2.96Å; L120-A122 PolarHBondContact O-N 3.2Å; A122-A125 PolarHBondContact O-N 2.91Å; A122-T126 WeakPolarHBondContact O-CB 3.46Å; A122-T126 PolarHBondContact O-N 3.39Å; A122-T126 PolarHBondContact O-OG1 2.84Å; A122-I189 HydrophobicContact CB-CD1 4.16Å; A122-I189 HydrophobicContact CB-CG1 3.73Å
123T98.9Very high98.8Very high7 Ų727.1 Ų27.14%0.04316%0.155CC..Hα-helixtrans-69.5-40.6177.9-52.50000111.1F90 F91 L94 L119 L120 L121 T126 A127F90-T123 HydrophobicContact CD1-CG2 4.19Å; F90-T123 HydrophobicContact CE1-CG2 4.02Å; F90-T123 HydrophobicContact CE2-CG2 4.47Å; F90-T123 HydrophobicContact CG-CG2 4.5Å; F90-T123 HydrophobicContact CZ-CG2 4.18Å; F91-T123 HydrophobicContact CE2-CG2 4.39Å; F91-T123 HydrophobicContact CZ-CG2 4.13Å; L94-T123 HydrophobicContact CD1-CG2 3.72Å; L119-T123 WeakPolarHBondContact O-CB 3.45Å; L119-T123 PolarHBondContact O-N 3.46Å; L119-T123 PolarHBondContact O-OG1 2.94Å; L120-T123 PolarHBondContact O-N 3.17Å; L121-T123 VanDerWaalsContact C-N 3.34Å; L121-T123 PolarHBondContact O-N 3.13Å; T123-T126 PolarHBondContact O-N 3.27Å; T123-A127 WeakPolarHBondContact O-CB 3.42Å; T123-A127 PolarHBondContact O-N 3.48Å
124M98.8Very high98.8Very high18 Ų1827 Ų279%0.08916%0.158CC..Hα-helixtrans-58.4-48.9171.8-72.5177.285.800111.8F91 L120 L121 T126 A127 F128 F274 I298F91-M124 HydrophobicContact CE1-CG 3.81Å; F91-M124 HydrophobicContact CZ-CG 4.14Å; L120-M124 HydrophobicContact CD1-CG 4.18Å; L120-M124 HydrophobicContact CD1-SD 3.96Å; L120-M124 HydrophobicContact CG-SD 3.9Å; L120-M124 WeakPolarHBondContact O-CB 3.48Å; L120-M124 VanDerWaalsContact O-CG 3.25Å; L120-M124 WeakPolarHBondContact O-CG 3.44Å; L120-M124 PolarHBondContact O-N 3.37Å; L121-M124 PolarHBondContact O-N 3.27Å; M124-T126 VanDerWaalsContact C-N 3.34Å; M124-T126 PolarHBondContact O-N 3.33Å; M124-A127 PolarHBondContact O-N 3.45Å; M124-F128 WeakPolarHBondContact O-CB 3.34Å; M124-F128 PolarHBondContact O-N 3.11Å; M124-F274 HydrophobicContact CB-CE1 3.82Å; M124-F274 HydrophobicContact CB-CZ 4.24Å; M124-F274 HydrophobicContact CE-CD1 3.63Å; M124-F274 HydrophobicContact CE-CE1 3.49Å; M124-F274 VanDerWaalsContact CE-CE1 3.49Å; M124-F274 HydrophobicContact CG-CE1 3.85Å; M124-F274 WeakPolarHBondContact O-CZ 3.25Å; M124-I298 HydrophobicContact CE-CD1 3.42Å; M124-I298 VanDerWaalsContact CE-CD1 3.42Å; M124-I298 HydrophobicContact CE-CG1 4.2Å; M124-I298 HydrophobicContact SD-CD1 3.86Å; M124-I298 HydrophobicContact SD-CG1 4.48Å; M124-I298 HydrophobicContact SD-CG2 4.44Å
125A98.7Very high98.8Very high40 Ų4024.2 Ų24.233%0.33114%0.142SC..Hα-helixtrans-60.6-44.4176.400000111.8L121 A122 F128 M129 L185L121-A125 WeakPolarHBondContact O-CB 3.44Å; L121-A125 PolarHBondContact O-N 3.39Å; A122-A125 PolarHBondContact O-N 2.91Å; A125-F128 PolarHBondContact O-N 2.81Å; A125-M129 HydrophobicContact CB-CE 4.33Å; A125-M129 VanDerWaalsContact O-CE 3.24Å; A125-M129 WeakPolarHBondContact O-CE 3.43Å; A125-M129 PolarHBondContact O-N 3.39Å; A125-M129 VanDerWaalsContact O-N 3.08Å; A125-L185 HydrophobicContact CB-CD1 4.14Å
126T98.9Very high98.7Very high13 Ų1323.2 Ų23.28%0.0814%0.137CC..Hα-helixtrans-59.9-49.7178.7-57.10000111.3A122 T123 M124 M129 G130 H182 L185 P186 I189A122-T126 WeakPolarHBondContact O-CB 3.46Å; A122-T126 PolarHBondContact O-N 3.39Å; A122-T126 PolarHBondContact O-OG1 2.84Å; T123-T126 PolarHBondContact O-N 3.27Å; M124-T126 VanDerWaalsContact C-N 3.34Å; M124-T126 PolarHBondContact O-N 3.33Å; T126-M129 PolarHBondContact O-N 3.09Å; T126-G130 PolarHBondContact O-N 2.96Å; T126-H182 PolarHBondContact O-CE1 3.38Å; T126-H182 PolarHBondContact O-ND1 2.98Å; T126-L185 HydrophobicContact CG2-CB 4.49Å; T126-L185 WeakPolarHBondContact OG1-CB 3.4Å; T126-L185 WeakPolarHBondContact OG1-CD1 2.98Å; T126-P186 HydrophobicContact CG2-CG 3.89Å; T126-I189 WeakPolarHBondContact OG1-CD1 3.27Å
127A98.8Very high98.7Very high13 Ų1322.6 Ų22.611%0.10713%0.128CC..Hα-helixtrans-67.4-40.5-178.400000112.5F91 T123 M124 G130 Y131 Y273F91-A127 HydrophobicContact CE2-CB 3.48Å; F91-A127 VanDerWaalsContact CE2-CB 3.48Å; F91-A127 HydrophobicContact CZ-CB 3.86Å; T123-A127 WeakPolarHBondContact O-CB 3.42Å; T123-A127 PolarHBondContact O-N 3.48Å; M124-A127 PolarHBondContact O-N 3.45Å; A127-G130 PolarHBondContact O-N 2.74Å; A127-Y131 WeakPolarHBondContact O-CB 3.26Å; A127-Y131 PolarHBondContact O-N 3.27Å; A127-Y273 HydrophobicContact CB-CE2 3.98Å
128F98.7Very high98.6Very high43 Ų4322.1 Ų22.119%0.18913%0.125CC..Hα-helixtrans-56.4-52.3173.8169.4-103.3000111.2M124 A125 G130 Y131 V132 I146 T147 F178 F274M124-F128 WeakPolarHBondContact O-CB 3.34Å; M124-F128 PolarHBondContact O-N 3.11Å; A125-F128 PolarHBondContact O-N 2.81Å; F128-G130 VanDerWaalsContact C-N 3.34Å; F128-G130 PolarHBondContact O-N 2.92Å; F128-Y131 PolarHBondContact O-N 3.43Å; F128-V132 WeakPolarHBondContact O-CG2 3.27Å; F128-V132 PolarHBondContact O-N 2.71Å; F128-I146 HydrophobicContact CD2-CG2 4.38Å; F128-I146 HydrophobicContact CE2-CB 3.76Å; F128-I146 HydrophobicContact CE2-CG1 4.11Å; F128-I146 HydrophobicContact CE2-CG2 3.73Å; F128-I146 HydrophobicContact CZ-CB 4.03Å; F128-I146 HydrophobicContact CZ-CG2 3.93Å; F128-T147 HydrophobicContact CE1-CG2 4.22Å; F128-T147 HydrophobicContact CZ-CG2 4.08Å; F128-F178 AromaticContact CE1-CE2 3.9Å; F128-F178 HydrophobicContact CE1-CE2 3.9Å; F128-F178 HydrophobicContact CE1-CZ 4.19Å; F128-F178 HydrophobicContact CZ-CE2 4.47Å; F128-F274 HydrophobicContact CB-CE2 4.28Å; F128-F274 HydrophobicContact CB-CZ 4.18Å
129M98.7Very high98.6Very high18 Ų1818.3 Ų18.39%0.08911%0.106CC..Hα-helixtrans-66.1-37.4179.7-69.6-178-72.700112.4A125 T126 Y131 V132 L133 F178 F181 H182 L185A125-M129 HydrophobicContact CB-CE 4.33Å; A125-M129 VanDerWaalsContact O-CE 3.24Å; A125-M129 WeakPolarHBondContact O-CE 3.43Å; A125-M129 PolarHBondContact O-N 3.39Å; A125-M129 VanDerWaalsContact O-N 3.08Å; T126-M129 PolarHBondContact O-N 3.09Å; M129-Y131 VanDerWaalsContact C-N 3.28Å; M129-Y131 PolarHBondContact O-N 3.03Å; M129-V132 WeakPolarHBondContact O-CB 3.2Å; M129-V132 PolarHBondContact O-N 3.07Å; M129-V132 VanDerWaalsContact O-N 3.09Å; M129-L133 WeakPolarHBondContact O-CG 3.45Å; M129-F178 HydrophobicContact CB-CB 4.25Å; M129-F178 HydrophobicContact CB-CD2 4.4Å; M129-F178 HydrophobicContact CB-CG 4.34Å; M129-F178 HydrophobicContact CG-CB 4.33Å; M129-F178 HydrophobicContact CG-CD1 4.19Å; M129-F178 HydrophobicContact CG-CD2 4.04Å; M129-F178 HydrophobicContact CG-CE2 4.4Å; M129-F178 HydrophobicContact CG-CG 3.94Å; M129-F178 HydrophobicContact SD-CD1 4.11Å; M129-F178 HydrophobicContact SD-CG 4.33Å; M129-F181 HydrophobicContact CE-CB 3.77Å; M129-F181 HydrophobicContact SD-CB 3.47Å; M129-F181 WeakPolarHBondContact SD-CB 3.48Å; M129-F181 HydrophobicContact SD-CD2 4.48Å; M129-F181 HydrophobicContact SD-CG 4.32Å; M129-H182 HydrophobicContact CB-CB 4.1Å; M129-L185 HydrophobicContact CE-CD1 3.23Å; M129-L185 HydrophobicContact CE-CG 4.44Å
130G98.6Very high98.5Very high16 Ų1617.8 Ų17.817%0.16510%0.103CC..Hα-helixtrans-59.7-39.1175.100000112.5T126 A127 F128 V132 L133 P134 H182T126-G130 PolarHBondContact O-N 2.96Å; A127-G130 PolarHBondContact O-N 2.74Å; F128-G130 VanDerWaalsContact C-N 3.34Å; F128-G130 PolarHBondContact O-N 2.92Å; G130-V132 PolarHBondContact O-N 3.1Å; G130-L133 WeakPolarHBondContact O-CB 3.33Å; G130-L133 WeakPolarHBondContact O-CG 3.36Å; G130-L133 PolarHBondContact O-N 3.23Å; G130-P134 WeakPolarHBondContact O-CD 3.26Å; G130-H182 WeakPolarHBondContact CA-CE1 3.49Å; G130-H182 VanDerWaalsContact CA-ND1 3.27Å; G130-H182 WeakPolarHBondContact CA-ND1 3.33Å; G130-H182 PolarHBondContact N-ND1 2.55Å
131Y98.6Very high98.5Very high41 Ų4119 Ų1916%0.16111%0.107CC..Hα-helixtrans-68.9-18.3177.2-168-104.1000113.5A127 F128 M129 P134 M138 S139 E271A127-Y131 WeakPolarHBondContact O-CB 3.26Å; A127-Y131 PolarHBondContact O-N 3.27Å; F128-Y131 PolarHBondContact O-N 3.43Å; M129-Y131 VanDerWaalsContact C-N 3.28Å; M129-Y131 PolarHBondContact O-N 3.03Å; Y131-P134 WeakPolarHBondContact O-CD 3.35Å; Y131-M138 HydrophobicContact CE1-CB 4.14Å; Y131-S139 VanDerWaalsContact O-CB 3.27Å; Y131-S139 WeakPolarHBondContact O-CB 3.34Å; Y131-S139 PolarHBondContact O-OG 2.92Å; Y131-E271 HydrophobicContact CD1-CG 4.19Å; Y131-E271 HydrophobicContact CD2-CG 3.45Å; Y131-E271 VanDerWaalsContact CD2-CG 3.45Å; Y131-E271 HydrophobicContact CE1-CG 4.14Å; Y131-E271 HydrophobicContact CE2-CG 3.38Å; Y131-E271 WeakPolarHBondContact CE2-OE1 3.15Å; Y131-E271 HydrophobicContact CG-CG 3.85Å; Y131-E271 PolarHBondContact OH-OE1 3.2Å
132V98.7Very high98.4Very high2 Ų216.6 Ų16.61%0.01210%0.096CC..Hα-helixtrans-78.8-28174.8-177.30000111.7F128 M129 G130 P134 W135 A143 L175 F178F128-V132 WeakPolarHBondContact O-CG2 3.27Å; F128-V132 PolarHBondContact O-N 2.71Å; M129-V132 WeakPolarHBondContact O-CB 3.2Å; M129-V132 PolarHBondContact O-N 3.07Å; M129-V132 VanDerWaalsContact O-N 3.09Å; G130-V132 PolarHBondContact O-N 3.1Å; V132-P134 VanDerWaalsContact C-CD 3.49Å; V132-W135 HydrophobicContact CG1-CE3 4.15Å; V132-W135 HydrophobicContact CG1-CZ3 3.94Å; V132-W135 PolarHBondContact O-N 3.4Å; V132-A143 HydrophobicContact CG1-CB 4.06Å; V132-A143 HydrophobicContact CG2-CB 3.74Å; V132-L175 HydrophobicContact CG1-CD1 4.38Å; V132-F178 HydrophobicContact CB-CD2 3.93Å; V132-F178 HydrophobicContact CG1-CD2 3.97Å; V132-F178 HydrophobicContact CG1-CE2 4.5Å; V132-F178 HydrophobicContact CG2-CD2 3.88Å; V132-F178 HydrophobicContact CG2-CE2 4.04Å
133L98.8Very high98.3Very high17 Ų1716 Ų169%0.0899%0.091CC..THydrogen-bonded Turntrans-59.9-34.9-171.9-53.7-175.3000115.1Y55 M129 G130 W135 L175 F178 F179 H182Y55-L133 HydrophobicContact CE1-CB 4.44Å; Y55-L133 HydrophobicContact CE2-CB 4.43Å; Y55-L133 WeakPolarHBondContact CE2-O 3.35Å; Y55-L133 PolarHBondContact OH-O 3.34Å; M129-L133 WeakPolarHBondContact O-CG 3.45Å; G130-L133 WeakPolarHBondContact O-CB 3.33Å; G130-L133 WeakPolarHBondContact O-CG 3.36Å; G130-L133 PolarHBondContact O-N 3.23Å; L133-W135 PolarHBondContact O-N 3.13Å; L133-W135 VanDerWaalsContact O-N 3.14Å; L133-L175 HydrophobicContact CD2-CD1 3.99Å; L133-F178 HydrophobicContact CD2-CB 4.49Å; L133-F179 HydrophobicContact CD1-CD2 4.05Å; L133-F179 HydrophobicContact CD2-CB 3.92Å; L133-H182 HydrophobicContact CD1-CB 4.31Å
134P98.5Very high98.2Very high25 Ų2517 Ų1716%0.16210%0.098CC..THydrogen-bonded Turntrans-62.9-18.1175.3-25.336000115.1F63 I66 G130 Y131 V132 G136F63-P134 WeakPolarHBondContact CA-O 3.19Å; F63-P134 WeakPolarHBondContact CD2-O 3.28Å; I66-P134 HydrophobicContact CG1-CB 4.46Å; G130-P134 WeakPolarHBondContact O-CD 3.26Å; Y131-P134 WeakPolarHBondContact O-CD 3.35Å; V132-P134 VanDerWaalsContact C-CD 3.49Å; P134-G136 PolarHBondContact O-N 2.99Å
135W98.5Very high98.1Very high13 Ų1318.9 Ų18.95%0.04911%0.11CC..  trans55.935.3177.6-150.6-110.8000114.4A59 A62 F63 V132 L133 F140 V170 L175 A259A59-W135 HydrophobicContact CB-CZ2 3.73Å; A62-W135 HydrophobicContact CB-CB 3.85Å; A62-W135 HydrophobicContact CB-CG 4.38Å; F63-W135 HydrophobicContact CB-CB 4.45Å; V132-W135 HydrophobicContact CG1-CE3 4.15Å; V132-W135 HydrophobicContact CG1-CZ3 3.94Å; V132-W135 PolarHBondContact O-N 3.4Å; L133-W135 PolarHBondContact O-N 3.13Å; L133-W135 VanDerWaalsContact O-N 3.14Å; W135-F140 HydrophobicContact CH2-CD2 4.1Å; W135-F140 AromaticContact CZ2-CD2 3.93Å; W135-F140 HydrophobicContact CZ2-CD2 3.93Å; W135-F140 HydrophobicContact CZ2-CE2 4.31Å; W135-V170 HydrophobicContact CH2-CG1 3.7Å; W135-V170 HydrophobicContact CZ3-CG1 4.03Å; W135-L175 HydrophobicContact CD2-CD2 3.83Å; W135-L175 HydrophobicContact CE3-CB 4.26Å; W135-L175 HydrophobicContact CE3-CD1 3.63Å; W135-L175 HydrophobicContact CE3-CD2 3.66Å; W135-L175 HydrophobicContact CE3-CG 4.05Å; W135-L175 HydrophobicContact CG-CD2 4.27Å; W135-L175 HydrophobicContact CH2-CB 4.12Å; W135-L175 HydrophobicContact CZ3-CB 3.79Å; W135-L175 HydrophobicContact CZ3-CD1 3.83Å; W135-L175 HydrophobicContact CZ3-CD2 4.03Å; W135-L175 HydrophobicContact CZ3-CG 4.09Å; W135-A259 HydrophobicContact CG-CB 4.44Å; W135-A259 WeakPolarHBondContact O-CB 3.49Å; W135-A259 PolarHBondContact O-N 3.25Å; W135-A259 VanDerWaalsContact O-N 3.12Å
136G98.3Very high98Very high0 Ų019.2 Ų19.20%011%0.106CC..BIsolated β-bridgetrans-85.2-179.916900000112.7P134 M138 S139 F140 N255 T257P134-G136 PolarHBondContact O-N 2.99Å; G136-M138 PolarHBondContact O-N 3.45Å; G136-S139 WeakPolarHBondContact O-CB 3.34Å; G136-S139 PolarHBondContact O-N 3Å; G136-F140 PolarHBondContact O-N 3.27Å; G136-N255 VanDerWaalsContact C-OD1 3.3Å; G136-N255 VanDerWaalsContact CA-OD1 3.25Å; G136-N255 WeakPolarHBondContact CA-OD1 3.32Å; G136-T257 CarbonylContact C-O 3.26Å; G136-T257 WeakPolarHBondContact CA-O 3.27Å
137Q98.1Very high97.9Very high12 Ų1219.1 Ų19.16%0.05611%0.105CC..Hα-helixtrans-58.3-48.9-179.4-75.2-76.663.600112.9F140 W141 D254 T257 N263 P265Q137-F140 PolarHBondContact O-N 3.5Å; Q137-W141 WeakPolarHBondContact O-CB 3.27Å; Q137-W141 PolarHBondContact O-N 2.92Å; Q137-D254 HydrophobicContact CB-CB 4.42Å; Q137-T257 WeakPolarHBondContact CG-OG1 3.3Å; Q137-T257 PolarHBondContact N-O 3.31Å; Q137-N263 PolarHBondContact NE2-O 2.94Å; Q137-P265 HydrophobicContact CB-CG 3.86Å
138M97.2Very high97.9Very high2 Ų221.5 Ų21.51%0.0112%0.116CC..Hα-helixtrans-68.3-36.6179.9-70.9-62.7160.800112.1Y131 G136 G142 D252 D254 N255 P265Y131-M138 HydrophobicContact CE1-CB 4.14Å; G136-M138 PolarHBondContact O-N 3.45Å; M138-G142 WeakPolarHBondContact O-CA 3.22Å; M138-G142 PolarHBondContact O-N 3.38Å; M138-D252 HydrophobicContact CG-CB 4.09Å; M138-D254 HydrophobicContact CE-CB 3.54Å; M138-D254 WeakPolarHBondContact CE-OD2 3.38Å; M138-D254 HydrophobicContact CG-CB 3.81Å; M138-N255 HydrophobicContact CB-CB 4.17Å; M138-N255 PolarHBondContact N-OD1 3.19Å; M138-P265 HydrophobicContact CE-CB 3.44Å; M138-P265 VanDerWaalsContact CE-CB 3.44Å; M138-P265 HydrophobicContact CE-CG 3.94Å
139S97.4Very high97.7Very high1 Ų120.5 Ų20.51%0.00711%0.112CC..Hα-helixtrans-55.3-54.5172-66.30000111.9Y131 G136 A143 N255Y131-S139 VanDerWaalsContact O-CB 3.27Å; Y131-S139 WeakPolarHBondContact O-CB 3.34Å; Y131-S139 PolarHBondContact O-OG 2.92Å; G136-S139 WeakPolarHBondContact O-CB 3.34Å; G136-S139 PolarHBondContact O-N 3Å; S139-A143 VanDerWaalsContact O-CB 3.3Å; S139-A143 WeakPolarHBondContact O-CB 3.48Å; S139-A143 PolarHBondContact O-N 3.43Å; S139-N255 PolarHBondContact N-OD1 3.41Å; S139-N255 PolarHBondContact OG-ND2 3.39Å; S139-N255 PolarHBondContact OG-OD1 3.43Å
140F98.1Very high97.6Very high10 Ų1022.3 Ų22.34%0.04412%0.122CC..Hα-helixtrans-68.8-49.9-175.4175.6-90.9000112.7W135 G136 Q137 A143 T144 V170 A259 P261W135-F140 HydrophobicContact CH2-CD2 4.1Å; W135-F140 AromaticContact CZ2-CD2 3.93Å; W135-F140 HydrophobicContact CZ2-CD2 3.93Å; W135-F140 HydrophobicContact CZ2-CE2 4.31Å; G136-F140 PolarHBondContact O-N 3.27Å; Q137-F140 PolarHBondContact O-N 3.5Å; F140-A143 PolarHBondContact O-N 2.84Å; F140-T144 WeakPolarHBondContact O-CB 3.27Å; F140-T144 PolarHBondContact O-N 3.38Å; F140-T144 PolarHBondContact O-OG1 3.08Å; F140-V170 HydrophobicContact CD2-CB 4.49Å; F140-V170 HydrophobicContact CD2-CG1 4.08Å; F140-V170 HydrophobicContact CE2-CB 4.1Å; F140-V170 HydrophobicContact CE2-CG1 4.11Å; F140-V170 VanDerWaalsContact CE2-O 3.27Å; F140-V170 WeakPolarHBondContact CE2-O 3.39Å; F140-A259 HydrophobicContact CB-CB 3.52Å; F140-A259 HydrophobicContact CD2-CB 4.28Å; F140-A259 HydrophobicContact CG-CB 3.94Å; F140-P261 HydrophobicContact CE1-CB 4.1Å; F140-P261 HydrophobicContact CE1-CG 4.26Å; F140-P261 HydrophobicContact CE2-CG 4.23Å; F140-P261 HydrophobicContact CZ-CB 3.86Å; F140-P261 HydrophobicContact CZ-CG 3.8Å
141W98.3Very high97.5Very high34 Ų3423 Ų2313%0.12912%0.124CC..Hα-helixtrans-72.1-35.7-177.4-74106000111.9Q137 T144 V145 N260 P261 N263 T264 P265 I268Q137-W141 WeakPolarHBondContact O-CB 3.27Å; Q137-W141 PolarHBondContact O-N 2.92Å; W141-T144 PolarHBondContact O-N 2.98Å; W141-V145 WeakPolarHBondContact O-CB 3.28Å; W141-V145 WeakPolarHBondContact O-CG2 3.28Å; W141-V145 PolarHBondContact O-N 2.95Å; W141-N260 PolarHBondContact NE1-O 3.46Å; W141-P261 WeakPolarHBondContact CH2-O 3.47Å; W141-P261 WeakPolarHBondContact CZ2-O 3.27Å; W141-N263 PolarHBondContact NE1-O 2.83Å; W141-T264 HydrophobicContact CD2-CG2 4.23Å; W141-T264 HydrophobicContact CE3-CG2 4.21Å; W141-T264 VanDerWaalsContact CH2-OG1 3.27Å; W141-T264 WeakPolarHBondContact CH2-OG1 3.46Å; W141-T264 WeakPolarHBondContact CZ2-OG1 3.36Å; W141-T264 HydrophobicContact CZ3-CG2 4.36Å; W141-P265 HydrophobicContact CG-CG 4.37Å; W141-I268 HydrophobicContact CB-CD1 3.72Å; W141-I268 HydrophobicContact CB-CG1 3.9Å; W141-I268 HydrophobicContact CB-CG2 4.17Å; W141-I268 HydrophobicContact CD2-CD1 4.29Å; W141-I268 HydrophobicContact CE3-CD1 4.2Å; W141-I268 HydrophobicContact CG-CD1 4.13Å
142G96.3Very high97.4Very high9 Ų921.9 Ų21.99%0.09312%0.123CC..Hα-helixtrans-59.6-47.8170.400000111.6M138 T144 V145 I146M138-G142 WeakPolarHBondContact O-CA 3.22Å; M138-G142 PolarHBondContact O-N 3.38Å; G142-T144 VanDerWaalsContact C-N 3.35Å; G142-T144 PolarHBondContact O-N 3.43Å; G142-V145 PolarHBondContact O-N 3.36Å; G142-I146 WeakPolarHBondContact O-CB 3.39Å; G142-I146 VanDerWaalsContact O-CG1 3.25Å; G142-I146 WeakPolarHBondContact O-CG1 3.45Å; G142-I146 PolarHBondContact O-N 3.48Å
143A97.1Very high97.3Very high1 Ų124.5 Ų24.51%0.00814%0.137CC..Hα-helixtrans-57.3-48.5175.300000111.6V132 S139 F140 T147 V170V132-A143 HydrophobicContact CG1-CB 4.06Å; V132-A143 HydrophobicContact CG2-CB 3.74Å; S139-A143 VanDerWaalsContact O-CB 3.3Å; S139-A143 WeakPolarHBondContact O-CB 3.48Å; S139-A143 PolarHBondContact O-N 3.43Å; F140-A143 PolarHBondContact O-N 2.84Å; A143-T147 WeakPolarHBondContact O-CB 3.45Å; A143-T147 WeakPolarHBondContact O-CG2 3.44Å; A143-T147 PolarHBondContact O-N 3.43Å; A143-T147 PolarHBondContact O-OG1 3.05Å; A143-V170 HydrophobicContact CB-CG1 4.22Å; A143-V170 HydrophobicContact CB-CG2 4.29Å
144T97.6Very high97.2Very high30 Ų3027.1 Ų27.118%0.18416%0.155CC..Hα-helixtrans-59.5-49.8-179.1-60.30000111.7F140 W141 G142 N148F140-T144 WeakPolarHBondContact O-CB 3.27Å; F140-T144 PolarHBondContact O-N 3.38Å; F140-T144 PolarHBondContact O-OG1 3.08Å; W141-T144 PolarHBondContact O-N 2.98Å; G142-T144 VanDerWaalsContact C-N 3.35Å; G142-T144 PolarHBondContact O-N 3.43Å; T144-N148 WeakPolarHBondContact O-CB 3.36Å; T144-N148 PolarHBondContact O-N 3.21Å
145V96.9Very high97.1Very high56 Ų5636.8 Ų36.834%0.33919%0.19SC..Hα-helixtrans-66.8-49.6-178171.40000111.3W141 G142 N148 L149 I268W141-V145 WeakPolarHBondContact O-CB 3.28Å; W141-V145 WeakPolarHBondContact O-CG2 3.28Å; W141-V145 PolarHBondContact O-N 2.95Å; G142-V145 PolarHBondContact O-N 3.36Å; V145-N148 PolarHBondContact O-N 3.31Å; V145-L149 PolarHBondContact O-N 3.37Å; V145-I268 HydrophobicContact CG2-CD1 4.24Å; V145-I268 HydrophobicContact CG2-CG2 4.29Å
146I96.2Very high97.1Very high48 Ų4841.1 Ų41.125%0.24621%0.213CC..Hα-helixtrans-68.9-45.2-173.2-63.8-61.5000111.6F128 G142 N148 L149F128-I146 HydrophobicContact CD2-CG2 4.38Å; F128-I146 HydrophobicContact CE2-CB 3.76Å; F128-I146 HydrophobicContact CE2-CG1 4.11Å; F128-I146 HydrophobicContact CE2-CG2 3.73Å; F128-I146 HydrophobicContact CZ-CB 4.03Å; F128-I146 HydrophobicContact CZ-CG2 3.93Å; G142-I146 WeakPolarHBondContact O-CB 3.39Å; G142-I146 VanDerWaalsContact O-CG1 3.25Å; G142-I146 WeakPolarHBondContact O-CG1 3.45Å; G142-I146 PolarHBondContact O-N 3.48Å; I146-N148 VanDerWaalsContact C-N 3.33Å; I146-N148 PolarHBondContact O-N 3.43Å; I146-L149 HydrophobicContact CD1-CD1 4.23Å; I146-L149 WeakPolarHBondContact O-CB 3.33Å; I146-L149 WeakPolarHBondContact O-CG 3.45Å; I146-L149 PolarHBondContact O-N 2.79Å
147T97.4Very high97Very high10 Ų1041.2 Ų41.26%0.06121%0.213CC..Hα-helixtrans-67.9-35.4178.9550000111.9F128 A143 L149 L150 V161 I164 W165 F178F128-T147 HydrophobicContact CE1-CG2 4.22Å; F128-T147 HydrophobicContact CZ-CG2 4.08Å; A143-T147 WeakPolarHBondContact O-CB 3.45Å; A143-T147 WeakPolarHBondContact O-CG2 3.44Å; A143-T147 PolarHBondContact O-N 3.43Å; A143-T147 PolarHBondContact O-OG1 3.05Å; T147-L149 PolarHBondContact O-N 3.41Å; T147-L149 VanDerWaalsContact O-N 3.12Å; T147-L150 WeakPolarHBondContact O-CB 3.31Å; T147-L150 PolarHBondContact O-N 3.47Å; T147-L150 VanDerWaalsContact O-N 3.13Å; T147-V161 WeakPolarHBondContact O-CG2 3.28Å; T147-I164 HydrophobicContact CG2-CG2 4.41Å; T147-W165 PolarHBondContact OG1-NE1 2.95Å; T147-F178 HydrophobicContact CG2-CZ 4.04Å
