A0A077Z7W3_TRITR Loading...

ER membrane protein complex subunit 2

Part of the endoplasmic reticulum membrane protein complex (EMC) that enables the energy-independent insertion into endoplasmic reticulum membranes of newly synthesized membrane proteins.

AlphaFold DB , UniProt , Accession A0A077Z7W3, Species TRITR (Trichuris trichiura, Whipworm), Gene n/a, Length 295 aa.

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Site Residue pLDDT pLDDT confidence pLDDT10 pLDDT10 confidence SASA SASA [Ų] SASA10 SASA10 [Ų] RSA RSA unformatted RSA10 RSA10 unformatted Surface Surface10 (not used) Disorder (not used) Disorder Sec. str. Secondary structure Isomer Phi (φ) Psi (ψ) Omega (ω) Chi 1 (χ1) Chi 2 (χ2) Chi 3 (χ3) Chi 4 (χ4) Chi 5 (χ5) Tau (τ) Contacts (colored by PAE) Contact details
1M50.5Low78.6Confident207 Ų207101.8 Ų101.8100%1.0253%0.528SS*.  01300-120.5-177.8-77.500106.7R28M1-R28 PolarHBondContact SD-NH2 2.88Å
2E61.2Low79.9Confident178 Ų178106.7 Ų106.783%0.83254%0.536SS*.PPolyproline II helixtrans-63.2142.2-174.4-68.4173.7173.100111.4V4E2-V4 PolarHBondContact O-N 3.48Å
3P70.9Confident81Confident111 Ų111104.7 Ų104.772%0.72153%0.528SS*.PPolyproline II helixtrans-60.5132.1172.424.5-31.1000109.8M5P3-M5 PolarHBondContact O-N 3.17Å
4V75.8Confident82.1Confident47 Ų4797.2 Ų97.229%0.28549%0.49SS..PPolyproline II helixtrans-71.6119.9176.3179.60000107.8E2 V6 L9 L17 W21 T31E2-V4 PolarHBondContact O-N 3.48Å; V4-V6 HydrophobicContact CB-CG2 4.42Å; V4-V6 HydrophobicContact CG1-CG2 4.15Å; V4-V6 PolarHBondContact O-N 3.06Å; V4-L9 HydrophobicContact CG1-CD1 3.77Å; V4-L17 HydrophobicContact CG1-CD2 3.99Å; V4-L17 HydrophobicContact CG2-CD2 4.43Å; V4-W21 HydrophobicContact CG2-CZ2 4.36Å; V4-T31 HydrophobicContact CB-CG2 4.4Å
5M82.5Confident83Confident122 Ų12291.9 Ų91.960%0.60146%0.464SS*.  trans-75.278174.5-66.3-61-62.800110.1P3 D7 K8P3-M5 PolarHBondContact O-N 3.17Å; M5-D7 VanDerWaalsContact C-N 3.3Å; M5-D7 PolarHBondContact O-N 2.76Å; M5-K8 PolarHBondContact O-N 2.93Å; M5-K8 VanDerWaalsContact O-N 3.11Å
6V83.7Confident83.8Confident12 Ų1290.5 Ų90.57%0.07346%0.458CS..G310 helixtrans-55.6-41.9-169.1177.20000112.9V4 K8 L9 T31 E34 I35 A38V4-V6 HydrophobicContact CB-CG2 4.42Å; V4-V6 HydrophobicContact CG1-CG2 4.15Å; V4-V6 PolarHBondContact O-N 3.06Å; V6-K8 PolarHBondContact O-N 3.01Å; V6-L9 WeakPolarHBondContact O-CB 3.24Å; V6-L9 PolarHBondContact O-N 3.41Å; V6-L9 VanDerWaalsContact O-N 3.11Å; V6-T31 HydrophobicContact CG2-CG2 4.21Å; V6-E34 HydrophobicContact CB-CB 4.49Å; V6-E34 HydrophobicContact CG1-CB 4.11Å; V6-E34 HydrophobicContact CG2-CB 4.1Å; V6-I35 HydrophobicContact CG1-CB 4.41Å; V6-I35 HydrophobicContact CG1-CG1 3.89Å; V6-I35 HydrophobicContact CG2-CG1 4.1Å; V6-A38 HydrophobicContact CG1-CB 3.81Å
7D78Confident84.5Confident146 Ų14687.2 Ų87.278%0.78144%0.442SS*.G310 helixtrans-64.9-15.1-176.7-62.5-33.3000114.5M5M5-D7 VanDerWaalsContact C-N 3.3Å; M5-D7 PolarHBondContact O-N 2.76Å
8K85.4Confident85.2Confident176 Ų17682.3 Ų82.377%0.76542%0.417SS*.G310 helixtrans-102.70.7179.7-63.6-174.6179.5-179.30113.3M5 V6M5-K8 PolarHBondContact O-N 2.93Å; M5-K8 VanDerWaalsContact O-N 3.11Å; V6-K8 PolarHBondContact O-N 3.01Å
9L89.5Confident85.8Confident35 Ų3581.4 Ų81.418%0.18341%0.411CS..  trans-73.5128.1179.4-75.7166.3000110.9V4 V6 N13 A14 L17 I35 V39V4-L9 HydrophobicContact CG1-CD1 3.77Å; V6-L9 WeakPolarHBondContact O-CB 3.24Å; V6-L9 PolarHBondContact O-N 3.41Å; V6-L9 VanDerWaalsContact O-N 3.11Å; L9-N13 HydrophobicContact CD2-CB 3.89Å; L9-A14 HydrophobicContact CB-CB 4.39Å; L9-L17 HydrophobicContact CD1-CD2 4.33Å; L9-I35 HydrophobicContact CD1-CD1 4.29Å; L9-I35 HydrophobicContact CD1-CG1 4.06Å; L9-V39 HydrophobicContact CB-CG2 4.26Å
10S93.1Very high86.3Confident53 Ų5382.6 Ų82.637%0.37141%0.413SS..  trans-68.4157.9163.669.30000110.2Y12 N13 A14S10-Y12 VanDerWaalsContact C-N 3.26Å; S10-Y12 PolarHBondContact O-N 3.45Å; S10-N13 PolarHBondContact O-N 3.43Å; S10-N13 WeakPolarHBondContact OG-CB 3.44Å; S10-N13 VanDerWaalsContact OG-CG 3.29Å; S10-N13 PolarHBondContact OG-N 3.47Å; S10-N13 PolarHBondContact OG-ND2 3.04Å; S10-A14 WeakPolarHBondContact O-CB 3.34Å; S10-A14 PolarHBondContact O-N 3.32Å
11L93.7Very high86.8Confident33 Ų3379.1 Ų79.117%0.17340%0.396CS..Hα-helixtrans-52.8-46.1174.6-17862000112N13 A14 V15 V39 I40 Q43 R46 L47L11-N13 PolarHBondContact O-N 3.36Å; L11-A14 PolarHBondContact O-N 3.48Å; L11-V15 HydrophobicContact CD1-CG2 4.25Å; L11-V15 HydrophobicContact CG-CG2 4.49Å; L11-V15 VanDerWaalsContact O-CG2 3.3Å; L11-V15 WeakPolarHBondContact O-CG2 3.28Å; L11-V15 PolarHBondContact O-N 2.96Å; L11-V39 HydrophobicContact CB-CG1 4.46Å; L11-V39 HydrophobicContact CD1-CG1 4.38Å; L11-I40 HydrophobicContact CD1-CG1 4.43Å; L11-Q43 HydrophobicContact CD1-CB 4.09Å; L11-Q43 HydrophobicContact CD2-CB 3.98Å; L11-R46 HydrophobicContact CD2-CB 4.43Å; L11-L47 HydrophobicContact CD1-CD1 4.37Å; L11-L47 HydrophobicContact CD1-CD2 4.38Å; L11-L47 HydrophobicContact CD2-CD2 3.99Å; L11-L47 HydrophobicContact CG-CD2 4.2Å
12Y94.1Very high89Confident160 Ų16072.6 Ų72.663%0.62736%0.36SS*.Hα-helixtrans-58-49178.7177.5-106.4000111.9S10 A14 V15 L16S10-Y12 VanDerWaalsContact C-N 3.26Å; S10-Y12 PolarHBondContact O-N 3.45Å; Y12-A14 VanDerWaalsContact C-N 3.35Å; Y12-A14 PolarHBondContact O-N 3.31Å; Y12-V15 PolarHBondContact O-N 3.27Å; Y12-L16 HydrophobicContact CD1-CD1 3.91Å; Y12-L16 HydrophobicContact CE1-CD1 3.33Å; Y12-L16 HydrophobicContact CE1-CG 4.31Å; Y12-L16 HydrophobicContact CE2-CD1 4.03Å; Y12-L16 HydrophobicContact CE2-CG 4.25Å; Y12-L16 HydrophobicContact CG-CD1 4.49Å; Y12-L16 VanDerWaalsContact CZ-CD1 3.4Å; Y12-L16 WeakPolarHBondContact O-CG 3.4Å; Y12-L16 PolarHBondContact O-N 2.87Å
13N95Very high90.6Very high81 Ų8171.2 Ų71.243%0.43335%0.353SS..Hα-helixtrans-68.3-34.8179.6-69.7-13.5000112.3L9 S10 L11 L17L9-N13 HydrophobicContact CD2-CB 3.89Å; S10-N13 PolarHBondContact O-N 3.43Å; S10-N13 WeakPolarHBondContact OG-CB 3.44Å; S10-N13 VanDerWaalsContact OG-CG 3.29Å; S10-N13 PolarHBondContact OG-N 3.47Å; S10-N13 PolarHBondContact OG-ND2 3.04Å; L11-N13 PolarHBondContact O-N 3.36Å; N13-L17 VanDerWaalsContact O-CB 3.23Å; N13-L17 WeakPolarHBondContact O-CB 3.34Å; N13-L17 PolarHBondContact O-N 3.25Å
14A95.3Very high91.7Very high0 Ų071.3 Ų71.30%034%0.344CS..Hα-helixtrans-63.8-45.9174.900000111.5L9 S10 L11 Y12 L17 L18 I35 V39 I40L9-A14 HydrophobicContact CB-CB 4.39Å; S10-A14 WeakPolarHBondContact O-CB 3.34Å; S10-A14 PolarHBondContact O-N 3.32Å; L11-A14 PolarHBondContact O-N 3.48Å; Y12-A14 VanDerWaalsContact C-N 3.35Å; Y12-A14 PolarHBondContact O-N 3.31Å; A14-L17 PolarHBondContact O-N 3.2Å; A14-L18 WeakPolarHBondContact O-CB 3.08Å; A14-L18 WeakPolarHBondContact O-CG 3.5Å; A14-L18 PolarHBondContact O-N 3.36Å; A14-I35 HydrophobicContact CB-CG2 3.77Å; A14-V39 HydrophobicContact CB-CB 4.4Å; A14-V39 HydrophobicContact CB-CG1 4.03Å; A14-I40 HydrophobicContact CB-CD1 4.43Å; A14-I40 HydrophobicContact CB-CG1 4.3Å
15V96.3Very high92.5Very high17 Ų1772 Ų7210%0.10336%0.361CS..Hα-helixtrans-63.3-49.3177.8171.70000111L11 Y12 L17 L18 E19 L47 E50 I54L11-V15 HydrophobicContact CD1-CG2 4.25Å; L11-V15 HydrophobicContact CG-CG2 4.49Å; L11-V15 VanDerWaalsContact O-CG2 3.3Å; L11-V15 WeakPolarHBondContact O-CG2 3.28Å; L11-V15 PolarHBondContact O-N 2.96Å; Y12-V15 PolarHBondContact O-N 3.27Å; V15-L17 VanDerWaalsContact C-N 3.29Å; V15-L17 PolarHBondContact O-N 2.85Å; V15-L18 PolarHBondContact O-N 3.27Å; V15-E19 WeakPolarHBondContact O-CB 3.42Å; V15-E19 PolarHBondContact O-N 2.9Å; V15-L47 HydrophobicContact CG2-CD1 3.58Å; V15-L47 HydrophobicContact CG2-CD2 3.93Å; V15-L47 HydrophobicContact CG2-CG 4.44Å; V15-E50 HydrophobicContact CG1-CG 3.76Å; V15-I54 HydrophobicContact CG1-CD1 4.31Å; V15-I54 HydrophobicContact CG2-CD1 3.91Å