148N97.4Very high97Very high63 Ų6344.5 Ų44.534%0.33724%0.235SC..G310 helixtrans-68.8-6.5176-169.636.1000113.7T144 V145 I146 L150 S151 W165 K287T144-N148 WeakPolarHBondContact O-CB 3.36Å; T144-N148 PolarHBondContact O-N 3.21Å; V145-N148 PolarHBondContact O-N 3.31Å; I146-N148 VanDerWaalsContact C-N 3.33Å; I146-N148 PolarHBondContact O-N 3.43Å; N148-L150 PolarHBondContact O-N 3.5Å; N148-S151 PolarHBondContact O-N 3.24Å; N148-S151 PolarHBondContact O-OG 3.2Å; N148-S151 PolarHBondContact OD1-OG 3.26Å; N148-W165 HydrophobicContact CB-CH2 4.27Å; N148-W165 HydrophobicContact CB-CZ2 4.09Å; N148-K287 PolarHBondContact O-NZ 3.37Å; N148-K287 VanDerWaalsContact O-NZ 3.11Å
149L95.6Very high97.1Very high23 Ų2349.5 Ų49.512%0.1226%0.261CS..G310 helixtrans-62-31.6168.7-67.2179000111.8V145 I146 T147 S151 A152 L281 V291 L294V145-L149 PolarHBondContact O-N 3.37Å; I146-L149 HydrophobicContact CD1-CD1 4.23Å; I146-L149 WeakPolarHBondContact O-CB 3.33Å; I146-L149 WeakPolarHBondContact O-CG 3.45Å; I146-L149 PolarHBondContact O-N 2.79Å; T147-L149 PolarHBondContact O-N 3.41Å; T147-L149 VanDerWaalsContact O-N 3.12Å; L149-S151 PolarHBondContact O-N 3.03Å; L149-A152 VanDerWaalsContact O-CB 3.23Å; L149-A152 WeakPolarHBondContact O-CB 3.34Å; L149-A152 PolarHBondContact O-N 3.23Å; L149-L281 HydrophobicContact CD1-CD1 4.36Å; L149-L281 HydrophobicContact CD1-CD2 3.64Å; L149-L281 HydrophobicContact CD2-CD1 4.26Å; L149-L281 HydrophobicContact CD2-CD2 4.18Å; L149-V291 HydrophobicContact CB-CG2 3.73Å; L149-V291 HydrophobicContact CD2-CG2 4.03Å; L149-V291 HydrophobicContact CG-CG2 4.3Å; L149-L294 HydrophobicContact CD1-CD2 4.43Å
150L95.3Very high97.1Very high56 Ų5652 Ų5229%0.29328%0.275SS..G310 helixtrans-66.1-20.6179.7-65172.8000113.4T147 N148 A152 I153 G157 L160 V161 I164T147-L150 WeakPolarHBondContact O-CB 3.31Å; T147-L150 PolarHBondContact O-N 3.47Å; T147-L150 VanDerWaalsContact O-N 3.13Å; N148-L150 PolarHBondContact O-N 3.5Å; L150-A152 PolarHBondContact O-N 3.11Å; L150-A152 VanDerWaalsContact O-N 3.1Å; L150-I153 HydrophobicContact CD2-CD1 4.06Å; L150-I153 WeakPolarHBondContact O-CB 3.42Å; L150-I153 WeakPolarHBondContact O-CG1 3.42Å; L150-I153 PolarHBondContact O-N 3.31Å; L150-G157 VanDerWaalsContact O-CA 3.28Å; L150-G157 WeakPolarHBondContact O-CA 3.49Å; L150-L160 HydrophobicContact CB-CD2 4.27Å; L150-L160 HydrophobicContact CD1-CD2 4.2Å; L150-V161 HydrophobicContact CB-CG2 3.83Å; L150-I164 HydrophobicContact CD1-CD1 3.3Å
151S96.9Very high97.1Very high30 Ų3051.7 Ų51.721%0.2127%0.273CS..G310 helixtrans-66.2-10.4173.163.80000113.4N148 L149 I153 K287N148-S151 PolarHBondContact O-N 3.24Å; N148-S151 PolarHBondContact O-OG 3.2Å; N148-S151 PolarHBondContact OD1-OG 3.26Å; L149-S151 PolarHBondContact O-N 3.03Å; S151-I153 PolarHBondContact O-N 3.12Å; S151-K287 PolarHBondContact OG-NZ 3.02Å
152A96.6Very high97.1Very high17 Ų1753.5 Ų53.514%0.1428%0.283CS..G310 helixtrans-71.1-16.4171.300000113.4L149 L150 P154 K287 L288 V291L149-A152 VanDerWaalsContact O-CB 3.23Å; L149-A152 WeakPolarHBondContact O-CB 3.34Å; L149-A152 PolarHBondContact O-N 3.23Å; L150-A152 PolarHBondContact O-N 3.11Å; L150-A152 VanDerWaalsContact O-N 3.1Å; A152-P154 WeakPolarHBondContact O-CD 3.48Å; A152-K287 HydrophobicContact CB-CB 4.48Å; A152-K287 HydrophobicContact CB-CD 3.98Å; A152-K287 HydrophobicContact CB-CG 3.9Å; A152-L288 HydrophobicContact CB-CB 4.26Å; A152-L288 HydrophobicContact CB-CD1 4.4Å; A152-V291 HydrophobicContact CB-CG2 4.34Å
153I97Very high97.2Very high57 Ų5761.9 Ų61.929%0.29231%0.312SS..SBendtrans-68.8122.3178.3-60.8171.3000108.8L150 S151 I156 G157 L160L150-I153 HydrophobicContact CD2-CD1 4.06Å; L150-I153 WeakPolarHBondContact O-CB 3.42Å; L150-I153 WeakPolarHBondContact O-CG1 3.42Å; L150-I153 PolarHBondContact O-N 3.31Å; S151-I153 PolarHBondContact O-N 3.12Å; I153-I156 HydrophobicContact CG2-CD1 4.18Å; I153-I156 HydrophobicContact CG2-CG1 3.7Å; I153-G157 VanDerWaalsContact O-CA 3.32Å; I153-G157 WeakPolarHBondContact O-CA 3.4Å; I153-G157 PolarHBondContact O-N 3.44Å; I153-L160 HydrophobicContact CD1-CD2 4.12Å
154P96.6Very high97.2Very high72 Ų7263.4 Ų63.447%0.46832%0.32SS..THydrogen-bonded Turntrans-57.6144.2179.5-25.535000112.5A152 I156 L288A152-P154 WeakPolarHBondContact O-CD 3.48Å; P154-I156 PolarHBondContact O-N 3.19Å; P154-L288 HydrophobicContact CG-CD2 4.43Å
155Y96.5Very high97.2Very high228 Ų22863.1 Ų63.189%0.89432%0.315SS*.THydrogen-bonded Turntrans68.8-54.1177.1-45.7-69.7000115.5
156I97.9Very high97.3Very high105 Ų10562.2 Ų62.254%0.53832%0.317SS..THydrogen-bonded Turntrans-103.2-7.3-170.461.9168.9000114.4I153 P154 T158 D159 L160I153-I156 HydrophobicContact CG2-CD1 4.18Å; I153-I156 HydrophobicContact CG2-CG1 3.7Å; P154-I156 PolarHBondContact O-N 3.19Å; I156-T158 PolarHBondContact O-N 3.43Å; I156-D159 PolarHBondContact O-N 3.1Å; I156-L160 WeakPolarHBondContact O-CB 3.35Å; I156-L160 PolarHBondContact O-N 3.25Å
157G97.5Very high97.3Very high1 Ų161.3 Ų61.31%0.0132%0.32CS..Hα-helixtrans-62-44.9-168.600000114.1L150 I153 L160 V161L150-G157 VanDerWaalsContact O-CA 3.28Å; L150-G157 WeakPolarHBondContact O-CA 3.49Å; I153-G157 VanDerWaalsContact O-CA 3.32Å; I153-G157 WeakPolarHBondContact O-CA 3.4Å; I153-G157 PolarHBondContact O-N 3.44Å; G157-L160 PolarHBondContact O-N 2.9Å; G157-V161 WeakPolarHBondContact O-CG2 3.27Å; G157-V161 PolarHBondContact O-N 3.08Å
158T97.3Very high97.3Very high82 Ų8270.3 Ų70.350%0.50335%0.354SS..Hα-helixtrans-64.9-44.9-179.3-54.10000111.7I156 L160 V161 Q162I156-T158 PolarHBondContact O-N 3.43Å; T158-L160 VanDerWaalsContact C-N 3.31Å; T158-L160 PolarHBondContact O-N 3.48Å; T158-V161 PolarHBondContact O-N 3.44Å; T158-Q162 PolarHBondContact O-N 3.13Å
159D98.3Very high97.2Very high107 Ų10770.3 Ų70.357%0.57236%0.359SS*.Hα-helixtrans-63.3-39.7177.8-62-19.5000111I156 V161 Q162 W163I156-D159 PolarHBondContact O-N 3.1Å; D159-V161 PolarHBondContact O-N 3.19Å; D159-Q162 PolarHBondContact O-N 3.14Å; D159-W163 WeakPolarHBondContact O-CB 3.46Å; D159-W163 PolarHBondContact O-N 3.25Å
160L98.1Very high97.4Very high54 Ų5469.4 Ų69.428%0.28335%0.354SS..Hα-helixtrans-62.3-42.6176.2-177.264.1000112L150 I153 I156 G157 T158 W163 I164L150-L160 HydrophobicContact CB-CD2 4.27Å; L150-L160 HydrophobicContact CD1-CD2 4.2Å; I153-L160 HydrophobicContact CD1-CD2 4.12Å; I156-L160 WeakPolarHBondContact O-CB 3.35Å; I156-L160 PolarHBondContact O-N 3.25Å; G157-L160 PolarHBondContact O-N 2.9Å; T158-L160 VanDerWaalsContact C-N 3.31Å; T158-L160 PolarHBondContact O-N 3.48Å; L160-W163 HydrophobicContact CD1-CE3 4.17Å; L160-W163 PolarHBondContact O-N 2.9Å; L160-I164 HydrophobicContact CD1-CD1 4.34Å; L160-I164 HydrophobicContact CG-CD1 4.12Å; L160-I164 VanDerWaalsContact O-CG1 3.28Å; L160-I164 WeakPolarHBondContact O-CG1 3.13Å; L160-I164 PolarHBondContact O-N 2.86Å
161V98.3Very high97.4Very high3 Ų370.6 Ų70.62%0.01836%0.361CS..Hα-helixtrans-63.6-49.6177.4170.70000110.9T147 L150 G157 T158 D159 W163 I164 W165T147-V161 WeakPolarHBondContact O-CG2 3.28Å; L150-V161 HydrophobicContact CB-CG2 3.83Å; G157-V161 WeakPolarHBondContact O-CG2 3.27Å; G157-V161 PolarHBondContact O-N 3.08Å; T158-V161 PolarHBondContact O-N 3.44Å; D159-V161 PolarHBondContact O-N 3.19Å; V161-W163 VanDerWaalsContact C-N 3.28Å; V161-W163 PolarHBondContact O-N 3.14Å; V161-I164 PolarHBondContact O-N 2.98Å; V161-W165 HydrophobicContact CG1-CD2 3.64Å; V161-W165 VanDerWaalsContact CG1-CE2 3.44Å; V161-W165 HydrophobicContact CG1-CE3 3.69Å; V161-W165 HydrophobicContact CG1-CG 4.48Å; V161-W165 HydrophobicContact CG1-CH2 3.46Å; V161-W165 VanDerWaalsContact CG1-CH2 3.46Å; V161-W165 HydrophobicContact CG1-CZ2 3.38Å; V161-W165 HydrophobicContact CG1-CZ3 3.61Å; V161-W165 PolarHBondContact O-N 2.87Å
162Q98.2Very high97.5Very high71 Ų7170.3 Ų70.333%0.33236%0.359SS..Hα-helixtrans-63.9-35.4178.4-69.3-178.5-300111.9T158 D159 W165 G166 G167T158-Q162 PolarHBondContact O-N 3.13Å; D159-Q162 PolarHBondContact O-N 3.14Å; Q162-W165 PolarHBondContact O-N 3.13Å; Q162-G166 WeakPolarHBondContact O-CA 3.49Å; Q162-G166 PolarHBondContact O-N 2.77Å; Q162-G167 WeakPolarHBondContact CA-O 3.25Å; Q162-G167 PolarHBondContact O-N 2.74Å
163W98.4Very high97.5Very high186 Ų18672.3 Ų72.371%0.70537%0.371SS*.Hα-helixtrans-64-44.9173.4-179.479.7000111.7D159 L160 V161 W165 G166 R177D159-W163 WeakPolarHBondContact O-CB 3.46Å; D159-W163 PolarHBondContact O-N 3.25Å; L160-W163 HydrophobicContact CD1-CE3 4.17Å; L160-W163 PolarHBondContact O-N 2.9Å; V161-W163 VanDerWaalsContact C-N 3.28Å; V161-W163 PolarHBondContact O-N 3.14Å; W163-W165 VanDerWaalsContact C-N 3.32Å; W163-W165 PolarHBondContact O-N 3.32Å; W163-G166 PolarHBondContact O-N 3.31Å; W163-R177 PolarHBondContact O-NH1 2.91Å
164I97.6Very high97.6Very high33 Ų3369.6 Ų69.617%0.16936%0.357CS..Hα-helixtrans-63-38.3175-71.9167.9000111.2T147 L150 L160 V161 R177 F178T147-I164 HydrophobicContact CG2-CG2 4.41Å; L150-I164 HydrophobicContact CD1-CD1 3.3Å; L160-I164 HydrophobicContact CD1-CD1 4.34Å; L160-I164 HydrophobicContact CG-CD1 4.12Å; L160-I164 VanDerWaalsContact O-CG1 3.28Å; L160-I164 WeakPolarHBondContact O-CG1 3.13Å; L160-I164 PolarHBondContact O-N 2.86Å; V161-I164 PolarHBondContact O-N 2.98Å; I164-R177 WeakPolarHBondContact O-CD 3.45Å; I164-R177 PolarHBondContact O-NE 3.39Å; I164-R177 PolarHBondContact O-NH1 3.47Å; I164-F178 HydrophobicContact CG2-CE1 4.23Å; I164-F178 HydrophobicContact CG2-CZ 4.41Å
165W98.4Very high97.7Very high24 Ų2466.2 Ų66.29%0.09134%0.335CS..Hα-helixtrans-74.6-33177.8-66.2-16.1000112.7T147 N148 V161 Q162 W163 G167 Y168 S169 V170 T174T147-W165 PolarHBondContact OG1-NE1 2.95Å; N148-W165 HydrophobicContact CB-CH2 4.27Å; N148-W165 HydrophobicContact CB-CZ2 4.09Å; V161-W165 HydrophobicContact CG1-CD2 3.64Å; V161-W165 VanDerWaalsContact CG1-CE2 3.44Å; V161-W165 HydrophobicContact CG1-CE3 3.69Å; V161-W165 HydrophobicContact CG1-CG 4.48Å; V161-W165 HydrophobicContact CG1-CH2 3.46Å; V161-W165 VanDerWaalsContact CG1-CH2 3.46Å; V161-W165 HydrophobicContact CG1-CZ2 3.38Å; V161-W165 HydrophobicContact CG1-CZ3 3.61Å; V161-W165 PolarHBondContact O-N 2.87Å; Q162-W165 PolarHBondContact O-N 3.13Å; W163-W165 VanDerWaalsContact C-N 3.32Å; W163-W165 PolarHBondContact O-N 3.32Å; W165-G167 VanDerWaalsContact C-N 3.32Å; W165-Y168 VanDerWaalsContact CZ3-O 3.26Å; W165-Y168 WeakPolarHBondContact CZ3-O 3.35Å; W165-S169 VanDerWaalsContact CE3-CA 3.5Å; W165-V170 HydrophobicContact CD2-CG2 4.39Å; W165-V170 HydrophobicContact CG-CG2 4.37Å; W165-V170 HydrophobicContact CZ2-CG2 4.32Å; W165-T174 WeakPolarHBondContact CA-OG1 3.49Å; W165-T174 PolarHBondContact O-N 3.4Å; W165-T174 PolarHBondContact O-OG1 3.44Å
166G97.6Very high97.8Very high37 Ų3758.3 Ų58.338%0.38131%0.311SS..THydrogen-bonded Turntrans73.427.6-168.600000113.1Q162 W163Q162-G166 WeakPolarHBondContact O-CA 3.49Å; Q162-G166 PolarHBondContact O-N 2.77Å; W163-G166 PolarHBondContact O-N 3.31Å
167G96.4Very high97.8Very high29 Ų2956.6 Ų56.630%0.29930%0.297SS..SBendtrans171.7-166.2-171.600000110.9Q162 W165Q162-G167 WeakPolarHBondContact CA-O 3.25Å; Q162-G167 PolarHBondContact O-N 2.74Å; W165-G167 VanDerWaalsContact C-N 3.32Å
168Y97.2Very high97.8Very high198 Ų19857.1 Ų57.178%0.77630%0.299SS*.SBendtrans-90.4-11.3-176.2-59-71.5000114.2W165W165-Y168 VanDerWaalsContact CZ3-O 3.26Å; W165-Y168 WeakPolarHBondContact CZ3-O 3.35Å
169S96.6Very high97.9Very high64 Ų6455.1 Ų55.145%0.44828%0.284SS..SBendtrans-149.3167.9177.457.20000109.8W165 D171W165-S169 VanDerWaalsContact CE3-CA 3.5Å; S169-D171 PolarHBondContact O-N 3.34Å
170V97.9Very high97.9Very high3 Ų354 Ų542%0.01828%0.28CS..SBendtrans-61.4123.5166.4175.70000108.6W135 F140 A143 W165 T174W135-V170 HydrophobicContact CH2-CG1 3.7Å; W135-V170 HydrophobicContact CZ3-CG1 4.03Å; F140-V170 HydrophobicContact CD2-CB 4.49Å; F140-V170 HydrophobicContact CD2-CG1 4.08Å; F140-V170 HydrophobicContact CE2-CB 4.1Å; F140-V170 HydrophobicContact CE2-CG1 4.11Å; F140-V170 VanDerWaalsContact CE2-O 3.27Å; F140-V170 WeakPolarHBondContact CE2-O 3.39Å; A143-V170 HydrophobicContact CB-CG1 4.22Å; A143-V170 HydrophobicContact CB-CG2 4.29Å; W165-V170 HydrophobicContact CD2-CG2 4.39Å; W165-V170 HydrophobicContact CG-CG2 4.37Å; W165-V170 HydrophobicContact CZ2-CG2 4.32Å; V170-T174 HydrophobicContact CG1-CG2 4.22Å
171D97.2Very high97.9Very high81 Ų8156.6 Ų56.643%0.43329%0.29SS..SBendtrans-158.3-170.4-178.4-161.60.2000110.7S169 P173 T174 L175S169-D171 PolarHBondContact O-N 3.34Å; D171-P173 VanDerWaalsContact C-CD 3.45Å; D171-P173 VanDerWaalsContact C-N 3.33Å; D171-T174 PolarHBondContact N-OG1 2.58Å; D171-T174 WeakPolarHBondContact O-CA 3.25Å; D171-T174 VanDerWaalsContact O-CB 3.25Å; D171-T174 WeakPolarHBondContact O-CB 3.48Å; D171-T174 PolarHBondContact O-N 3.42Å; D171-L175 PolarHBondContact O-N 3.45Å
172S97.3Very high98Very high24 Ų2457.8 Ų57.817%0.16830%0.295CS..Hα-helixtrans-43.7-47.3178.9-82.30000114D58 A59 T174 L175 T176D58-S172 PolarHBondContact OD2-OG 3.18Å; A59-S172 VanDerWaalsContact CB-OG 3.22Å; A59-S172 WeakPolarHBondContact CB-OG 3.46Å; A59-S172 PolarHBondContact N-OG 3.47Å; S172-T174 PolarHBondContact O-N 3.49Å; S172-L175 PolarHBondContact O-N 2.88Å; S172-L175 VanDerWaalsContact O-N 3.09Å; S172-T176 PolarHBondContact O-N 3.12Å; S172-T176 PolarHBondContact O-OG1 2.73Å; S172-T176 VanDerWaalsContact O-OG1 3.1Å
173P98.1Very high98Very high60 Ų6058.2 Ų58.239%0.3930%0.296SS..Hα-helixtrans-58.7-34.6177.1-24.935.2000113.6D171 R177D171-P173 VanDerWaalsContact C-CD 3.45Å; D171-P173 VanDerWaalsContact C-N 3.33Å; P173-R177 WeakPolarHBondContact O-CG 3.19Å; P173-R177 PolarHBondContact O-N 2.92Å; P173-R177 PolarHBondContact O-NE 2.95Å
174T98.2Very high98Very high0 Ų053.2 Ų53.20%028%0.282CS..Hα-helixtrans-71.9-40175.7-43.90000111.4W165 V170 D171 S172 R177 F178W165-T174 WeakPolarHBondContact CA-OG1 3.49Å; W165-T174 PolarHBondContact O-N 3.4Å; W165-T174 PolarHBondContact O-OG1 3.44Å; V170-T174 HydrophobicContact CG1-CG2 4.22Å; D171-T174 PolarHBondContact N-OG1 2.58Å; D171-T174 WeakPolarHBondContact O-CA 3.25Å; D171-T174 VanDerWaalsContact O-CB 3.25Å; D171-T174 WeakPolarHBondContact O-CB 3.48Å; D171-T174 PolarHBondContact O-N 3.42Å; S172-T174 PolarHBondContact O-N 3.49Å; T174-R177 WeakPolarHBondContact O-CG 3.48Å; T174-F178 HydrophobicContact CG2-CD1 4.34Å; T174-F178 HydrophobicContact CG2-CD2 4.44Å; T174-F178 HydrophobicContact CG2-CE1 4.05Å; T174-F178 HydrophobicContact CG2-CE2 4.17Å; T174-F178 HydrophobicContact CG2-CZ 3.96Å; T174-F178 WeakPolarHBondContact O-CB 3.38Å; T174-F178 WeakPolarHBondContact O-CG 3.48Å; T174-F178 PolarHBondContact O-N 3.19Å
175L98.1Very high98.1Very high0 Ų053.2 Ų53.20%028%0.282CS..Hα-helixtrans-67.1-45.1-179.8-17455.5000111.9A62 V132 L133 W135 D171 S172 R177 F178 F179A62-L175 HydrophobicContact CB-CD2 3.52Å; V132-L175 HydrophobicContact CG1-CD1 4.38Å; L133-L175 HydrophobicContact CD2-CD1 3.99Å; W135-L175 HydrophobicContact CD2-CD2 3.83Å; W135-L175 HydrophobicContact CE3-CB 4.26Å; W135-L175 HydrophobicContact CE3-CD1 3.63Å; W135-L175 HydrophobicContact CE3-CD2 3.66Å; W135-L175 HydrophobicContact CE3-CG 4.05Å; W135-L175 HydrophobicContact CG-CD2 4.27Å; W135-L175 HydrophobicContact CH2-CB 4.12Å; W135-L175 HydrophobicContact CZ3-CB 3.79Å; W135-L175 HydrophobicContact CZ3-CD1 3.83Å; W135-L175 HydrophobicContact CZ3-CD2 4.03Å; W135-L175 HydrophobicContact CZ3-CG 4.09Å; D171-L175 PolarHBondContact O-N 3.45Å; S172-L175 PolarHBondContact O-N 2.88Å; S172-L175 VanDerWaalsContact O-N 3.09Å; L175-R177 PolarHBondContact O-N 2.91Å; L175-F178 PolarHBondContact O-N 2.91Å; L175-F179 PolarHBondContact O-N 3.35Å
176T98.4Very high98.1Very high63 Ų6352.9 Ų52.939%0.38728%0.284SS..Hα-helixtrans-61.1-44.4179.2-51.30000112.1P57 S172 F179 T180P57-T176 PolarHBondContact O-OG1 2.93Å; S172-T176 PolarHBondContact O-N 3.12Å; S172-T176 PolarHBondContact O-OG1 2.73Å; S172-T176 VanDerWaalsContact O-OG1 3.1Å; T176-F179 PolarHBondContact O-N 3.21Å; T176-T180 PolarHBondContact O-N 2.87Å; T176-T180 VanDerWaalsContact O-N 3.11Å; T176-T180 PolarHBondContact O-OG1 3.49Å; T176-T180 VanDerWaalsContact O-OG1 3.11Å
177R98.2Very high98.1Very high69 Ų6955.7 Ų55.726%0.2629%0.285SS..Hα-helixtrans-68.3-38.7176.466.6-174.468.2-155.4-11.5112.4W163 I164 P173 T174 L175 F179 T180 F181W163-R177 PolarHBondContact O-NH1 2.91Å; I164-R177 WeakPolarHBondContact O-CD 3.45Å; I164-R177 PolarHBondContact O-NE 3.39Å; I164-R177 PolarHBondContact O-NH1 3.47Å; P173-R177 WeakPolarHBondContact O-CG 3.19Å; P173-R177 PolarHBondContact O-N 2.92Å; P173-R177 PolarHBondContact O-NE 2.95Å; T174-R177 WeakPolarHBondContact O-CG 3.48Å; L175-R177 PolarHBondContact O-N 2.91Å; R177-F179 VanDerWaalsContact C-N 3.3Å; R177-F179 PolarHBondContact O-N 2.84Å; R177-T180 PolarHBondContact O-N 3.37Å; R177-F181 HydrophobicContact CB-CD2 4.34Å; R177-F181 HydrophobicContact CB-CE2 4.26Å; R177-F181 WeakPolarHBondContact O-CD2 3.28Å; R177-F181 PolarHBondContact O-N 3.45Å
178F98.6Very high98.3Very high11 Ų1158.1 Ų58.15%0.04829%0.291CS..Hα-helixtrans-66.1-37178.9-82.814.9000110.6F128 M129 V132 L133 T147 I164 T174 L175 H182F128-F178 AromaticContact CE1-CE2 3.9Å; F128-F178 HydrophobicContact CE1-CE2 3.9Å; F128-F178 HydrophobicContact CE1-CZ 4.19Å; F128-F178 HydrophobicContact CZ-CE2 4.47Å; M129-F178 HydrophobicContact CB-CB 4.25Å; M129-F178 HydrophobicContact CB-CD2 4.4Å; M129-F178 HydrophobicContact CB-CG 4.34Å; M129-F178 HydrophobicContact CG-CB 4.33Å; M129-F178 HydrophobicContact CG-CD1 4.19Å; M129-F178 HydrophobicContact CG-CD2 4.04Å; M129-F178 HydrophobicContact CG-CE2 4.4Å; M129-F178 HydrophobicContact CG-CG 3.94Å; M129-F178 HydrophobicContact SD-CD1 4.11Å; M129-F178 HydrophobicContact SD-CG 4.33Å; V132-F178 HydrophobicContact CB-CD2 3.93Å; V132-F178 HydrophobicContact CG1-CD2 3.97Å; V132-F178 HydrophobicContact CG1-CE2 4.5Å; V132-F178 HydrophobicContact CG2-CD2 3.88Å; V132-F178 HydrophobicContact CG2-CE2 4.04Å; L133-F178 HydrophobicContact CD2-CB 4.49Å; T147-F178 HydrophobicContact CG2-CZ 4.04Å; I164-F178 HydrophobicContact CG2-CE1 4.23Å; I164-F178 HydrophobicContact CG2-CZ 4.41Å; T174-F178 HydrophobicContact CG2-CD1 4.34Å; T174-F178 HydrophobicContact CG2-CD2 4.44Å; T174-F178 HydrophobicContact CG2-CE1 4.05Å; T174-F178 HydrophobicContact CG2-CE2 4.17Å; T174-F178 HydrophobicContact CG2-CZ 3.96Å; T174-F178 WeakPolarHBondContact O-CB 3.38Å; T174-F178 WeakPolarHBondContact O-CG 3.48Å; T174-F178 PolarHBondContact O-N 3.19Å; L175-F178 PolarHBondContact O-N 2.91Å; F178-H182 WeakPolarHBondContact O-CB 3.34Å; F178-H182 PolarHBondContact O-N 2.91Å
179F98.8Very high98.3Very high41 Ų4149 Ų4918%0.1826%0.255CS..Hα-helixtrans-59.3-50.1169.5175.6-109.1000111.7A52 Y55 P57 L133 L175 T176 R177 F181 H182 F183A52-F179 HydrophobicContact CB-CE2 4.22Å; A52-F179 HydrophobicContact CB-CZ 4.1Å; Y55-F179 AromaticContact CD1-CD2 3.62Å; Y55-F179 HydrophobicContact CD1-CD2 3.62Å; Y55-F179 AromaticContact CD1-CE2 3.62Å; Y55-F179 HydrophobicContact CD1-CE2 3.62Å; Y55-F179 HydrophobicContact CD1-CG 4.33Å; Y55-F179 HydrophobicContact CD1-CZ 4.32Å; Y55-F179 HydrophobicContact CE1-CB 4.33Å; Y55-F179 AromaticContact CE1-CD2 3.57Å; Y55-F179 HydrophobicContact CE1-CD2 3.57Å; Y55-F179 HydrophobicContact CE1-CE2 4.08Å; Y55-F179 HydrophobicContact CE1-CG 4.02Å; P57-F179 HydrophobicContact CB-CB 3.78Å; P57-F179 HydrophobicContact CB-CD1 3.96Å; P57-F179 HydrophobicContact CB-CG 3.89Å; P57-F179 HydrophobicContact CG-CD1 3.93Å; P57-F179 HydrophobicContact CG-CE1 4.42Å; P57-F179 HydrophobicContact CG-CG 4.36Å; L133-F179 HydrophobicContact CD1-CD2 4.05Å; L133-F179 HydrophobicContact CD2-CB 3.92Å; L175-F179 PolarHBondContact O-N 3.35Å; T176-F179 PolarHBondContact O-N 3.21Å; R177-F179 VanDerWaalsContact C-N 3.3Å; R177-F179 PolarHBondContact O-N 2.84Å; F179-F181 PolarHBondContact O-N 3.26Å; F179-H182 PolarHBondContact O-N 3.42Å; F179-F183 HydrophobicContact CZ-CD2 4.37Å; F179-F183 WeakPolarHBondContact O-CB 3.36Å; F179-F183 PolarHBondContact O-N 3.22Å
180T98.7Very high98.4Very high82 Ų8247.8 Ų47.850%0.50325%0.249SC..Hα-helixtrans-58.5-46.1178.5-58.30000112.4T176 R177 F183 I184T176-T180 PolarHBondContact O-N 2.87Å; T176-T180 VanDerWaalsContact O-N 3.11Å; T176-T180 PolarHBondContact O-OG1 3.49Å; T176-T180 VanDerWaalsContact O-OG1 3.11Å; R177-T180 PolarHBondContact O-N 3.37Å; T180-F183 PolarHBondContact O-N 2.85Å; T180-I184 WeakPolarHBondContact O-CG2 3.47Å; T180-I184 PolarHBondContact O-N 3.05Å; T180-I184 VanDerWaalsContact O-N 3.11Å