16L96Very high93Very high70 Ų7068.5 Ų68.537%0.36635%0.346SS..Hα-helixtrans-58.6-39.7176.9-76.6-179.1000112.8Y12 K20Y12-L16 HydrophobicContact CD1-CD1 3.91Å; Y12-L16 HydrophobicContact CE1-CD1 3.33Å; Y12-L16 HydrophobicContact CE1-CG 4.31Å; Y12-L16 HydrophobicContact CE2-CD1 4.03Å; Y12-L16 HydrophobicContact CE2-CG 4.25Å; Y12-L16 HydrophobicContact CG-CD1 4.49Å; Y12-L16 VanDerWaalsContact CZ-CD1 3.4Å; Y12-L16 WeakPolarHBondContact O-CG 3.4Å; Y12-L16 PolarHBondContact O-N 2.87Å; L16-K20 WeakPolarHBondContact O-CB 3.38Å; L16-K20 PolarHBondContact O-N 3.47Å
17L95.6Very high93.4Very high34 Ų3474.8 Ų74.818%0.17837%0.369CS..Hα-helixtrans-66.6-43.1178.3-178.860.8000111.5V4 L9 N13 A14 V15 K20 W21 I35V4-L17 HydrophobicContact CG1-CD2 3.99Å; V4-L17 HydrophobicContact CG2-CD2 4.43Å; L9-L17 HydrophobicContact CD1-CD2 4.33Å; N13-L17 VanDerWaalsContact O-CB 3.23Å; N13-L17 WeakPolarHBondContact O-CB 3.34Å; N13-L17 PolarHBondContact O-N 3.25Å; A14-L17 PolarHBondContact O-N 3.2Å; V15-L17 VanDerWaalsContact C-N 3.29Å; V15-L17 PolarHBondContact O-N 2.85Å; L17-K20 PolarHBondContact O-N 3.36Å; L17-W21 HydrophobicContact CD1-CD2 4.38Å; L17-W21 HydrophobicContact CD1-CH2 4.5Å; L17-W21 HydrophobicContact CD1-CZ2 3.71Å; L17-W21 HydrophobicContact CD2-CH2 3.85Å; L17-W21 HydrophobicContact CD2-CZ2 3.8Å; L17-W21 HydrophobicContact CG-CD2 4.28Å; L17-W21 HydrophobicContact CG-CH2 4.04Å; L17-W21 HydrophobicContact CG-CZ2 3.74Å; L17-W21 HydrophobicContact CG-CZ3 4.44Å; L17-W21 PolarHBondContact O-N 2.89Å; L17-I35 HydrophobicContact CD2-CD1 3.9Å
18L96.7Very high94.2Very high0 Ų071.1 Ų71.10%034%0.344CS..Hα-helixtrans-64.2-43.2176.3-76.8-167.1000111.9A14 V15 W21 R22 V32 I35 I40 I54 Q57A14-L18 WeakPolarHBondContact O-CB 3.08Å; A14-L18 WeakPolarHBondContact O-CG 3.5Å; A14-L18 PolarHBondContact O-N 3.36Å; V15-L18 PolarHBondContact O-N 3.27Å; L18-W21 HydrophobicContact CD2-CE3 3.98Å; L18-W21 HydrophobicContact CD2-CZ3 4.18Å; L18-W21 PolarHBondContact O-N 2.8Å; L18-R22 WeakPolarHBondContact O-CG 3.41Å; L18-R22 PolarHBondContact O-N 2.91Å; L18-V32 HydrophobicContact CD2-CB 4.42Å; L18-V32 HydrophobicContact CD2-CG1 4.24Å; L18-V32 HydrophobicContact CD2-CG2 3.85Å; L18-I35 HydrophobicContact CD1-CG2 4.44Å; L18-I35 HydrophobicContact CD2-CD1 4.27Å; L18-I35 HydrophobicContact CG-CG2 4.44Å; L18-I40 HydrophobicContact CD1-CD1 3.24Å; L18-I40 HydrophobicContact CG-CD1 4.27Å; L18-I54 HydrophobicContact CD1-CG1 4.37Å; L18-I54 HydrophobicContact CD1-CG2 4.02Å; L18-Q57 PolarHBondContact O-NE2 3.32Å; L18-Q57 PolarHBondContact O-OE1 3.42Å
19E96.6Very high94.8Very high65 Ų6563.5 Ų63.530%0.30431%0.313SS..Hα-helixtrans-57.3-52.8174.2-177.8175.4-16000111.3V15 W21 R22 E23V15-E19 WeakPolarHBondContact O-CB 3.42Å; V15-E19 PolarHBondContact O-N 2.9Å; E19-W21 VanDerWaalsContact C-N 3.27Å; E19-W21 PolarHBondContact O-N 3.29Å; E19-R22 WeakPolarHBondContact O-CB 3.25Å; E19-R22 PolarHBondContact O-N 3.38Å; E19-E23 WeakPolarHBondContact O-CG 3.35Å; E19-E23 PolarHBondContact O-N 3.41Å
20K96.5Very high95.1Very high104 Ų10467.3 Ų67.345%0.45233%0.329SS..Hα-helixtrans-52.2-45.5175.2179.8177.7-178.8177.50112.1L16 L17 R22 E23 E24L16-K20 WeakPolarHBondContact O-CB 3.38Å; L16-K20 PolarHBondContact O-N 3.47Å; L17-K20 PolarHBondContact O-N 3.36Å; K20-R22 VanDerWaalsContact C-N 3.34Å; K20-R22 PolarHBondContact O-N 3.31Å; K20-E23 PolarHBondContact O-N 3.14Å; K20-E24 WeakPolarHBondContact CE-OE1 3.49Å; K20-E24 WeakPolarHBondContact CE-OE2 3.21Å; K20-E24 HydrophobicContact CG-CG 4.3Å; K20-E24 IonicContact NZ-OE1 2.71Å; K20-E24 WeakPolarHBondContact O-CB 3.37Å; K20-E24 WeakPolarHBondContact O-CG 3.46Å; K20-E24 PolarHBondContact O-N 2.9Å
21W96.5Very high95.2Very high11 Ų1166.2 Ų66.24%0.04232%0.32CS..Hα-helixtrans-67.5-31.8178.5-69.9-14.4000113.6V4 L17 L18 E19 G25 V26 R28 T31 V32 I35V4-W21 HydrophobicContact CG2-CZ2 4.36Å; L17-W21 HydrophobicContact CD1-CD2 4.38Å; L17-W21 HydrophobicContact CD1-CH2 4.5Å; L17-W21 HydrophobicContact CD1-CZ2 3.71Å; L17-W21 HydrophobicContact CD2-CH2 3.85Å; L17-W21 HydrophobicContact CD2-CZ2 3.8Å; L17-W21 HydrophobicContact CG-CD2 4.28Å; L17-W21 HydrophobicContact CG-CH2 4.04Å; L17-W21 HydrophobicContact CG-CZ2 3.74Å; L17-W21 HydrophobicContact CG-CZ3 4.44Å; L17-W21 PolarHBondContact O-N 2.89Å; L18-W21 HydrophobicContact CD2-CE3 3.98Å; L18-W21 HydrophobicContact CD2-CZ3 4.18Å; L18-W21 PolarHBondContact O-N 2.8Å; E19-W21 VanDerWaalsContact C-N 3.27Å; E19-W21 PolarHBondContact O-N 3.29Å; W21-G25 PolarHBondContact O-N 3.44Å; W21-G25 VanDerWaalsContact O-N 3.13Å; W21-V26 HydrophobicContact CB-CB 4.14Å; W21-V26 HydrophobicContact CG-CB 4.12Å; W21-V26 HydrophobicContact CG-CG1 4.2Å; W21-V26 PolarHBondContact O-N 3.35Å; W21-R28 HydrophobicContact CZ3-CB 4.47Å; W21-T31 HydrophobicContact CH2-CG2 3.65Å; W21-T31 HydrophobicContact CZ3-CG2 4.21Å; W21-V32 HydrophobicContact CE3-CG2 3.87Å; W21-V32 HydrophobicContact CZ3-CG2 3.93Å; W21-I35 HydrophobicContact CH2-CD1 3.9Å; W21-I35 HydrophobicContact CZ3-CD1 3.77Å
22R95.7Very high95.4Very high69 Ų6964.9 Ų64.926%0.2631%0.314SS..Hα-helixtrans-67-44.2172.6-66.6-172.7-55.5-102.85111.2L18 E19 K20 G25 E50 Q57L18-R22 WeakPolarHBondContact O-CG 3.41Å; L18-R22 PolarHBondContact O-N 2.91Å; E19-R22 WeakPolarHBondContact O-CB 3.25Å; E19-R22 PolarHBondContact O-N 3.38Å; K20-R22 VanDerWaalsContact C-N 3.34Å; K20-R22 PolarHBondContact O-N 3.31Å; R22-G25 PolarHBondContact O-N 2.79Å; R22-E50 IonicContact CZ-OE1 2.69Å; R22-E50 IonicContact NH1-OE1 3.4Å; R22-E50 PolarHBondContact NH1-OE1 2.8Å; R22-E50 IonicContact NH2-OE1 3.9Å; R22-E50 PolarHBondContact NH2-OE1 2.7Å; R22-E50 IonicContact NH2-OE2 3.34Å; R22-Q57 VanDerWaalsContact CD-OE1 3.29Å; R22-Q57 HydrophobicContact CG-CB 4.39Å; R22-Q57 HydrophobicContact CG-CG 4.05Å; R22-Q57 VanDerWaalsContact CG-NE2 3.3Å; R22-Q57 VanDerWaalsContact CG-OE1 3.29Å
23E95.3Very high95.6Very high149 Ų14958 Ų5870%0.69629%0.288SS*.Hα-helixtrans-66.6-41.7-179.5-67.4-176.8159.400112.4E19 K20 G25E19-E23 WeakPolarHBondContact O-CG 3.35Å; E19-E23 PolarHBondContact O-N 3.41Å; K20-E23 PolarHBondContact O-N 3.14Å; E23-G25 VanDerWaalsContact C-N 3.27Å; E23-G25 PolarHBondContact O-N 3.18Å
24E95.3Very high95.6Very high113 Ų11359 Ų5953%0.52829%0.29SS..THydrogen-bonded Turntrans-80.4-5.7178.9-66.317916600113.2K20 V26K20-E24 WeakPolarHBondContact CE-OE1 3.49Å; K20-E24 WeakPolarHBondContact CE-OE2 3.21Å; K20-E24 HydrophobicContact CG-CG 4.3Å; K20-E24 IonicContact NZ-OE1 2.71Å; K20-E24 WeakPolarHBondContact O-CB 3.37Å; K20-E24 WeakPolarHBondContact O-CG 3.46Å; K20-E24 PolarHBondContact O-N 2.9Å; E24-V26 HydrophobicContact CB-CG2 3.69Å; E24-V26 PolarHBondContact O-N 2.78Å
25G91.5Very high95.7Very high63 Ų6359 Ų5965%0.64929%0.29SS*.THydrogen-bonded Turntrans64.624.4-175.500000113.8W21 R22 E23 R27W21-G25 PolarHBondContact O-N 3.44Å; W21-G25 VanDerWaalsContact O-N 3.13Å; R22-G25 PolarHBondContact O-N 2.79Å; E23-G25 VanDerWaalsContact C-N 3.27Å; E23-G25 PolarHBondContact O-N 3.18Å; G25-R27 PolarHBondContact O-N 3.18Å
26V93Very high95.7Very high47 Ų4758.4 Ų58.429%0.28529%0.286SS..  trans-76.8115.7-177.11740000109.8W21 E24 R28W21-V26 HydrophobicContact CB-CB 4.14Å; W21-V26 HydrophobicContact CG-CB 4.12Å; W21-V26 HydrophobicContact CG-CG1 4.2Å; W21-V26 PolarHBondContact O-N 3.35Å; E24-V26 HydrophobicContact CB-CG2 3.69Å; E24-V26 PolarHBondContact O-N 2.78Å; V26-R28 HydrophobicContact CG1-CG 3.93Å
27R93.2Very high95.7Very high144 Ų14458.3 Ų58.354%0.54329%0.286SS..  trans-93.6110.3178.8-161.6157-166.3151.63.5111.4G25 I60 D64G25-R27 PolarHBondContact O-N 3.18Å; R27-I60 VanDerWaalsContact NH2-CG2 3.34Å; R27-D64 IonicContact CZ-OD1 3.02Å; R27-D64 IonicContact CZ-OD2 3.66Å; R27-D64 IonicContact NE-OD1 3.26Å; R27-D64 IonicContact NE-OD2 2.96Å; R27-D64 PolarHBondContact NE-OD2 2.97Å; R27-D64 IonicContact NH2-OD1 3.36Å; R27-D64 PolarHBondContact NH2-OD1 3.43Å; R27-D64 IonicContact NH2-OD2 2.64Å; R27-D64 PolarHBondContact NH2-OD2 3.16Å
28R94.6Very high95.7Very high69 Ų6958.4 Ų58.426%0.2629%0.291SS..  trans-140.169.9178.1-69.8-176.1-179.6-172.72.4111M1 W21 V26 E30 T31 V32M1-R28 PolarHBondContact SD-NH2 2.88Å; W21-R28 HydrophobicContact CZ3-CB 4.47Å; V26-R28 HydrophobicContact CG1-CG 3.93Å; R28-E30 VanDerWaalsContact C-N 3.34Å; R28-E30 PolarHBondContact O-N 2.71Å; R28-T31 PolarHBondContact O-N 2.9Å; R28-V32 VanDerWaalsContact O-CG2 3.23Å; R28-V32 WeakPolarHBondContact O-CG2 3.48Å; R28-V32 PolarHBondContact O-N 3.45Å
29P96.6Very high95.6Very high17 Ų1759.1 Ų59.111%0.1130%0.296CS..Hα-helixtrans-65.2-37.5-166.928.1-34.9000112.6V32 L33 A61 D64P29-V32 PolarHBondContact O-N 3.27Å; P29-L33 WeakPolarHBondContact O-CG 3.47Å; P29-L33 PolarHBondContact O-N 3.39Å; P29-A61 HydrophobicContact CB-CB 3.85Å; P29-D64 HydrophobicContact CB-CB 3.62Å; P29-D64 HydrophobicContact CG-CB 3.81Å
30E96.5Very high95.5Very high114 Ų11456 Ų5653%0.53328%0.281SS..Hα-helixtrans-62.3-50.8178.3-58.777.4-170.800111.1R28 V32 L33 E34R28-E30 VanDerWaalsContact C-N 3.34Å; R28-E30 PolarHBondContact O-N 2.71Å; E30-V32 VanDerWaalsContact C-N 3.32Å; E30-V32 PolarHBondContact O-N 3.22Å; E30-L33 PolarHBondContact O-N 3.45Å; E30-L33 VanDerWaalsContact O-N 3.12Å; E30-E34 WeakPolarHBondContact O-CG 3.19Å; E30-E34 PolarHBondContact O-N 3.44Å
31T95.6Very high95.5Very high30 Ų3056.5 Ų56.518%0.18428%0.283CS..Hα-helixtrans-66.5-33.8179.9-44.90000112.2V4 V6 W21 R28 L33 E34 I35V4-T31 HydrophobicContact CB-CG2 4.4Å; V6-T31 HydrophobicContact CG2-CG2 4.21Å; W21-T31 HydrophobicContact CH2-CG2 3.65Å; W21-T31 HydrophobicContact CZ3-CG2 4.21Å; R28-T31 PolarHBondContact O-N 2.9Å; T31-L33 VanDerWaalsContact C-N 3.32Å; T31-L33 PolarHBondContact O-N 2.89Å; T31-E34 PolarHBondContact O-N 3.47Å; T31-I35 HydrophobicContact CG2-CD1 4.26Å; T31-I35 VanDerWaalsContact O-CG1 3.29Å; T31-I35 WeakPolarHBondContact O-CG1 3.45Å; T31-I35 PolarHBondContact O-N 3.15Å
32V97.4Very high95.4Very high6 Ų666 Ų664%0.03632%0.319CS..Hα-helixtrans-61.7-42.6173169.40000110.6L18 W21 R28 P29 E30 I35 W36 Q57 V58 A61L18-V32 HydrophobicContact CD2-CB 4.42Å; L18-V32 HydrophobicContact CD2-CG1 4.24Å; L18-V32 HydrophobicContact CD2-CG2 3.85Å; W21-V32 HydrophobicContact CE3-CG2 3.87Å; W21-V32 HydrophobicContact CZ3-CG2 3.93Å; R28-V32 VanDerWaalsContact O-CG2 3.23Å; R28-V32 WeakPolarHBondContact O-CG2 3.48Å; R28-V32 PolarHBondContact O-N 3.45Å; P29-V32 PolarHBondContact O-N 3.27Å; E30-V32 VanDerWaalsContact C-N 3.32Å; E30-V32 PolarHBondContact O-N 3.22Å; V32-I35 PolarHBondContact O-N 3.36Å; V32-W36 WeakPolarHBondContact O-CB 3.36Å; V32-W36 PolarHBondContact O-N 3.47Å; V32-Q57 HydrophobicContact CG1-CG 4.37Å; V32-V58 HydrophobicContact CG1-CG2 4.02Å; V32-A61 HydrophobicContact CB-CB 3.82Å; V32-A61 HydrophobicContact CG1-CB 3.61Å
33L97.4Very high95.4Very high14 Ų1465.5 Ų65.57%0.07332%0.319CS..Hα-helixtrans-68.9-35.4177.1-68.4178.3000112.8P29 E30 T31 W36 N37 V58 A61 A62 C65 N67 V70P29-L33 WeakPolarHBondContact O-CG 3.47Å; P29-L33 PolarHBondContact O-N 3.39Å; E30-L33 PolarHBondContact O-N 3.45Å; E30-L33 VanDerWaalsContact O-N 3.12Å; T31-L33 VanDerWaalsContact C-N 3.32Å; T31-L33 PolarHBondContact O-N 2.89Å; L33-W36 PolarHBondContact O-N 3.11Å; L33-N37 WeakPolarHBondContact O-CB 3.41Å; L33-N37 PolarHBondContact O-N 2.98Å; L33-N37 PolarHBondContact O-ND2 3.49Å; L33-V58 HydrophobicContact CD2-CG1 4.18Å; L33-A61 HydrophobicContact CG-CB 4.37Å; L33-A62 HydrophobicContact CD2-CB 4.01Å; L33-C65 HydrophobicContact CD1-CB 3.63Å; L33-N67 HydrophobicContact CD1-CB 4.32Å; L33-V70 HydrophobicContact CD2-CG1 4.02Å
34E96.5Very high95.4Very high102 Ų10258.6 Ų58.648%0.47729%0.287SS..Hα-helixtrans-60.6-50.9172-70.5170.5176.800110.7V6 E30 T31 W36 N37 A38V6-E34 HydrophobicContact CB-CB 4.49Å; V6-E34 HydrophobicContact CG1-CB 4.11Å; V6-E34 HydrophobicContact CG2-CB 4.1Å; E30-E34 WeakPolarHBondContact O-CG 3.19Å; E30-E34 PolarHBondContact O-N 3.44Å; T31-E34 PolarHBondContact O-N 3.47Å; E34-W36 VanDerWaalsContact C-N 3.3Å; E34-W36 PolarHBondContact O-N 3.01Å; E34-N37 PolarHBondContact O-N 3.35Å; E34-A38 VanDerWaalsContact O-CB 3.28Å; E34-A38 WeakPolarHBondContact O-CB 3.37Å; E34-A38 PolarHBondContact O-N 2.68Å
35I96.3Very high95.3Very high0 Ų059.4 Ų59.40%030%0.295CS..Hα-helixtrans-60-42.4177.8-67.6167.4000110.9V6 L9 A14 L17 L18 W21 T31 V32 V39 I40V6-I35 HydrophobicContact CG1-CB 4.41Å; V6-I35 HydrophobicContact CG1-CG1 3.89Å; V6-I35 HydrophobicContact CG2-CG1 4.1Å; L9-I35 HydrophobicContact CD1-CD1 4.29Å; L9-I35 HydrophobicContact CD1-CG1 4.06Å; A14-I35 HydrophobicContact CB-CG2 3.77Å; L17-I35 HydrophobicContact CD2-CD1 3.9Å; L18-I35 HydrophobicContact CD1-CG2 4.44Å; L18-I35 HydrophobicContact CD2-CD1 4.27Å; L18-I35 HydrophobicContact CG-CG2 4.44Å; W21-I35 HydrophobicContact CH2-CD1 3.9Å; W21-I35 HydrophobicContact CZ3-CD1 3.77Å; T31-I35 HydrophobicContact CG2-CD1 4.26Å; T31-I35 VanDerWaalsContact O-CG1 3.29Å; T31-I35 WeakPolarHBondContact O-CG1 3.45Å; T31-I35 PolarHBondContact O-N 3.15Å; V32-I35 PolarHBondContact O-N 3.36Å; I35-V39 PolarHBondContact O-N 3.37Å; I35-I40 HydrophobicContact CG2-CD1 3.72Å; I35-I40 HydrophobicContact CG2-CG1 4.07Å; I35-I40 PolarHBondContact O-N 2.99Å
36W97.1Very high95.5Very high6 Ų665 Ų652%0.02330%0.297CS..Iπ-helixtrans-56.5-52.8175.3170.5-107.6000111.5V32 L33 E34 I40 K41 I44 Y55 V58V32-W36 WeakPolarHBondContact O-CB 3.36Å; V32-W36 PolarHBondContact O-N 3.47Å; L33-W36 PolarHBondContact O-N 3.11Å; E34-W36 VanDerWaalsContact C-N 3.3Å; E34-W36 PolarHBondContact O-N 3.01Å; W36-I40 HydrophobicContact CE3-CB 4Å; W36-I40 HydrophobicContact CE3-CG2 3.63Å; W36-I40 HydrophobicContact CZ3-CB 4.49Å; W36-I40 HydrophobicContact CZ3-CG2 3.7Å; W36-I40 PolarHBondContact O-N 3.3Å; W36-K41 HydrophobicContact CD2-CB 4.06Å; W36-K41 HydrophobicContact CE3-CB 4.49Å; W36-K41 HydrophobicContact CH2-CB 4.44Å; W36-K41 HydrophobicContact CZ2-CB 4Å; W36-K41 HydrophobicContact CZ2-CG 3.9Å; W36-K41 WeakPolarHBondContact O-CB 3.33Å; W36-K41 PolarHBondContact O-N 3.03Å; W36-I44 HydrophobicContact CH2-CG1 4.34Å; W36-I44 HydrophobicContact CZ3-CB 4.42Å; W36-I44 HydrophobicContact CZ3-CD1 4.12Å; W36-I44 HydrophobicContact CZ3-CG1 4.12Å; W36-Y55 HydrophobicContact CH2-CD1 4.12Å; W36-Y55 AromaticContact CH2-CE1 3.58Å; W36-Y55 HydrophobicContact CH2-CE1 3.58Å; W36-Y55 HydrophobicContact CZ2-CE1 4.38Å; W36-Y55 HydrophobicContact CZ3-CE1 4.32Å; W36-V58 HydrophobicContact CB-CG1 4.08Å; W36-V58 HydrophobicContact CB-CG2 4Å; W36-V58 HydrophobicContact CD2-CB 4.45Å; W36-V58 HydrophobicContact CD2-CG1 3.72Å; W36-V58 HydrophobicContact CD2-CG2 4.06Å; W36-V58 HydrophobicContact CE3-CB 4.42Å; W36-V58 HydrophobicContact CE3-CG1 4.17Å; W36-V58 HydrophobicContact CE3-CG2 3.77Å; W36-V58 HydrophobicContact CG-CG1 3.66Å; W36-V58 HydrophobicContact CG-CG2 4.18Å
37N96Very high95.5Very high68 Ų6863.9 Ų63.936%0.36429%0.289SS..Iπ-helixtrans-71.7-38.3-174.8-73-50.1000113.2L33 E34L33-N37 WeakPolarHBondContact O-CB 3.41Å; L33-N37 PolarHBondContact O-N 2.98Å; L33-N37 PolarHBondContact O-ND2 3.49Å; E34-N37 PolarHBondContact O-N 3.35Å