181F98.7Very high98.5Very high110 Ų11050.7 Ų50.748%0.48227%0.274SS..Hα-helixtrans-68.4-41.9178.2-74.5-57.8000112.5M129 R177 F179 F183 I184 L185M129-F181 HydrophobicContact CE-CB 3.77Å; M129-F181 HydrophobicContact SD-CB 3.47Å; M129-F181 WeakPolarHBondContact SD-CB 3.48Å; M129-F181 HydrophobicContact SD-CD2 4.48Å; M129-F181 HydrophobicContact SD-CG 4.32Å; R177-F181 HydrophobicContact CB-CD2 4.34Å; R177-F181 HydrophobicContact CB-CE2 4.26Å; R177-F181 WeakPolarHBondContact O-CD2 3.28Å; R177-F181 PolarHBondContact O-N 3.45Å; F179-F181 PolarHBondContact O-N 3.26Å; F181-F183 PolarHBondContact O-N 3.45Å; F181-I184 WeakPolarHBondContact O-CG2 3.33Å; F181-I184 PolarHBondContact O-N 3.49Å; F181-L185 WeakPolarHBondContact O-CB 3.43Å; F181-L185 WeakPolarHBondContact O-CG 3.19Å; F181-L185 PolarHBondContact O-N 3.38Å
182H98.8Very high98.6Very high28 Ų2848.5 Ų48.513%0.1326%0.261CS..Hα-helixtrans-61.3-33.9174.4179.972.6000111.9H83 T126 M129 G130 L133 F178 F179 P186H83-H182 AromaticContact NE2-NE2 3.96Å; T126-H182 PolarHBondContact O-CE1 3.38Å; T126-H182 PolarHBondContact O-ND1 2.98Å; M129-H182 HydrophobicContact CB-CB 4.1Å; G130-H182 WeakPolarHBondContact CA-CE1 3.49Å; G130-H182 VanDerWaalsContact CA-ND1 3.27Å; G130-H182 WeakPolarHBondContact CA-ND1 3.33Å; G130-H182 PolarHBondContact N-ND1 2.55Å; L133-H182 HydrophobicContact CD1-CB 4.31Å; F178-H182 WeakPolarHBondContact O-CB 3.34Å; F178-H182 PolarHBondContact O-N 2.91Å; F179-H182 PolarHBondContact O-N 3.42Å; H182-P186 WeakPolarHBondContact O-CD 3.37Å; H182-P186 WeakPolarHBondContact O-CG 3.2Å
183F98.8Very high98.6Very high79 Ų7948.8 Ų48.835%0.34627%0.265SS..Hα-helixtrans-72.5-43.2177.5-166.7-84000112.5L49 A52 F179 T180 F181 F187L49-F183 HydrophobicContact CD1-CE2 4.25Å; L49-F183 HydrophobicContact CD1-CZ 4.04Å; A52-F183 HydrophobicContact CB-CD2 4.26Å; A52-F183 HydrophobicContact CB-CE2 3.96Å; F179-F183 HydrophobicContact CZ-CD2 4.37Å; F179-F183 WeakPolarHBondContact O-CB 3.36Å; F179-F183 PolarHBondContact O-N 3.22Å; T180-F183 PolarHBondContact O-N 2.85Å; F181-F183 PolarHBondContact O-N 3.45Å; F183-F187 HydrophobicContact CD1-CE2 4.07Å; F183-F187 AromaticContact CE1-CE2 3.83Å; F183-F187 HydrophobicContact CE1-CE2 3.83Å; F183-F187 HydrophobicContact CE1-CZ 4.45Å; F183-F187 HydrophobicContact CZ-CE2 4.49Å; F183-F187 VanDerWaalsContact O-CD2 3.26Å; F183-F187 WeakPolarHBondContact O-CD2 3.43Å; F183-F187 VanDerWaalsContact O-CE2 3.25Å; F183-F187 WeakPolarHBondContact O-CE2 3.48Å
184I98.8Very high98.6Very high82 Ų8248.9 Ų48.942%0.42127%0.271SS..Hα-helixtrans-79.2-35-175.7-168.960.6000113.5T180 F181 F187 I188T180-I184 WeakPolarHBondContact O-CG2 3.47Å; T180-I184 PolarHBondContact O-N 3.05Å; T180-I184 VanDerWaalsContact O-N 3.11Å; F181-I184 WeakPolarHBondContact O-CG2 3.33Å; F181-I184 PolarHBondContact O-N 3.49Å; I184-F187 PolarHBondContact O-N 3.04Å; I184-F187 VanDerWaalsContact O-N 3.13Å; I184-I188 HydrophobicContact CG1-CD1 4.21Å; I184-I188 PolarHBondContact O-N 2.79Å
185L98.7Very high98.6Very high32 Ų3251.9 Ų51.917%0.16829%0.287CS..Hα-helixtrans-59.6-39.9-174.7-81.1177.7000114.8A125 T126 M129 F181 F187 I188 I189A125-L185 HydrophobicContact CB-CD1 4.14Å; T126-L185 HydrophobicContact CG2-CB 4.49Å; T126-L185 WeakPolarHBondContact OG1-CB 3.4Å; T126-L185 WeakPolarHBondContact OG1-CD1 2.98Å; M129-L185 HydrophobicContact CE-CD1 3.23Å; M129-L185 HydrophobicContact CE-CG 4.44Å; F181-L185 WeakPolarHBondContact O-CB 3.43Å; F181-L185 WeakPolarHBondContact O-CG 3.19Å; F181-L185 PolarHBondContact O-N 3.38Å; L185-F187 PolarHBondContact O-N 3.32Å; L185-I188 HydrophobicContact CD2-CD1 4.17Å; L185-I188 CarbonylContact O-C 3.34Å; L185-I188 WeakPolarHBondContact O-CA 3.37Å; L185-I188 WeakPolarHBondContact O-CB 3.46Å; L185-I188 PolarHBondContact O-N 2.89Å; L185-I189 WeakPolarHBondContact O-CG1 3.4Å; L185-I189 PolarHBondContact O-N 3.13Å
186P98.8Very high98.7Very high18 Ų1853.2 Ų53.212%0.11729%0.293CS..Hα-helixtrans-54.2-34.7174.6-29.134.7000114I45 T126 H182 I189 A190I45-P186 HydrophobicContact CD1-CB 4.2Å; I45-P186 HydrophobicContact CG1-CB 3.7Å; T126-P186 HydrophobicContact CG2-CG 3.89Å; H182-P186 WeakPolarHBondContact O-CD 3.37Å; H182-P186 WeakPolarHBondContact O-CG 3.2Å; P186-I189 PolarHBondContact O-N 2.93Å; P186-A190 PolarHBondContact O-N 3.5Å
187F98.7Very high98.7Very high96 Ų9653.7 Ų53.742%0.42129%0.293SS..Hα-helixtrans-74.4-35.7176.3-58.7-75.4000112.1I45 F183 I184 L185 I189 A190 A191I45-F187 HydrophobicContact CG2-CE1 4.02Å; I45-F187 HydrophobicContact CG2-CZ 4.21Å; F183-F187 HydrophobicContact CD1-CE2 4.07Å; F183-F187 AromaticContact CE1-CE2 3.83Å; F183-F187 HydrophobicContact CE1-CE2 3.83Å; F183-F187 HydrophobicContact CE1-CZ 4.45Å; F183-F187 HydrophobicContact CZ-CE2 4.49Å; F183-F187 VanDerWaalsContact O-CD2 3.26Å; F183-F187 WeakPolarHBondContact O-CD2 3.43Å; F183-F187 VanDerWaalsContact O-CE2 3.25Å; F183-F187 WeakPolarHBondContact O-CE2 3.48Å; I184-F187 PolarHBondContact O-N 3.04Å; I184-F187 VanDerWaalsContact O-N 3.13Å; L185-F187 PolarHBondContact O-N 3.32Å; F187-I189 VanDerWaalsContact C-N 3.34Å; F187-A190 WeakPolarHBondContact O-CB 3.5Å; F187-A190 PolarHBondContact O-N 3.48Å; F187-A191 PolarHBondContact O-N 3.2Å; F187-A191 VanDerWaalsContact O-N 3.08Å
188I98.8Very high98.6Very high79 Ų7955.1 Ų55.141%0.40531%0.305SS..Hα-helixtrans-64.3-42171.1-64.4168.4000110.1I184 L185 A190 A191 L192I184-I188 HydrophobicContact CG1-CD1 4.21Å; I184-I188 PolarHBondContact O-N 2.79Å; L185-I188 HydrophobicContact CD2-CD1 4.17Å; L185-I188 CarbonylContact O-C 3.34Å; L185-I188 WeakPolarHBondContact O-CA 3.37Å; L185-I188 WeakPolarHBondContact O-CB 3.46Å; L185-I188 PolarHBondContact O-N 2.89Å; I188-A190 VanDerWaalsContact C-N 3.31Å; I188-A190 PolarHBondContact O-N 3.07Å; I188-A191 PolarHBondContact O-N 3.32Å; I188-L192 HydrophobicContact CG2-CD1 4.04Å; I188-L192 HydrophobicContact CG2-CG 4.42Å; I188-L192 WeakPolarHBondContact O-CG 2.85Å; I188-L192 PolarHBondContact O-N 3.38Å
189I98.9Very high98.6Very high7 Ų757.8 Ų57.84%0.03632%0.317CS..Hα-helixtrans-60-41.7174.1-68.6167.1000110.5L41 L119 A122 T126 L185 P186 F187 A191 L192 A193L41-I189 HydrophobicContact CD1-CB 4.35Å; L41-I189 HydrophobicContact CD1-CG2 3.87Å; L41-I189 HydrophobicContact CD2-CG2 3.98Å; L119-I189 HydrophobicContact CD2-CG2 3.82Å; A122-I189 HydrophobicContact CB-CD1 4.16Å; A122-I189 HydrophobicContact CB-CG1 3.73Å; T126-I189 WeakPolarHBondContact OG1-CD1 3.27Å; L185-I189 WeakPolarHBondContact O-CG1 3.4Å; L185-I189 PolarHBondContact O-N 3.13Å; P186-I189 PolarHBondContact O-N 2.93Å; F187-I189 VanDerWaalsContact C-N 3.34Å; I189-A191 PolarHBondContact O-N 3.26Å; I189-L192 PolarHBondContact O-N 2.9Å; I189-A193 VanDerWaalsContact O-CB 3.3Å; I189-A193 WeakPolarHBondContact O-CB 3.43Å; I189-A193 PolarHBondContact O-N 2.87Å
190A98.8Very high98.6Very high39 Ų3957.6 Ų57.632%0.32232%0.317SS..Hα-helixtrans-61.3-42.5175.800000112.4L41 P186 F187 I188 A193 A194L41-A190 HydrophobicContact CD2-CB 3.96Å; P186-A190 PolarHBondContact O-N 3.5Å; F187-A190 WeakPolarHBondContact O-CB 3.5Å; F187-A190 PolarHBondContact O-N 3.48Å; I188-A190 VanDerWaalsContact C-N 3.31Å; I188-A190 PolarHBondContact O-N 3.07Å; A190-A193 PolarHBondContact O-N 3.04Å; A190-A194 PolarHBondContact O-N 3.48Å
191A98.8Very high98.5Very high64 Ų6456.9 Ų56.953%0.52931%0.308SS..Hα-helixtrans-64.9-43.5175.100000112.1F187 I188 I189 A193 A194 L195F187-A191 PolarHBondContact O-N 3.2Å; F187-A191 VanDerWaalsContact O-N 3.08Å; I188-A191 PolarHBondContact O-N 3.32Å; I189-A191 PolarHBondContact O-N 3.26Å; A191-A193 VanDerWaalsContact C-N 3.32Å; A191-A193 PolarHBondContact O-N 2.96Å; A191-A194 PolarHBondContact O-N 3.48Å; A191-L195 PolarHBondContact O-N 3.45Å
192L98.8Very high98.4Very high34 Ų3458.8 Ų58.818%0.17832%0.319CS..Hα-helixtrans-64.2-35.3175-72170.4000112.2I118 L119 I188 I189 L195 H196I118-L192 HydrophobicContact CG2-CD1 3.85Å; I118-L192 HydrophobicContact CG2-CD2 4.32Å; L119-L192 HydrophobicContact CD2-CB 3.55Å; L119-L192 HydrophobicContact CG-CB 4.07Å; I188-L192 HydrophobicContact CG2-CD1 4.04Å; I188-L192 HydrophobicContact CG2-CG 4.42Å; I188-L192 WeakPolarHBondContact O-CG 2.85Å; I188-L192 PolarHBondContact O-N 3.38Å; I189-L192 PolarHBondContact O-N 2.9Å; L192-L195 PolarHBondContact O-N 2.95Å; L192-H196 WeakPolarHBondContact O-CB 3.26Å; L192-H196 PolarHBondContact O-N 3.23Å
193A98.8Very high98.1Very high30 Ų3060.8 Ų60.825%0.24833%0.333CS..Hα-helixtrans-68-38176.100000111.5L119 I189 A190 A191 L195 H196 L197L119-A193 HydrophobicContact CD2-CB 4.38Å; I189-A193 VanDerWaalsContact O-CB 3.3Å; I189-A193 WeakPolarHBondContact O-CB 3.43Å; I189-A193 PolarHBondContact O-N 2.87Å; A190-A193 PolarHBondContact O-N 3.04Å; A191-A193 VanDerWaalsContact C-N 3.32Å; A191-A193 PolarHBondContact O-N 2.96Å; A193-L195 VanDerWaalsContact C-N 3.35Å; A193-H196 WeakPolarHBondContact O-CB 3.15Å; A193-H196 PolarHBondContact O-N 3.47Å; A193-L197 WeakPolarHBondContact O-CG 3.18Å; A193-L197 PolarHBondContact O-N 2.97Å
194A98.3Very high98Very high62 Ų6257.5 Ų57.551%0.51232%0.322SS..Hα-helixtrans-62.6-42.2171.300000111.5A190 A191 L197 L198A190-A194 PolarHBondContact O-N 3.48Å; A191-A194 PolarHBondContact O-N 3.48Å; A194-L197 PolarHBondContact O-N 3.2Å; A194-L198 PolarHBondContact O-N 3.01Å
195L98.5Very high97.9Very high63 Ų6355 Ų5533%0.3331%0.311SS..Hα-helixtrans-64.8-39.1174.3-177.761.3000112.4I115 A191 L192 A193 L197 L198 F199I115-L195 HydrophobicContact CD1-CD2 3.8Å; I115-L195 HydrophobicContact CD1-CG 4.38Å; I115-L195 HydrophobicContact CG1-CD2 4.41Å; I115-L195 HydrophobicContact CG1-CG 4.47Å; A191-L195 PolarHBondContact O-N 3.45Å; L192-L195 PolarHBondContact O-N 2.95Å; A193-L195 VanDerWaalsContact C-N 3.35Å; L195-L197 PolarHBondContact O-N 3.41Å; L195-L198 HydrophobicContact CD1-CD2 4.07Å; L195-L198 WeakPolarHBondContact O-CB 3.48Å; L195-L198 PolarHBondContact O-N 3.14Å; L195-F199 HydrophobicContact CD1-CD2 4.07Å; L195-F199 HydrophobicContact CD1-CE2 3.57Å; L195-F199 HydrophobicContact CD1-CZ 4.2Å; L195-F199 HydrophobicContact CD2-CE2 4.29Å; L195-F199 HydrophobicContact CG-CD2 4.09Å; L195-F199 HydrophobicContact CG-CE2 3.76Å; L195-F199 WeakPolarHBondContact O-CD2 3.39Å; L195-F199 PolarHBondContact O-N 3.4Å; L195-F199 VanDerWaalsContact O-N 3.13Å
196H98.6Very high97.9Very high29 Ų2953.7 Ų53.713%0.13430%0.304CS..Hα-helixtrans-60.1-45.2175-174.481.4000111.5T112 I115 L119 L192 A193 L200T112-H196 WeakPolarHBondContact CG2-CE1 3.23Å; T112-H196 PolarHBondContact O-CE1 3.21Å; T112-H196 PolarHBondContact O-ND1 3.15Å; I115-H196 HydrophobicContact CB-CB 4.48Å; I115-H196 HydrophobicContact CG2-CB 3.67Å; L119-H196 HydrophobicContact CD1-CB 3.8Å; L192-H196 WeakPolarHBondContact O-CB 3.26Å; L192-H196 PolarHBondContact O-N 3.23Å; A193-H196 WeakPolarHBondContact O-CB 3.15Å; A193-H196 PolarHBondContact O-N 3.47Å; H196-L200 WeakPolarHBondContact O-CB 3.08Å; H196-L200 PolarHBondContact O-N 3.13Å
197L98.2Very high97.9Very high73 Ų7353 Ų5338%0.38230%0.3SS..Hα-helixtrans-68.5-33.8176.3-69.9174.9000112.4A193 A194 L195 L200 H201A193-L197 WeakPolarHBondContact O-CG 3.18Å; A193-L197 PolarHBondContact O-N 2.97Å; A194-L197 PolarHBondContact O-N 3.2Å; L195-L197 PolarHBondContact O-N 3.41Å; L197-L200 HydrophobicContact CD2-CD2 4.12Å; L197-L200 PolarHBondContact O-N 2.93Å; L197-H201 WeakPolarHBondContact O-CB 3.49Å; L197-H201 PolarHBondContact O-CD2 3.27Å; L197-H201 PolarHBondContact O-N 2.9Å
198L97.6Very high97.9Very high98 Ų9849.1 Ų49.151%0.51328%0.284SS..Hα-helixtrans-57.8-54.2174.1-17478.6000110.6A194 L195 L200 H201 E202A194-L198 PolarHBondContact O-N 3.01Å; L195-L198 HydrophobicContact CD1-CD2 4.07Å; L195-L198 WeakPolarHBondContact O-CB 3.48Å; L195-L198 PolarHBondContact O-N 3.14Å; L198-L200 VanDerWaalsContact C-N 3.3Å; L198-L200 PolarHBondContact O-N 3.45Å; L198-H201 PolarHBondContact O-N 3.2Å; L198-H201 VanDerWaalsContact O-N 3.07Å; L198-E202 PolarHBondContact O-N 3.36Å
199F98.3Very high97.9Very high68 Ų6848 Ų4830%0.29828%0.279SS..Hα-helixtrans-63.7-34.1177.5-72.7-58.8000113E111 T112 I115 L195 H201 E202E111-F199 HydrophobicContact CB-CB 4.04Å; E111-F199 HydrophobicContact CB-CD1 3.64Å; E111-F199 HydrophobicContact CB-CD2 3.98Å; E111-F199 HydrophobicContact CB-CE1 4.01Å; E111-F199 HydrophobicContact CB-CE2 4.3Å; E111-F199 HydrophobicContact CB-CG 3.63Å; E111-F199 HydrophobicContact CB-CZ 4.32Å; E111-F199 HydrophobicContact CG-CD1 4.05Å; E111-F199 HydrophobicContact CG-CE1 4.04Å; E111-F199 HydrophobicContact CG-CZ 4.49Å; T112-F199 WeakPolarHBondContact OG1-CB 3.37Å; I115-F199 HydrophobicContact CG1-CD2 4.01Å; I115-F199 HydrophobicContact CG1-CE2 4.07Å; L195-F199 HydrophobicContact CD1-CD2 4.07Å; L195-F199 HydrophobicContact CD1-CE2 3.57Å; L195-F199 HydrophobicContact CD1-CZ 4.2Å; L195-F199 HydrophobicContact CD2-CE2 4.29Å; L195-F199 HydrophobicContact CG-CD2 4.09Å; L195-F199 HydrophobicContact CG-CE2 3.76Å; L195-F199 WeakPolarHBondContact O-CD2 3.39Å; L195-F199 PolarHBondContact O-N 3.4Å; L195-F199 VanDerWaalsContact O-N 3.13Å; F199-H201 VanDerWaalsContact C-N 3.32Å; F199-H201 PolarHBondContact O-N 3.09Å; F199-E202 PolarHBondContact O-N 3.2Å
200L97.9Very high97.8Very high36 Ų3648.2 Ų48.219%0.18828%0.282CS..Hα-helixtrans-62.9-38.9172.5179.664.1000111.8T112 H196 L197 L198 E202 T203 G204T112-L200 HydrophobicContact CG2-CB 4.17Å; T112-L200 HydrophobicContact CG2-CD1 4.47Å; T112-L200 PolarHBondContact OG1-N 3.28Å; H196-L200 WeakPolarHBondContact O-CB 3.08Å; H196-L200 PolarHBondContact O-N 3.13Å; L197-L200 HydrophobicContact CD2-CD2 4.12Å; L197-L200 PolarHBondContact O-N 2.93Å; L198-L200 VanDerWaalsContact C-N 3.3Å; L198-L200 PolarHBondContact O-N 3.45Å; L200-E202 VanDerWaalsContact C-N 3.33Å; L200-E202 PolarHBondContact O-N 2.96Å; L200-T203 PolarHBondContact O-N 3.44Å; L200-T203 PolarHBondContact O-OG1 3.02Å; L200-G204 VanDerWaalsContact O-CA 3.31Å; L200-G204 WeakPolarHBondContact O-CA 3.36Å; L200-G204 PolarHBondContact O-N 3.02Å
201H96.8Very high97.7Very high67 Ų6751.2 Ų51.231%0.3129%0.292SS..Hα-helixtrans-73.5-22.8-178.5-69.8169.9000113.6L197 L198 F199 T203L197-H201 WeakPolarHBondContact O-CB 3.49Å; L197-H201 PolarHBondContact O-CD2 3.27Å; L197-H201 PolarHBondContact O-N 2.9Å; L198-H201 PolarHBondContact O-N 3.2Å; L198-H201 VanDerWaalsContact O-N 3.07Å; F199-H201 VanDerWaalsContact C-N 3.32Å; F199-H201 PolarHBondContact O-N 3.09Å; H201-T203 VanDerWaalsContact C-N 3.31Å; H201-T203 PolarHBondContact O-N 2.59Å
202E96.1Very high97.6Very high150 Ų15052.8 Ų52.870%0.70130%0.295SS*.Hα-helixtrans-62.1-38.3172.3-67.8-59.7131.500112.1L198 F199 L200L198-E202 PolarHBondContact O-N 3.36Å; F199-E202 PolarHBondContact O-N 3.2Å; L200-E202 VanDerWaalsContact C-N 3.33Å; L200-E202 PolarHBondContact O-N 2.96Å
203T94.4Very high97.5Very high71 Ų7152 Ų5244%0.43629%0.293SS..Hα-helixtrans-100.5-28.9-17852.60000113.1Y109 L200 H201Y109-T203 HydrophobicContact CD1-CG2 4.17Å; Y109-T203 HydrophobicContact CE1-CG2 4.43Å; L200-T203 PolarHBondContact O-N 3.44Å; L200-T203 PolarHBondContact O-OG1 3.02Å; H201-T203 VanDerWaalsContact C-N 3.31Å; H201-T203 PolarHBondContact O-N 2.59Å
204G95.5Very high97.3Very high10 Ų1057.4 Ų57.410%0.10331%0.312CS..  trans79.6169.9-166.200000112.6L200L200-G204 VanDerWaalsContact O-CA 3.31Å; L200-G204 WeakPolarHBondContact O-CA 3.36Å; L200-G204 PolarHBondContact O-N 3.02Å
205S97.2Very high97.2Very high29 Ų2960.1 Ų60.120%0.20333%0.328CS..  trans-67.1139.7178.6-740000112.5P24P24-S205 WeakPolarHBondContact CG-O 3.38Å
206N98.1Very high97.2Very high5 Ų561.1 Ų61.13%0.02733%0.333CS..  trans-64.9174.5159.5-172.721.6000110.2I27 W31 Y104 S106 Y109 Q313I27-N206 WeakPolarHBondContact CG2-O 3.44Å; W31-N206 VanDerWaalsContact CE2-O 3.28Å; W31-N206 HydrophobicContact CZ2-CB 4.3Å; W31-N206 VanDerWaalsContact CZ2-O 3.26Å; W31-N206 WeakPolarHBondContact CZ2-O 3.38Å; W31-N206 PolarHBondContact NE1-O 3.36Å; Y104-N206 PolarHBondContact O-ND2 3.49Å; S106-N206 PolarHBondContact OG-ND2 2.95Å; Y109-N206 HydrophobicContact CE2-CB 3.68Å; N206-Q313 PolarHBondContact ND2-NE2 2.74Å
207N98.6Very high97.1Very high4 Ų463 Ų632%0.02134%0.341CS..  trans-140.5167.6175.569.985.2000112.7P24 N26 I27 L209 G210 I211P24-N207 HydrophobicContact CB-CB 3.87Å; P24-N207 HydrophobicContact CG-CB 4.19Å; N26-N207 PolarHBondContact ND2-OD1 2.88Å; N26-N207 WeakPolarHBondContact OD1-CB 3.11Å; I27-N207 HydrophobicContact CG2-CB 4.14Å; N207-L209 PolarHBondContact O-N 3.41Å; N207-L209 VanDerWaalsContact O-N 3.13Å; N207-L209 WeakPolarHBondContact OD1-CB 3.46Å; N207-L209 PolarHBondContact OD1-N 3.28Å; N207-L209 VanDerWaalsContact OD1-N 3.1Å; N207-G210 PolarHBondContact O-N 3.38Å; N207-I211 PolarHBondContact ND2-O 3.06Å
208P98.6Very high97.1Very high14 Ų1461.5 Ų61.59%0.09133%0.333CS..THydrogen-bonded Turntrans-56.9-31.6-173.9-3037.4000115.5N26 W31 Y104 G210 S314 M316N26-P208 VanDerWaalsContact O-CD 3.26Å; N26-P208 WeakPolarHBondContact O-CD 3.42Å; N26-P208 WeakPolarHBondContact O-CG 3.39Å; W31-P208 HydrophobicContact CH2-CG 4.07Å; W31-P208 HydrophobicContact CZ3-CG 3.82Å; Y104-P208 VanDerWaalsContact CD1-CA 3.48Å; Y104-P208 HydrophobicContact CD1-CB 4.21Å; Y104-P208 WeakPolarHBondContact CD1-O 3.47Å; Y104-P208 VanDerWaalsContact CE1-CA 3.46Å; Y104-P208 HydrophobicContact CE1-CB 3.65Å; Y104-P208 HydrophobicContact CE1-CG 4.4Å; P208-G210 VanDerWaalsContact C-N 3.3Å; P208-G210 PolarHBondContact O-N 2.83Å; P208-S314 WeakPolarHBondContact O-CB 3.43Å; P208-S314 PolarHBondContact O-OG 2.85Å; P208-M316 HydrophobicContact CB-SD 4.31Å
209L98.3Very high97.1Very high55 Ų5559.7 Ų59.729%0.28833%0.326SS..THydrogen-bonded Turntrans-75.6-19.9-178.4-57.5178.9000112.5N207 I211 M316 F317N207-L209 PolarHBondContact O-N 3.41Å; N207-L209 VanDerWaalsContact O-N 3.13Å; N207-L209 WeakPolarHBondContact OD1-CB 3.46Å; N207-L209 PolarHBondContact OD1-N 3.28Å; N207-L209 VanDerWaalsContact OD1-N 3.1Å; L209-I211 HydrophobicContact CB-CD1 4.21Å; L209-I211 HydrophobicContact CB-CG1 3.84Å; L209-I211 HydrophobicContact CD1-CD1 3.97Å; L209-I211 HydrophobicContact CD1-CG1 4.33Å; L209-I211 PolarHBondContact O-N 3.09Å; L209-M316 HydrophobicContact CD2-CE 3.69Å; L209-M316 HydrophobicContact CD2-SD 3.47Å; L209-M316 WeakPolarHBondContact CD2-SD 3.37Å; L209-F317 HydrophobicContact CB-CE2 4.46Å; L209-F317 HydrophobicContact CD2-CE2 4.2Å; L209-F317 HydrophobicContact CD2-CZ 3.81Å
210G97.4Very high97.1Very high11 Ų1157.9 Ų57.911%0.11332%0.318CS..  trans63.926.8-176.100000113.9N207 P208N207-G210 PolarHBondContact O-N 3.38Å; P208-G210 VanDerWaalsContact C-N 3.3Å; P208-G210 PolarHBondContact O-N 2.83Å
211I97Very high97.2Very high102 Ų10260.7 Ų60.752%0.52333%0.33SS..SBendtrans-116.6163.4173.464.7178.8000109.6N207 L209 S213N207-I211 PolarHBondContact ND2-O 3.06Å; L209-I211 HydrophobicContact CB-CD1 4.21Å; L209-I211 HydrophobicContact CB-CG1 3.84Å; L209-I211 HydrophobicContact CD1-CD1 3.97Å; L209-I211 HydrophobicContact CD1-CG1 4.33Å; L209-I211 PolarHBondContact O-N 3.09Å; I211-S213 PolarHBondContact O-N 3.12Å
212T96.6Very high97.2Very high98 Ų9860.6 Ų60.660%0.60134%0.336SS*.  trans-59.2134.8176.1-177.50000111.7H214T212-H214 PolarHBondContact OG1-CD2 2.99Å; T212-H214 PolarHBondContact OG1-N 2.98Å
213S96.6Very high97.3Very high17 Ų1759.8 Ų59.812%0.11933%0.327CS..  trans-105.91417879.10000112.8P24 I211 S215 D216 K217P24-S213 WeakPolarHBondContact CB-OG 3.38Å; P24-S213 WeakPolarHBondContact CG-OG 3.29Å; I211-S213 PolarHBondContact O-N 3.12Å; S213-S215 PolarHBondContact O-N 3.44Å; S213-D216 CarbonylContact O-C 3.51Å; S213-D216 VanDerWaalsContact O-C 3.26Å; S213-D216 PolarHBondContact O-N 2.78Å; S213-K217 VanDerWaalsContact O-CG 3.28Å; S213-K217 WeakPolarHBondContact O-CG 3.24Å
214H95.2Very high97.5Very high144 Ų14456.9 Ų56.967%0.66731%0.308SS*.THydrogen-bonded Turntrans-59.4-30.2-176.6-70.7-58.6000113.1T212 D216T212-H214 PolarHBondContact OG1-CD2 2.99Å; T212-H214 PolarHBondContact OG1-N 2.98Å; H214-D216 VanDerWaalsContact C-N 3.26Å; H214-D216 PolarHBondContact O-N 2.77Å
215S96.4Very high97.6Very high119 Ų11958.7 Ų58.783%0.83232%0.317SS*.THydrogen-bonded Turntrans-69.7-21.3177.155.70000113.7S213S213-S215 PolarHBondContact O-N 3.44Å
216D97.4Very high97.7Very high84 Ų8462.9 Ų62.945%0.44934%0.336SS..SBendtrans-145.384-176.9-172.718.1000111.2S25 S213 H214S25-D216 VanDerWaalsContact CB-OD2 3.27Å; S25-D216 WeakPolarHBondContact CB-OD2 3.26Å; S25-D216 PolarHBondContact N-O 3.08Å; S25-D216 PolarHBondContact OG-OD2 3.45Å; S213-D216 CarbonylContact O-C 3.51Å; S213-D216 VanDerWaalsContact O-C 3.26Å; S213-D216 PolarHBondContact O-N 2.78Å; H214-D216 VanDerWaalsContact C-N 3.26Å; H214-D216 PolarHBondContact O-N 2.77Å
217K97.9Very high97.7Very high68 Ų6865.1 Ų65.130%0.29635%0.346SS..EExtended strand (participates in β ladder)trans-113.9140.4170.4-64.9-164.7175.3-1700109.9P22 T23 S213P22-K217 HydrophobicContact CB-CB 4.16Å; P22-K217 HydrophobicContact CB-CD 3.62Å; T23-K217 WeakPolarHBondContact O-CA 3.32Å; S213-K217 VanDerWaalsContact O-CG 3.28Å; S213-K217 WeakPolarHBondContact O-CG 3.24Å
218I98.3Very high97.7Very high41 Ų4166.4 Ų66.421%0.2135%0.353CS..EExtended strand (participates in β ladder)trans-112157.917162.6-178.1000109.4T23 Y223 Y224T23-I218 PolarHBondContact N-O 3.22Å; T23-I218 PolarHBondContact O-N 3Å; I218-Y223 HydrophobicContact CB-CD2 4.06Å; I218-Y223 HydrophobicContact CB-CE2 4.22Å; I218-Y223 HydrophobicContact CD1-CD1 4.31Å; I218-Y223 HydrophobicContact CD1-CD2 3.82Å; I218-Y223 HydrophobicContact CD1-CE2 4.49Å; I218-Y223 HydrophobicContact CD1-CG 3.71Å; I218-Y223 HydrophobicContact CG1-CD2 4.19Å; I218-Y224 HydrophobicContact CD1-CE2 3.7Å; I218-Y224 HydrophobicContact CG1-CD2 4.5Å; I218-Y224 HydrophobicContact CG1-CE2 3.74Å
219T97.6Very high97.7Very high61 Ų6168.2 Ų68.237%0.37437%0.369SS..EExtended strand (participates in β ladder)trans-68.5145.8172.252.20000110.5H221T219-H221 WeakPolarHBondContact CB-O 3.39Å; T219-H221 PolarHBondContact O-N 3.32Å; T219-H221 PolarHBondContact OG1-O 2.93Å
220F98.4Very high97.8Very high29 Ų2970.4 Ų70.413%0.12738%0.38CS..SBendtrans-60.6-45179.1-170.4-82.7000112.1F18 I19 L21 P222 Y223 Y224 T225F18-F220 WeakPolarHBondContact O-CD1 3.41Å; I19-F220 PolarHBondContact O-N 3.46Å; L21-F220 HydrophobicContact CB-CB 3.95Å; L21-F220 HydrophobicContact CD2-CD2 4.23Å; L21-F220 PolarHBondContact O-N 3.42Å; F220-P222 CarbonylContact O-C 2.91Å; F220-Y223 PolarHBondContact O-N 2.71Å; F220-Y224 VanDerWaalsContact CD2-CB 3.48Å; F220-Y224 HydrophobicContact CD2-CD2 4.18Å; F220-Y224 HydrophobicContact CD2-CG 4.15Å; F220-Y224 HydrophobicContact CE2-CG 4.22Å; F220-Y224 WeakPolarHBondContact O-CA 3.47Å; F220-Y224 PolarHBondContact O-N 2.95Å; F220-T225 HydrophobicContact CD1-CG2 3.67Å; F220-T225 HydrophobicContact CE1-CG2 3.68Å; F220-T225 PolarHBondContact O-N 3.29Å
221H98.1Very high97.8Very high96 Ų9670.4 Ų70.444%0.44438%0.38SS..THydrogen-bonded Turntrans-90.1133.8169.5-174.871.7000110.6I19 T219 T225I19-H221 HydrophobicContact CG2-CB 4.11Å; I19-H221 PolarHBondContact O-N 2.89Å; T219-H221 WeakPolarHBondContact CB-O 3.39Å; T219-H221 PolarHBondContact O-N 3.32Å; T219-H221 PolarHBondContact OG1-O 2.93Å; H221-T225 HydrophobicContact CB-CG2 3.95Å; H221-T225 PolarHBondContact ND1-OG1 3.37Å
222P98Very high97.9Very high65 Ų6568.7 Ų68.742%0.42237%0.372SS..THydrogen-bonded Turncis-88.8-16.22.635.1-35.4000115F220 Y224 T225 I226F220-P222 CarbonylContact O-C 2.91Å; P222-Y224 PolarHBondContact O-N 3.45Å; P222-T225 VanDerWaalsContact C-OG1 3.27Å; P222-T225 WeakPolarHBondContact CA-OG1 3.44Å; P222-T225 PolarHBondContact O-N 2.8Å; P222-T225 PolarHBondContact O-OG1 2.89Å; P222-I226 WeakPolarHBondContact O-CG2 3.45Å; P222-I226 PolarHBondContact O-N 3.48Å
223Y98.5Very high98Very high133 Ų13369.3 Ų69.352%0.52237%0.371SS..Hα-helixtrans-57.8-53.6-164.2-61.5-76.9000114.3I218 F220 I226 K227I218-Y223 HydrophobicContact CB-CD2 4.06Å; I218-Y223 HydrophobicContact CB-CE2 4.22Å; I218-Y223 HydrophobicContact CD1-CD1 4.31Å; I218-Y223 HydrophobicContact CD1-CD2 3.82Å; I218-Y223 HydrophobicContact CD1-CE2 4.49Å; I218-Y223 HydrophobicContact CD1-CG 3.71Å; I218-Y223 HydrophobicContact CG1-CD2 4.19Å; F220-Y223 PolarHBondContact O-N 2.71Å; Y223-I226 VanDerWaalsContact O-CG2 3.29Å; Y223-I226 WeakPolarHBondContact O-CG2 3.48Å; Y223-K227 WeakPolarHBondContact O-CB 3.35Å; Y223-K227 PolarHBondContact O-N 3.41Å
224Y98.3Very high98.1Very high9 Ų973.4 Ų73.44%0.03539%0.391CS..Hα-helixtrans-83.1-26-179.5-66.6-60.2000112.3T23 P24 S25 I27 I218 F220 P222 I226 K227 D228T23-Y224 HydrophobicContact CG2-CD2 3.49Å; T23-Y224 VanDerWaalsContact CG2-CD2 3.49Å; T23-Y224 HydrophobicContact CG2-CE2 3.29Å; T23-Y224 HydrophobicContact CG2-CG 4.33Å; P24-Y224 PolarHBondContact O-OH 3.46Å; S25-Y224 VanDerWaalsContact C-OH 3.25Å; S25-Y224 PolarHBondContact O-OH 2.95Å; S25-Y224 VanDerWaalsContact O-OH 3.14Å; I27-Y224 HydrophobicContact CD1-CD1 3.79Å; I27-Y224 HydrophobicContact CD1-CD2 4.46Å; I27-Y224 HydrophobicContact CD1-CE1 3.51Å; I27-Y224 HydrophobicContact CD1-CE2 4.16Å; I27-Y224 HydrophobicContact CD1-CG 4.3Å; I27-Y224 HydrophobicContact CG1-CD1 4.04Å; I27-Y224 HydrophobicContact CG1-CE1 3.23Å; I27-Y224 HydrophobicContact CG1-CE2 4.14Å; I27-Y224 WeakPolarHBondContact CG1-OH 3.43Å; I218-Y224 HydrophobicContact CD1-CE2 3.7Å; I218-Y224 HydrophobicContact CG1-CD2 4.5Å; I218-Y224 HydrophobicContact CG1-CE2 3.74Å; F220-Y224 VanDerWaalsContact CD2-CB 3.48Å; F220-Y224 HydrophobicContact CD2-CD2 4.18Å; F220-Y224 HydrophobicContact CD2-CG 4.15Å; F220-Y224 HydrophobicContact CE2-CG 4.22Å; F220-Y224 WeakPolarHBondContact O-CA 3.47Å; F220-Y224 PolarHBondContact O-N 2.95Å; P222-Y224 PolarHBondContact O-N 3.45Å; Y224-I226 PolarHBondContact O-N 2.75Å; Y224-K227 HydrophobicContact CD1-CD 3.92Å; Y224-K227 HydrophobicContact CE1-CD 4.03Å; Y224-K227 PolarHBondContact O-N 3.17Å; Y224-D228 WeakPolarHBondContact O-CB 3.34Å; Y224-D228 VanDerWaalsContact O-CG 3.31Å; Y224-D228 PolarHBondContact O-N 3.45Å
225T98.4Very high98.3Very high48 Ų4867.1 Ų67.129%0.29436%0.362SS..Hα-helixtrans-61.1-44.1170.454.10000112.6F220 H221 P222 A229F220-T225 HydrophobicContact CD1-CG2 3.67Å; F220-T225 HydrophobicContact CE1-CG2 3.68Å; F220-T225 PolarHBondContact O-N 3.29Å; H221-T225 HydrophobicContact CB-CG2 3.95Å; H221-T225 PolarHBondContact ND1-OG1 3.37Å; P222-T225 VanDerWaalsContact C-OG1 3.27Å; P222-T225 WeakPolarHBondContact CA-OG1 3.44Å; P222-T225 PolarHBondContact O-N 2.8Å; P222-T225 PolarHBondContact O-OG1 2.89Å; T225-A229 WeakPolarHBondContact O-CB 3.3Å; T225-A229 PolarHBondContact O-N 3.21Å
226I98.5Very high98.4Very high118 Ų11864.9 Ų64.961%0.60534%0.34SS*.Hα-helixtrans-73.8-36.6179.2-168.561000111.6P222 Y223 Y224 A229 L230P222-I226 WeakPolarHBondContact O-CG2 3.45Å; P222-I226 PolarHBondContact O-N 3.48Å; Y223-I226 VanDerWaalsContact O-CG2 3.29Å; Y223-I226 WeakPolarHBondContact O-CG2 3.48Å; Y224-I226 PolarHBondContact O-N 2.75Å; I226-A229 PolarHBondContact O-N 3.44Å; I226-L230 PolarHBondContact O-N 2.72Å
227K98.6Very high98.4Very high52 Ų5266.1 Ų66.123%0.22635%0.346CS..Hα-helixtrans-64.6-40.8175.7-173.3-177.4164.9-147.30111.6I27 S28 N32 Y223 Y224 L230 G231I27-K227 PolarHBondContact O-NZ 2.69Å; S28-K227 VanDerWaalsContact C-NZ 3.26Å; S28-K227 PolarHBondContact O-NZ 3Å; N32-K227 PolarHBondContact ND2-O 3.24Å; N32-K227 VanDerWaalsContact ND2-O 3.09Å; N32-K227 WeakPolarHBondContact OD1-CE 3.01Å; N32-K227 PolarHBondContact OD1-NZ 2.84Å; Y223-K227 WeakPolarHBondContact O-CB 3.35Å; Y223-K227 PolarHBondContact O-N 3.41Å; Y224-K227 HydrophobicContact CD1-CD 3.92Å; Y224-K227 HydrophobicContact CE1-CD 4.03Å; Y224-K227 PolarHBondContact O-N 3.17Å; K227-L230 PolarHBondContact O-N 3.38Å; K227-G231 PolarHBondContact O-N 2.79Å
228D98.6Very high98.5Very high31 Ų3165.2 Ų65.217%0.16635%0.349CS..Hα-helixtrans-70.2-37.3176.7-78.511000111.6N32 S35 Y224 L230 G231 L232N32-D228 PolarHBondContact ND2-OD1 2.71Å; S35-D228 WeakPolarHBondContact CB-OD2 3.43Å; S35-D228 PolarHBondContact OG-OD2 3.33Å; Y224-D228 WeakPolarHBondContact O-CB 3.34Å; Y224-D228 VanDerWaalsContact O-CG 3.31Å; Y224-D228 PolarHBondContact O-N 3.45Å; D228-L230 VanDerWaalsContact C-N 3.33Å; D228-L230 PolarHBondContact O-N 2.8Å; D228-G231 PolarHBondContact O-N 3.36Å; D228-L232 WeakPolarHBondContact O-CB 3.38Å; D228-L232 PolarHBondContact O-N 3.46Å
229A98.6Very high98.5Very high52 Ų5263.3 Ų63.343%0.4334%0.339SS..Hα-helixtrans-60.2-40.9171.700000112.3T225 I226 L232 L233T225-A229 WeakPolarHBondContact O-CB 3.3Å; T225-A229 PolarHBondContact O-N 3.21Å; I226-A229 PolarHBondContact O-N 3.44Å; A229-L232 PolarHBondContact O-N 3.3Å; A229-L233 PolarHBondContact O-N 3.47Å
230L98.7Very high98.5Very high100 Ų10063.4 Ų63.452%0.52434%0.336SS..Hα-helixtrans-63.1-45.3172.9176.562.4000111.6I226 K227 D228 L232 L233 L234I226-L230 PolarHBondContact O-N 2.72Å; K227-L230 PolarHBondContact O-N 3.38Å; D228-L230 VanDerWaalsContact C-N 3.33Å; D228-L230 PolarHBondContact O-N 2.8Å; L230-L232 VanDerWaalsContact C-N 3.32Å; L230-L232 PolarHBondContact O-N 3.31Å; L230-L233 PolarHBondContact O-N 2.89Å; L230-L234 WeakPolarHBondContact O-CG 3.4Å; L230-L234 PolarHBondContact O-N 3.3Å; L230-L234 VanDerWaalsContact O-N 3.08Å
231G98.7Very high98.5Very high12 Ų1265.1 Ų65.112%0.12435%0.349CS..Hα-helixtrans-57.9-44.4175.400000112.2K227 D228 L234 F235K227-G231 PolarHBondContact O-N 2.79Å; D228-G231 PolarHBondContact O-N 3.36Å; G231-L234 PolarHBondContact O-N 3.35Å; G231-F235 WeakPolarHBondContact O-CB 3.41Å; G231-F235 PolarHBondContact O-N 3.07Å
232L98.8Very high98.6Very high65 Ų6561.5 Ų61.534%0.3433%0.332SS..Hα-helixtrans-63.4-40.5176.8-178.862.3000112L36 A39 D228 A229 L230 F235 L236L36-L232 HydrophobicContact CD2-CB 4.49Å; L36-L232 HydrophobicContact CD2-CD1 4.5Å; A39-L232 HydrophobicContact CB-CD1 3.72Å; D228-L232 WeakPolarHBondContact O-CB 3.38Å; D228-L232 PolarHBondContact O-N 3.46Å; A229-L232 PolarHBondContact O-N 3.3Å; L230-L232 VanDerWaalsContact C-N 3.32Å; L230-L232 PolarHBondContact O-N 3.31Å; L232-F235 HydrophobicContact CD1-CD1 4.18Å; L232-F235 WeakPolarHBondContact O-CB 3.46Å; L232-F235 PolarHBondContact O-N 3.06Å; L232-L236 HydrophobicContact CD1-CD1 4.29Å; L232-L236 HydrophobicContact CD1-CG 4.17Å; L232-L236 HydrophobicContact CG-CD1 4.08Å; L232-L236 HydrophobicContact CG-CG 4.38Å; L232-L236 WeakPolarHBondContact O-CB 3.01Å; L232-L236 VanDerWaalsContact O-CG 3.32Å; L232-L236 WeakPolarHBondContact O-CG 3.49Å; L232-L236 PolarHBondContact O-N 3.11Å
233L98.8Very high98.6Very high112 Ų11258.4 Ų58.459%0.58631%0.313SS*.Hα-helixtrans-60.7-45.9176.1178.764.7000111.6A229 L230 L236 L237A229-L233 PolarHBondContact O-N 3.47Å; L230-L233 PolarHBondContact O-N 2.89Å; L233-L236 PolarHBondContact O-N 3.05Å; L233-L237 WeakPolarHBondContact O-CB 3.43Å; L233-L237 PolarHBondContact O-N 2.7Å
234L98.7Very high98.6Very high103 Ų10356 Ų5654%0.53931%0.308SS..Hα-helixtrans-65.7-40.4177.6-66.2175.8000111.9L230 G231 L237 S238L230-L234 WeakPolarHBondContact O-CG 3.4Å; L230-L234 PolarHBondContact O-N 3.3Å; L230-L234 VanDerWaalsContact O-N 3.08Å; G231-L234 PolarHBondContact O-N 3.35Å; L234-L237 PolarHBondContact O-N 3.41Å; L234-S238 PolarHBondContact O-N 2.91Å; L234-S238 PolarHBondContact O-OG 2.99Å
235F98.6Very high98.6Very high11 Ų1163.6 Ų63.65%0.04834%0.341CS..Hα-helixtrans-58.1-52.7172.9168.5-90000111.3L36 C40 M89 G231 L232 L237 S238 L239L36-F235 HydrophobicContact CD1-CB 4.44Å; L36-F235 HydrophobicContact CD2-CB 3.64Å; L36-F235 HydrophobicContact CD2-CD2 4.38Å; L36-F235 HydrophobicContact CD2-CG 4.02Å; C40-F235 WeakPolarHBondContact SG-CE2 3.49Å; C40-F235 WeakPolarHBondContact SG-CZ 3.5Å; M89-F235 HydrophobicContact CB-CE2 3.69Å; M89-F235 HydrophobicContact CB-CZ 4.07Å; M89-F235 HydrophobicContact CE-CD2 3.87Å; M89-F235 HydrophobicContact CE-CE2 3.97Å; M89-F235 HydrophobicContact CG-CE2 4.42Å; G231-F235 WeakPolarHBondContact O-CB 3.41Å; G231-F235 PolarHBondContact O-N 3.07Å; L232-F235 HydrophobicContact CD1-CD1 4.18Å; L232-F235 WeakPolarHBondContact O-CB 3.46Å; L232-F235 PolarHBondContact O-N 3.06Å; F235-L237 VanDerWaalsContact C-N 3.31Å; F235-L237 PolarHBondContact O-N 3.35Å; F235-S238 PolarHBondContact O-N 3.02Å; F235-S238 PolarHBondContact O-OG 3.47Å; F235-L239 HydrophobicContact CE1-CD2 4.1Å; F235-L239 HydrophobicContact CZ-CD2 4.34Å; F235-L239 PolarHBondContact O-N 3.33Å
236L98.6Very high98.6Very high73 Ų7363.3 Ų63.338%0.38234%0.342SS..Hα-helixtrans-62.1-40.1179.7-71.9174.2000111.2L232 L233 S238 L239 M240L232-L236 HydrophobicContact CD1-CD1 4.29Å; L232-L236 HydrophobicContact CD1-CG 4.17Å; L232-L236 HydrophobicContact CG-CD1 4.08Å; L232-L236 HydrophobicContact CG-CG 4.38Å; L232-L236 WeakPolarHBondContact O-CB 3.01Å; L232-L236 VanDerWaalsContact O-CG 3.32Å; L232-L236 WeakPolarHBondContact O-CG 3.49Å; L232-L236 PolarHBondContact O-N 3.11Å; L233-L236 PolarHBondContact O-N 3.05Å; L236-S238 PolarHBondContact O-N 3.05Å; L236-L239 PolarHBondContact O-N 3.43Å; L236-M240 VanDerWaalsContact O-CB 3.26Å; L236-M240 WeakPolarHBondContact O-CB 3.39Å; L236-M240 WeakPolarHBondContact O-CG 3.16Å; L236-M240 PolarHBondContact O-N 3.01Å
237L98.7Very high98.6Very high109 Ų10959.3 Ų59.357%0.57132%0.323SS*.Hα-helixtrans-56.9-51174.2-179.663.5000110.8L233 L234 F235 L239 M240 T241L233-L237 WeakPolarHBondContact O-CB 3.43Å; L233-L237 PolarHBondContact O-N 2.7Å; L234-L237 PolarHBondContact O-N 3.41Å; F235-L237 VanDerWaalsContact C-N 3.31Å; F235-L237 PolarHBondContact O-N 3.35Å; L237-L239 PolarHBondContact O-N 2.93Å; L237-M240 PolarHBondContact O-N 2.93Å; L237-T241 WeakPolarHBondContact O-CB 3.4Å; L237-T241 PolarHBondContact O-N 3.09Å; L237-T241 PolarHBondContact O-OG1 3.31Å
238S98.5Very high98.6Very high50 Ų5060.3 Ų60.335%0.3533%0.331SS..Hα-helixtrans-62.2-44.1179.566.90000113.1M89 L234 F235 L236 T241 L242M89-S238 WeakPolarHBondContact CE-OG 3.36Å; L234-S238 PolarHBondContact O-N 2.91Å; L234-S238 PolarHBondContact O-OG 2.99Å; F235-S238 PolarHBondContact O-N 3.02Å; F235-S238 PolarHBondContact O-OG 3.47Å; L236-S238 PolarHBondContact O-N 3.05Å; S238-T241 PolarHBondContact O-N 3.36Å; S238-L242 WeakPolarHBondContact O-CB 3.33Å; S238-L242 PolarHBondContact O-N 2.91Å
239L98.8Very high98.6Very high0 Ų064.8 Ų64.80%035%0.354CS..Hα-helixtrans-63.6-44.1178173.863.8000111.4L43 L82 N85 M89 F235 L236 L237 L242 T243L43-L239 HydrophobicContact CD2-CD2 3.44Å; L43-L239 VanDerWaalsContact CD2-CD2 3.44Å; L82-L239 HydrophobicContact CD2-CD2 3.91Å; L82-L239 HydrophobicContact CD2-CG 4.04Å; N85-L239 HydrophobicContact CB-CD1 3.9Å; M89-L239 HydrophobicContact CG-CB 4.35Å; M89-L239 HydrophobicContact CG-CD1 3.9Å; F235-L239 HydrophobicContact CE1-CD2 4.1Å; F235-L239 HydrophobicContact CZ-CD2 4.34Å; F235-L239 PolarHBondContact O-N 3.33Å; L236-L239 PolarHBondContact O-N 3.43Å; L237-L239 PolarHBondContact O-N 2.93Å; L239-L242 PolarHBondContact O-N 3.33Å; L239-T243 WeakPolarHBondContact O-CB 3.32Å; L239-T243 PolarHBondContact O-N 3.34Å; L239-T243 PolarHBondContact O-OG1 2.67Å
240M98.6Very high98.5Very high63 Ų6365 Ų6531%0.3135%0.348SS..Hα-helixtrans-69.4-38.2179.3-68.7-56.7-60.800111.3I78 L82 L236 L237 T243 L244I78-M240 HydrophobicContact CD1-CE 4.23Å; L82-M240 HydrophobicContact CD2-SD 3.83Å; L236-M240 VanDerWaalsContact O-CB 3.26Å; L236-M240 WeakPolarHBondContact O-CB 3.39Å; L236-M240 WeakPolarHBondContact O-CG 3.16Å; L236-M240 PolarHBondContact O-N 3.01Å; L237-M240 PolarHBondContact O-N 2.93Å; M240-T243 PolarHBondContact O-N 3.15Å; M240-L244 HydrophobicContact CE-CD1 3.69Å; M240-L244 HydrophobicContact CE-CD2 4.22Å; M240-L244 HydrophobicContact CE-CG 3.94Å; M240-L244 VanDerWaalsContact O-CB 3.23Å; M240-L244 WeakPolarHBondContact O-CB 3.43Å; M240-L244 VanDerWaalsContact O-CG 3.25Å; M240-L244 WeakPolarHBondContact O-CG 3.33Å; M240-L244 PolarHBondContact O-N 3.49Å
241T98.7Very high98.4Very high66 Ų6662.2 Ų62.241%0.40534%0.343SS..Hα-helixtrans-59.9-48.5173.6-61.30000110.7L237 S238 F245L237-T241 WeakPolarHBondContact O-CB 3.4Å; L237-T241 PolarHBondContact O-N 3.09Å; L237-T241 PolarHBondContact O-OG1 3.31Å; S238-T241 PolarHBondContact O-N 3.36Å; T241-F245 HydrophobicContact CG2-CD2 4.12Å; T241-F245 WeakPolarHBondContact O-CB 3.26Å; T241-F245 PolarHBondContact O-N 3.42Å
242L98.5Very high98.3Very high19 Ų1962.6 Ų62.610%0.09934%0.343CS..Hα-helixtrans-59.9-49.5176.4178.462000111.2N85 S238 L239 L244 S246 P247 L249 L250N85-L242 HydrophobicContact CB-CD2 3.75Å; N85-L242 HydrophobicContact CB-CG 4.13Å; N85-L242 WeakPolarHBondContact OD1-CD2 2.98Å; S238-L242 WeakPolarHBondContact O-CB 3.33Å; S238-L242 PolarHBondContact O-N 2.91Å; L239-L242 PolarHBondContact O-N 3.33Å; L242-L244 PolarHBondContact O-N 3.24Å; L242-S246 WeakPolarHBondContact CD1-O 3.45Å; L242-S246 CarbonylContact O-C 3.45Å; L242-S246 WeakPolarHBondContact O-CA 3.38Å; L242-S246 PolarHBondContact O-N 3.14Å; L242-P247 WeakPolarHBondContact O-CA 3.4Å; L242-L249 HydrophobicContact CD1-CB 4Å; L242-L249 HydrophobicContact CD1-CD2 4.12Å; L242-L250 HydrophobicContact CD1-CG 4.38Å; L242-L250 HydrophobicContact CD2-CD1 3.69Å; L242-L250 HydrophobicContact CD2-CG 4.37Å
243T98.3Very high98.2Very high1 Ų164 Ų641%0.00636%0.356CS..Hα-helixtrans-66.6-37.3-175.4-61.50000113.3I78 L82 L239 M240 P247I78-T243 HydrophobicContact CG1-CG2 4.26Å; L82-T243 HydrophobicContact CD2-CG2 4.17Å; L82-T243 HydrophobicContact CG-CG2 4.16Å; L239-T243 WeakPolarHBondContact O-CB 3.32Å; L239-T243 PolarHBondContact O-N 3.34Å; L239-T243 PolarHBondContact O-OG1 2.67Å; M240-T243 PolarHBondContact O-N 3.15Å; T243-P247 WeakPolarHBondContact O-CB 3.4Å
244L98.6Very high98.1Very high81 Ų8161.2 Ų61.242%0.42434%0.341SS..Hα-helixtrans-91.2-33.5-174.5-64177.7000113.3W77 I78 M240 L242W77-L244 HydrophobicContact CH2-CD2 3.9Å; W77-L244 HydrophobicContact CZ3-CD2 4.23Å; I78-L244 HydrophobicContact CD1-CD2 3.98Å; M240-L244 HydrophobicContact CE-CD1 3.69Å; M240-L244 HydrophobicContact CE-CD2 4.22Å; M240-L244 HydrophobicContact CE-CG 3.94Å; M240-L244 VanDerWaalsContact O-CB 3.23Å; M240-L244 WeakPolarHBondContact O-CB 3.43Å; M240-L244 VanDerWaalsContact O-CG 3.25Å; M240-L244 WeakPolarHBondContact O-CG 3.33Å; M240-L244 PolarHBondContact O-N 3.49Å; L242-L244 PolarHBondContact O-N 3.24Å
245F98.6Very high98.1Very high169 Ų16957.3 Ų57.374%0.74132%0.321SS*.Hα-helixtrans-106-28.3-174.1-64.5-76.3000113.8T241T241-F245 HydrophobicContact CG2-CD2 4.12Å; T241-F245 WeakPolarHBondContact O-CB 3.26Å; T241-F245 PolarHBondContact O-N 3.42Å
246S98.4Very high98Very high43 Ų4361.5 Ų61.530%0.30134%0.337SS..  trans-145.455.1-176.663.80000112.3L242 D248 L249L242-S246 WeakPolarHBondContact CD1-O 3.45Å; L242-S246 CarbonylContact O-C 3.45Å; L242-S246 WeakPolarHBondContact O-CA 3.38Å; L242-S246 PolarHBondContact O-N 3.14Å; S246-D248 PolarHBondContact O-N 3.31Å; S246-D248 VanDerWaalsContact O-N 3.1Å; S246-L249 VanDerWaalsContact O-CB 3.28Å; S246-L249 WeakPolarHBondContact O-CB 3.49Å; S246-L249 PolarHBondContact O-N 3.2Å; S246-L249 VanDerWaalsContact O-N 3.09Å
247P98.1Very high98Very high33 Ų3361.3 Ų61.321%0.21434%0.339CS..THydrogen-bonded Turntrans-60.5-26.2-167.920.7-32.8000114.6Y81 N85 L242 T243Y81-P247 HydrophobicContact CD1-CB 3.55Å; Y81-P247 HydrophobicContact CD2-CB 4.04Å; Y81-P247 HydrophobicContact CE1-CB 3.75Å; Y81-P247 HydrophobicContact CE2-CB 4.21Å; Y81-P247 HydrophobicContact CG-CB 3.71Å; N85-P247 PolarHBondContact ND2-O 2.85Å; N85-P247 PolarHBondContact OD1-O 3.44Å; L242-P247 WeakPolarHBondContact O-CA 3.4Å; T243-P247 WeakPolarHBondContact O-CB 3.4Å
248D98.2Very high98Very high73 Ų7360.8 Ų60.839%0.3934%0.336SS..THydrogen-bonded Turntrans-1002.2-176.9-63.5-52.5000113.6S246 L250 G251 Y256S246-D248 PolarHBondContact O-N 3.31Å; S246-D248 VanDerWaalsContact O-N 3.1Å; D248-L250 PolarHBondContact O-N 2.83Å; D248-L250 VanDerWaalsContact O-N 3.12Å; D248-G251 PolarHBondContact O-N 3.4Å; D248-G251 VanDerWaalsContact O-N 3.15Å; D248-Y256 WeakPolarHBondContact OD1-CE2 3.4Å; D248-Y256 VanDerWaalsContact OD1-CZ 3.31Å; D248-Y256 PolarHBondContact OD1-OH 3.42Å
249L98.4Very high97.9Very high125 Ų12559.1 Ų59.165%0.65433%0.325SS*.THydrogen-bonded Turntrans-56.3-34.1-17317963.8000113.6L242 S246L242-L249 HydrophobicContact CD1-CB 4Å; L242-L249 HydrophobicContact CD1-CD2 4.12Å; S246-L249 VanDerWaalsContact O-CB 3.28Å; S246-L249 WeakPolarHBondContact O-CB 3.49Å; S246-L249 PolarHBondContact O-N 3.2Å; S246-L249 VanDerWaalsContact O-N 3.09Å
250L97.9Very high97.8Very high57 Ų5762.4 Ų62.430%0.29834%0.343SS..THydrogen-bonded Turntrans-99.8-6.1-175.5-58.4-177.3000113.7L242 D248L242-L250 HydrophobicContact CD1-CG 4.38Å; L242-L250 HydrophobicContact CD2-CD1 3.69Å; L242-L250 HydrophobicContact CD2-CG 4.37Å; D248-L250 PolarHBondContact O-N 2.83Å; D248-L250 VanDerWaalsContact O-N 3.12Å
251G95.6Very high97.7Very high41 Ų4163.1 Ų63.142%0.42335%0.352SS..SBendtrans-98168.5-178.600000112.9D248D248-G251 PolarHBondContact O-N 3.4Å; D248-G251 VanDerWaalsContact O-N 3.15Å
252D97.1Very high97.6Very high21 Ų2167.9 Ų67.911%0.11237%0.374CS..  trans-98.6129.6175.9-161.3-73000111.6M138 D254 N255 K269M138-D252 HydrophobicContact CG-CB 4.09Å; D252-D254 PolarHBondContact O-N 3.24Å; D252-D254 WeakPolarHBondContact OD1-CB 3.44Å; D252-D254 PolarHBondContact OD1-N 3.02Å; D252-N255 WeakPolarHBondContact O-CB 3.42Å; D252-N255 PolarHBondContact O-N 3.01Å; D252-N255 VanDerWaalsContact O-N 3.1Å; D252-K269 WeakPolarHBondContact OD2-CE 3.27Å; D252-K269 IonicContact OD2-NZ 3.64Å; D252-K269 PolarHBondContact OD2-NZ 2.95Å
253P97.1Very high97.5Very high94 Ų9471.3 Ų71.361%0.6139%0.393SS*.G310 helixtrans-62.1-27.2-177.925.8-35.9000113.5N255 Y256P253-N255 PolarHBondContact O-N 2.82Å; P253-N255 VanDerWaalsContact O-N 3.14Å; P253-Y256 WeakPolarHBondContact O-CB 3.43Å; P253-Y256 PolarHBondContact O-N 3.23Å