38A94.8Very high95.4Very high35 Ų3563.5 Ų63.529%0.28930%0.298SS..Iπ-helixtrans-77.2-42-176.100000112.8V6 E34V6-A38 HydrophobicContact CG1-CB 3.81Å; E34-A38 VanDerWaalsContact O-CB 3.28Å; E34-A38 WeakPolarHBondContact O-CB 3.37Å; E34-A38 PolarHBondContact O-N 2.68Å
39V94.6Very high95.3Very high16 Ų1666 Ų6610%0.09731%0.312CS..Iπ-helixtrans-119.2-59.2-167.7-174.70000111.7L9 L11 A14 I35L9-V39 HydrophobicContact CB-CG2 4.26Å; L11-V39 HydrophobicContact CB-CG1 4.46Å; L11-V39 HydrophobicContact CD1-CG1 4.38Å; A14-V39 HydrophobicContact CB-CB 4.4Å; A14-V39 HydrophobicContact CB-CG1 4.03Å; I35-V39 PolarHBondContact O-N 3.37Å
40I95.9Very high95.2Very high0 Ų067.2 Ų67.20%032%0.317CS..Iπ-helixtrans-75.9-44.5-161.3-63.2-179.8000112.5L11 A14 L18 I35 W36 R42 Q43 I44 I54L11-I40 HydrophobicContact CD1-CG1 4.43Å; A14-I40 HydrophobicContact CB-CD1 4.43Å; A14-I40 HydrophobicContact CB-CG1 4.3Å; L18-I40 HydrophobicContact CD1-CD1 3.24Å; L18-I40 HydrophobicContact CG-CD1 4.27Å; I35-I40 HydrophobicContact CG2-CD1 3.72Å; I35-I40 HydrophobicContact CG2-CG1 4.07Å; I35-I40 PolarHBondContact O-N 2.99Å; W36-I40 HydrophobicContact CE3-CB 4Å; W36-I40 HydrophobicContact CE3-CG2 3.63Å; W36-I40 HydrophobicContact CZ3-CB 4.49Å; W36-I40 HydrophobicContact CZ3-CG2 3.7Å; W36-I40 PolarHBondContact O-N 3.3Å; I40-R42 PolarHBondContact O-N 3.05Å; I40-Q43 CarbonylContact O-C 3.42Å; I40-Q43 PolarHBondContact O-N 2.93Å; I40-I44 HydrophobicContact CG2-CB 4.29Å; I40-I44 HydrophobicContact CG2-CD1 3.69Å; I40-I44 HydrophobicContact CG2-CG1 4.47Å; I40-I44 WeakPolarHBondContact O-CB 3.48Å; I40-I44 PolarHBondContact O-N 3.34Å; I40-I54 HydrophobicContact CD1-CG2 4.12Å; I40-I54 HydrophobicContact CG2-CG2 3.98Å
41K96.1Very high95.2Very high113 Ų11363.5 Ų63.549%0.49130%0.299SS..THydrogen-bonded Turntrans-51.5-35.5-172.6-179.3-178.9-179.8-179.90113.2W36W36-K41 HydrophobicContact CD2-CB 4.06Å; W36-K41 HydrophobicContact CE3-CB 4.49Å; W36-K41 HydrophobicContact CH2-CB 4.44Å; W36-K41 HydrophobicContact CZ2-CB 4Å; W36-K41 HydrophobicContact CZ2-CG 3.9Å; W36-K41 WeakPolarHBondContact O-CB 3.33Å; W36-K41 PolarHBondContact O-N 3.03Å
42R94.5Very high95.2Very high210 Ų21063.6 Ų63.679%0.79230%0.296SS*.THydrogen-bonded Turntrans-82.7-16.9-178.7-60.6177.8-173.2165.12.9113.8I40I40-R42 PolarHBondContact O-N 3.05Å
43Q95.1Very high95.2Very high59 Ų5966.1 Ų66.128%0.27631%0.309SS..THydrogen-bonded Turntrans-126.54.7-170.7-61.4-175.4-15.200112.8L11 I40 D45 R46L11-Q43 HydrophobicContact CD1-CB 4.09Å; L11-Q43 HydrophobicContact CD2-CB 3.98Å; I40-Q43 CarbonylContact O-C 3.42Å; I40-Q43 PolarHBondContact O-N 2.93Å; Q43-D45 PolarHBondContact O-N 3.47Å; Q43-D45 VanDerWaalsContact O-N 3.14Å; Q43-R46 VanDerWaalsContact O-CB 3.28Å; Q43-R46 WeakPolarHBondContact O-CB 3.4Å; Q43-R46 PolarHBondContact O-N 2.93Å
44I95.3Very high95.1Very high5 Ų565.5 Ų65.53%0.02631%0.305CS..G310 helixtrans-56.2-32-175.7-171.258.3000112.8W36 I40 R46 L47 K51 I54 Y55W36-I44 HydrophobicContact CH2-CG1 4.34Å; W36-I44 HydrophobicContact CZ3-CB 4.42Å; W36-I44 HydrophobicContact CZ3-CD1 4.12Å; W36-I44 HydrophobicContact CZ3-CG1 4.12Å; I40-I44 HydrophobicContact CG2-CB 4.29Å; I40-I44 HydrophobicContact CG2-CD1 3.69Å; I40-I44 HydrophobicContact CG2-CG1 4.47Å; I40-I44 WeakPolarHBondContact O-CB 3.48Å; I40-I44 PolarHBondContact O-N 3.34Å; I44-R46 PolarHBondContact O-N 3.29Å; I44-L47 HydrophobicContact CD1-CD1 4.1Å; I44-L47 WeakPolarHBondContact O-CB 3.47Å; I44-L47 PolarHBondContact O-N 3.27Å; I44-L47 VanDerWaalsContact O-N 3.15Å; I44-K51 HydrophobicContact CD1-CB 3.55Å; I44-K51 HydrophobicContact CG1-CB 4.04Å; I44-I54 HydrophobicContact CD1-CB 4.49Å; I44-I54 HydrophobicContact CD1-CG2 4.26Å; I44-Y55 HydrophobicContact CD1-CE2 4.27Å; I44-Y55 HydrophobicContact CG1-CD2 4.43Å; I44-Y55 HydrophobicContact CG1-CE1 4.43Å; I44-Y55 HydrophobicContact CG1-CE2 3.66Å
45D94.2Very high95.2Very high130 Ų13061.8 Ų61.870%0.69529%0.287SS*.G310 helixtrans-71.6-17.4178.6-65.7-43.3000113.6Q43 L47Q43-D45 PolarHBondContact O-N 3.47Å; Q43-D45 VanDerWaalsContact O-N 3.14Å; D45-L47 PolarHBondContact O-N 3.09Å
46R94.3Very high95.2Very high180 Ų18062.7 Ų62.768%0.67929%0.291SS*.G310 helixtrans-76.7-11.6172.5-58.4-177.4178.1-178.8-3.2112.8L11 Q43 I44L11-R46 HydrophobicContact CD2-CB 4.43Å; Q43-R46 VanDerWaalsContact O-CB 3.28Å; Q43-R46 WeakPolarHBondContact O-CB 3.4Å; Q43-R46 PolarHBondContact O-N 2.93Å; I44-R46 PolarHBondContact O-N 3.29Å
47L92.9Very high95.3Very high23 Ų2363.5 Ų63.512%0.1230%0.295CS..  trans-93.6130.7177.1-54.2-178.6000108.2L11 V15 I44 D45 K51 I54L11-L47 HydrophobicContact CD1-CD1 4.37Å; L11-L47 HydrophobicContact CD1-CD2 4.38Å; L11-L47 HydrophobicContact CD2-CD2 3.99Å; L11-L47 HydrophobicContact CG-CD2 4.2Å; V15-L47 HydrophobicContact CG2-CD1 3.58Å; V15-L47 HydrophobicContact CG2-CD2 3.93Å; V15-L47 HydrophobicContact CG2-CG 4.44Å; I44-L47 HydrophobicContact CD1-CD1 4.1Å; I44-L47 WeakPolarHBondContact O-CB 3.47Å; I44-L47 PolarHBondContact O-N 3.27Å; I44-L47 VanDerWaalsContact O-N 3.15Å; D45-L47 PolarHBondContact O-N 3.09Å; L47-K51 HydrophobicContact CB-CB 3.98Å; L47-K51 WeakPolarHBondContact O-CD 3.17Å; L47-K51 PolarHBondContact O-NZ 3.17Å; L47-I54 HydrophobicContact CD1-CD1 3.44Å; L47-I54 VanDerWaalsContact CD1-CD1 3.44Å
48D91.5Very high95.4Very high136 Ų13660.2 Ų60.273%0.72728%0.278SS*.SBendtrans-73.1-107-175.2-66.1-40.3000111.7K51D48-K51 VanDerWaalsContact O-CE 3.3Å; D48-K51 WeakPolarHBondContact O-CE 3.04Å; D48-K51 WeakPolarHBondContact O-CG 3.38Å
49E93.1Very high95.5Very high121 Ų12158.7 Ų58.757%0.56527%0.265SS*.SBendtrans-80.4-22.8177.2-70.4-62.314200112.2K51 W52 K81E49-K51 PolarHBondContact O-N 3.42Å; E49-W52 PolarHBondContact O-N 3.18Å; E49-W52 PolarHBondContact OE2-NE1 3.03Å; E49-K81 IonicContact OE1-NZ 3.39Å; E49-K81 PolarHBondContact OE1-NZ 3.45Å; E49-K81 IonicContact OE2-NZ 3.95Å
50E94Very high95.6Very high44 Ų4460.3 Ų60.321%0.20627%0.272CS..Hα-helixtrans-59.2-30.1178.4179.353.1-150.300112.8V15 R22 W52 L53 I54V15-E50 HydrophobicContact CG1-CG 3.76Å; R22-E50 IonicContact CZ-OE1 2.69Å; R22-E50 IonicContact NH1-OE1 3.4Å; R22-E50 PolarHBondContact NH1-OE1 2.8Å; R22-E50 IonicContact NH2-OE1 3.9Å; R22-E50 PolarHBondContact NH2-OE1 2.7Å; R22-E50 IonicContact NH2-OE2 3.34Å; E50-W52 PolarHBondContact O-N 2.73Å; E50-W52 VanDerWaalsContact O-N 3.09Å; E50-L53 PolarHBondContact O-N 3.37Å; E50-L53 VanDerWaalsContact O-N 3.12Å; E50-I54 HydrophobicContact CG-CD1 3.96Å; E50-I54 PolarHBondContact O-N 2.93Å
51K96.2Very high95.8Very high36 Ų3660.5 Ų60.516%0.15727%0.274CS..Hα-helixtrans-57.2-31179.674.8-175.2155-1510113.1I44 L47 D48 E49 I54 Y55I44-K51 HydrophobicContact CD1-CB 3.55Å; I44-K51 HydrophobicContact CG1-CB 4.04Å; L47-K51 HydrophobicContact CB-CB 3.98Å; L47-K51 WeakPolarHBondContact O-CD 3.17Å; L47-K51 PolarHBondContact O-NZ 3.17Å; D48-K51 VanDerWaalsContact O-CE 3.3Å; D48-K51 WeakPolarHBondContact O-CE 3.04Å; D48-K51 WeakPolarHBondContact O-CG 3.38Å; E49-K51 PolarHBondContact O-N 3.42Å; K51-I54 PolarHBondContact O-N 2.87Å; K51-Y55 HydrophobicContact CB-CD2 4.41Å; K51-Y55 HydrophobicContact CB-CE2 4.37Å; K51-Y55 HydrophobicContact CD-CE2 4.41Å; K51-Y55 HydrophobicContact CG-CD2 4.38Å; K51-Y55 HydrophobicContact CG-CE2 4.31Å; K51-Y55 WeakPolarHBondContact O-CB 3.37Å; K51-Y55 WeakPolarHBondContact O-CD2 3.18Å; K51-Y55 PolarHBondContact O-N 2.86Å
52W96.4Very high95.9Very high32 Ų3255.1 Ų55.112%0.12125%0.25CS..Hα-helixtrans-72.3-37-177.7-50.3121.5000111.7E49 E50 I54 Y55 E56 K81 F82E49-W52 PolarHBondContact O-N 3.18Å; E49-W52 PolarHBondContact OE2-NE1 3.03Å; E50-W52 PolarHBondContact O-N 2.73Å; E50-W52 VanDerWaalsContact O-N 3.09Å; W52-I54 VanDerWaalsContact C-N 3.31Å; W52-Y55 AromaticContact CE3-CD2 3.84Å; W52-Y55 HydrophobicContact CE3-CD2 3.84Å; W52-Y55 HydrophobicContact CE3-CE2 4.31Å; W52-Y55 HydrophobicContact CZ3-CD2 4.11Å; W52-Y55 HydrophobicContact CZ3-CE2 4.15Å; W52-Y55 PolarHBondContact O-N 3.45Å; W52-E56 PolarHBondContact O-N 3.3Å; W52-K81 HydrophobicContact CD2-CG 4.03Å; W52-K81 HydrophobicContact CE3-CB 4.25Å; W52-K81 HydrophobicContact CE3-CG 4.22Å; W52-K81 HydrophobicContact CH2-CB 3.89Å; W52-K81 HydrophobicContact CH2-CD 4.11Å; W52-K81 HydrophobicContact CH2-CG 4Å; W52-K81 HydrophobicContact CZ2-CB 4.21Å; W52-K81 HydrophobicContact CZ2-CD 3.57Å; W52-K81 HydrophobicContact CZ2-CG 3.78Å; W52-K81 HydrophobicContact CZ3-CB 3.91Å; W52-K81 HydrophobicContact CZ3-CG 4.21Å; W52-F82 HydrophobicContact CB-CE2 4.15Å; W52-F82 HydrophobicContact CB-CZ 3.96Å; W52-F82 HydrophobicContact CG-CE2 4.35Å; W52-F82 HydrophobicContact CG-CZ 4.03Å
53L96.1Very high96Very high59 Ų5945.8 Ų45.831%0.30922%0.216SC..Hα-helixtrans-64.9-40172.9-59-174.5000110.9E50 E56 Q57E50-L53 PolarHBondContact O-N 3.37Å; E50-L53 VanDerWaalsContact O-N 3.12Å; L53-E56 PolarHBondContact O-N 3.02Å; L53-Q57 PolarHBondContact O-N 3.45Å
54I97.3Very high96.1Very high0 Ų046.3 Ų46.30%022%0.221CC..Hα-helixtrans-66.8-44.5177-65.9168000111.5V15 L18 I40 I44 L47 E50 K51 W52 E56 Q57 V58V15-I54 HydrophobicContact CG1-CD1 4.31Å; V15-I54 HydrophobicContact CG2-CD1 3.91Å; L18-I54 HydrophobicContact CD1-CG1 4.37Å; L18-I54 HydrophobicContact CD1-CG2 4.02Å; I40-I54 HydrophobicContact CD1-CG2 4.12Å; I40-I54 HydrophobicContact CG2-CG2 3.98Å; I44-I54 HydrophobicContact CD1-CB 4.49Å; I44-I54 HydrophobicContact CD1-CG2 4.26Å; L47-I54 HydrophobicContact CD1-CD1 3.44Å; L47-I54 VanDerWaalsContact CD1-CD1 3.44Å; E50-I54 HydrophobicContact CG-CD1 3.96Å; E50-I54 PolarHBondContact O-N 2.93Å; K51-I54 PolarHBondContact O-N 2.87Å; W52-I54 VanDerWaalsContact C-N 3.31Å; I54-E56 PolarHBondContact O-N 3.07Å; I54-Q57 PolarHBondContact O-N 3.45Å; I54-V58 HydrophobicContact CG2-CG2 4.03Å; I54-V58 WeakPolarHBondContact O-CB 3.29Å; I54-V58 VanDerWaalsContact O-CG2 3.27Å; I54-V58 WeakPolarHBondContact O-CG2 3.2Å; I54-V58 PolarHBondContact O-N 3.28Å
55Y98Very high96.2Very high25 Ų2548.2 Ų48.210%0.09823%0.234CC..Hα-helixtrans-55.2-40.6175.9-88.1-61.8000111.7W36 I44 K51 W52 Y59 C74 A77W36-Y55 HydrophobicContact CH2-CD1 4.12Å; W36-Y55 AromaticContact CH2-CE1 3.58Å; W36-Y55 HydrophobicContact CH2-CE1 3.58Å; W36-Y55 HydrophobicContact CZ2-CE1 4.38Å; W36-Y55 HydrophobicContact CZ3-CE1 4.32Å; I44-Y55 HydrophobicContact CD1-CE2 4.27Å; I44-Y55 HydrophobicContact CG1-CD2 4.43Å; I44-Y55 HydrophobicContact CG1-CE1 4.43Å; I44-Y55 HydrophobicContact CG1-CE2 3.66Å; K51-Y55 HydrophobicContact CB-CD2 4.41Å; K51-Y55 HydrophobicContact CB-CE2 4.37Å; K51-Y55 HydrophobicContact CD-CE2 4.41Å; K51-Y55 HydrophobicContact CG-CD2 4.38Å; K51-Y55 HydrophobicContact CG-CE2 4.31Å; K51-Y55 WeakPolarHBondContact O-CB 3.37Å; K51-Y55 WeakPolarHBondContact O-CD2 3.18Å; K51-Y55 PolarHBondContact O-N 2.86Å; W52-Y55 AromaticContact CE3-CD2 3.84Å; W52-Y55 HydrophobicContact CE3-CD2 3.84Å; W52-Y55 HydrophobicContact CE3-CE2 4.31Å; W52-Y55 HydrophobicContact CZ3-CD2 4.11Å; W52-Y55 HydrophobicContact CZ3-CE2 4.15Å; W52-Y55 PolarHBondContact O-N 3.45Å; Y55-Y59 WeakPolarHBondContact O-CB 3.49Å; Y55-Y59 PolarHBondContact O-N 2.97Å; Y55-C74 HydrophobicContact CD1-CB 4Å; Y55-A77 HydrophobicContact CD1-CB 4.13Å; Y55-A77 HydrophobicContact CD2-CB 4.47Å; Y55-A77 HydrophobicContact CE1-CB 3.85Å; Y55-A77 HydrophobicContact CE2-CB 4.23Å; Y55-A77 HydrophobicContact CG-CB 4.44Å
56E96.9Very high96.3Very high18 Ų1845.3 Ų45.38%0.08423%0.229CC..Hα-helixtrans-70.6-43.1176.8-70.3-171.1-166.500113.4W52 L53 I54 V58 Y59 I60 L78 R87 L91W52-E56 PolarHBondContact O-N 3.3Å; L53-E56 PolarHBondContact O-N 3.02Å; I54-E56 PolarHBondContact O-N 3.07Å; E56-V58 VanDerWaalsContact C-N 3.32Å; E56-V58 PolarHBondContact O-N 3.47Å; E56-Y59 WeakPolarHBondContact O-CB 3.38Å; E56-Y59 PolarHBondContact O-N 3.13Å; E56-I60 VanDerWaalsContact O-CG1 3.31Å; E56-I60 WeakPolarHBondContact O-CG1 3.49Å; E56-I60 PolarHBondContact O-N 3.01Å; E56-L78 HydrophobicContact CG-CD1 3.64Å; E56-L78 HydrophobicContact CG-CD2 3.75Å; E56-L78 HydrophobicContact CG-CG 4.36Å; E56-R87 WeakPolarHBondContact OE1-CD 3.25Å; E56-R87 WeakPolarHBondContact OE1-CG 3.3Å; E56-R87 IonicContact OE1-CZ 2.97Å; E56-R87 IonicContact OE1-NE 2.69Å; E56-R87 PolarHBondContact OE1-NE 3.49Å; E56-R87 IonicContact OE1-NH1 3.73Å; E56-R87 IonicContact OE1-NH2 3.86Å; E56-R87 PolarHBondContact OE1-NH2 3.26Å; E56-R87 IonicContact OE2-CZ 3.28Å; E56-R87 IonicContact OE2-NE 2.7Å; E56-R87 PolarHBondContact OE2-NE 3.39Å; E56-R87 IonicContact OE2-NH2 2.84Å; E56-R87 PolarHBondContact OE2-NH2 3.09Å; E56-L91 HydrophobicContact CG-CD1 3.93Å
57Q97.4Very high96.4Very high23 Ų2339.3 Ų39.311%0.10721%0.21CC..Hα-helixtrans-61.3-43.8177.3-174.6175.314.600111.4L18 R22 V32 L53 I54 I60 A61L18-Q57 PolarHBondContact O-NE2 3.32Å; L18-Q57 PolarHBondContact O-OE1 3.42Å; R22-Q57 VanDerWaalsContact CD-OE1 3.29Å; R22-Q57 HydrophobicContact CG-CB 4.39Å; R22-Q57 HydrophobicContact CG-CG 4.05Å; R22-Q57 VanDerWaalsContact CG-NE2 3.3Å; R22-Q57 VanDerWaalsContact CG-OE1 3.29Å; V32-Q57 HydrophobicContact CG1-CG 4.37Å; L53-Q57 PolarHBondContact O-N 3.45Å; I54-Q57 PolarHBondContact O-N 3.45Å; Q57-I60 PolarHBondContact O-N 3.28Å; Q57-A61 WeakPolarHBondContact O-CB 3.26Å; Q57-A61 PolarHBondContact O-N 2.91Å
58V98.1Very high96.5Very high0 Ų041.5 Ų41.50%022%0.22CC..Hα-helixtrans-67.2-39.1175.9174.10000110.9V32 L33 W36 I54 E56 A61 A62 V70V32-V58 HydrophobicContact CG1-CG2 4.02Å; L33-V58 HydrophobicContact CD2-CG1 4.18Å; W36-V58 HydrophobicContact CB-CG1 4.08Å; W36-V58 HydrophobicContact CB-CG2 4Å; W36-V58 HydrophobicContact CD2-CB 4.45Å; W36-V58 HydrophobicContact CD2-CG1 3.72Å; W36-V58 HydrophobicContact CD2-CG2 4.06Å; W36-V58 HydrophobicContact CE3-CB 4.42Å; W36-V58 HydrophobicContact CE3-CG1 4.17Å; W36-V58 HydrophobicContact CE3-CG2 3.77Å; W36-V58 HydrophobicContact CG-CG1 3.66Å; W36-V58 HydrophobicContact CG-CG2 4.18Å; I54-V58 HydrophobicContact CG2-CG2 4.03Å; I54-V58 WeakPolarHBondContact O-CB 3.29Å; I54-V58 VanDerWaalsContact O-CG2 3.27Å; I54-V58 WeakPolarHBondContact O-CG2 3.2Å; I54-V58 PolarHBondContact O-N 3.28Å; E56-V58 VanDerWaalsContact C-N 3.32Å; E56-V58 PolarHBondContact O-N 3.47Å; V58-A61 PolarHBondContact O-N 2.88Å; V58-A62 VanDerWaalsContact O-CB 3.23Å; V58-A62 WeakPolarHBondContact O-CB 3.5Å; V58-A62 PolarHBondContact O-N 2.94Å; V58-V70 HydrophobicContact CG1-CG1 3.67Å
59Y98.2Very high96.8Very high3 Ų340.3 Ų40.31%0.01222%0.218CC..Hα-helixtrans-59.4-49.4175174.3-97.6000112Y55 E56 A61 A62 L63 A71 C74 F75 L91 N95Y55-Y59 WeakPolarHBondContact O-CB 3.49Å; Y55-Y59 PolarHBondContact O-N 2.97Å; E56-Y59 WeakPolarHBondContact O-CB 3.38Å; E56-Y59 PolarHBondContact O-N 3.13Å; Y59-A61 VanDerWaalsContact C-N 3.34Å; Y59-A61 PolarHBondContact O-N 3.35Å; Y59-A62 WeakPolarHBondContact O-CB 3.49Å; Y59-A62 PolarHBondContact O-N 3.36Å; Y59-L63 HydrophobicContact CD1-CD1 4.1Å; Y59-L63 HydrophobicContact CE1-CD1 3.47Å; Y59-L63 VanDerWaalsContact CE1-CD1 3.47Å; Y59-L63 HydrophobicContact CE1-CG 4.2Å; Y59-L63 HydrophobicContact CE2-CD1 4.49Å; Y59-L63 WeakPolarHBondContact O-CG 3.45Å; Y59-L63 PolarHBondContact O-N 3.47Å; Y59-A71 HydrophobicContact CD2-CB 4Å; Y59-A71 WeakPolarHBondContact CD2-O 3.49Å; Y59-A71 HydrophobicContact CE2-CB 4.02Å; Y59-A71 WeakPolarHBondContact CE2-O 3.33Å; Y59-C74 HydrophobicContact CD2-CB 4.31Å; Y59-F75 HydrophobicContact CD2-CB 4.05Å; Y59-F75 HydrophobicContact CE2-CB 3.67Å; Y59-F75 AromaticContact CE2-CD2 3.86Å; Y59-F75 HydrophobicContact CE2-CD2 3.86Å; Y59-F75 HydrophobicContact CE2-CG 4.16Å; Y59-F75 AromaticContact CZ-CD2 3.82Å; Y59-L91 HydrophobicContact CD1-CB 4.26Å; Y59-L91 HydrophobicContact CD1-CD1 4.4Å; Y59-L91 HydrophobicContact CD1-CD2 3.75Å; Y59-L91 HydrophobicContact CD1-CG 4.33Å; Y59-L91 HydrophobicContact CE1-CB 3.61Å; Y59-L91 HydrophobicContact CE1-CD2 3.84Å; Y59-L91 HydrophobicContact CE1-CG 4.16Å; Y59-L91 PolarHBondContact OH-O 3.28Å; Y59-N95 VanDerWaalsContact OH-CB 3.23Å; Y59-N95 WeakPolarHBondContact OH-CB 3.44Å