254D97Very high97.3Very high54 Ų5474.8 Ų74.829%0.28941%0.414SS..G310 helixtrans-63.1-23.3178.7-76.8-9.4000111.2Q137 M138 D252 Y256 T257Q137-D254 HydrophobicContact CB-CB 4.42Å; M138-D254 HydrophobicContact CE-CB 3.54Å; M138-D254 WeakPolarHBondContact CE-OD2 3.38Å; M138-D254 HydrophobicContact CG-CB 3.81Å; D252-D254 PolarHBondContact O-N 3.24Å; D252-D254 WeakPolarHBondContact OD1-CB 3.44Å; D252-D254 PolarHBondContact OD1-N 3.02Å; D254-Y256 PolarHBondContact O-N 3.45Å; D254-T257 PolarHBondContact O-N 3.38Å; D254-T257 PolarHBondContact O-OG1 3.09Å
255N97.6Very high97.1Very high20 Ų2071.4 Ų71.411%0.10740%0.397CS..G310 helixtrans-73.1-5.3177-139.532000114.3G136 M138 S139 D252 P253 T257G136-N255 VanDerWaalsContact C-OD1 3.3Å; G136-N255 VanDerWaalsContact CA-OD1 3.25Å; G136-N255 WeakPolarHBondContact CA-OD1 3.32Å; M138-N255 HydrophobicContact CB-CB 4.17Å; M138-N255 PolarHBondContact N-OD1 3.19Å; S139-N255 PolarHBondContact N-OD1 3.41Å; S139-N255 PolarHBondContact OG-ND2 3.39Å; S139-N255 PolarHBondContact OG-OD1 3.43Å; D252-N255 WeakPolarHBondContact O-CB 3.42Å; D252-N255 PolarHBondContact O-N 3.01Å; D252-N255 VanDerWaalsContact O-N 3.1Å; P253-N255 PolarHBondContact O-N 2.82Å; P253-N255 VanDerWaalsContact O-N 3.14Å; N255-T257 VanDerWaalsContact C-N 3.31Å
256Y97.6Very high96.7Very high100 Ų10069.8 Ų69.839%0.39240%0.404SS..G310 helixtrans-87.42.1167.4-75.6-70.3000113.7F63 R80 Y81 D248 P253 D254F63-Y256 WeakPolarHBondContact CZ-O 3.29Å; R80-Y256 PolarHBondContact NH1-OH 3Å; R80-Y256 VanDerWaalsContact NH1-OH 3.16Å; Y81-Y256 PolarHBondContact OH-OH 2.57Å; D248-Y256 WeakPolarHBondContact OD1-CE2 3.4Å; D248-Y256 VanDerWaalsContact OD1-CZ 3.31Å; D248-Y256 PolarHBondContact OD1-OH 3.42Å; P253-Y256 WeakPolarHBondContact O-CB 3.43Å; P253-Y256 PolarHBondContact O-N 3.23Å; D254-Y256 PolarHBondContact O-N 3.45Å
257T97.9Very high96.4Very high68 Ų6870.1 Ų70.142%0.41740%0.4SS..SBendtrans-106.6134.6170.760.70000110G136 Q137 D254 N255 A259G136-T257 CarbonylContact C-O 3.26Å; G136-T257 WeakPolarHBondContact CA-O 3.27Å; Q137-T257 WeakPolarHBondContact CG-OG1 3.3Å; Q137-T257 PolarHBondContact N-O 3.31Å; D254-T257 PolarHBondContact O-N 3.38Å; D254-T257 PolarHBondContact O-OG1 3.09Å; N255-T257 VanDerWaalsContact C-N 3.31Å; T257-A259 PolarHBondContact O-N 2.93Å
258L97.6Very high96.2Very high99 Ų9969.9 Ų69.952%0.51840%0.397SS..BIsolated β-bridgetrans-56.5137.7178.9175.265.5000110.3F63 N260F63-L258 HydrophobicContact CB-CD1 3.44Å; F63-L258 VanDerWaalsContact CB-CD1 3.44Å; F63-L258 HydrophobicContact CD1-CB 4.21Å; F63-L258 HydrophobicContact CD1-CD1 4.11Å; F63-L258 HydrophobicContact CD2-CB 4.47Å; F63-L258 HydrophobicContact CD2-CD1 4.21Å; F63-L258 HydrophobicContact CE1-CB 4.34Å; F63-L258 HydrophobicContact CG-CB 4.29Å; F63-L258 HydrophobicContact CG-CD1 3.66Å; L258-N260 PolarHBondContact O-N 3.4Å
259A97.3Very high96.1Very high14 Ų1469.1 Ų69.112%0.11639%0.39CS..  trans-52.9128.6176.300000112.3W135 F140 T257W135-A259 HydrophobicContact CG-CB 4.44Å; W135-A259 WeakPolarHBondContact O-CB 3.49Å; W135-A259 PolarHBondContact O-N 3.25Å; W135-A259 VanDerWaalsContact O-N 3.12Å; F140-A259 HydrophobicContact CB-CB 3.52Å; F140-A259 HydrophobicContact CD2-CB 4.28Å; F140-A259 HydrophobicContact CG-CB 3.94Å; T257-A259 PolarHBondContact O-N 2.93Å
260N97.2Very high96Very high69 Ų6964.1 Ų64.137%0.36937%0.365SS..  trans-125.8108173-177.7-11.9000109.2W141 L258 L262 N263W141-N260 PolarHBondContact NE1-O 3.46Å; L258-N260 PolarHBondContact O-N 3.4Å; N260-L262 PolarHBondContact O-N 3.32Å; N260-L262 WeakPolarHBondContact OD1-CB 3.43Å; N260-L262 PolarHBondContact OD1-N 3.14Å; N260-N263 HydrophobicContact CB-CB 4.16Å; N260-N263 PolarHBondContact O-N 3.34Å; N260-N263 VanDerWaalsContact O-N 3.09Å
261P96Very high96Very high79 Ų7962.4 Ų62.451%0.51336%0.355SS..THydrogen-bonded Turntrans-60.3-15.4179.2-24.434.3000114.9F140 W141F140-P261 HydrophobicContact CE1-CB 4.1Å; F140-P261 HydrophobicContact CE1-CG 4.26Å; F140-P261 HydrophobicContact CE2-CG 4.23Å; F140-P261 HydrophobicContact CZ-CB 3.86Å; F140-P261 HydrophobicContact CZ-CG 3.8Å; W141-P261 WeakPolarHBondContact CH2-O 3.47Å; W141-P261 WeakPolarHBondContact CZ2-O 3.27Å
262L96.7Very high96.1Very high165 Ų16563.4 Ų63.486%0.86435%0.347SS*.THydrogen-bonded Turntrans-100.7-5.2-179.2-55.4179.5000113.5N260N260-L262 PolarHBondContact O-N 3.32Å; N260-L262 WeakPolarHBondContact OD1-CB 3.43Å; N260-L262 PolarHBondContact OD1-N 3.14Å
263N96.1Very high96.2Very high92 Ų9262.9 Ų62.949%0.49234%0.343SS..  trans-128100.9-179.8-174.512.5000110.8Q137 W141 N260Q137-N263 PolarHBondContact NE2-O 2.94Å; W141-N263 PolarHBondContact NE1-O 2.83Å; N260-N263 HydrophobicContact CB-CB 4.16Å; N260-N263 PolarHBondContact O-N 3.34Å; N260-N263 VanDerWaalsContact O-N 3.09Å
264T94.3Very high96.3Very high73 Ų7359.7 Ų59.745%0.44832%0.319SS..  trans-78.9127.6179.1-48.80000110.8W141 I268W141-T264 HydrophobicContact CD2-CG2 4.23Å; W141-T264 HydrophobicContact CE3-CG2 4.21Å; W141-T264 VanDerWaalsContact CH2-OG1 3.27Å; W141-T264 WeakPolarHBondContact CH2-OG1 3.46Å; W141-T264 WeakPolarHBondContact CZ2-OG1 3.36Å; W141-T264 HydrophobicContact CZ3-CG2 4.36Å; T264-I268 HydrophobicContact CG2-CD1 3.43Å; T264-I268 VanDerWaalsContact CG2-CD1 3.43Å; T264-I268 HydrophobicContact CG2-CG1 4.28Å
265P94.1Very high96.4Very high11 Ų1157.9 Ų57.97%0.07131%0.31CS..  trans-57.1150173.2-28.235.7000112.6Q137 M138 W141 H267 I268Q137-P265 HydrophobicContact CB-CG 3.86Å; M138-P265 HydrophobicContact CE-CB 3.44Å; M138-P265 VanDerWaalsContact CE-CB 3.44Å; M138-P265 HydrophobicContact CE-CG 3.94Å; W141-P265 HydrophobicContact CG-CG 4.37Å; P265-H267 PolarHBondContact O-N 2.94Å; P265-I268 HydrophobicContact CB-CG1 4.35Å; P265-I268 HydrophobicContact CG-CG1 4.5Å
266P90.8Very high96.4Very high135 Ų13558 Ų5888%0.87731%0.309SS*.SBendtrans-57.8-34.3-178.7-25.233.8000114.1
267H92.5Very high96.5Very high50 Ų5053.3 Ų53.323%0.23129%0.292CS..SBendtrans-14292.4-179.4-173.2-126.9000111.7P265 K269 G340 Q341P265-H267 PolarHBondContact O-N 2.94Å; H267-K269 PolarHBondContact O-N 3.24Å; H267-G340 PolarHBondContact CE1-O 2.87Å; H267-G340 VanDerWaalsContact CE1-O 3.23Å; H267-Q341 PolarHBondContact NE2-O 3.02Å
268I94Very high96.5Very high27 Ų2751.5 Ų51.514%0.13828%0.277CS..  trans-74.9121.6175.3-58.1161.8000109.6W141 V145 T264 P265 Y278W141-I268 HydrophobicContact CB-CD1 3.72Å; W141-I268 HydrophobicContact CB-CG1 3.9Å; W141-I268 HydrophobicContact CB-CG2 4.17Å; W141-I268 HydrophobicContact CD2-CD1 4.29Å; W141-I268 HydrophobicContact CE3-CD1 4.2Å; W141-I268 HydrophobicContact CG-CD1 4.13Å; V145-I268 HydrophobicContact CG2-CD1 4.24Å; V145-I268 HydrophobicContact CG2-CG2 4.29Å; T264-I268 HydrophobicContact CG2-CD1 3.43Å; T264-I268 VanDerWaalsContact CG2-CD1 3.43Å; T264-I268 HydrophobicContact CG2-CG1 4.28Å; P265-I268 HydrophobicContact CB-CG1 4.35Å; P265-I268 HydrophobicContact CG-CG1 4.5Å; I268-Y278 PolarHBondContact O-OH 3.28Å; I268-Y278 VanDerWaalsContact O-OH 3.12Å
269K94.9Very high96.5Very high58 Ų5846.9 Ų46.925%0.25225%0.253SS..  trans-142.9152.7176.960.1-177.6174.5-179.30109.5D252 H267 L275 Y278D252-K269 WeakPolarHBondContact OD2-CE 3.27Å; D252-K269 IonicContact OD2-NZ 3.64Å; D252-K269 PolarHBondContact OD2-NZ 2.95Å; H267-K269 PolarHBondContact O-N 3.24Å; K269-L275 HydrophobicContact CB-CD2 4.13Å; K269-Y278 HydrophobicContact CB-CE1 4.38Å
270P96.9Very high96.6Very high19 Ų1946.3 Ų46.312%0.12325%0.248CC..  trans-77.4174.4170.835.9-36.8000110.9F274 L275 Y278P270-F274 HydrophobicContact CB-CB 3.79Å; P270-F274 HydrophobicContact CB-CD2 4.14Å; P270-F274 HydrophobicContact CB-CG 4.39Å; P270-F274 HydrophobicContact CG-CB 3.71Å; P270-L275 HydrophobicContact CG-CD2 4.12Å; P270-L275 WeakPolarHBondContact O-CD2 3.35Å; P270-Y278 HydrophobicContact CG-CD2 4.41Å; P270-Y278 HydrophobicContact CG-CG 4.08Å
271E97.8Very high96.7Very high21 Ų2143.9 Ų43.910%0.09824%0.235CC..  trans-58156.5172.1-68.9-68.6105.800112.7Y131 Y273 F274Y131-E271 HydrophobicContact CD1-CG 4.19Å; Y131-E271 HydrophobicContact CD2-CG 3.45Å; Y131-E271 VanDerWaalsContact CD2-CG 3.45Å; Y131-E271 HydrophobicContact CE1-CG 4.14Å; Y131-E271 HydrophobicContact CE2-CG 3.38Å; Y131-E271 WeakPolarHBondContact CE2-OE1 3.15Å; Y131-E271 HydrophobicContact CG-CG 3.85Å; Y131-E271 PolarHBondContact OH-OE1 3.2Å; E271-Y273 HydrophobicContact CB-CD1 4.17Å; E271-Y273 HydrophobicContact CB-CE1 3.55Å; E271-Y273 HydrophobicContact CB-CE2 4.08Å; E271-Y273 VanDerWaalsContact CB-CZ 3.49Å; E271-Y273 HydrophobicContact CG-CE1 4.29Å; E271-Y273 PolarHBondContact O-N 3.46Å; E271-F274 PolarHBondContact O-N 2.72Å
272W98.6Very high96.7Very high63 Ų6342.9 Ų42.924%0.23922%0.221CC..G310 helixtrans-53.5-36.9-166.771.3-93.5000114.1S88 F91 I92 F95 F274 L275S88-W272 WeakPolarHBondContact O-CZ2 3.2Å; S88-W272 PolarHBondContact OG-NE1 2.97Å; F91-W272 HydrophobicContact CB-CH2 4.1Å; F91-W272 HydrophobicContact CB-CZ2 4.13Å; I92-W272 HydrophobicContact CD1-CH2 4.49Å; I92-W272 HydrophobicContact CD1-CZ2 4.29Å; I92-W272 HydrophobicContact CG1-CH2 3.55Å; I92-W272 HydrophobicContact CG1-CZ2 3.71Å; F95-W272 HydrophobicContact CD2-CH2 4.17Å; F95-W272 HydrophobicContact CD2-CZ3 4.12Å; F95-W272 HydrophobicContact CE2-CH2 4Å; F95-W272 AromaticContact CE2-CZ3 3.81Å; F95-W272 HydrophobicContact CE2-CZ3 3.81Å; W272-F274 PolarHBondContact O-N 2.72Å; W272-L275 HydrophobicContact CB-CD1 4.27Å; W272-L275 WeakPolarHBondContact O-CB 3.39Å; W272-L275 PolarHBondContact O-N 3.48Å; W272-L275 VanDerWaalsContact O-N 3.1Å
273Y98.5Very high96.8Very high9 Ų935.6 Ų35.64%0.03518%0.184CC..G310 helixtrans-70.5-8.4-178.846.2-96.3000113.9F91 F95 A127 E271 F276F91-Y273 HydrophobicContact CB-CD1 4.22Å; F91-Y273 HydrophobicContact CB-CG 3.95Å; F91-Y273 AromaticContact CD1-CD2 3.95Å; F91-Y273 HydrophobicContact CD1-CD2 3.95Å; F91-Y273 AromaticContact CD1-CG 4Å; F91-Y273 HydrophobicContact CD1-CG 4Å; F91-Y273 AromaticContact CD2-CD1 3.76Å; F91-Y273 HydrophobicContact CD2-CD1 3.76Å; F91-Y273 AromaticContact CD2-CD2 3.51Å; F91-Y273 HydrophobicContact CD2-CD2 3.51Å; F91-Y273 HydrophobicContact CD2-CE1 4.06Å; F91-Y273 AromaticContact CD2-CE2 3.77Å; F91-Y273 HydrophobicContact CD2-CE2 3.77Å; F91-Y273 AromaticContact CD2-CG 3.5Å; F91-Y273 HydrophobicContact CD2-CG 3.5Å; F91-Y273 AromaticContact CE1-CD2 3.9Å; F91-Y273 HydrophobicContact CE1-CD2 3.9Å; F91-Y273 HydrophobicContact CE1-CG 4.42Å; F91-Y273 HydrophobicContact CE2-CD1 4.42Å; F91-Y273 AromaticContact CE2-CD2 3.47Å; F91-Y273 HydrophobicContact CE2-CD2 3.47Å; F91-Y273 VanDerWaalsContact CE2-CD2 3.47Å; F91-Y273 HydrophobicContact CE2-CE1 4.44Å; F91-Y273 AromaticContact CE2-CE2 3.43Å; F91-Y273 HydrophobicContact CE2-CE2 3.43Å; F91-Y273 VanDerWaalsContact CE2-CE2 3.43Å; F91-Y273 AromaticContact CE2-CG 3.99Å; F91-Y273 HydrophobicContact CE2-CG 3.99Å; F91-Y273 AromaticContact CE2-CZ 3.98Å; F91-Y273 HydrophobicContact CG-CD1 4.06Å; F91-Y273 AromaticContact CG-CD2 3.77Å; F91-Y273 HydrophobicContact CG-CD2 3.77Å; F91-Y273 HydrophobicContact CG-CE2 4.47Å; F91-Y273 AromaticContact CG-CG 3.52Å; F91-Y273 HydrophobicContact CG-CG 3.52Å; F91-Y273 AromaticContact CZ-CD2 3.67Å; F91-Y273 HydrophobicContact CZ-CD2 3.67Å; F91-Y273 AromaticContact CZ-CE2 3.87Å; F91-Y273 HydrophobicContact CZ-CE2 3.87Å; F91-Y273 HydrophobicContact CZ-CG 4.42Å; F95-Y273 WeakPolarHBondContact CZ-O 3.33Å; A127-Y273 HydrophobicContact CB-CE2 3.98Å; E271-Y273 HydrophobicContact CB-CD1 4.17Å; E271-Y273 HydrophobicContact CB-CE1 3.55Å; E271-Y273 HydrophobicContact CB-CE2 4.08Å; E271-Y273 VanDerWaalsContact CB-CZ 3.49Å; E271-Y273 HydrophobicContact CG-CE1 4.29Å; E271-Y273 PolarHBondContact O-N 3.46Å; Y273-F276 WeakPolarHBondContact O-CE1 3.06Å
274F98.6Very high96.9Very high27 Ų2733.8 Ų33.812%0.11818%0.176CC..G310 helixtrans-103.4-9.9171.2-66.4-58.5000113.8M124 F128 P270 E271 W272 F276 A277 Y278M124-F274 HydrophobicContact CB-CE1 3.82Å; M124-F274 HydrophobicContact CB-CZ 4.24Å; M124-F274 HydrophobicContact CE-CD1 3.63Å; M124-F274 HydrophobicContact CE-CE1 3.49Å; M124-F274 VanDerWaalsContact CE-CE1 3.49Å; M124-F274 HydrophobicContact CG-CE1 3.85Å; M124-F274 WeakPolarHBondContact O-CZ 3.25Å; F128-F274 HydrophobicContact CB-CE2 4.28Å; F128-F274 HydrophobicContact CB-CZ 4.18Å; P270-F274 HydrophobicContact CB-CB 3.79Å; P270-F274 HydrophobicContact CB-CD2 4.14Å; P270-F274 HydrophobicContact CB-CG 4.39Å; P270-F274 HydrophobicContact CG-CB 3.71Å; E271-F274 PolarHBondContact O-N 2.72Å; W272-F274 PolarHBondContact O-N 2.72Å; F274-F276 VanDerWaalsContact C-N 3.3Å; F274-F276 PolarHBondContact O-N 2.9Å; F274-A277 PolarHBondContact O-N 3.32Å; F274-Y278 WeakPolarHBondContact O-CB 3.22Å; F274-Y278 PolarHBondContact O-N 3.3Å
275L98.7Very high97Very high16 Ų1636.4 Ų36.48%0.08419%0.194CC..Hα-helixtrans-62.9-33.8-170-68.1178.8000113.3K269 P270 W272 A277 Y278 T279 T336K269-L275 HydrophobicContact CB-CD2 4.13Å; P270-L275 HydrophobicContact CG-CD2 4.12Å; P270-L275 WeakPolarHBondContact O-CD2 3.35Å; W272-L275 HydrophobicContact CB-CD1 4.27Å; W272-L275 WeakPolarHBondContact O-CB 3.39Å; W272-L275 PolarHBondContact O-N 3.48Å; W272-L275 VanDerWaalsContact O-N 3.1Å; L275-A277 PolarHBondContact O-N 3.31Å; L275-Y278 HydrophobicContact CD2-CD1 4.36Å; L275-Y278 PolarHBondContact O-N 3.27Å; L275-T279 PolarHBondContact O-N 3.25Å; L275-T279 PolarHBondContact O-OG1 3.08Å; L275-T336 HydrophobicContact CB-CG2 4.06Å; L275-T336 WeakPolarHBondContact CB-O 3.39Å; L275-T336 HydrophobicContact CD1-CG2 4.35Å
276F98.9Very high97.1Very high22 Ų2240.3 Ų40.310%0.09622%0.215CC..Hα-helixtrans-60.8-45.9177.980.5-83.8000111.8F95 Y273 F274 T279 I280 L332 L335F95-F276 HydrophobicContact CE1-CE1 4.41Å; F95-F276 HydrophobicContact CZ-CE1 4.31Å; Y273-F276 WeakPolarHBondContact O-CE1 3.06Å; F274-F276 VanDerWaalsContact C-N 3.3Å; F274-F276 PolarHBondContact O-N 2.9Å; F276-T279 PolarHBondContact O-N 2.91Å; F276-I280 PolarHBondContact O-N 3.05Å; F276-L332 HydrophobicContact CB-CD2 4.2Å; F276-L332 HydrophobicContact CD2-CD2 3.63Å; F276-L332 HydrophobicContact CE2-CD2 4.31Å; F276-L332 HydrophobicContact CG-CD2 4.06Å; F276-L335 HydrophobicContact CB-CB 3.94Å
277A98.6Very high97.3Very high3 Ų338.8 Ų38.83%0.02519%0.194CC..Hα-helixtrans-72.4-37.2179.100000110.6F274 L275 T279 I280 L281 L294F274-A277 PolarHBondContact O-N 3.32Å; L275-A277 PolarHBondContact O-N 3.31Å; A277-T279 VanDerWaalsContact C-N 3.29Å; A277-T279 PolarHBondContact O-N 3.44Å; A277-I280 PolarHBondContact O-N 3.46Å; A277-I280 VanDerWaalsContact O-N 3.13Å; A277-L281 PolarHBondContact O-N 2.8Å; A277-L294 HydrophobicContact CB-CD1 3.63Å; A277-L294 WeakPolarHBondContact O-CD1 3.46Å
278Y98.5Very high97.5Very high30 Ų3039.3 Ų39.312%0.11820%0.199CC..Hα-helixtrans-59.6-37.7173.4179.7-114.5000112.4I268 K269 P270 F274 L275 L281 R282I268-Y278 PolarHBondContact O-OH 3.28Å; I268-Y278 VanDerWaalsContact O-OH 3.12Å; K269-Y278 HydrophobicContact CB-CE1 4.38Å; P270-Y278 HydrophobicContact CG-CD2 4.41Å; P270-Y278 HydrophobicContact CG-CG 4.08Å; F274-Y278 WeakPolarHBondContact O-CB 3.22Å; F274-Y278 PolarHBondContact O-N 3.3Å; L275-Y278 HydrophobicContact CD2-CD1 4.36Å; L275-Y278 PolarHBondContact O-N 3.27Å; Y278-L281 HydrophobicContact CD2-CD2 4.18Å; Y278-L281 WeakPolarHBondContact O-CB 3.33Å; Y278-L281 PolarHBondContact O-N 2.72Å; Y278-R282 HydrophobicContact CE1-CG 4.47Å; Y278-R282 VanDerWaalsContact CE1-CZ 3.43Å; Y278-R282 HydrophobicContact CE2-CG 4.17Å; Y278-R282 VanDerWaalsContact CZ-CD 3.44Å; Y278-R282 WeakPolarHBondContact O-CG 3.41Å; Y278-R282 PolarHBondContact O-N 3.31Å; Y278-R282 VanDerWaalsContact O-N 3.15Å
279T98.8Very high97.7Very high2 Ų239.1 Ų39.11%0.01220%0.203CC..Hα-helixtrans-62-47.9171.3-64.90000111.7L275 F276 A277 L281 R282 S283 L335 I338 G339L275-T279 PolarHBondContact O-N 3.25Å; L275-T279 PolarHBondContact O-OG1 3.08Å; F276-T279 PolarHBondContact O-N 2.91Å; A277-T279 VanDerWaalsContact C-N 3.29Å; A277-T279 PolarHBondContact O-N 3.44Å; T279-L281 VanDerWaalsContact C-N 3.3Å; T279-L281 PolarHBondContact O-N 2.79Å; T279-R282 PolarHBondContact O-N 3.45Å; T279-R282 VanDerWaalsContact O-N 3.1Å; T279-S283 PolarHBondContact O-N 3.34Å; T279-S283 PolarHBondContact O-OG 3.27Å; T279-L335 WeakPolarHBondContact CB-O 3.36Å; T279-L335 HydrophobicContact CG2-CD2 3.53Å; T279-L335 PolarHBondContact OG1-O 2.94Å; T279-I338 HydrophobicContact CG2-CB 4.03Å; T279-I338 HydrophobicContact CG2-CG2 3.6Å; T279-G339 WeakPolarHBondContact OG1-CA 3.49Å; T279-G339 PolarHBondContact OG1-N 3.48Å
280I98.8Very high97.9Very high1 Ų136.4 Ų36.41%0.00519%0.191CC..Hα-helixtrans-58.6-42178.8-66.7170.9000111.4F276 A277 R282 S283 A293 S297 L335 Y358 F359F276-I280 PolarHBondContact O-N 3.05Å; A277-I280 PolarHBondContact O-N 3.46Å; A277-I280 VanDerWaalsContact O-N 3.13Å; I280-R282 PolarHBondContact O-N 2.68Å; I280-S283 PolarHBondContact O-N 3.33Å; I280-A293 HydrophobicContact CG2-CB 3.81Å; I280-S297 VanDerWaalsContact CD1-CB 3.43Å; I280-L335 HydrophobicContact CD1-CD1 4.06Å; I280-L335 HydrophobicContact CG1-CD1 4.21Å; I280-L335 HydrophobicContact CG1-CD2 4.15Å; I280-Y358 HydrophobicContact CD1-CD1 3.94Å; I280-Y358 HydrophobicContact CD1-CE1 4.27Å; I280-Y358 HydrophobicContact CD1-CG 4.27Å; I280-F359 HydrophobicContact CG2-CE2 3.87Å; I280-F359 HydrophobicContact CG2-CZ 4.33Å
281L98.4Very high97.9Very high19 Ų1936.5 Ų36.510%0.09919%0.192CC..Hα-helixtrans-54.9-50.3173.4169.465.5000111.8L149 A277 Y278 T279 S283 G290 V291 L294L149-L281 HydrophobicContact CD1-CD1 4.36Å; L149-L281 HydrophobicContact CD1-CD2 3.64Å; L149-L281 HydrophobicContact CD2-CD1 4.26Å; L149-L281 HydrophobicContact CD2-CD2 4.18Å; A277-L281 PolarHBondContact O-N 2.8Å; Y278-L281 HydrophobicContact CD2-CD2 4.18Å; Y278-L281 WeakPolarHBondContact O-CB 3.33Å; Y278-L281 PolarHBondContact O-N 2.72Å; T279-L281 VanDerWaalsContact C-N 3.3Å; T279-L281 PolarHBondContact O-N 2.79Å; L281-S283 VanDerWaalsContact C-N 3.32Å; L281-S283 PolarHBondContact O-N 3.01Å; L281-G290 WeakPolarHBondContact CD1-O 2.92Å; L281-V291 HydrophobicContact CD1-CG2 4.25Å; L281-L294 HydrophobicContact CB-CB 4.22Å; L281-L294 HydrophobicContact CB-CD1 4.05Å
282R97.1Very high97.9Very high57 Ų5739.8 Ų39.822%0.21521%0.209CC..Hα-helixtrans-73.9-21.3-176-65.3-171.1-57.1173.313.7113.7Y278 T279 I280 V284 I338 Q341Y278-R282 HydrophobicContact CE1-CG 4.47Å; Y278-R282 VanDerWaalsContact CE1-CZ 3.43Å; Y278-R282 HydrophobicContact CE2-CG 4.17Å; Y278-R282 VanDerWaalsContact CZ-CD 3.44Å; Y278-R282 WeakPolarHBondContact O-CG 3.41Å; Y278-R282 PolarHBondContact O-N 3.31Å; Y278-R282 VanDerWaalsContact O-N 3.15Å; T279-R282 PolarHBondContact O-N 3.45Å; T279-R282 VanDerWaalsContact O-N 3.1Å; I280-R282 PolarHBondContact O-N 2.68Å; R282-V284 PolarHBondContact O-N 3.23Å; R282-I338 PolarHBondContact NH2-O 3.45Å; R282-Q341 PolarHBondContact NH1-O 3.25Å; R282-Q341 PolarHBondContact NH2-O 3.07Å
283S98Very high97.9Very high13 Ų1337.4 Ų37.49%0.09120%0.203CC..Hα-helixtrans-67.1-25.9179.5-67.90000113.1T279 I280 L281 P285 G351 Q352 S355T279-S283 PolarHBondContact O-N 3.34Å; T279-S283 PolarHBondContact O-OG 3.27Å; I280-S283 PolarHBondContact O-N 3.33Å; L281-S283 VanDerWaalsContact C-N 3.32Å; L281-S283 PolarHBondContact O-N 3.01Å; S283-P285 WeakPolarHBondContact O-CD 3.06Å; S283-G351 PolarHBondContact OG-O 2.81Å; S283-G351 VanDerWaalsContact OG-O 3.05Å; S283-Q352 WeakPolarHBondContact O-CG 3.37Å; S283-Q352 PolarHBondContact O-NE2 2.82Å; S283-Q352 PolarHBondContact OG-N 3.32Å; S283-S355 WeakPolarHBondContact CB-OG 3.12Å; S283-S355 PolarHBondContact OG-OG 2.86Å
284V98Very high97.9Very high53 Ų5339 Ų3932%0.32121%0.212SC..SBendtrans-92.8117.3-179.2-175.60000109.8R282 N286 A293R282-V284 PolarHBondContact O-N 3.23Å; V284-N286 HydrophobicContact CG1-CB 4.26Å; V284-N286 PolarHBondContact O-N 3.42Å; V284-A293 HydrophobicContact CG2-CB 3.87Å
285P96.1Very high97.9Very high128 Ų12841.8 Ų41.883%0.83123%0.228SC*.SBendtrans-78.544.3-178.734.7-37.2000112.3S283S283-P285 WeakPolarHBondContact O-CD 3.06Å
286N97.5Very high97.8Very high94 Ų9445.5 Ų45.550%0.50325%0.247SC..SBendtrans-151.8130.2175.9-180-81000108.9V284 L288 G289 G290V284-N286 HydrophobicContact CG1-CB 4.26Å; V284-N286 PolarHBondContact O-N 3.42Å; N286-L288 PolarHBondContact O-N 3.33Å; N286-L288 PolarHBondContact OD1-N 3.47Å; N286-L288 VanDerWaalsContact OD1-N 3.07Å; N286-G289 PolarHBondContact O-N 3.19Å; N286-G289 PolarHBondContact OD1-N 3.13Å; N286-G290 PolarHBondContact O-N 3.19Å