60I97.1Very high97Very high49 Ų4935 Ų3525%0.25119%0.194SC..Hα-helixtrans-61.8-44.3178.5-66.8169.3000110.4R27 E56 Q57 A62 L63 D64 L91 M94R27-I60 VanDerWaalsContact NH2-CG2 3.34Å; E56-I60 VanDerWaalsContact O-CG1 3.31Å; E56-I60 WeakPolarHBondContact O-CG1 3.49Å; E56-I60 PolarHBondContact O-N 3.01Å; Q57-I60 PolarHBondContact O-N 3.28Å; I60-A62 VanDerWaalsContact C-N 3.32Å; I60-A62 PolarHBondContact O-N 2.95Å; I60-L63 PolarHBondContact O-N 2.93Å; I60-D64 PolarHBondContact O-N 3.42Å; I60-D64 VanDerWaalsContact O-N 3.09Å; I60-L91 HydrophobicContact CG1-CD2 4.34Å; I60-M94 HydrophobicContact CB-CE 4.36Å; I60-M94 HydrophobicContact CD1-CE 4.27Å; I60-M94 HydrophobicContact CG1-CE 3.78Å; I60-M94 HydrophobicContact CG1-SD 4.3Å; I60-M94 HydrophobicContact CG2-CE 3.89Å
61A98.1Very high97.2Very high4 Ų433 Ų333%0.03319%0.185CC..Hα-helixtrans-61.8-39.2175.300000112.8P29 V32 L33 Q57 V58 Y59 D64 C65P29-A61 HydrophobicContact CB-CB 3.85Å; V32-A61 HydrophobicContact CB-CB 3.82Å; V32-A61 HydrophobicContact CG1-CB 3.61Å; L33-A61 HydrophobicContact CG-CB 4.37Å; Q57-A61 WeakPolarHBondContact O-CB 3.26Å; Q57-A61 PolarHBondContact O-N 2.91Å; V58-A61 PolarHBondContact O-N 2.88Å; Y59-A61 VanDerWaalsContact C-N 3.34Å; Y59-A61 PolarHBondContact O-N 3.35Å; A61-D64 PolarHBondContact O-N 3.22Å; A61-C65 PolarHBondContact O-N 2.96Å; A61-C65 VanDerWaalsContact O-N 3.09Å
62A98.3Very high97.2Very high0 Ų034.8 Ų34.80%020%0.201CC..Hα-helixtrans-64.5-39.8176.900000112L33 V58 Y59 I60 C65 A66 N67 V70 A71L33-A62 HydrophobicContact CD2-CB 4.01Å; V58-A62 VanDerWaalsContact O-CB 3.23Å; V58-A62 WeakPolarHBondContact O-CB 3.5Å; V58-A62 PolarHBondContact O-N 2.94Å; Y59-A62 WeakPolarHBondContact O-CB 3.49Å; Y59-A62 PolarHBondContact O-N 3.36Å; I60-A62 VanDerWaalsContact C-N 3.32Å; I60-A62 PolarHBondContact O-N 2.95Å; A62-C65 CarbonylContact O-C 3.47Å; A62-C65 PolarHBondContact O-N 3.33Å; A62-A66 CarbonylContact O-C 3.44Å; A62-A66 PolarHBondContact O-N 2.88Å; A62-A66 VanDerWaalsContact O-N 3.11Å; A62-N67 HydrophobicContact CB-CB 4.43Å; A62-N67 PolarHBondContact O-N 2.89Å; A62-V70 HydrophobicContact CB-CB 4.05Å; A62-V70 HydrophobicContact CB-CG1 3.98Å; A62-A71 HydrophobicContact CB-CB 3.83Å
63L97.9Very high97.2Very high14 Ų1436.9 Ų36.97%0.07322%0.218CC..Hα-helixtrans-63.5-43.6173.9-68-178.1000111.8Y59 I60 C65 A66 M68 A71 M94 N95 A98Y59-L63 HydrophobicContact CD1-CD1 4.1Å; Y59-L63 HydrophobicContact CE1-CD1 3.47Å; Y59-L63 VanDerWaalsContact CE1-CD1 3.47Å; Y59-L63 HydrophobicContact CE1-CG 4.2Å; Y59-L63 HydrophobicContact CE2-CD1 4.49Å; Y59-L63 WeakPolarHBondContact O-CG 3.45Å; Y59-L63 PolarHBondContact O-N 3.47Å; I60-L63 PolarHBondContact O-N 2.93Å; L63-C65 VanDerWaalsContact C-N 3.29Å; L63-C65 PolarHBondContact O-N 3.4Å; L63-A66 PolarHBondContact O-N 3.07Å; L63-M68 HydrophobicContact CD2-SD 4.22Å; L63-A71 HydrophobicContact CD2-CB 3.94Å; L63-A71 HydrophobicContact CG-CB 4.45Å; L63-M94 HydrophobicContact CD1-CB 3.82Å; L63-N95 HydrophobicContact CD1-CB 4.4Å; L63-N95 HydrophobicContact CD2-CB 4.26Å; L63-A98 HydrophobicContact CB-CB 4.33Å; L63-A98 HydrophobicContact CD2-CB 3.99Å
64D96.1Very high97.3Very high71 Ų7134 Ų3438%0.3820%0.203SC..Hα-helixtrans-60.7-38.3178.1-69.2-30.1000112.8R27 P29 I60 A61 A66R27-D64 IonicContact CZ-OD1 3.02Å; R27-D64 IonicContact CZ-OD2 3.66Å; R27-D64 IonicContact NE-OD1 3.26Å; R27-D64 IonicContact NE-OD2 2.96Å; R27-D64 PolarHBondContact NE-OD2 2.97Å; R27-D64 IonicContact NH2-OD1 3.36Å; R27-D64 PolarHBondContact NH2-OD1 3.43Å; R27-D64 IonicContact NH2-OD2 2.64Å; R27-D64 PolarHBondContact NH2-OD2 3.16Å; P29-D64 HydrophobicContact CB-CB 3.62Å; P29-D64 HydrophobicContact CG-CB 3.81Å; I60-D64 PolarHBondContact O-N 3.42Å; I60-D64 VanDerWaalsContact O-N 3.09Å; A61-D64 PolarHBondContact O-N 3.22Å; D64-A66 VanDerWaalsContact C-N 3.31Å
65C97.1Very high97.3Very high44 Ų4435.5 Ų35.530%0.29721%0.21SC..THydrogen-bonded Turntrans-89.19.5177-61.60000113.6L33 A61 A62 L63 N67L33-C65 HydrophobicContact CD1-CB 3.63Å; A61-C65 PolarHBondContact O-N 2.96Å; A61-C65 VanDerWaalsContact O-N 3.09Å; A62-C65 CarbonylContact O-C 3.47Å; A62-C65 PolarHBondContact O-N 3.33Å; L63-C65 VanDerWaalsContact C-N 3.29Å; L63-C65 PolarHBondContact O-N 3.4Å; C65-N67 PolarHBondContact O-N 3.32Å; C65-N67 VanDerWaalsContact O-N 3.07Å
66A96.3Very high97.2Very high70 Ų7037 Ų3758%0.57922%0.224SC*.THydrogen-bonded Turntrans52.625.9-175.100000115A62 L63 D64 M68A62-A66 CarbonylContact O-C 3.44Å; A62-A66 PolarHBondContact O-N 2.88Å; A62-A66 VanDerWaalsContact O-N 3.11Å; L63-A66 PolarHBondContact O-N 3.07Å; D64-A66 VanDerWaalsContact C-N 3.31Å; A66-M68 HydrophobicContact CB-CE 4.49Å; A66-M68 PolarHBondContact O-N 2.88Å; A66-M68 VanDerWaalsContact O-N 3.09Å
67N96.9Very high97.2Very high54 Ų5436.5 Ų36.529%0.28922%0.222SC..  trans-84.478.1176.6-170.1-27000110.8L33 A62 C65 V69 V70 A71L33-N67 HydrophobicContact CD1-CB 4.32Å; A62-N67 HydrophobicContact CB-CB 4.43Å; A62-N67 PolarHBondContact O-N 2.89Å; C65-N67 PolarHBondContact O-N 3.32Å; C65-N67 VanDerWaalsContact O-N 3.07Å; N67-V69 PolarHBondContact O-N 3.35Å; N67-V70 PolarHBondContact O-N 2.99Å; N67-V70 WeakPolarHBondContact OD1-CG2 3.33Å; N67-V70 PolarHBondContact OD1-N 3.36Å; N67-V70 VanDerWaalsContact OD1-N 3.16Å; N67-A71 PolarHBondContact O-N 2.92Å
68M95.8Very high97.1Very high68 Ų6835.4 Ų35.434%0.33522%0.217SC..Hα-helixtrans-65.2-23.4-174.7-57.9-53.4175.900113.8L63 A66 S72 A98L63-M68 HydrophobicContact CD2-SD 4.22Å; A66-M68 HydrophobicContact CB-CE 4.49Å; A66-M68 PolarHBondContact O-N 2.88Å; A66-M68 VanDerWaalsContact O-N 3.09Å; M68-S72 WeakPolarHBondContact O-CB 3.5Å; M68-S72 PolarHBondContact O-N 2.93Å; M68-A98 HydrophobicContact CE-CB 4.32Å
69V96.7Very high97Very high112 Ų11239.4 Ų39.468%0.67924%0.236SC*.Hα-helixtrans-67.6-48.9176.9176.70000110.8N67 T73N67-V69 PolarHBondContact O-N 3.35Å; V69-T73 PolarHBondContact O-N 3.5Å; V69-T73 VanDerWaalsContact O-N 3.11Å; V69-T73 PolarHBondContact O-OG1 3.34Å
70V97.6Very high96.8Very high10 Ų1048.2 Ų48.26%0.06127%0.269CS..Hα-helixtrans-68.2-43.4177175.30000110.1L33 V58 A62 N67 S72 T73 C74L33-V70 HydrophobicContact CD2-CG1 4.02Å; V58-V70 HydrophobicContact CG1-CG1 3.67Å; A62-V70 HydrophobicContact CB-CB 4.05Å; A62-V70 HydrophobicContact CB-CG1 3.98Å; N67-V70 PolarHBondContact O-N 2.99Å; N67-V70 WeakPolarHBondContact OD1-CG2 3.33Å; N67-V70 PolarHBondContact OD1-N 3.36Å; N67-V70 VanDerWaalsContact OD1-N 3.16Å; V70-S72 PolarHBondContact O-N 3.36Å; V70-T73 WeakPolarHBondContact O-CB 3.41Å; V70-T73 PolarHBondContact O-N 3.14Å; V70-C74 PolarHBondContact O-N 3.27Å; V70-C74 PolarHBondContact O-SG 3.46Å
71A97.8Very high96.7Very high2 Ų250.1 Ų50.12%0.01728%0.276CS..Hα-helixtrans-56.7-48.8177.300000111.6Y59 A62 L63 N67 T73 C74 F75Y59-A71 HydrophobicContact CD2-CB 4Å; Y59-A71 WeakPolarHBondContact CD2-O 3.49Å; Y59-A71 HydrophobicContact CE2-CB 4.02Å; Y59-A71 WeakPolarHBondContact CE2-O 3.33Å; A62-A71 HydrophobicContact CB-CB 3.83Å; L63-A71 HydrophobicContact CD2-CB 3.94Å; L63-A71 HydrophobicContact CG-CB 4.45Å; N67-A71 PolarHBondContact O-N 2.92Å; A71-T73 VanDerWaalsContact C-N 3.35Å; A71-T73 PolarHBondContact O-N 3.28Å; A71-C74 PolarHBondContact O-N 3.33Å; A71-F75 WeakPolarHBondContact O-CB 3.43Å; A71-F75 PolarHBondContact O-N 3.16Å
72S96.9Very high96.4Very high72 Ų7253.6 Ų53.650%0.50329%0.29SS..Hα-helixtrans-60-43.9177.3179.70000112M68 V70 C74 F75 S76M68-S72 WeakPolarHBondContact O-CB 3.5Å; M68-S72 PolarHBondContact O-N 2.93Å; V70-S72 PolarHBondContact O-N 3.36Å; S72-C74 PolarHBondContact O-N 3.04Å; S72-F75 PolarHBondContact O-N 3.32Å; S72-S76 PolarHBondContact O-N 3.12Å; S72-S76 PolarHBondContact O-OG 2.91Å
73T97.3Very high95.7Very high76 Ų7661.6 Ų61.647%0.46633%0.325SS..Hα-helixtrans-58.7-49177.7-57.70000111.8V69 V70 A71 A77V69-T73 PolarHBondContact O-N 3.5Å; V69-T73 VanDerWaalsContact O-N 3.11Å; V69-T73 PolarHBondContact O-OG1 3.34Å; V70-T73 WeakPolarHBondContact O-CB 3.41Å; V70-T73 PolarHBondContact O-N 3.14Å; A71-T73 VanDerWaalsContact C-N 3.35Å; A71-T73 PolarHBondContact O-N 3.28Å; T73-A77 PolarHBondContact O-N 3.44Å
74C97.7Very high95.2Very high0 Ų069.9 Ų69.90%036%0.36CS..Hα-helixtrans-65.8-42.1179-63.20000111.4Y55 Y59 V70 A71 S72 A77 L78Y55-C74 HydrophobicContact CD1-CB 4Å; Y59-C74 HydrophobicContact CD2-CB 4.31Å; V70-C74 PolarHBondContact O-N 3.27Å; V70-C74 PolarHBondContact O-SG 3.46Å; A71-C74 PolarHBondContact O-N 3.33Å; S72-C74 PolarHBondContact O-N 3.04Å; C74-A77 WeakPolarHBondContact O-CB 3.2Å; C74-A77 PolarHBondContact O-N 3.47Å; C74-L78 WeakPolarHBondContact O-CG 3.39Å; C74-L78 PolarHBondContact O-N 3.45Å
75F96.8Very high94.9Very high31 Ų3168.5 Ų68.514%0.13636%0.362CS..Hα-helixtrans-62.3-47179.5-169.5-94.5000112.1Y59 A71 S72 A77 L78 E79 L88 L91 Q92Y59-F75 HydrophobicContact CD2-CB 4.05Å; Y59-F75 HydrophobicContact CE2-CB 3.67Å; Y59-F75 AromaticContact CE2-CD2 3.86Å; Y59-F75 HydrophobicContact CE2-CD2 3.86Å; Y59-F75 HydrophobicContact CE2-CG 4.16Å; Y59-F75 AromaticContact CZ-CD2 3.82Å; A71-F75 WeakPolarHBondContact O-CB 3.43Å; A71-F75 PolarHBondContact O-N 3.16Å; S72-F75 PolarHBondContact O-N 3.32Å; F75-A77 VanDerWaalsContact C-N 3.26Å; F75-A77 PolarHBondContact O-N 2.86Å; F75-L78 PolarHBondContact O-N 2.67Å; F75-L78 VanDerWaalsContact O-N 3.16Å; F75-E79 HydrophobicContact CE1-CB 4.21Å; F75-E79 WeakPolarHBondContact O-CB 3.49Å; F75-E79 PolarHBondContact O-N 2.69Å; F75-L88 HydrophobicContact CE2-CD2 4.47Å; F75-L91 HydrophobicContact CD2-CB 4.33Å; F75-L91 HydrophobicContact CE2-CB 4.09Å; F75-Q92 HydrophobicContact CE1-CG 4.41Å; F75-Q92 HydrophobicContact CE2-CG 3.67Å; F75-Q92 HydrophobicContact CZ-CG 3.34Å
76S96.2Very high94.6Very high57 Ų5769.9 Ų69.940%0.39936%0.364SS..Hα-helixtrans-60.9-35176.8-62.90000112.6S72 R80S72-S76 PolarHBondContact O-N 3.12Å; S72-S76 PolarHBondContact O-OG 2.91Å; S76-R80 WeakPolarHBondContact O-CB 3.45Å; S76-R80 PolarHBondContact O-N 3.23Å; S76-R80 VanDerWaalsContact O-N 3.13Å
77A96.1Very high94.4Very high6 Ų671 Ų715%0.0535%0.354CS..Hα-helixtrans-65.8-44.517500000111.9Y55 T73 C74 F75 K81Y55-A77 HydrophobicContact CD1-CB 4.13Å; Y55-A77 HydrophobicContact CD2-CB 4.47Å; Y55-A77 HydrophobicContact CE1-CB 3.85Å; Y55-A77 HydrophobicContact CE2-CB 4.23Å; Y55-A77 HydrophobicContact CG-CB 4.44Å; T73-A77 PolarHBondContact O-N 3.44Å; C74-A77 WeakPolarHBondContact O-CB 3.2Å; C74-A77 PolarHBondContact O-N 3.47Å; F75-A77 VanDerWaalsContact C-N 3.26Å; F75-A77 PolarHBondContact O-N 2.86Å; A77-K81 PolarHBondContact O-N 3.48Å
78L96.7Very high94.3Very high0 Ų068.8 Ų68.80%034%0.342CS..Hα-helixtrans-67.1-45.2178.3-68.3164.2000111.8E56 C74 F75 R80 K81 F82 L88 L91E56-L78 HydrophobicContact CG-CD1 3.64Å; E56-L78 HydrophobicContact CG-CD2 3.75Å; E56-L78 HydrophobicContact CG-CG 4.36Å; C74-L78 WeakPolarHBondContact O-CG 3.39Å; C74-L78 PolarHBondContact O-N 3.45Å; F75-L78 PolarHBondContact O-N 2.67Å; F75-L78 VanDerWaalsContact O-N 3.16Å; L78-R80 VanDerWaalsContact C-N 3.33Å; L78-R80 PolarHBondContact O-N 3.34Å; L78-K81 PolarHBondContact O-N 3.04Å; L78-F82 HydrophobicContact CD2-CD2 4.33Å; L78-F82 HydrophobicContact CD2-CE2 3.89Å; L78-F82 WeakPolarHBondContact O-CD2 3.49Å; L78-F82 PolarHBondContact O-N 3.29Å; L78-L88 HydrophobicContact CB-CD2 3.82Å; L78-L91 HydrophobicContact CD1-CD1 3.73Å
79E95.4Very high94.3Very high84 Ų8467.7 Ų67.739%0.39334%0.337SS..Hα-helixtrans-60.6-43179.5-174.2176.5-118.700111.3F75 K81 K83F75-E79 HydrophobicContact CE1-CB 4.21Å; F75-E79 WeakPolarHBondContact O-CB 3.49Å; F75-E79 PolarHBondContact O-N 2.69Å; E79-K81 VanDerWaalsContact C-N 3.32Å; E79-K81 PolarHBondContact O-N 2.91Å; E79-K83 WeakPolarHBondContact O-CA 3.44Å; E79-K83 PolarHBondContact O-N 3.11Å
80R94.7Very high94.2Very high189 Ų18965.5 Ų65.571%0.71332%0.317SS*.Hα-helixtrans-61.5-37.6176.8-176.7172.660.8-134.5-1.3113S76 L78S76-R80 WeakPolarHBondContact O-CB 3.45Å; S76-R80 PolarHBondContact O-N 3.23Å; S76-R80 VanDerWaalsContact O-N 3.13Å; L78-R80 VanDerWaalsContact C-N 3.33Å; L78-R80 PolarHBondContact O-N 3.34Å
81K94.3Very high94.1Very high89 Ų8965.3 Ų65.339%0.38732%0.315SS..Hα-helixtrans-76.2-49.5-179.517366.9171.5-167.10111.8E49 W52 A77 L78 E79E49-K81 IonicContact OE1-NZ 3.39Å; E49-K81 PolarHBondContact OE1-NZ 3.45Å; E49-K81 IonicContact OE2-NZ 3.95Å; W52-K81 HydrophobicContact CD2-CG 4.03Å; W52-K81 HydrophobicContact CE3-CB 4.25Å; W52-K81 HydrophobicContact CE3-CG 4.22Å; W52-K81 HydrophobicContact CH2-CB 3.89Å; W52-K81 HydrophobicContact CH2-CD 4.11Å; W52-K81 HydrophobicContact CH2-CG 4Å; W52-K81 HydrophobicContact CZ2-CB 4.21Å; W52-K81 HydrophobicContact CZ2-CD 3.57Å; W52-K81 HydrophobicContact CZ2-CG 3.78Å; W52-K81 HydrophobicContact CZ3-CB 3.91Å; W52-K81 HydrophobicContact CZ3-CG 4.21Å; A77-K81 PolarHBondContact O-N 3.48Å; L78-K81 PolarHBondContact O-N 3.04Å; E79-K81 VanDerWaalsContact C-N 3.32Å; E79-K81 PolarHBondContact O-N 2.91Å
82F92.6Very high94.1Very high76 Ų7668.6 Ų68.633%0.33333%0.33SS..Hα-helixtrans-94.7-20.2-170.2-61.2-68.4000113.7W52 L78 K84 L88W52-F82 HydrophobicContact CB-CE2 4.15Å; W52-F82 HydrophobicContact CB-CZ 3.96Å; W52-F82 HydrophobicContact CG-CE2 4.35Å; W52-F82 HydrophobicContact CG-CZ 4.03Å; L78-F82 HydrophobicContact CD2-CD2 4.33Å; L78-F82 HydrophobicContact CD2-CE2 3.89Å; L78-F82 WeakPolarHBondContact O-CD2 3.49Å; L78-F82 PolarHBondContact O-N 3.29Å; F82-K84 PolarHBondContact O-N 3.35Å; F82-K84 VanDerWaalsContact O-O 3.09Å; F82-L88 HydrophobicContact CB-CD1 3.77Å; F82-L88 HydrophobicContact CB-CG 4.15Å
83K83.4Confident94.1Very high169 Ų16965.1 Ų65.174%0.73531%0.306SS*.SBendtrans59.7-51.1-178.9-60.6-179.4178.7178.80115.4E79E79-K83 WeakPolarHBondContact O-CA 3.44Å; E79-K83 PolarHBondContact O-N 3.11Å
84K86Confident94.1Very high188 Ų18863.2 Ų63.282%0.81729%0.292SS*.SBendtrans-150.3155.6175.9-64.7-171.6179.6-177.60109.8F82F82-K84 PolarHBondContact O-N 3.35Å; F82-K84 VanDerWaalsContact O-O 3.09Å
85G90.2Very high94Very high41 Ų4165.7 Ų65.742%0.42331%0.305SS..  trans156.8162.9171.200000112.4R87 L88 L89G85-R87 PolarHBondContact O-N 3.43Å; G85-L88 PolarHBondContact O-N 3.46Å; G85-L89 WeakPolarHBondContact O-CB 3.47Å; G85-L89 PolarHBondContact O-N 3.45Å
86Q91.5Very high94.1Very high73 Ų7365.6 Ų65.634%0.34131%0.306SS..Hα-helixtrans-56.5-35178.8-60.9-175.947.900112L89 R90 L112 V115Q86-L89 PolarHBondContact O-N 2.9Å; Q86-R90 WeakPolarHBondContact O-CG 3.27Å; Q86-R90 PolarHBondContact O-N 3.22Å; Q86-L112 HydrophobicContact CB-CD2 3.97Å; Q86-L112 HydrophobicContact CG-CD2 4.46Å; Q86-L112 WeakPolarHBondContact O-CD2 3.45Å; Q86-V115 HydrophobicContact CG-CG1 3.95Å