287K94.9Very high97.8Very high102 Ų10244.6 Ų44.644%0.44324%0.244SC..Hα-helixtrans-58.7-52.7-175.8-166.4-175.2-179.3177.60112.3N148 S151 A152 G290 V291N148-K287 PolarHBondContact O-NZ 3.37Å; N148-K287 VanDerWaalsContact O-NZ 3.11Å; S151-K287 PolarHBondContact OG-NZ 3.02Å; A152-K287 HydrophobicContact CB-CB 4.48Å; A152-K287 HydrophobicContact CB-CD 3.98Å; A152-K287 HydrophobicContact CB-CG 3.9Å; K287-G290 PolarHBondContact O-N 3.03Å; K287-V291 VanDerWaalsContact O-CG2 3.29Å; K287-V291 WeakPolarHBondContact O-CG2 3.35Å; K287-V291 PolarHBondContact O-N 3.38Å
288L96.9Very high97.8Very high62 Ų6245.3 Ų45.333%0.32525%0.247SC..Hα-helixtrans-65.5-44.5179.7176.960.1000111.3A152 P154 N286 G290 V291 L292A152-L288 HydrophobicContact CB-CB 4.26Å; A152-L288 HydrophobicContact CB-CD1 4.4Å; P154-L288 HydrophobicContact CG-CD2 4.43Å; N286-L288 PolarHBondContact O-N 3.33Å; N286-L288 PolarHBondContact OD1-N 3.47Å; N286-L288 VanDerWaalsContact OD1-N 3.07Å; L288-G290 VanDerWaalsContact C-N 3.33Å; L288-G290 PolarHBondContact O-N 3.08Å; L288-V291 PolarHBondContact O-N 3.35Å; L288-L292 HydrophobicContact CD1-CD1 4.29Å; L288-L292 HydrophobicContact CD1-CG 4.21Å; L288-L292 HydrophobicContact CG-CD1 4.16Å; L288-L292 HydrophobicContact CG-CG 4.49Å; L288-L292 WeakPolarHBondContact O-CG 3.14Å; L288-L292 PolarHBondContact O-N 2.82Å
289G98.3Very high97.8Very high23 Ų2346.9 Ų46.924%0.23726%0.257CS..Hα-helixtrans-58.9-42.6177.400000112.7N286 L292 A293N286-G289 PolarHBondContact O-N 3.19Å; N286-G289 PolarHBondContact OD1-N 3.13Å; G289-L292 PolarHBondContact O-N 3.08Å; G289-A293 WeakPolarHBondContact O-CB 3.47Å; G289-A293 PolarHBondContact O-N 2.96Å
290G98Very high97.8Very high0 Ų047.1 Ų47.10%026%0.258CS..Hα-helixtrans-65.2-41.1175.200000112.6L281 N286 K287 L288 A293 L294L281-G290 WeakPolarHBondContact CD1-O 2.92Å; N286-G290 PolarHBondContact O-N 3.19Å; K287-G290 PolarHBondContact O-N 3.03Å; L288-G290 VanDerWaalsContact C-N 3.33Å; L288-G290 PolarHBondContact O-N 3.08Å; G290-A293 PolarHBondContact O-N 3.3Å; G290-L294 WeakPolarHBondContact O-CB 3.32Å; G290-L294 PolarHBondContact O-N 2.87Å
291V97.8Very high97.8Very high22 Ų2248 Ų4813%0.13326%0.263CS..Hα-helixtrans-63.3-42175.71720000111.5L149 A152 L281 K287 L288 L294 L295L149-V291 HydrophobicContact CB-CG2 3.73Å; L149-V291 HydrophobicContact CD2-CG2 4.03Å; L149-V291 HydrophobicContact CG-CG2 4.3Å; A152-V291 HydrophobicContact CB-CG2 4.34Å; L281-V291 HydrophobicContact CD1-CG2 4.25Å; K287-V291 VanDerWaalsContact O-CG2 3.29Å; K287-V291 WeakPolarHBondContact O-CG2 3.35Å; K287-V291 PolarHBondContact O-N 3.38Å; L288-V291 PolarHBondContact O-N 3.35Å; V291-L294 PolarHBondContact O-N 2.64Å; V291-L295 PolarHBondContact O-N 3.47Å
292L98.3Very high97.8Very high89 Ų8949 Ų4947%0.46627%0.273SS..Hα-helixtrans-64.6-42.2174.1-67.9174.4000111.3L288 G289 L295 L296L288-L292 HydrophobicContact CD1-CD1 4.29Å; L288-L292 HydrophobicContact CD1-CG 4.21Å; L288-L292 HydrophobicContact CG-CD1 4.16Å; L288-L292 HydrophobicContact CG-CG 4.49Å; L288-L292 WeakPolarHBondContact O-CG 3.14Å; L288-L292 PolarHBondContact O-N 2.82Å; G289-L292 PolarHBondContact O-N 3.08Å; L292-L295 PolarHBondContact O-N 2.89Å; L292-L296 VanDerWaalsContact O-CB 3.29Å; L292-L296 WeakPolarHBondContact O-CB 3.47Å; L292-L296 WeakPolarHBondContact O-CG 3.39Å; L292-L296 PolarHBondContact O-N 3.32Å
293A98.4Very high97.8Very high13 Ų1350.3 Ų50.311%0.10728%0.283CS..Hα-helixtrans-63.4-41.5177.900000112.5I280 V284 G289 G290 L296 S297I280-A293 HydrophobicContact CG2-CB 3.81Å; V284-A293 HydrophobicContact CG2-CB 3.87Å; G289-A293 WeakPolarHBondContact O-CB 3.47Å; G289-A293 PolarHBondContact O-N 2.96Å; G290-A293 PolarHBondContact O-N 3.3Å; A293-L296 PolarHBondContact O-N 2.75Å; A293-S297 WeakPolarHBondContact O-CB 3.48Å; A293-S297 PolarHBondContact O-N 3.28Å
294L97.9Very high97.8Very high44 Ų4450.4 Ų50.423%0.2328%0.282CS..Hα-helixtrans-57.7-49.8172.1177.992.2000111.5L149 A277 L281 G290 V291 L296 S297L149-L294 HydrophobicContact CD1-CD2 4.43Å; A277-L294 HydrophobicContact CB-CD1 3.63Å; A277-L294 WeakPolarHBondContact O-CD1 3.46Å; L281-L294 HydrophobicContact CB-CB 4.22Å; L281-L294 HydrophobicContact CB-CD1 4.05Å; G290-L294 WeakPolarHBondContact O-CB 3.32Å; G290-L294 PolarHBondContact O-N 2.87Å; V291-L294 PolarHBondContact O-N 2.64Å; L294-L296 VanDerWaalsContact C-N 3.35Å; L294-S297 PolarHBondContact O-N 3.32Å; L294-S297 PolarHBondContact O-OG 3.44Å
295L97.4Very high97.8Very high85 Ų8549.5 Ų49.545%0.44528%0.278SS..Hα-helixtrans-63.7-45.1-179.3-177.765.8000110.6V291 L292 S297 I298 L299V291-L295 PolarHBondContact O-N 3.47Å; L292-L295 PolarHBondContact O-N 2.89Å; L295-S297 VanDerWaalsContact C-N 3.29Å; L295-S297 PolarHBondContact O-N 3.31Å; L295-I298 PolarHBondContact O-N 3.41Å; L295-L299 HydrophobicContact CD1-CD1 3.92Å; L295-L299 HydrophobicContact CD1-CG 4.18Å; L295-L299 HydrophobicContact CD2-CD1 4.08Å; L295-L299 HydrophobicContact CG-CD1 3.69Å; L295-L299 HydrophobicContact CG-CG 4.2Å; L295-L299 WeakPolarHBondContact O-CG 3.46Å; L295-L299 PolarHBondContact O-N 3.17Å
296L98.3Very high97.8Very high93 Ų9348.9 Ų48.949%0.48727%0.266SS..Hα-helixtrans-66.2-28.5178.9-70.6172.3000112.6L292 A293 L294 I298 L299 I300 F359L292-L296 VanDerWaalsContact O-CB 3.29Å; L292-L296 WeakPolarHBondContact O-CB 3.47Å; L292-L296 WeakPolarHBondContact O-CG 3.39Å; L292-L296 PolarHBondContact O-N 3.32Å; A293-L296 PolarHBondContact O-N 2.75Å; L294-L296 VanDerWaalsContact C-N 3.35Å; L296-I298 PolarHBondContact O-N 3.45Å; L296-I298 VanDerWaalsContact O-N 3.16Å; L296-L299 PolarHBondContact O-N 2.93Å; L296-I300 WeakPolarHBondContact O-CB 3.43Å; L296-I300 WeakPolarHBondContact O-CG2 3.48Å; L296-I300 PolarHBondContact O-N 2.98Å; L296-F359 HydrophobicContact CB-CE1 4.23Å; L296-F359 HydrophobicContact CB-CZ 4.35Å
297S98.4Very high97.8Very high3 Ų346.1 Ų46.12%0.02125%0.251CS..Hα-helixtrans-66-16176720000113.6I280 A293 L294 L295 Y358I280-S297 VanDerWaalsContact CD1-CB 3.43Å; A293-S297 WeakPolarHBondContact O-CB 3.48Å; A293-S297 PolarHBondContact O-N 3.28Å; L294-S297 PolarHBondContact O-N 3.32Å; L294-S297 PolarHBondContact O-OG 3.44Å; L295-S297 VanDerWaalsContact C-N 3.29Å; L295-S297 PolarHBondContact O-N 3.31Å; S297-Y358 PolarHBondContact O-OH 3.11Å
298I98.3Very high98Very high18 Ų1843.2 Ų43.29%0.09224%0.239CC..Hα-helixtrans-102-47.5173.2-54.1162.6000109.6L120 L121 M124 L295 L296 I300 L301L120-I298 HydrophobicContact CD2-CG2 3.9Å; L121-I298 HydrophobicContact CD2-CD1 4.47Å; L121-I298 HydrophobicContact CD2-CG2 3.8Å; L121-I298 HydrophobicContact CG-CG2 4.46Å; M124-I298 HydrophobicContact CE-CD1 3.42Å; M124-I298 VanDerWaalsContact CE-CD1 3.42Å; M124-I298 HydrophobicContact CE-CG1 4.2Å; M124-I298 HydrophobicContact SD-CD1 3.86Å; M124-I298 HydrophobicContact SD-CG1 4.48Å; M124-I298 HydrophobicContact SD-CG2 4.44Å; L295-I298 PolarHBondContact O-N 3.41Å; L296-I298 PolarHBondContact O-N 3.45Å; L296-I298 VanDerWaalsContact O-N 3.16Å; I298-I300 PolarHBondContact O-N 3.3Å; I298-L301 WeakPolarHBondContact O-CB 3.15Å; I298-L301 WeakPolarHBondContact O-CG 3.36Å; I298-L301 PolarHBondContact O-N 3.28Å; I298-L301 VanDerWaalsContact O-N 3.16Å
299L98.2Very high98Very high63 Ų6344.4 Ų44.433%0.3324%0.244SC..Hα-helixtrans-67.6-16.6-177.3-65.7-173.6000113.8L121 L295 L296 L301 A302L121-L299 HydrophobicContact CD1-CD2 4.14Å; L295-L299 HydrophobicContact CD1-CD1 3.92Å; L295-L299 HydrophobicContact CD1-CG 4.18Å; L295-L299 HydrophobicContact CD2-CD1 4.08Å; L295-L299 HydrophobicContact CG-CD1 3.69Å; L295-L299 HydrophobicContact CG-CG 4.2Å; L295-L299 WeakPolarHBondContact O-CG 3.46Å; L295-L299 PolarHBondContact O-N 3.17Å; L296-L299 PolarHBondContact O-N 2.93Å; L299-L301 PolarHBondContact O-N 3.08Å; L299-L301 VanDerWaalsContact O-N 3.12Å; L299-A302 WeakPolarHBondContact O-CB 3.46Å; L299-A302 PolarHBondContact O-N 3.09Å
300I98.5Very high98Very high8 Ų843.8 Ų43.84%0.04124%0.236CC..G310 helixtrans-57.2-24.4171.7-167.1164.8000112.6L296 I298 A302 M303 I304 Y358 F359 I362 L363L296-I300 WeakPolarHBondContact O-CB 3.43Å; L296-I300 WeakPolarHBondContact O-CG2 3.48Å; L296-I300 PolarHBondContact O-N 2.98Å; I298-I300 PolarHBondContact O-N 3.3Å; I300-A302 PolarHBondContact O-N 2.77Å; I300-M303 WeakPolarHBondContact O-CB 2.9Å; I300-M303 PolarHBondContact O-N 3.34Å; I300-I304 PolarHBondContact O-N 2.8Å; I300-Y358 HydrophobicContact CG2-CE1 4.13Å; I300-Y358 VanDerWaalsContact CG2-OH 3.23Å; I300-Y358 WeakPolarHBondContact CG2-OH 3.27Å; I300-F359 HydrophobicContact CD1-CD1 3.72Å; I300-F359 HydrophobicContact CD1-CE1 4.1Å; I300-I362 HydrophobicContact CD1-CB 3.84Å; I300-I362 HydrophobicContact CD1-CD1 4.02Å; I300-I362 HydrophobicContact CD1-CG2 3.58Å; I300-I362 HydrophobicContact CG1-CG2 3.77Å; I300-I362 HydrophobicContact CG2-CD1 4.27Å; I300-L363 HydrophobicContact CD1-CD1 4.4Å; I300-L363 HydrophobicContact CD1-CD2 3.71Å; I300-L363 HydrophobicContact CD1-CG 3.85Å; I300-L363 HydrophobicContact CG1-CD2 4.13Å
301L98.6Very high98Very high19 Ų1950.1 Ų50.110%0.09926%0.264CS..G310 helixtrans-57.1-32.3172.5-67.8175.5000112.5I98 L102 W113 I117 L120 I298 L299 M303 I304I98-L301 HydrophobicContact CG2-CD1 4.43Å; I98-L301 HydrophobicContact CG2-CD2 4.15Å; L102-L301 HydrophobicContact CD2-CD2 4.4Å; W113-L301 HydrophobicContact CH2-CD2 4.43Å; W113-L301 HydrophobicContact CZ2-CB 4.19Å; W113-L301 HydrophobicContact CZ2-CD2 4Å; W113-L301 PolarHBondContact NE1-O 2.92Å; I117-L301 HydrophobicContact CD1-CB 3.82Å; I117-L301 HydrophobicContact CG1-CB 3.97Å; L120-L301 HydrophobicContact CD2-CD1 3.76Å; I298-L301 WeakPolarHBondContact O-CB 3.15Å; I298-L301 WeakPolarHBondContact O-CG 3.36Å; I298-L301 PolarHBondContact O-N 3.28Å; I298-L301 VanDerWaalsContact O-N 3.16Å; L299-L301 PolarHBondContact O-N 3.08Å; L299-L301 VanDerWaalsContact O-N 3.12Å; L301-M303 PolarHBondContact O-N 3.15Å; L301-I304 WeakPolarHBondContact O-CB 3.26Å; L301-I304 WeakPolarHBondContact O-CG1 3.27Å; L301-I304 PolarHBondContact O-N 3.12Å
302A98.2Very high98Very high39 Ų3951.1 Ų51.132%0.32227%0.267SS..G310 helixtrans-70.5-21.917700000112.6I117 L299 I300 P305I117-A302 HydrophobicContact CD1-CB 3.89Å; L299-A302 WeakPolarHBondContact O-CB 3.46Å; L299-A302 PolarHBondContact O-N 3.09Å; I300-A302 PolarHBondContact O-N 2.77Å; A302-P305 WeakPolarHBondContact O-CD 3.17Å
303M97.6Very high98Very high85 Ų8548.9 Ų48.942%0.41925%0.254SS..G310 helixtrans-81.3-20.4176.6-60.7-59.6-65.600112.5I300 L301 I306 L307I300-M303 WeakPolarHBondContact O-CB 2.9Å; I300-M303 PolarHBondContact O-N 3.34Å; L301-M303 PolarHBondContact O-N 3.15Å; M303-I306 HydrophobicContact CE-CD1 4.44Å; M303-I306 WeakPolarHBondContact O-CB 3.28Å; M303-I306 PolarHBondContact O-N 2.84Å; M303-I306 HydrophobicContact SD-CD1 4.42Å; M303-L307 HydrophobicContact CB-CD1 3.89Å; M303-L307 HydrophobicContact CB-CG 4.38Å; M303-L307 VanDerWaalsContact O-CG 3.3Å; M303-L307 WeakPolarHBondContact O-CG 3.39Å; M303-L307 PolarHBondContact O-N 2.69Å
304I98.2Very high98Very high15 Ų1548.3 Ų48.38%0.07725%0.25CC..THydrogen-bonded Turntrans-54.8-46-173.9-60-68.1000113.4L102 F107 I300 L301 I306 L307 H308 I362L102-I304 HydrophobicContact CD2-CB 4.47Å; L102-I304 HydrophobicContact CD2-CD1 4.23Å; L102-I304 HydrophobicContact CD2-CG1 4.01Å; L102-I304 HydrophobicContact CD2-CG2 3.88Å; F107-I304 HydrophobicContact CB-CG2 4.32Å; F107-I304 HydrophobicContact CD1-CG2 3.46Å; F107-I304 VanDerWaalsContact CD1-CG2 3.46Å; F107-I304 HydrophobicContact CD2-CG2 3.81Å; F107-I304 HydrophobicContact CE1-CG2 3.56Å; F107-I304 HydrophobicContact CE2-CG2 3.94Å; F107-I304 HydrophobicContact CG-CG2 3.59Å; F107-I304 HydrophobicContact CZ-CG2 3.81Å; I300-I304 PolarHBondContact O-N 2.8Å; L301-I304 WeakPolarHBondContact O-CB 3.26Å; L301-I304 WeakPolarHBondContact O-CG1 3.27Å; L301-I304 PolarHBondContact O-N 3.12Å; I304-I306 VanDerWaalsContact C-N 3.25Å; I304-I306 PolarHBondContact O-N 3.1Å; I304-L307 PolarHBondContact O-N 2.96Å; I304-H308 PolarHBondContact O-N 3.2Å; I304-I362 HydrophobicContact CD1-CG2 3.43Å; I304-I362 VanDerWaalsContact CD1-CG2 3.43Å
305P97.6Very high98Very high34 Ų3447 Ų4722%0.22124%0.242CC..THydrogen-bonded Turntrans-60.4-35.5178-22.734.2000113.2F107 A302 H308F107-P305 HydrophobicContact CB-CG 4.3Å; F107-P305 HydrophobicContact CD2-CB 4.26Å; F107-P305 HydrophobicContact CD2-CG 4.18Å; F107-P305 WeakPolarHBondContact O-CG 3.31Å; A302-P305 WeakPolarHBondContact O-CD 3.17Å; P305-H308 WeakPolarHBondContact O-CB 3.44Å; P305-H308 PolarHBondContact O-N 3.01Å
306I97.1Very high98Very high116 Ų11646.6 Ų46.660%0.59524%0.239SC*.THydrogen-bonded Turntrans-74.4-33-179.5-54.1170.7000110.8M303 I304 H308M303-I306 HydrophobicContact CE-CD1 4.44Å; M303-I306 WeakPolarHBondContact O-CB 3.28Å; M303-I306 PolarHBondContact O-N 2.84Å; M303-I306 HydrophobicContact SD-CD1 4.42Å; I304-I306 VanDerWaalsContact C-N 3.25Å; I304-I306 PolarHBondContact O-N 3.1Å; I306-H308 PolarHBondContact O-N 3.14Å
307L97.7Very high98Very high35 Ų3547.5 Ų47.518%0.18324%0.239CC..THydrogen-bonded Turntrans-78.5-4.8179.3-67.4171.8000113.2M303 I304 M309 I362 L363 P367M303-L307 HydrophobicContact CB-CD1 3.89Å; M303-L307 HydrophobicContact CB-CG 4.38Å; M303-L307 VanDerWaalsContact O-CG 3.3Å; M303-L307 WeakPolarHBondContact O-CG 3.39Å; M303-L307 PolarHBondContact O-N 2.69Å; I304-L307 PolarHBondContact O-N 2.96Å; L307-M309 PolarHBondContact O-N 3.02Å; L307-M309 VanDerWaalsContact O-N 3.15Å; L307-I362 HydrophobicContact CD1-CG2 4.16Å; L307-L363 HydrophobicContact CD1-CD2 3.85Å; L307-P367 HydrophobicContact CB-CG 4.06Å; L307-P367 HydrophobicContact CD2-CG 4.12Å
308H98Very high98Very high42 Ų4247.6 Ų47.619%0.19424%0.239CC..  trans-75.8103.1-179.2-172.877.8000112.1F107 L108 I304 P305 I306 S310 Q312F107-H308 HydrophobicContact CE2-CB 3.81Å; F107-H308 AromaticContact CE2-CG 3.92Å; F107-H308 AromaticContact CE2-ND1 3.82Å; F107-H308 HydrophobicContact CZ-CB 4.28Å; F107-H308 AromaticContact CZ-ND1 3.58Å; L108-H308 HydrophobicContact CD2-CB 4.31Å; I304-H308 PolarHBondContact O-N 3.2Å; P305-H308 WeakPolarHBondContact O-CB 3.44Å; P305-H308 PolarHBondContact O-N 3.01Å; I306-H308 PolarHBondContact O-N 3.14Å; H308-S310 PolarHBondContact NE2-O 3.24Å; H308-Q312 PolarHBondContact CE1-O 3.44Å
309M97.7Very high98Very high87 Ų8751.1 Ų51.143%0.42926%0.263SS..  trans-103.9-3.4-178.9-60.5-63.7170.500114L307 P367 L371 N374L307-M309 PolarHBondContact O-N 3.02Å; L307-M309 VanDerWaalsContact O-N 3.15Å; M309-P367 HydrophobicContact CG-CB 4.04Å; M309-L371 HydrophobicContact CB-CD2 3.83Å; M309-L371 HydrophobicContact CB-CG 3.87Å; M309-L371 HydrophobicContact CG-CD2 4.48Å; M309-L371 HydrophobicContact CG-CG 4.39Å; M309-N374 PolarHBondContact O-ND2 3.1Å
310S98Very high98Very high10 Ų1051.4 Ų51.47%0.0727%0.265CS..  trans-77.2146.9-178.3172.30000111.3H308 Q312 R318H308-S310 PolarHBondContact NE2-O 3.24Å; S310-Q312 VanDerWaalsContact C-N 3.32Å; S310-Q312 WeakPolarHBondContact CB-O 3.04Å; S310-Q312 PolarHBondContact OG-N 3.38Å; S310-Q312 PolarHBondContact OG-O 3.05Å; S310-R318 WeakPolarHBondContact OG-CD 3.26Å; S310-R318 VanDerWaalsContact OG-CZ 3.31Å; S310-R318 PolarHBondContact OG-NE 3.18Å; S310-R318 PolarHBondContact OG-NH1 3.23Å
311K97.8Very high98Very high133 Ų13351.1 Ų51.158%0.57826%0.263SS*.SBendtrans-82.7-12.7169-54.5-71.9-174168.50112.7N374 W379 A380K311-N374 PolarHBondContact N-OD1 2.9Å; K311-W379 HydrophobicContact CB-CD2 4.07Å; K311-W379 HydrophobicContact CB-CE3 3.48Å; K311-W379 VanDerWaalsContact CB-CE3 3.48Å; K311-W379 HydrophobicContact CB-CZ3 3.74Å; K311-W379 HydrophobicContact CG-CB 4.21Å; K311-W379 HydrophobicContact CG-CD2 4.28Å; K311-W379 HydrophobicContact CG-CE3 3.92Å; K311-W379 HydrophobicContact CG-CG 4.47Å; K311-A380 WeakPolarHBondContact CE-O 3.46Å; K311-A380 PolarHBondContact NZ-O 3.3Å
312Q98.1Very high98.1Very high42 Ų4252.7 Ų52.720%0.19627%0.27CS..SBendtrans-99.3129.9170.5-80.7160.7-24.500110.6H308 S310 R318 W379H308-Q312 PolarHBondContact CE1-O 3.44Å; S310-Q312 VanDerWaalsContact C-N 3.32Å; S310-Q312 WeakPolarHBondContact CB-O 3.04Å; S310-Q312 PolarHBondContact OG-N 3.38Å; S310-Q312 PolarHBondContact OG-O 3.05Å; Q312-R318 HydrophobicContact CB-CG 4.4Å; Q312-R318 PolarHBondContact O-NH1 2.99Å; Q312-W379 HydrophobicContact CB-CZ3 4.42Å; Q312-W379 HydrophobicContact CG-CH2 3.44Å; Q312-W379 VanDerWaalsContact CG-CH2 3.44Å; Q312-W379 HydrophobicContact CG-CZ3 3.56Å
313Q97.8Very high98.1Very high42 Ų4254.2 Ų54.220%0.19628%0.278CS..SBendtrans-66.1-55.3178.1175.2169.34.600112.3G105 L108 N206G105-Q313 PolarHBondContact O-NE2 3Å; L108-Q313 HydrophobicContact CD1-CB 4.15Å; L108-Q313 HydrophobicContact CD1-CG 3.73Å; N206-Q313 PolarHBondContact ND2-NE2 2.74Å
314S98.3Very high98.1Very high2 Ų251 Ų511%0.01426%0.263CS..SBendtrans-83.2147.8-177.3174.20000112.4Y104 P208 M316 R318Y104-S314 WeakPolarHBondContact CD1-OG 3.46Å; P208-S314 WeakPolarHBondContact O-CB 3.43Å; P208-S314 PolarHBondContact O-OG 2.85Å; S314-M316 PolarHBondContact O-N 2.92Å; S314-M316 WeakPolarHBondContact OG-CB 3.2Å; S314-M316 PolarHBondContact OG-N 3.41Å; S314-R318 WeakPolarHBondContact O-CD 3.16Å
315M98.6Very high98.1Very high15 Ų1551.8 Ų51.87%0.07427%0.265CS..G310 helixtrans-75-5.6170-65-175-176.200113.5Y103 F317 R318 Q322 Y325 M366Y103-M315 HydrophobicContact CD2-CB 4.27Å; Y103-M315 HydrophobicContact CD2-SD 4.3Å; Y103-M315 HydrophobicContact CE1-CB 4.41Å; Y103-M315 HydrophobicContact CE2-CB 4.18Å; Y103-M315 HydrophobicContact CG-CB 4.45Å; Y103-M315 VanDerWaalsContact O-CB 3.27Å; Y103-M315 WeakPolarHBondContact O-CB 3.44Å; Y103-M315 VanDerWaalsContact O-CG 3.31Å; Y103-M315 WeakPolarHBondContact O-CG 3.46Å; Y103-M315 PolarHBondContact O-N 3.49Å; M315-F317 PolarHBondContact O-N 3.4Å; M315-R318 PolarHBondContact O-N 3.48Å; M315-Q322 HydrophobicContact CB-CG 4.18Å; M315-Q322 VanDerWaalsContact O-CG 3.27Å; M315-Q322 WeakPolarHBondContact O-CG 3.15Å; M315-Q322 PolarHBondContact O-NE2 3.12Å; M315-Y325 HydrophobicContact SD-CD2 4.49Å; M315-Y325 HydrophobicContact SD-CG 4.39Å; M315-M366 HydrophobicContact CE-CE 4.49Å
316M98Very high98.2Very high78 Ų7857 Ų5738%0.38428%0.28SS..G310 helixtrans-52.5-33.5-176.3-178.5166.9179.600114.3P208 L209 S314 Q322P208-M316 HydrophobicContact CB-SD 4.31Å; L209-M316 HydrophobicContact CD2-CE 3.69Å; L209-M316 HydrophobicContact CD2-SD 3.47Å; L209-M316 WeakPolarHBondContact CD2-SD 3.37Å; S314-M316 PolarHBondContact O-N 2.92Å; S314-M316 WeakPolarHBondContact OG-CB 3.2Å; S314-M316 PolarHBondContact OG-N 3.41Å; M316-Q322 PolarHBondContact O-NE2 2.93Å
317F98.1Very high98.3Very high111 Ų11154.9 Ų54.949%0.48727%0.27SS..G310 helixtrans-108.719.5179.7-55.6-62000113.6L209 M315L209-F317 HydrophobicContact CB-CE2 4.46Å; L209-F317 HydrophobicContact CD2-CE2 4.2Å; L209-F317 HydrophobicContact CD2-CZ 3.81Å; M315-F317 PolarHBondContact O-N 3.4Å
318R98.4Very high98.3Very high6 Ų653.6 Ų53.62%0.02326%0.263CS..  trans-12777.8-170.9-69.9175.456.5-165.3-0.3111S310 Q312 S314 M315 L320 S321 Q322 S370 E373S310-R318 WeakPolarHBondContact OG-CD 3.26Å; S310-R318 VanDerWaalsContact OG-CZ 3.31Å; S310-R318 PolarHBondContact OG-NE 3.18Å; S310-R318 PolarHBondContact OG-NH1 3.23Å; Q312-R318 HydrophobicContact CB-CG 4.4Å; Q312-R318 PolarHBondContact O-NH1 2.99Å; S314-R318 WeakPolarHBondContact O-CD 3.16Å; M315-R318 PolarHBondContact O-N 3.48Å; R318-L320 VanDerWaalsContact C-N 3.3Å; R318-L320 PolarHBondContact O-N 3.4Å; R318-S321 PolarHBondContact NE-OG 3.36Å; R318-S321 PolarHBondContact NH2-OG 3.08Å; R318-S321 PolarHBondContact O-N 2.89Å; R318-S321 VanDerWaalsContact O-N 3.12Å; R318-Q322 WeakPolarHBondContact O-CG 3.24Å; R318-Q322 PolarHBondContact O-N 3.32Å; R318-S370 PolarHBondContact NH2-OG 3.41Å; R318-E373 VanDerWaalsContact CA-OE1 3.29Å; R318-E373 WeakPolarHBondContact CA-OE1 3.32Å; R318-E373 WeakPolarHBondContact CB-OE1 3.37Å; R318-E373 WeakPolarHBondContact CB-OE2 3.15Å; R318-E373 IonicContact CZ-OE2 2.88Å; R318-E373 IonicContact NE-OE2 2.9Å; R318-E373 PolarHBondContact NE-OE2 3.39Å; R318-E373 IonicContact NH2-OE2 3.49Å; R318-E373 PolarHBondContact NH2-OE2 2.86Å
319P98.3Very high98.4Very high92 Ų9253 Ų5360%0.59727%0.265SS*.Hα-helixtrans-63.1-32.4-167.924.5-34.4000113.7Q322 S323P319-Q322 PolarHBondContact O-N 3.37Å; P319-S323 PolarHBondContact O-N 2.97Å
320L98.4Very high98.4Very high69 Ų6951 Ų5136%0.36126%0.262SS..Hα-helixtrans-73.6-36.6177.4-59.6177.6000110.6R318 S323 L324 I369 I372 E373 L376R318-L320 VanDerWaalsContact C-N 3.3Å; R318-L320 PolarHBondContact O-N 3.4Å; L320-S323 PolarHBondContact O-N 2.99Å; L320-S323 PolarHBondContact O-OG 3.47Å; L320-L324 PolarHBondContact O-N 3.42Å; L320-I369 HydrophobicContact CB-CD1 4.43Å; L320-I369 HydrophobicContact CB-CG2 3.42Å; L320-I369 VanDerWaalsContact CB-CG2 3.42Å; L320-I369 HydrophobicContact CD1-CD1 4.38Å; L320-I372 HydrophobicContact CD1-CG2 4.38Å; L320-E373 HydrophobicContact CB-CG 4.23Å; L320-E373 WeakPolarHBondContact CB-OE1 3.39Å; L320-E373 HydrophobicContact CD1-CG 4.2Å; L320-E373 HydrophobicContact CG-CG 4.5Å; L320-E373 PolarHBondContact N-OE1 2.8Å; L320-L376 HydrophobicContact CD1-CD1 4.34Å
321S98.4Very high98.5Very high1 Ų150.6 Ų50.61%0.00726%0.26CS..Hα-helixtrans-69-34.3173.6-63.40000112.5R318 L324 Y325 E373R318-S321 PolarHBondContact NE-OG 3.36Å; R318-S321 PolarHBondContact NH2-OG 3.08Å; R318-S321 PolarHBondContact O-N 2.89Å; R318-S321 VanDerWaalsContact O-N 3.12Å; S321-L324 PolarHBondContact O-N 2.79Å; S321-Y325 WeakPolarHBondContact O-CB 3.25Å; S321-Y325 PolarHBondContact O-N 2.94Å; S321-E373 PolarHBondContact N-OE1 2.84Å; S321-E373 PolarHBondContact OG-OE2 3.41Å
322Q98.8Very high98.5Very high53 Ų5346.9 Ų46.925%0.24825%0.246CC..Hα-helixtrans-61.8-44.2173.8-70.5178.43800112Y103 M315 M316 R318 P319 L324 Y325 W326Y103-Q322 HydrophobicContact CE2-CG 3.94Å; Y103-Q322 VanDerWaalsContact OH-CD 3.23Å; Y103-Q322 WeakPolarHBondContact OH-CG 3.44Å; Y103-Q322 PolarHBondContact OH-OE1 2.98Å; M315-Q322 HydrophobicContact CB-CG 4.18Å; M315-Q322 VanDerWaalsContact O-CG 3.27Å; M315-Q322 WeakPolarHBondContact O-CG 3.15Å; M315-Q322 PolarHBondContact O-NE2 3.12Å; M316-Q322 PolarHBondContact O-NE2 2.93Å; R318-Q322 WeakPolarHBondContact O-CG 3.24Å; R318-Q322 PolarHBondContact O-N 3.32Å; P319-Q322 PolarHBondContact O-N 3.37Å; Q322-L324 VanDerWaalsContact C-N 3.33Å; Q322-L324 PolarHBondContact O-N 2.86Å; Q322-Y325 PolarHBondContact O-N 3.14Å; Q322-W326 PolarHBondContact O-N 3.49Å
323S98.4Very high98.5Very high70 Ų7051 Ų5149%0.4927%0.268SS..Hα-helixtrans-64.1-39.917867.60000111.5P319 L320 W326 L327P319-S323 PolarHBondContact O-N 2.97Å; L320-S323 PolarHBondContact O-N 2.99Å; L320-S323 PolarHBondContact O-OG 3.47Å; S323-W326 PolarHBondContact O-N 3.25Å; S323-L327 WeakPolarHBondContact O-CB 3.4Å; S323-L327 PolarHBondContact O-N 2.92Å
324L98.5Very high98.6Very high17 Ų1752.2 Ų52.29%0.08928%0.276CS..Hα-helixtrans-65.9-37173.6-74.2-172.4000113.4L320 S321 Q322 L327 L328 L365 M366 I369L320-L324 PolarHBondContact O-N 3.42Å; S321-L324 PolarHBondContact O-N 2.79Å; Q322-L324 VanDerWaalsContact C-N 3.33Å; Q322-L324 PolarHBondContact O-N 2.86Å; L324-L327 HydrophobicContact CD2-CD2 4.08Å; L324-L327 PolarHBondContact O-N 3.22Å; L324-L328 WeakPolarHBondContact O-CB 3.43Å; L324-L328 PolarHBondContact O-N 2.85Å; L324-L365 HydrophobicContact CD1-CB 3.72Å; L324-L365 WeakPolarHBondContact CD1-O 3.32Å; L324-L365 HydrophobicContact CD2-CB 4.18Å; L324-L365 HydrophobicContact CD2-CD1 4.21Å; L324-M366 HydrophobicContact CB-CG 4.38Å; L324-M366 HydrophobicContact CD1-CG 4.21Å; L324-I369 HydrophobicContact CD1-CB 3.86Å; L324-I369 HydrophobicContact CD1-CG1 3.5Å; L324-I369 VanDerWaalsContact CD1-CG1 3.5Å; L324-I369 HydrophobicContact CD1-CG2 4.33Å; L324-I369 HydrophobicContact CG-CG1 4.38Å
325Y98.8Very high98.6Very high32 Ų3252.1 Ų52.113%0.12528%0.275CS..Hα-helixtrans-61.5-46.1173.9170.3-91.1000111.4G99 L102 Y103 M315 S321 Q322 L328 A329G99-Y325 WeakPolarHBondContact O-CE2 3.43Å; G99-Y325 PolarHBondContact O-OH 3.03Å; L102-Y325 HydrophobicContact CB-CE2 4.23Å; Y103-Y325 AromaticContact CD2-CD1 3.52Å; Y103-Y325 HydrophobicContact CD2-CD1 3.52Å; Y103-Y325 HydrophobicContact CD2-CD2 4.07Å; Y103-Y325 AromaticContact CD2-CE1 3.73Å; Y103-Y325 HydrophobicContact CD2-CE1 3.73Å; Y103-Y325 HydrophobicContact CD2-CE2 4.26Å; Y103-Y325 AromaticContact CD2-CG 3.7Å; Y103-Y325 HydrophobicContact CD2-CG 3.7Å; Y103-Y325 HydrophobicContact CE2-CD1 4.05Å; Y103-Y325 HydrophobicContact CE2-CE1 4.46Å; Y103-Y325 HydrophobicContact CE2-CG 4.43Å; M315-Y325 HydrophobicContact SD-CD2 4.49Å; M315-Y325 HydrophobicContact SD-CG 4.39Å; S321-Y325 WeakPolarHBondContact O-CB 3.25Å; S321-Y325 PolarHBondContact O-N 2.94Å; Q322-Y325 PolarHBondContact O-N 3.14Å; Y325-L328 WeakPolarHBondContact O-CB 3.34Å; Y325-L328 PolarHBondContact O-N 2.86Å; Y325-A329 PolarHBondContact O-N 3.26Å
326W98.8Very high98.6Very high143 Ų14353.1 Ų53.154%0.54228%0.282SS..Hα-helixtrans-70.9-31.6178.3-71.6117.1000112.7Q322 S323 A329 A330Q322-W326 PolarHBondContact O-N 3.49Å; S323-W326 PolarHBondContact O-N 3.25Å; W326-A329 HydrophobicContact CE3-CB 4.14Å; W326-A329 PolarHBondContact O-N 2.93Å; W326-A330 WeakPolarHBondContact O-CB 3.41Å; W326-A330 PolarHBondContact O-N 3.38Å
327L98.7Very high98.7Very high72 Ų7255.5 Ų55.538%0.37729%0.287SS..Hα-helixtrans-60.3-47.2168.9-179.765000110.9S323 L324 A329 A330 D331 L357S323-L327 WeakPolarHBondContact O-CB 3.4Å; S323-L327 PolarHBondContact O-N 2.92Å; L324-L327 HydrophobicContact CD2-CD2 4.08Å; L324-L327 PolarHBondContact O-N 3.22Å; L327-A329 VanDerWaalsContact C-N 3.34Å; L327-A329 PolarHBondContact O-N 3.26Å; L327-A330 PolarHBondContact O-N 3.44Å; L327-D331 WeakPolarHBondContact O-CB 3.5Å; L327-D331 PolarHBondContact O-N 2.85Å; L327-L357 HydrophobicContact CD1-CD2 4.29Å; L327-L357 HydrophobicContact CD2-CD1 4.33Å
328L98.8Very high98.7Very high9 Ų950.4 Ų50.45%0.04726%0.264CS..Hα-helixtrans-61.7-41.7176.6179.563.3000111.9L324 Y325 D331 L332 Y358 T361 I362 M366L324-L328 WeakPolarHBondContact O-CB 3.43Å; L324-L328 PolarHBondContact O-N 2.85Å; Y325-L328 WeakPolarHBondContact O-CB 3.34Å; Y325-L328 PolarHBondContact O-N 2.86Å; L328-D331 PolarHBondContact O-N 3.48Å; L328-L332 WeakPolarHBondContact O-CG 3.38Å; L328-L332 PolarHBondContact O-N 2.91Å; L328-Y358 HydrophobicContact CD1-CD2 3.65Å; L328-Y358 HydrophobicContact CD1-CE2 3.96Å; L328-T361 HydrophobicContact CB-CG2 4.1Å; L328-I362 HydrophobicContact CD1-CD1 4.11Å; L328-I362 HydrophobicContact CD1-CG1 4.1Å; L328-I362 HydrophobicContact CD2-CD1 4.22Å; L328-I362 HydrophobicContact CD2-CG1 3.92Å; L328-M366 HydrophobicContact CB-CE 4.3Å; L328-M366 HydrophobicContact CD2-CE 3.79Å
329A98.8Very high98.7Very high28 Ų2850.1 Ų50.123%0.23126%0.263CS..Hα-helixtrans-63.3-43.7176.400000111.8Y325 W326 L327 L332 L333Y325-A329 PolarHBondContact O-N 3.26Å; W326-A329 HydrophobicContact CE3-CB 4.14Å; W326-A329 PolarHBondContact O-N 2.93Å; L327-A329 VanDerWaalsContact C-N 3.34Å; L327-A329 PolarHBondContact O-N 3.26Å; A329-L332 PolarHBondContact O-N 3.45Å; A329-L333 WeakPolarHBondContact O-CG 3.36Å; A329-L333 PolarHBondContact O-N 3.5Å; A329-L333 VanDerWaalsContact O-N 3.17Å
330A98.9Very high98.6Very high45 Ų4546.6 Ų46.637%0.37224%0.244SC..Hα-helixtrans-64.8-39.8175.500000112W326 L327 L333 I334W326-A330 WeakPolarHBondContact O-CB 3.41Å; W326-A330 PolarHBondContact O-N 3.38Å; L327-A330 PolarHBondContact O-N 3.44Å; A330-L333 WeakPolarHBondContact O-CB 3.34Å; A330-L333 PolarHBondContact O-N 2.87Å; A330-I334 WeakPolarHBondContact O-CG1 3.31Å; A330-I334 PolarHBondContact O-N 2.84Å
331D98.9Very high98.6Very high3 Ų345.8 Ų45.82%0.01624%0.239CC..Hα-helixtrans-63.7-41.6176.8-172.954.9000112L327 L328 L333 I334 L335 A354 L357 Y358L327-D331 WeakPolarHBondContact O-CB 3.5Å; L327-D331 PolarHBondContact O-N 2.85Å; L328-D331 PolarHBondContact O-N 3.48Å; D331-L333 VanDerWaalsContact C-N 3.31Å; D331-L333 PolarHBondContact O-N 3.36Å; D331-I334 WeakPolarHBondContact O-CB 3.38Å; D331-I334 PolarHBondContact O-N 3.46Å; D331-I334 VanDerWaalsContact O-N 3.14Å; D331-L335 WeakPolarHBondContact O-CG 3.27Å; D331-L335 PolarHBondContact O-N 3.24Å; D331-A354 VanDerWaalsContact OD1-CA 3.31Å; D331-A354 WeakPolarHBondContact OD1-CA 3.23Å; D331-A354 WeakPolarHBondContact OD1-CB 3.25Å; D331-A354 VanDerWaalsContact OD2-O 3.08Å; D331-L357 HydrophobicContact CB-CD2 4.24Å; D331-Y358 VanDerWaalsContact OD2-CA 3.29Å; D331-Y358 WeakPolarHBondContact OD2-CA 3.22Å; D331-Y358 WeakPolarHBondContact OD2-CB 3.45Å; D331-Y358 PolarHBondContact OD2-N 2.74Å; D331-Y358 VanDerWaalsContact OD2-N 3.1Å
332L98.9Very high98.5Very high54 Ų5448.6 Ų48.628%0.28326%0.257SS..Hα-helixtrans-61-37172.1-78.5168.7000112.9F276 L328 A329 L335 T336 Y358F276-L332 HydrophobicContact CB-CD2 4.2Å; F276-L332 HydrophobicContact CD2-CD2 3.63Å; F276-L332 HydrophobicContact CE2-CD2 4.31Å; F276-L332 HydrophobicContact CG-CD2 4.06Å; L328-L332 WeakPolarHBondContact O-CG 3.38Å; L328-L332 PolarHBondContact O-N 2.91Å; A329-L332 PolarHBondContact O-N 3.45Å; L332-L335 HydrophobicContact CD2-CD1 4.39Å; L332-L335 PolarHBondContact O-N 2.77Å; L332-T336 WeakPolarHBondContact O-CB 3.44Å; L332-T336 PolarHBondContact O-N 3.1Å; L332-T336 PolarHBondContact O-OG1 3.39Å; L332-Y358 HydrophobicContact CD2-CD2 4.02Å; L332-Y358 HydrophobicContact CD2-CE2 3.78Å; L332-Y358 HydrophobicContact CG-CD2 4.38Å; L332-Y358 HydrophobicContact CG-CE2 4.31Å
333L98.8Very high98.3Very high128 Ų12850.9 Ų50.967%0.6727%0.274SS*.Hα-helixtrans-67-39.8173.7-68.4173.1000111.5A329 A330 D331 T336 W337A329-L333 WeakPolarHBondContact O-CG 3.36Å; A329-L333 PolarHBondContact O-N 3.5Å; A329-L333 VanDerWaalsContact O-N 3.17Å; A330-L333 WeakPolarHBondContact O-CB 3.34Å; A330-L333 PolarHBondContact O-N 2.87Å; D331-L333 VanDerWaalsContact C-N 3.31Å; D331-L333 PolarHBondContact O-N 3.36Å; L333-T336 PolarHBondContact O-N 3.04Å; L333-W337 WeakPolarHBondContact O-CB 3.46Å; L333-W337 PolarHBondContact O-N 3.09Å
334I98.9Very high98.2Very high69 Ų6949.9 Ų49.935%0.35427%0.267SS..Hα-helixtrans-63.3-48.2174-69.1165.5000110.2A330 D331 T336 W337 I338 I350 A354A330-I334 WeakPolarHBondContact O-CG1 3.31Å; A330-I334 PolarHBondContact O-N 2.84Å; D331-I334 WeakPolarHBondContact O-CB 3.38Å; D331-I334 PolarHBondContact O-N 3.46Å; D331-I334 VanDerWaalsContact O-N 3.14Å; I334-T336 VanDerWaalsContact C-N 3.27Å; I334-T336 PolarHBondContact O-N 2.95Å; I334-W337 HydrophobicContact CG2-CE3 4.46Å; I334-W337 PolarHBondContact O-N 2.84Å; I334-I338 HydrophobicContact CG2-CG1 4.16Å; I334-I338 WeakPolarHBondContact O-CB 3.45Å; I334-I338 VanDerWaalsContact O-CG1 3.29Å; I334-I338 WeakPolarHBondContact O-CG1 3.25Å; I334-I338 PolarHBondContact O-N 2.96Å; I334-I350 HydrophobicContact CG2-CG2 4.01Å; I334-A354 HydrophobicContact CG2-CB 4.09Å
335L98.9Very high98.1Very high0 Ų058.8 Ų58.80%030%0.301CS..Hα-helixtrans-57.6-41.4176.3-72.7170.5000111.6F276 T279 I280 D331 L332 G339 A354 Y358F276-L335 HydrophobicContact CB-CB 3.94Å; T279-L335 WeakPolarHBondContact CB-O 3.36Å; T279-L335 HydrophobicContact CG2-CD2 3.53Å; T279-L335 PolarHBondContact OG1-O 2.94Å; I280-L335 HydrophobicContact CD1-CD1 4.06Å; I280-L335 HydrophobicContact CG1-CD1 4.21Å; I280-L335 HydrophobicContact CG1-CD2 4.15Å; D331-L335 WeakPolarHBondContact O-CG 3.27Å; D331-L335 PolarHBondContact O-N 3.24Å; L332-L335 HydrophobicContact CD2-CD1 4.39Å; L332-L335 PolarHBondContact O-N 2.77Å; L335-G339 PolarHBondContact O-N 2.93Å; L335-A354 HydrophobicContact CD2-CB 3.59Å; L335-A354 HydrophobicContact CG-CB 3.96Å; L335-Y358 HydrophobicContact CD1-CD2 4.29Å; L335-Y358 HydrophobicContact CD1-CG 4.33Å
336T98.8Very high98Very high36 Ų3659.8 Ų59.822%0.22131%0.311CS..Hα-helixtrans-63.1-48.3175.7-57.70000111.1L275 L332 L333 I334 G339 G340L275-T336 HydrophobicContact CB-CG2 4.06Å; L275-T336 WeakPolarHBondContact CB-O 3.39Å; L275-T336 HydrophobicContact CD1-CG2 4.35Å; L332-T336 WeakPolarHBondContact O-CB 3.44Å; L332-T336 PolarHBondContact O-N 3.1Å; L332-T336 PolarHBondContact O-OG1 3.39Å; L333-T336 PolarHBondContact O-N 3.04Å; I334-T336 VanDerWaalsContact C-N 3.27Å; I334-T336 PolarHBondContact O-N 2.95Å; T336-G339 PolarHBondContact O-N 3.11Å; T336-G340 PolarHBondContact O-N 3.36Å
337W98.7Very high98Very high128 Ų12855 Ų5549%0.48530%0.295SS..Hα-helixtrans-59.1-49.9177.3165.758.1000112.1L333 I334 G339 G340 Q341 F347 I350L333-W337 WeakPolarHBondContact O-CB 3.46Å; L333-W337 PolarHBondContact O-N 3.09Å; I334-W337 HydrophobicContact CG2-CE3 4.46Å; I334-W337 PolarHBondContact O-N 2.84Å; W337-G339 PolarHBondContact O-N 2.89Å; W337-G340 PolarHBondContact O-N 3.44Å; W337-G340 VanDerWaalsContact O-N 3.11Å; W337-Q341 WeakPolarHBondContact O-CG 3.26Å; W337-F347 HydrophobicContact CH2-CD1 4.39Å; W337-F347 HydrophobicContact CH2-CE1 4.06Å; W337-F347 HydrophobicContact CZ2-CD1 4.4Å; W337-F347 AromaticContact CZ2-CE1 3.77Å; W337-F347 HydrophobicContact CZ2-CE1 3.77Å; W337-I350 HydrophobicContact CH2-CD1 4.49Å
338I98.7Very high98Very high3 Ų354.2 Ų54.22%0.01529%0.293CS..Hα-helixtrans-60.9-33.2178.1-66.1-60.3000111.6T279 R282 I334 G340 Q341 F347 I350T279-I338 HydrophobicContact CG2-CB 4.03Å; T279-I338 HydrophobicContact CG2-CG2 3.6Å; R282-I338 PolarHBondContact NH2-O 3.45Å; I334-I338 HydrophobicContact CG2-CG1 4.16Å; I334-I338 WeakPolarHBondContact O-CB 3.45Å; I334-I338 VanDerWaalsContact O-CG1 3.29Å; I334-I338 WeakPolarHBondContact O-CG1 3.25Å; I334-I338 PolarHBondContact O-N 2.96Å; I338-G340 PolarHBondContact O-N 3.11Å; I338-Q341 WeakPolarHBondContact O-CB 3.36Å; I338-Q341 PolarHBondContact O-N 3.11Å; I338-F347 HydrophobicContact CD1-CB 4.28Å; I338-F347 HydrophobicContact CD1-CD1 3.75Å; I338-F347 HydrophobicContact CD1-CG 4.47Å; I338-I350 HydrophobicContact CD1-CB 3.89Å; I338-I350 HydrophobicContact CD1-CD1 4.38Å; I338-I350 HydrophobicContact CD1-CG2 3.66Å; I338-I350 HydrophobicContact CG1-CB 4.38Å; I338-I350 HydrophobicContact CG1-CG2 3.83Å
339G98.1Very high98Very high0 Ų057.7 Ų57.70%031%0.311CS..Hα-helixtrans-62.3-31.5178.500000112.2T279 L335 T336 W337 Q341T279-G339 WeakPolarHBondContact OG1-CA 3.49Å; T279-G339 PolarHBondContact OG1-N 3.48Å; L335-G339 PolarHBondContact O-N 2.93Å; T336-G339 PolarHBondContact O-N 3.11Å; W337-G339 PolarHBondContact O-N 2.89Å; G339-Q341 VanDerWaalsContact C-N 3.33Å
340G97Very high98Very high19 Ų1959 Ų5920%0.19631%0.313CS..THydrogen-bonded Turntrans-80-8.4174.100000114.8H267 T336 W337 I338H267-G340 PolarHBondContact CE1-O 2.87Å; H267-G340 VanDerWaalsContact CE1-O 3.23Å; T336-G340 PolarHBondContact O-N 3.36Å; W337-G340 PolarHBondContact O-N 3.44Å; W337-G340 VanDerWaalsContact O-N 3.11Å; I338-G340 PolarHBondContact O-N 3.11Å
341Q97.9Very high97.9Very high52 Ų5257 Ų5724%0.24330%0.296CS..SBendtrans-94.2152.9-179.8-57.2-50.3-45.100112.4H267 R282 W337 I338 G339 F347H267-Q341 PolarHBondContact NE2-O 3.02Å; R282-Q341 PolarHBondContact NH1-O 3.25Å; R282-Q341 PolarHBondContact NH2-O 3.07Å; W337-Q341 WeakPolarHBondContact O-CG 3.26Å; I338-Q341 WeakPolarHBondContact O-CB 3.36Å; I338-Q341 PolarHBondContact O-N 3.11Å; G339-Q341 VanDerWaalsContact C-N 3.33Å; Q341-F347 HydrophobicContact CB-CB 4.11Å; Q341-F347 HydrophobicContact CB-CD1 3.94Å; Q341-F347 HydrophobicContact CB-CD2 3.72Å; Q341-F347 HydrophobicContact CB-CE1 4.27Å; Q341-F347 HydrophobicContact CB-CE2 4.05Å; Q341-F347 HydrophobicContact CB-CG 3.65Å; Q341-F347 HydrophobicContact CB-CZ 4.31Å; Q341-F347 HydrophobicContact CG-CD1 3.81Å; Q341-F347 HydrophobicContact CG-CD2 4.31Å; Q341-F347 HydrophobicContact CG-CE1 3.8Å; Q341-F347 HydrophobicContact CG-CE2 4.29Å; Q341-F347 HydrophobicContact CG-CG 4.07Å; Q341-F347 HydrophobicContact CG-CZ 4.04Å
342P95.9Very high97.9Very high59 Ų5960 Ų6038%0.38331%0.311SS..  trans-63.7157.9174.428.1-36.3000112.1S344 F347P342-S344 VanDerWaalsContact C-N 3.29Å; P342-S344 PolarHBondContact O-N 3.01Å; P342-F347 HydrophobicContact CG-CD2 4.32Å; P342-F347 HydrophobicContact CG-CE2 4.4Å
343V95.3Very high97.9Very high101 Ų10161.8 Ų61.861%0.61232%0.323SS*.SBendtrans-78.881.1175.3-172.20000109.4
344S96.2Very high97.9Very high50 Ų5055.9 Ų55.935%0.3529%0.293SS..  trans-146.1165.6177.961.80000111.2P342 F347 T348P342-S344 VanDerWaalsContact C-N 3.29Å; P342-S344 PolarHBondContact O-N 3.01Å; S344-F347 WeakPolarHBondContact O-CA 3.4Å; S344-F347 WeakPolarHBondContact O-CB 3.42Å; S344-F347 PolarHBondContact O-N 3.02Å; S344-T348 PolarHBondContact O-N 2.52Å; S344-T348 PolarHBondContact O-OG1 3.47Å
345Y96.3Very high97.9Very high203 Ų20353.1 Ų53.180%0.79628%0.28SS*.THydrogen-bonded Turntrans-66.7137.2169.5-178-90.9000110.4I349Y345-I349 HydrophobicContact CD2-CG2 4.46Å; Y345-I349 HydrophobicContact CE2-CG2 4.3Å
346P97.4Very high97.9Very high53 Ų5357.6 Ų57.634%0.34431%0.307SS..THydrogen-bonded Turncis-91.71.41.336.8-35.7000114.7T348 I349 I350P346-T348 VanDerWaalsContact C-N 3.32Å; P346-T348 PolarHBondContact O-N 2.93Å; P346-I349 HydrophobicContact CB-CG2 4.47Å; P346-I349 WeakPolarHBondContact O-CG2 3.4Å; P346-I349 PolarHBondContact O-N 3.08Å; P346-I350 HydrophobicContact CB-CD1 4.24Å; P346-I350 HydrophobicContact CG-CD1 4.26Å; P346-I350 WeakPolarHBondContact O-CG1 3.39Å; P346-I350 PolarHBondContact O-N 3.21Å; P346-I350 VanDerWaalsContact O-N 3.16Å
347F98.4Very high97.9Very high44 Ų4458.3 Ų58.319%0.19331%0.309CS..Hα-helixtrans-62.8-34.9-173.6-56.3-54.7000113.8W337 I338 Q341 P342 S344 I349 I350 G351W337-F347 HydrophobicContact CH2-CD1 4.39Å; W337-F347 HydrophobicContact CH2-CE1 4.06Å; W337-F347 HydrophobicContact CZ2-CD1 4.4Å; W337-F347 AromaticContact CZ2-CE1 3.77Å; W337-F347 HydrophobicContact CZ2-CE1 3.77Å; I338-F347 HydrophobicContact CD1-CB 4.28Å; I338-F347 HydrophobicContact CD1-CD1 3.75Å; I338-F347 HydrophobicContact CD1-CG 4.47Å; Q341-F347 HydrophobicContact CB-CB 4.11Å; Q341-F347 HydrophobicContact CB-CD1 3.94Å; Q341-F347 HydrophobicContact CB-CD2 3.72Å; Q341-F347 HydrophobicContact CB-CE1 4.27Å; Q341-F347 HydrophobicContact CB-CE2 4.05Å; Q341-F347 HydrophobicContact CB-CG 3.65Å; Q341-F347 HydrophobicContact CB-CZ 4.31Å; Q341-F347 HydrophobicContact CG-CD1 3.81Å; Q341-F347 HydrophobicContact CG-CD2 4.31Å; Q341-F347 HydrophobicContact CG-CE1 3.8Å; Q341-F347 HydrophobicContact CG-CE2 4.29Å; Q341-F347 HydrophobicContact CG-CG 4.07Å; Q341-F347 HydrophobicContact CG-CZ 4.04Å; P342-F347 HydrophobicContact CG-CD2 4.32Å; P342-F347 HydrophobicContact CG-CE2 4.4Å; S344-F347 WeakPolarHBondContact O-CA 3.4Å; S344-F347 WeakPolarHBondContact O-CB 3.42Å; S344-F347 PolarHBondContact O-N 3.02Å; F347-I349 PolarHBondContact O-N 2.86Å; F347-I350 PolarHBondContact O-N 3.24Å; F347-G351 PolarHBondContact O-N 3.02Å
348T97.9Very high97.9Very high55 Ų5552.8 Ų52.834%0.33729%0.288SS..Hα-helixtrans-58.8-48.8176.5-53.70000111.9S344 P346 G351 Q352S344-T348 PolarHBondContact O-N 2.52Å; S344-T348 PolarHBondContact O-OG1 3.47Å; P346-T348 VanDerWaalsContact C-N 3.32Å; P346-T348 PolarHBondContact O-N 2.93Å; T348-G351 PolarHBondContact O-N 3.16Å; T348-Q352 WeakPolarHBondContact O-CG 3.39Å; T348-Q352 PolarHBondContact O-N 3.23Å; T348-Q352 VanDerWaalsContact O-N 3.07Å
349I98.5Very high97.9Very high82 Ų8254.9 Ų54.942%0.42130%0.297SS..Hα-helixtrans-71.8-36.4-178.2-17460.9000111.5Y345 P346 F347 G351 Q352 V353Y345-I349 HydrophobicContact CD2-CG2 4.46Å; Y345-I349 HydrophobicContact CE2-CG2 4.3Å; P346-I349 HydrophobicContact CB-CG2 4.47Å; P346-I349 WeakPolarHBondContact O-CG2 3.4Å; P346-I349 PolarHBondContact O-N 3.08Å; F347-I349 PolarHBondContact O-N 2.86Å; I349-G351 VanDerWaalsContact C-N 3.34Å; I349-G351 PolarHBondContact O-N 3.39Å; I349-Q352 PolarHBondContact O-N 2.97Å; I349-V353 HydrophobicContact CD1-CG2 4.27Å; I349-V353 HydrophobicContact CG1-CG2 4.39Å; I349-V353 WeakPolarHBondContact O-CG2 3.07Å; I349-V353 PolarHBondContact O-N 3.4Å
350I98.8Very high98Very high55 Ų5557 Ų5728%0.28231%0.31SS..Hα-helixtrans-61.9-45.4174.7-61.5165.7000110I334 W337 I338 P346 F347 Q352 V353 A354I334-I350 HydrophobicContact CG2-CG2 4.01Å; W337-I350 HydrophobicContact CH2-CD1 4.49Å; I338-I350 HydrophobicContact CD1-CB 3.89Å; I338-I350 HydrophobicContact CD1-CD1 4.38Å; I338-I350 HydrophobicContact CD1-CG2 3.66Å; I338-I350 HydrophobicContact CG1-CB 4.38Å; I338-I350 HydrophobicContact CG1-CG2 3.83Å; P346-I350 HydrophobicContact CB-CD1 4.24Å; P346-I350 HydrophobicContact CG-CD1 4.26Å; P346-I350 WeakPolarHBondContact O-CG1 3.39Å; P346-I350 PolarHBondContact O-N 3.21Å; P346-I350 VanDerWaalsContact O-N 3.16Å; F347-I350 PolarHBondContact O-N 3.24Å; I350-Q352 VanDerWaalsContact C-N 3.34Å; I350-Q352 PolarHBondContact O-N 3.36Å; I350-V353 PolarHBondContact O-N 2.89Å; I350-A354 VanDerWaalsContact O-CB 3.27Å; I350-A354 WeakPolarHBondContact O-CB 3.46Å; I350-A354 PolarHBondContact O-N 3.5Å
351G98.7Very high98.1Very high2 Ų256.1 Ų56.12%0.02130%0.301CS..Hα-helixtrans-58.9-43.2176.700000112.9S283 F347 T348 I349 S355S283-G351 PolarHBondContact OG-O 2.81Å; S283-G351 VanDerWaalsContact OG-O 3.05Å; F347-G351 PolarHBondContact O-N 3.02Å; T348-G351 PolarHBondContact O-N 3.16Å; I349-G351 VanDerWaalsContact C-N 3.34Å; I349-G351 PolarHBondContact O-N 3.39Å; G351-S355 WeakPolarHBondContact O-CB 3.35Å; G351-S355 PolarHBondContact O-N 3.12Å; G351-S355 PolarHBondContact O-OG 2.74Å
352Q98.8Very high98.1Very high68 Ų6854 Ų5432%0.31829%0.291SS..Hα-helixtrans-63.2-48.5176.7-74.4173.9-24.300112.3S283 T348 I349 I350 S355 V356S283-Q352 WeakPolarHBondContact O-CG 3.37Å; S283-Q352 PolarHBondContact O-NE2 2.82Å; S283-Q352 PolarHBondContact OG-N 3.32Å; T348-Q352 WeakPolarHBondContact O-CG 3.39Å; T348-Q352 PolarHBondContact O-N 3.23Å; T348-Q352 VanDerWaalsContact O-N 3.07Å; I349-Q352 PolarHBondContact O-N 2.97Å; I350-Q352 VanDerWaalsContact C-N 3.34Å; I350-Q352 PolarHBondContact O-N 3.36Å; Q352-S355 PolarHBondContact O-N 2.97Å; Q352-V356 WeakPolarHBondContact O-CG2 3.09Å; Q352-V356 PolarHBondContact O-N 3.22Å
353V98.8Very high98.2Very high90 Ų9054.8 Ų54.855%0.54529%0.292SS..Hα-helixtrans-62.8-45.6179172.60000110.9I349 I350 S355 V356 L357I349-V353 HydrophobicContact CD1-CG2 4.27Å; I349-V353 HydrophobicContact CG1-CG2 4.39Å; I349-V353 WeakPolarHBondContact O-CG2 3.07Å; I349-V353 PolarHBondContact O-N 3.4Å; I350-V353 PolarHBondContact O-N 2.89Å; V353-S355 VanDerWaalsContact C-N 3.35Å; V353-S355 PolarHBondContact O-N 3.47Å; V353-V356 PolarHBondContact O-N 3.41Å; V353-L357 WeakPolarHBondContact O-CB 3.49Å; V353-L357 PolarHBondContact O-N 3Å
354A98.8Very high98.4Very high5 Ų554.5 Ų54.54%0.04129%0.286CS..Hα-helixtrans-61.5-42.3176.300000111.6D331 I334 L335 I350 V356 L357 Y358D331-A354 VanDerWaalsContact OD1-CA 3.31Å; D331-A354 WeakPolarHBondContact OD1-CA 3.23Å; D331-A354 WeakPolarHBondContact OD1-CB 3.25Å; D331-A354 VanDerWaalsContact OD2-O 3.08Å; I334-A354 HydrophobicContact CG2-CB 4.09Å; L335-A354 HydrophobicContact CD2-CB 3.59Å; L335-A354 HydrophobicContact CG-CB 3.96Å; I350-A354 VanDerWaalsContact O-CB 3.27Å; I350-A354 WeakPolarHBondContact O-CB 3.46Å; I350-A354 PolarHBondContact O-N 3.5Å; A354-V356 VanDerWaalsContact C-N 3.33Å; A354-V356 PolarHBondContact O-N 3.45Å; A354-L357 WeakPolarHBondContact O-CB 3.37Å; A354-L357 PolarHBondContact O-N 3.48Å; A354-L357 VanDerWaalsContact O-N 3.12Å; A354-Y358 PolarHBondContact O-N 2.78Å
355S98.8Very high98.5Very high10 Ų1054.9 Ų54.97%0.0728%0.284CS..Hα-helixtrans-63.1-39.7177.5-56.50000112S283 G351 Q352 V353 F359S283-S355 WeakPolarHBondContact CB-OG 3.12Å; S283-S355 PolarHBondContact OG-OG 2.86Å; G351-S355 WeakPolarHBondContact O-CB 3.35Å; G351-S355 PolarHBondContact O-N 3.12Å; G351-S355 PolarHBondContact O-OG 2.74Å; Q352-S355 PolarHBondContact O-N 2.97Å; V353-S355 VanDerWaalsContact C-N 3.35Å; V353-S355 PolarHBondContact O-N 3.47Å; S355-F359 VanDerWaalsContact O-CD2 3.28Å; S355-F359 WeakPolarHBondContact O-CD2 3.29Å; S355-F359 PolarHBondContact O-N 2.55Å
356V98.8Very high98.6Very high94 Ų9446.5 Ų46.557%0.5725%0.252SS*.Hα-helixtrans-65.6-42.1173.5171.60000110.7Q352 V353 A354 Y358 T360Q352-V356 WeakPolarHBondContact O-CG2 3.09Å; Q352-V356 PolarHBondContact O-N 3.22Å; V353-V356 PolarHBondContact O-N 3.41Å; A354-V356 VanDerWaalsContact C-N 3.33Å; A354-V356 PolarHBondContact O-N 3.45Å; V356-Y358 PolarHBondContact O-N 2.9Å; V356-T360 WeakPolarHBondContact O-CB 3.43Å; V356-T360 PolarHBondContact O-N 2.68Å; V356-T360 PolarHBondContact O-OG1 3.04Å
357L98.8Very high98.6Very high52 Ų5244.6 Ų44.627%0.27224%0.24SC..Hα-helixtrans-62.8-42.1179.2-17760.5000111.6L327 D331 V353 A354 T360 T361L327-L357 HydrophobicContact CD1-CD2 4.29Å; L327-L357 HydrophobicContact CD2-CD1 4.33Å; D331-L357 HydrophobicContact CB-CD2 4.24Å; V353-L357 WeakPolarHBondContact O-CB 3.49Å; V353-L357 PolarHBondContact O-N 3Å; A354-L357 WeakPolarHBondContact O-CB 3.37Å; A354-L357 PolarHBondContact O-N 3.48Å; A354-L357 VanDerWaalsContact O-N 3.12Å; L357-T360 PolarHBondContact O-N 2.95Å; L357-T361 VanDerWaalsContact O-CB 3.23Å; L357-T361 WeakPolarHBondContact O-CB 3.42Å; L357-T361 PolarHBondContact O-N 2.95Å; L357-T361 PolarHBondContact O-OG1 3.34Å
358Y98.9Very high98.6Very high12 Ų1245.4 Ų45.45%0.04725%0.249CC..Hα-helixtrans-53.2-58.8175.7175.6-97.9000112.1I280 S297 I300 L328 D331 L332 L335 A354 V356 T361 I362I280-Y358 HydrophobicContact CD1-CD1 3.94Å; I280-Y358 HydrophobicContact CD1-CE1 4.27Å; I280-Y358 HydrophobicContact CD1-CG 4.27Å; S297-Y358 PolarHBondContact O-OH 3.11Å; I300-Y358 HydrophobicContact CG2-CE1 4.13Å; I300-Y358 VanDerWaalsContact CG2-OH 3.23Å; I300-Y358 WeakPolarHBondContact CG2-OH 3.27Å; L328-Y358 HydrophobicContact CD1-CD2 3.65Å; L328-Y358 HydrophobicContact CD1-CE2 3.96Å; D331-Y358 VanDerWaalsContact OD2-CA 3.29Å; D331-Y358 WeakPolarHBondContact OD2-CA 3.22Å; D331-Y358 WeakPolarHBondContact OD2-CB 3.45Å; D331-Y358 PolarHBondContact OD2-N 2.74Å; D331-Y358 VanDerWaalsContact OD2-N 3.1Å; L332-Y358 HydrophobicContact CD2-CD2 4.02Å; L332-Y358 HydrophobicContact CD2-CE2 3.78Å; L332-Y358 HydrophobicContact CG-CD2 4.38Å; L332-Y358 HydrophobicContact CG-CE2 4.31Å; L335-Y358 HydrophobicContact CD1-CD2 4.29Å; L335-Y358 HydrophobicContact CD1-CG 4.33Å; A354-Y358 PolarHBondContact O-N 2.78Å; V356-Y358 PolarHBondContact O-N 2.9Å; Y358-T361 PolarHBondContact O-N 3Å; Y358-I362 HydrophobicContact CD1-CD1 4.48Å; Y358-I362 HydrophobicContact CD2-CD1 4.23Å; Y358-I362 HydrophobicContact CE1-CD1 3.95Å; Y358-I362 HydrophobicContact CE2-CD1 3.67Å; Y358-I362 PolarHBondContact O-N 3.46Å
359F98.8Very high98.6Very high46 Ų4644.3 Ų44.320%0.20224%0.24CC..Hα-helixtrans-66.9-40.8-178.9-74.5-71.2000111.9I280 L296 I300 S355 T361 I362 L363I280-F359 HydrophobicContact CG2-CE2 3.87Å; I280-F359 HydrophobicContact CG2-CZ 4.33Å; L296-F359 HydrophobicContact CB-CE1 4.23Å; L296-F359 HydrophobicContact CB-CZ 4.35Å; I300-F359 HydrophobicContact CD1-CD1 3.72Å; I300-F359 HydrophobicContact CD1-CE1 4.1Å; S355-F359 VanDerWaalsContact O-CD2 3.28Å; S355-F359 WeakPolarHBondContact O-CD2 3.29Å; S355-F359 PolarHBondContact O-N 2.55Å; F359-T361 VanDerWaalsContact C-N 3.34Å; F359-T361 PolarHBondContact O-N 2.88Å; F359-I362 PolarHBondContact O-N 3.3Å; F359-L363 HydrophobicContact CB-CD1 4.42Å; F359-L363 HydrophobicContact CD1-CD1 4.43Å; F359-L363 VanDerWaalsContact O-CB 3.28Å; F359-L363 WeakPolarHBondContact O-CB 3.4Å; F359-L363 WeakPolarHBondContact O-CG 3.26Å; F359-L363 PolarHBondContact O-N 2.95Å
360T98.8Very high98.6Very high45 Ų4540.7 Ų40.728%0.27622%0.222SC..Hα-helixtrans-63.6-41179.4-59.20000111.5V356 L357 I364 L365V356-T360 WeakPolarHBondContact O-CB 3.43Å; V356-T360 PolarHBondContact O-N 2.68Å; V356-T360 PolarHBondContact O-OG1 3.04Å; L357-T360 PolarHBondContact O-N 2.95Å; T360-I364 HydrophobicContact CG2-CB 4.44Å; T360-I364 HydrophobicContact CG2-CD1 4.42Å; T360-I364 WeakPolarHBondContact O-CA 3.21Å; T360-I364 WeakPolarHBondContact O-CB 3.49Å; T360-I364 PolarHBondContact O-N 3.41Å; T360-L365 HydrophobicContact CG2-CD1 4.35Å; T360-L365 HydrophobicContact CG2-CG 4.12Å; T360-L365 PolarHBondContact O-N 3.27Å
361T98.7Very high98.6Very high0 Ų042.1 Ų42.10%023%0.23CC..Iπ-helixtrans-61.9-47.3179.2-59.80000110.9L328 L357 Y358 F359 L365 M366L328-T361 HydrophobicContact CB-CG2 4.1Å; L357-T361 VanDerWaalsContact O-CB 3.23Å; L357-T361 WeakPolarHBondContact O-CB 3.42Å; L357-T361 PolarHBondContact O-N 2.95Å; L357-T361 PolarHBondContact O-OG1 3.34Å; Y358-T361 PolarHBondContact O-N 3Å; F359-T361 VanDerWaalsContact C-N 3.34Å; F359-T361 PolarHBondContact O-N 2.88Å; T361-L365 PolarHBondContact O-N 2.96Å; T361-M366 HydrophobicContact CG2-CE 4.24Å; T361-M366 HydrophobicContact CG2-CG 4.4Å; T361-M366 WeakPolarHBondContact O-CB 3.41Å; T361-M366 WeakPolarHBondContact O-CG 3.22Å; T361-M366 PolarHBondContact O-N 3.32Å
362I98.6Very high98.6Very high7 Ų745.8 Ų45.84%0.03625%0.248CC..Iπ-helixtrans-73.4-49.7-177.5-63.2168.6000111.9I300 I304 L307 L328 Y358 F359 P367I300-I362 HydrophobicContact CD1-CB 3.84Å; I300-I362 HydrophobicContact CD1-CD1 4.02Å; I300-I362 HydrophobicContact CD1-CG2 3.58Å; I300-I362 HydrophobicContact CG1-CG2 3.77Å; I300-I362 HydrophobicContact CG2-CD1 4.27Å; I304-I362 HydrophobicContact CD1-CG2 3.43Å; I304-I362 VanDerWaalsContact CD1-CG2 3.43Å; L307-I362 HydrophobicContact CD1-CG2 4.16Å; L328-I362 HydrophobicContact CD1-CD1 4.11Å; L328-I362 HydrophobicContact CD1-CG1 4.1Å; L328-I362 HydrophobicContact CD2-CD1 4.22Å; L328-I362 HydrophobicContact CD2-CG1 3.92Å; Y358-I362 HydrophobicContact CD1-CD1 4.48Å; Y358-I362 HydrophobicContact CD2-CD1 4.23Å; Y358-I362 HydrophobicContact CE1-CD1 3.95Å; Y358-I362 HydrophobicContact CE2-CD1 3.67Å; Y358-I362 PolarHBondContact O-N 3.46Å; F359-I362 PolarHBondContact O-N 3.3Å; I362-P367 WeakPolarHBondContact O-CD 3.27Å
363L98.6Very high98.5Very high77 Ų7743 Ų4340%0.40324%0.235SC..Iπ-helixtrans-80.2-28.8-170.7-62177.5000113.4I300 L307 F359I300-L363 HydrophobicContact CD1-CD1 4.4Å; I300-L363 HydrophobicContact CD1-CD2 3.71Å; I300-L363 HydrophobicContact CD1-CG 3.85Å; I300-L363 HydrophobicContact CG1-CD2 4.13Å; L307-L363 HydrophobicContact CD1-CD2 3.85Å; F359-L363 HydrophobicContact CB-CD1 4.42Å; F359-L363 HydrophobicContact CD1-CD1 4.43Å; F359-L363 VanDerWaalsContact O-CB 3.28Å; F359-L363 WeakPolarHBondContact O-CB 3.4Å; F359-L363 WeakPolarHBondContact O-CG 3.26Å; F359-L363 PolarHBondContact O-N 2.95Å
364I98.6Very high98.5Very high95 Ų9539 Ų3949%0.48721%0.211SC..Iπ-helixtrans-121.7-57.5-169.7-54.8177000111.1T360 P367 T368T360-I364 HydrophobicContact CG2-CB 4.44Å; T360-I364 HydrophobicContact CG2-CD1 4.42Å; T360-I364 WeakPolarHBondContact O-CA 3.21Å; T360-I364 WeakPolarHBondContact O-CB 3.49Å; T360-I364 PolarHBondContact O-N 3.41Å; I364-P367 WeakPolarHBondContact O-CD 3.32Å; I364-T368 HydrophobicContact CG2-CG2 4.43Å; I364-T368 WeakPolarHBondContact O-CB 3.34Å; I364-T368 WeakPolarHBondContact O-CG2 3.37Å; I364-T368 PolarHBondContact O-N 2.8Å; I364-T368 VanDerWaalsContact O-N 3.12Å; I364-T368 PolarHBondContact O-OG1 3.28Å
365L98.6Very high98.5Very high57 Ų5746.7 Ų46.730%0.29824%0.243SC..Iπ-helixtrans-68.8-45-170.5-56.5179.1000112.5L324 T360 T361 T368 I369L324-L365 HydrophobicContact CD1-CB 3.72Å; L324-L365 WeakPolarHBondContact CD1-O 3.32Å; L324-L365 HydrophobicContact CD2-CB 4.18Å; L324-L365 HydrophobicContact CD2-CD1 4.21Å; T360-L365 HydrophobicContact CG2-CD1 4.35Å; T360-L365 HydrophobicContact CG2-CG 4.12Å; T360-L365 PolarHBondContact O-N 3.27Å; T361-L365 PolarHBondContact O-N 2.96Å; L365-T368 WeakPolarHBondContact CA-OG1 3.48Å; L365-T368 PolarHBondContact O-N 3.16Å; L365-T368 PolarHBondContact O-OG1 2.93Å; L365-I369 WeakPolarHBondContact O-CB 3.08Å; L365-I369 WeakPolarHBondContact O-CG1 3.4Å; L365-I369 PolarHBondContact O-N 3.42Å
366M98.3Very high98.4Very high27 Ų2752 Ų5213%0.13327%0.271CS..Hα-helixtrans-62.3-48.4-179.9-79-175.2174.800113M315 L324 L328 T361 S370M315-M366 HydrophobicContact CE-CE 4.49Å; L324-M366 HydrophobicContact CB-CG 4.38Å; L324-M366 HydrophobicContact CD1-CG 4.21Å; L328-M366 HydrophobicContact CB-CE 4.3Å; L328-M366 HydrophobicContact CD2-CE 3.79Å; T361-M366 HydrophobicContact CG2-CE 4.24Å; T361-M366 HydrophobicContact CG2-CG 4.4Å; T361-M366 WeakPolarHBondContact O-CB 3.41Å; T361-M366 WeakPolarHBondContact O-CG 3.22Å; T361-M366 PolarHBondContact O-N 3.32Å; M366-S370 WeakPolarHBondContact O-CB 3.27Å; M366-S370 PolarHBondContact O-N 3.22Å; M366-S370 PolarHBondContact O-OG 3.24Å
367P98.3Very high98.4Very high14 Ų1451.6 Ų51.69%0.09127%0.265CS..Hα-helixtrans-62.4-42.5175.3-25.434.6000113.2L307 M309 I362 I364 S370 L371L307-P367 HydrophobicContact CB-CG 4.06Å; L307-P367 HydrophobicContact CD2-CG 4.12Å; M309-P367 HydrophobicContact CG-CB 4.04Å; I362-P367 WeakPolarHBondContact O-CD 3.27Å; I364-P367 WeakPolarHBondContact O-CD 3.32Å; P367-S370 WeakPolarHBondContact O-CB 3.26Å; P367-S370 PolarHBondContact O-N 3.11Å; P367-L371 WeakPolarHBondContact O-CG 3.47Å; P367-L371 PolarHBondContact O-N 3.48Å; P367-L371 VanDerWaalsContact O-N 3.11Å
368T98.5Very high98.3Very high60 Ų6058.4 Ų58.437%0.36829%0.292SS..Hα-helixtrans-66.6-44.7-179.152.40000112.1I364 L365 S370 L371 I372I364-T368 HydrophobicContact CG2-CG2 4.43Å; I364-T368 WeakPolarHBondContact O-CB 3.34Å; I364-T368 WeakPolarHBondContact O-CG2 3.37Å; I364-T368 PolarHBondContact O-N 2.8Å; I364-T368 VanDerWaalsContact O-N 3.12Å; I364-T368 PolarHBondContact O-OG1 3.28Å; L365-T368 WeakPolarHBondContact CA-OG1 3.48Å; L365-T368 PolarHBondContact O-N 3.16Å; L365-T368 PolarHBondContact O-OG1 2.93Å; T368-S370 VanDerWaalsContact C-N 3.31Å; T368-S370 PolarHBondContact O-N 3.04Å; T368-L371 PolarHBondContact O-N 3.17Å; T368-I372 WeakPolarHBondContact O-CG1 3.23Å; T368-I372 PolarHBondContact O-N 3.02Å
369I98.1Very high98Very high33 Ų3362.9 Ų62.917%0.16931%0.309CS..Hα-helixtrans-62.5-39174.1-73.5-59000111.3L320 L324 L365 L371 I372 E373L320-I369 HydrophobicContact CB-CD1 4.43Å; L320-I369 HydrophobicContact CB-CG2 3.42Å; L320-I369 VanDerWaalsContact CB-CG2 3.42Å; L320-I369 HydrophobicContact CD1-CD1 4.38Å; L324-I369 HydrophobicContact CD1-CB 3.86Å; L324-I369 HydrophobicContact CD1-CG1 3.5Å; L324-I369 VanDerWaalsContact CD1-CG1 3.5Å; L324-I369 HydrophobicContact CD1-CG2 4.33Å; L324-I369 HydrophobicContact CG-CG1 4.38Å; L365-I369 WeakPolarHBondContact O-CB 3.08Å; L365-I369 WeakPolarHBondContact O-CG1 3.4Å; L365-I369 PolarHBondContact O-N 3.42Å; I369-L371 VanDerWaalsContact C-N 3.3Å; I369-L371 PolarHBondContact O-N 3.26Å; I369-I372 HydrophobicContact CD1-CD1 4.08Å; I369-I372 PolarHBondContact O-N 2.83Å; I369-I372 VanDerWaalsContact O-N 3.14Å; I369-E373 HydrophobicContact CG2-CG 4.24Å; I369-E373 WeakPolarHBondContact O-CG 3.42Å; I369-E373 PolarHBondContact O-N 3.35Å
370S97.6Very high96.8Very high6 Ų667.7 Ų67.74%0.04236%0.357CS..Hα-helixtrans-57.2-43.8174.9-580000111.9R318 M366 P367 T368 E373 N374R318-S370 PolarHBondContact NH2-OG 3.41Å; M366-S370 WeakPolarHBondContact O-CB 3.27Å; M366-S370 PolarHBondContact O-N 3.22Å; M366-S370 PolarHBondContact O-OG 3.24Å; P367-S370 WeakPolarHBondContact O-CB 3.26Å; P367-S370 PolarHBondContact O-N 3.11Å; T368-S370 VanDerWaalsContact C-N 3.31Å; T368-S370 PolarHBondContact O-N 3.04Å; S370-E373 PolarHBondContact O-N 3.25Å; S370-N374 VanDerWaalsContact O-CG 3.23Å; S370-N374 PolarHBondContact O-N 2.89Å; S370-N374 PolarHBondContact O-ND2 3.35Å; S370-N374 PolarHBondContact O-OD1 3.11Å
371L98.3Very high96.7Very high84 Ų8468.8 Ų68.844%0.4436%0.361SS..Hα-helixtrans-67.3-37.1176.5-68.6172.5000112.4M309 P367 T368 I369 K375M309-L371 HydrophobicContact CB-CD2 3.83Å; M309-L371 HydrophobicContact CB-CG 3.87Å; M309-L371 HydrophobicContact CG-CD2 4.48Å; M309-L371 HydrophobicContact CG-CG 4.39Å; P367-L371 WeakPolarHBondContact O-CG 3.47Å; P367-L371 PolarHBondContact O-N 3.48Å; P367-L371 VanDerWaalsContact O-N 3.11Å; T368-L371 PolarHBondContact O-N 3.17Å; I369-L371 VanDerWaalsContact C-N 3.3Å; I369-L371 PolarHBondContact O-N 3.26Å; L371-K375 WeakPolarHBondContact O-CG 3.44Å; L371-K375 PolarHBondContact O-N 3.2Å; L371-K375 VanDerWaalsContact O-N 3.13Å
372I98.3Very high96.6Very high79 Ų7972.4 Ų72.441%0.40538%0.38SS..Hα-helixtrans-64.6-47175.6-69.8163.1000110.4L320 T368 I369 N374 K375 L376L320-I372 HydrophobicContact CD1-CG2 4.38Å; T368-I372 WeakPolarHBondContact O-CG1 3.23Å; T368-I372 PolarHBondContact O-N 3.02Å; I369-I372 HydrophobicContact CD1-CD1 4.08Å; I369-I372 PolarHBondContact O-N 2.83Å; I369-I372 VanDerWaalsContact O-N 3.14Å; I372-N374 VanDerWaalsContact C-N 3.33Å; I372-N374 PolarHBondContact O-N 3.37Å; I372-K375 WeakPolarHBondContact O-CB 3.49Å; I372-K375 PolarHBondContact O-N 3.36Å; I372-K375 VanDerWaalsContact O-N 3.12Å; I372-L376 HydrophobicContact CG2-CD1 4.13Å; I372-L376 HydrophobicContact CG2-CG 4.37Å; I372-L376 WeakPolarHBondContact O-CG 3.21Å; I372-L376 PolarHBondContact O-N 3.31Å
373E98.4Very high96.4Very high9 Ų976.1 Ų76.14%0.04240%0.399CS..Hα-helixtrans-60.1-42.1177.5-73177.6145.900111.8R318 L320 S321 I369 S370 K375 L376 L377R318-E373 VanDerWaalsContact CA-OE1 3.29Å; R318-E373 WeakPolarHBondContact CA-OE1 3.32Å; R318-E373 WeakPolarHBondContact CB-OE1 3.37Å; R318-E373 WeakPolarHBondContact CB-OE2 3.15Å; R318-E373 IonicContact CZ-OE2 2.88Å; R318-E373 IonicContact NE-OE2 2.9Å; R318-E373 PolarHBondContact NE-OE2 3.39Å; R318-E373 IonicContact NH2-OE2 3.49Å; R318-E373 PolarHBondContact NH2-OE2 2.86Å; L320-E373 HydrophobicContact CB-CG 4.23Å; L320-E373 WeakPolarHBondContact CB-OE1 3.39Å; L320-E373 HydrophobicContact CD1-CG 4.2Å; L320-E373 HydrophobicContact CG-CG 4.5Å; L320-E373 PolarHBondContact N-OE1 2.8Å; S321-E373 PolarHBondContact N-OE1 2.84Å; S321-E373 PolarHBondContact OG-OE2 3.41Å; I369-E373 HydrophobicContact CG2-CG 4.24Å; I369-E373 WeakPolarHBondContact O-CG 3.42Å; I369-E373 PolarHBondContact O-N 3.35Å; S370-E373 PolarHBondContact O-N 3.25Å; E373-K375 VanDerWaalsContact C-N 3.33Å; E373-K375 PolarHBondContact O-N 3.03Å; E373-L376 PolarHBondContact O-N 3.37Å; E373-L377 WeakPolarHBondContact O-CG 3.26Å; E373-L377 PolarHBondContact O-N 2.82Å; E373-L377 VanDerWaalsContact O-N 3.1Å
374N98.4Very high96.3Very high8 Ų876 Ų764%0.04340%0.399CS..Hα-helixtrans-57.1-46.3173-68.4-20.4000111.7M309 K311 S370 I372 L377 K378 W379M309-N374 PolarHBondContact O-ND2 3.1Å; K311-N374 PolarHBondContact N-OD1 2.9Å; S370-N374 VanDerWaalsContact O-CG 3.23Å; S370-N374 PolarHBondContact O-N 2.89Å; S370-N374 PolarHBondContact O-ND2 3.35Å; S370-N374 PolarHBondContact O-OD1 3.11Å; I372-N374 VanDerWaalsContact C-N 3.33Å; I372-N374 PolarHBondContact O-N 3.37Å; N374-L377 CarbonylContact O-C 3.51Å; N374-L377 PolarHBondContact O-N 3.26Å; N374-K378 PolarHBondContact O-N 2.86Å; N374-W379 HydrophobicContact CB-CB 4.34Å; N374-W379 PolarHBondContact O-N 3.1Å
375K97.8Very high96.2Very high165 Ų16574.8 Ų74.872%0.71739%0.393SS*.Hα-helixtrans-64.8-39.4178.9-73.8179.7179.7-177.50112.4L371 I372 E373 L377 K378L371-K375 WeakPolarHBondContact O-CG 3.44Å; L371-K375 PolarHBondContact O-N 3.2Å; L371-K375 VanDerWaalsContact O-N 3.13Å; I372-K375 WeakPolarHBondContact O-CB 3.49Å; I372-K375 PolarHBondContact O-N 3.36Å; I372-K375 VanDerWaalsContact O-N 3.12Å; E373-K375 VanDerWaalsContact C-N 3.33Å; E373-K375 PolarHBondContact O-N 3.03Å; K375-L377 PolarHBondContact O-N 3.25Å; K375-K378 PolarHBondContact O-N 3.44Å
376L97.8Very high96Very high123 Ų12376 Ų7664%0.64440%0.4SS*.Hα-helixtrans-60.8-34175.2-70.6173.6000111.8L320 I372 E373 K378L320-L376 HydrophobicContact CD1-CD1 4.34Å; I372-L376 HydrophobicContact CG2-CD1 4.13Å; I372-L376 HydrophobicContact CG2-CG 4.37Å; I372-L376 WeakPolarHBondContact O-CG 3.21Å; I372-L376 PolarHBondContact O-N 3.31Å; E373-L376 PolarHBondContact O-N 3.37Å; L376-K378 VanDerWaalsContact C-N 3.27Å; L376-K378 PolarHBondContact O-N 3.31Å
377L97.8Very high95.9Very high85 Ų8579.5 Ų79.545%0.44542%0.419SS..THydrogen-bonded Turntrans-84.55174.5-64.3176.5000113.9E373 N374 K375 W379E373-L377 WeakPolarHBondContact O-CG 3.26Å; E373-L377 PolarHBondContact O-N 2.82Å; E373-L377 VanDerWaalsContact O-N 3.1Å; N374-L377 CarbonylContact O-C 3.51Å; N374-L377 PolarHBondContact O-N 3.26Å; K375-L377 PolarHBondContact O-N 3.25Å; L377-W379 HydrophobicContact CB-CD2 4.11Å; L377-W379 HydrophobicContact CB-CE3 4.15Å; L377-W379 HydrophobicContact CB-CG 4.44Å; L377-W379 HydrophobicContact CD1-CD2 4.47Å; L377-W379 HydrophobicContact CD1-CE3 3.85Å; L377-W379 HydrophobicContact CD1-CH2 3.88Å; L377-W379 HydrophobicContact CD1-CZ2 4.47Å; L377-W379 HydrophobicContact CD1-CZ3 3.53Å; L377-W379 PolarHBondContact O-N 3.14Å
378K96.6Very high95.7Very high195 Ų19584.5 Ų84.585%0.84844%0.444SS*.THydrogen-bonded Turntrans56.331.7-176.4-53177.3-178.1176.80113N374 K375 L376N374-K378 PolarHBondContact O-N 2.86Å; K375-K378 PolarHBondContact O-N 3.44Å; L376-K378 VanDerWaalsContact C-N 3.27Å; L376-K378 PolarHBondContact O-N 3.31Å
379W94.1Very high95.4Very high106 Ų10686.6 Ų86.640%0.40245%0.45SS..  trans-83.1134.9170.5-74.1-24000111K311 Q312 N374 L377K311-W379 HydrophobicContact CB-CD2 4.07Å; K311-W379 HydrophobicContact CB-CE3 3.48Å; K311-W379 VanDerWaalsContact CB-CE3 3.48Å; K311-W379 HydrophobicContact CB-CZ3 3.74Å; K311-W379 HydrophobicContact CG-CB 4.21Å; K311-W379 HydrophobicContact CG-CD2 4.28Å; K311-W379 HydrophobicContact CG-CE3 3.92Å; K311-W379 HydrophobicContact CG-CG 4.47Å; Q312-W379 HydrophobicContact CB-CZ3 4.42Å; Q312-W379 HydrophobicContact CG-CH2 3.44Å; Q312-W379 VanDerWaalsContact CG-CH2 3.44Å; Q312-W379 HydrophobicContact CG-CZ3 3.56Å; N374-W379 HydrophobicContact CB-CB 4.34Å; N374-W379 PolarHBondContact O-N 3.1Å; L377-W379 HydrophobicContact CB-CD2 4.11Å; L377-W379 HydrophobicContact CB-CE3 4.15Å; L377-W379 HydrophobicContact CB-CG 4.44Å; L377-W379 HydrophobicContact CD1-CD2 4.47Å; L377-W379 HydrophobicContact CD1-CE3 3.85Å; L377-W379 HydrophobicContact CD1-CH2 3.88Å; L377-W379 HydrophobicContact CD1-CZ2 4.47Å; L377-W379 HydrophobicContact CD1-CZ3 3.53Å; L377-W379 PolarHBondContact O-N 3.14Å
380A71.9Confident95.2Very high146 Ų14691.5 Ų91.5100%1.20748%0.476SS*.  trans-75.80-179.100000113.2K311K311-A380 WeakPolarHBondContact CE-O 3.46Å; K311-A380 PolarHBondContact NZ-O 3.3Å

Retrieved 380 of 380 residues in 315.8 ms (Link to these results)