87R91.6Very high94.1Very high94 Ų9464 Ų6436%0.35529%0.293SS..Hα-helixtrans-63.2-52.3179-163.3168.1-168-168.8-14.5112E56 G85 L89 R90 L91E56-R87 WeakPolarHBondContact OE1-CD 3.25Å; E56-R87 WeakPolarHBondContact OE1-CG 3.3Å; E56-R87 IonicContact OE1-CZ 2.97Å; E56-R87 IonicContact OE1-NE 2.69Å; E56-R87 PolarHBondContact OE1-NE 3.49Å; E56-R87 IonicContact OE1-NH1 3.73Å; E56-R87 IonicContact OE1-NH2 3.86Å; E56-R87 PolarHBondContact OE1-NH2 3.26Å; E56-R87 IonicContact OE2-CZ 3.28Å; E56-R87 IonicContact OE2-NE 2.7Å; E56-R87 PolarHBondContact OE2-NE 3.39Å; E56-R87 IonicContact OE2-NH2 2.84Å; E56-R87 PolarHBondContact OE2-NH2 3.09Å; G85-R87 PolarHBondContact O-N 3.43Å; R87-L89 VanDerWaalsContact C-N 3.31Å; R87-L89 PolarHBondContact O-N 2.93Å; R87-R90 PolarHBondContact O-N 3.4Å; R87-L91 WeakPolarHBondContact O-CG 3.37Å; R87-L91 PolarHBondContact O-N 2.86Å
88L94.4Very high94.1Very high8 Ų866 Ų664%0.04231%0.309CS..Hα-helixtrans-61.1-40.9175-76.5177.1000112F75 L78 F82 G85 R90 L91 Q92F75-L88 HydrophobicContact CE2-CD2 4.47Å; L78-L88 HydrophobicContact CB-CD2 3.82Å; F82-L88 HydrophobicContact CB-CD1 3.77Å; F82-L88 HydrophobicContact CB-CG 4.15Å; G85-L88 PolarHBondContact O-N 3.46Å; L88-R90 VanDerWaalsContact C-N 3.33Å; L88-R90 PolarHBondContact O-N 2.96Å; L88-L91 WeakPolarHBondContact O-CB 3.4Å; L88-L91 PolarHBondContact O-N 3.39Å; L88-L91 VanDerWaalsContact O-N 3.13Å; L88-Q92 WeakPolarHBondContact O-CG 3.36Å; L88-Q92 PolarHBondContact O-N 3.09Å
89L95.5Very high94Very high44 Ų4470 Ų7023%0.2333%0.33CS..Hα-helixtrans-64.3-37.8-179.4-174.862.8000111.8G85 Q86 R87 Q92 A93 I108 T111 L112G85-L89 WeakPolarHBondContact O-CB 3.47Å; G85-L89 PolarHBondContact O-N 3.45Å; Q86-L89 PolarHBondContact O-N 2.9Å; R87-L89 VanDerWaalsContact C-N 3.31Å; R87-L89 PolarHBondContact O-N 2.93Å; L89-Q92 PolarHBondContact O-N 3.21Å; L89-A93 PolarHBondContact O-N 3.36Å; L89-I108 HydrophobicContact CD1-CB 4.43Å; L89-I108 HydrophobicContact CD1-CD1 4.11Å; L89-I108 HydrophobicContact CD1-CG1 4.22Å; L89-I108 HydrophobicContact CD1-CG2 3.45Å; L89-I108 VanDerWaalsContact CD1-CG2 3.45Å; L89-I108 HydrophobicContact CD2-CG2 4.11Å; L89-I108 HydrophobicContact CG-CG2 3.4Å; L89-I108 VanDerWaalsContact CG-CG2 3.4Å; L89-I108 WeakPolarHBondContact O-CG2 3.29Å; L89-T111 HydrophobicContact CD2-CG2 4.22Å; L89-L112 HydrophobicContact CB-CD2 4.1Å; L89-L112 HydrophobicContact CD2-CD2 3.82Å; L89-L112 HydrophobicContact CD2-CG 3.92Å; L89-L112 HydrophobicContact CG-CD1 4.43Å; L89-L112 HydrophobicContact CG-CD2 4.06Å; L89-L112 HydrophobicContact CG-CG 4.13Å
90R95.5Very high94Very high67 Ų6768.6 Ų68.625%0.25334%0.339SS..Hα-helixtrans-60.3-44.6170.2-77.5-171.4-53.9-113.46.3112.4Q86 R87 L88 Q92 A93 M94 L112 N119 N122Q86-R90 WeakPolarHBondContact O-CG 3.27Å; Q86-R90 PolarHBondContact O-N 3.22Å; R87-R90 PolarHBondContact O-N 3.4Å; L88-R90 VanDerWaalsContact C-N 3.33Å; L88-R90 PolarHBondContact O-N 2.96Å; R90-Q92 VanDerWaalsContact C-N 3.34Å; R90-A93 WeakPolarHBondContact O-CB 3.29Å; R90-A93 PolarHBondContact O-N 2.96Å; R90-M94 WeakPolarHBondContact O-CG 3.37Å; R90-M94 PolarHBondContact O-N 3.02Å; R90-L112 HydrophobicContact CB-CD1 4.33Å; R90-L112 HydrophobicContact CG-CD1 3.5Å; R90-L112 VanDerWaalsContact CG-CD1 3.5Å; R90-L112 HydrophobicContact CG-CD2 3.96Å; R90-L112 HydrophobicContact CG-CG 4.37Å; R90-N119 PolarHBondContact NH1-ND2 3.39Å; R90-N122 VanDerWaalsContact CD-OD1 3.27Å; R90-N122 WeakPolarHBondContact CD-OD1 3.31Å
91L96.4Very high94.1Very high6 Ų663.4 Ų63.43%0.03132%0.323CS..Hα-helixtrans-63.8-40.7178.6-62.2179.6000111.3E56 Y59 I60 F75 L78 R87 L88 A93 M94 N95E56-L91 HydrophobicContact CG-CD1 3.93Å; Y59-L91 HydrophobicContact CD1-CB 4.26Å; Y59-L91 HydrophobicContact CD1-CD1 4.4Å; Y59-L91 HydrophobicContact CD1-CD2 3.75Å; Y59-L91 HydrophobicContact CD1-CG 4.33Å; Y59-L91 HydrophobicContact CE1-CB 3.61Å; Y59-L91 HydrophobicContact CE1-CD2 3.84Å; Y59-L91 HydrophobicContact CE1-CG 4.16Å; Y59-L91 PolarHBondContact OH-O 3.28Å; I60-L91 HydrophobicContact CG1-CD2 4.34Å; F75-L91 HydrophobicContact CD2-CB 4.33Å; F75-L91 HydrophobicContact CE2-CB 4.09Å; L78-L91 HydrophobicContact CD1-CD1 3.73Å; R87-L91 WeakPolarHBondContact O-CG 3.37Å; R87-L91 PolarHBondContact O-N 2.86Å; L88-L91 WeakPolarHBondContact O-CB 3.4Å; L88-L91 PolarHBondContact O-N 3.39Å; L88-L91 VanDerWaalsContact O-N 3.13Å; L91-A93 VanDerWaalsContact C-N 3.35Å; L91-A93 PolarHBondContact O-N 3.28Å; L91-M94 HydrophobicContact CD2-SD 4.37Å; L91-M94 PolarHBondContact O-N 3.45Å; L91-N95 PolarHBondContact O-N 3.25Å
92Q96.2Very high94.3Very high70 Ų7060.7 Ų60.733%0.32731%0.313SS..Hα-helixtrans-58.2-45.4173-71.7175-28.900111.9F75 L88 L89 R90 M94 N95 L96 I108F75-Q92 HydrophobicContact CE1-CG 4.41Å; F75-Q92 HydrophobicContact CE2-CG 3.67Å; F75-Q92 HydrophobicContact CZ-CG 3.34Å; L88-Q92 WeakPolarHBondContact O-CG 3.36Å; L88-Q92 PolarHBondContact O-N 3.09Å; L89-Q92 PolarHBondContact O-N 3.21Å; R90-Q92 VanDerWaalsContact C-N 3.34Å; Q92-M94 VanDerWaalsContact C-N 3.34Å; Q92-M94 PolarHBondContact O-N 3.07Å; Q92-N95 PolarHBondContact O-N 2.84Å; Q92-L96 WeakPolarHBondContact O-CG 3.4Å; Q92-L96 PolarHBondContact O-N 3.45Å; Q92-I108 HydrophobicContact CB-CD1 4.26Å
93A97.4Very high94.6Very high0 Ų061.8 Ų61.80%032%0.322CS..Hα-helixtrans-59.8-43.3175.300000112L89 R90 L91 N95 L96 E97 I108 Y109L89-A93 PolarHBondContact O-N 3.36Å; R90-A93 WeakPolarHBondContact O-CB 3.29Å; R90-A93 PolarHBondContact O-N 2.96Å; L91-A93 VanDerWaalsContact C-N 3.35Å; L91-A93 PolarHBondContact O-N 3.28Å; A93-N95 VanDerWaalsContact C-N 3.32Å; A93-N95 PolarHBondContact O-N 3.33Å; A93-L96 WeakPolarHBondContact O-CB 3.11Å; A93-L96 PolarHBondContact O-N 2.88Å; A93-L96 VanDerWaalsContact O-N 3.12Å; A93-E97 WeakPolarHBondContact O-CG 3.47Å; A93-E97 PolarHBondContact O-N 3.34Å; A93-I108 HydrophobicContact CB-CB 4Å; A93-I108 HydrophobicContact CB-CD1 4.41Å; A93-I108 HydrophobicContact CB-CG2 3.73Å; A93-Y109 HydrophobicContact CB-CD1 4.28Å; A93-Y109 HydrophobicContact CB-CE1 3.62Å; A93-Y109 HydrophobicContact CB-CE2 4Å; A93-Y109 VanDerWaalsContact CB-CZ 3.44Å
94M97Very high95.3Very high35 Ų3558 Ų5817%0.17231%0.307CS..Hα-helixtrans-62-37.6176.8-67.9177.870.200112.9I60 L63 R90 L91 Q92 E97 A98I60-M94 HydrophobicContact CB-CE 4.36Å; I60-M94 HydrophobicContact CD1-CE 4.27Å; I60-M94 HydrophobicContact CG1-CE 3.78Å; I60-M94 HydrophobicContact CG1-SD 4.3Å; I60-M94 HydrophobicContact CG2-CE 3.89Å; L63-M94 HydrophobicContact CD1-CB 3.82Å; R90-M94 WeakPolarHBondContact O-CG 3.37Å; R90-M94 PolarHBondContact O-N 3.02Å; L91-M94 HydrophobicContact CD2-SD 4.37Å; L91-M94 PolarHBondContact O-N 3.45Å; Q92-M94 VanDerWaalsContact C-N 3.34Å; Q92-M94 PolarHBondContact O-N 3.07Å; M94-E97 WeakPolarHBondContact CA-OE2 3.45Å; M94-E97 PolarHBondContact O-N 2.97Å; M94-A98 WeakPolarHBondContact O-CB 3.48Å; M94-A98 PolarHBondContact O-N 3.27Å
95N97.1Very high95.9Very high52 Ų5249 Ų4928%0.27827%0.268SS..Hα-helixtrans-67.9-38.3173.4176.379.4000112.4Y59 L63 L91 Q92 A93 E97 A98 N99Y59-N95 VanDerWaalsContact OH-CB 3.23Å; Y59-N95 WeakPolarHBondContact OH-CB 3.44Å; L63-N95 HydrophobicContact CD1-CB 4.4Å; L63-N95 HydrophobicContact CD2-CB 4.26Å; L91-N95 PolarHBondContact O-N 3.25Å; Q92-N95 PolarHBondContact O-N 2.84Å; A93-N95 VanDerWaalsContact C-N 3.32Å; A93-N95 PolarHBondContact O-N 3.33Å; N95-E97 VanDerWaalsContact C-N 3.32Å; N95-A98 PolarHBondContact O-N 3.28Å; N95-N99 PolarHBondContact ND2-ND2 2.99Å; N95-N99 PolarHBondContact O-N 3.41Å; N95-N99 PolarHBondContact O-ND2 3.22Å; N95-N99 PolarHBondContact OD1-ND2 3.44Å
96L97.7Very high96.3Very high30 Ų3047.9 Ų47.916%0.15725%0.252CS..Hα-helixtrans-61.7-42.6173.4-69.7169.4000111.1Q92 A93 A98 N99 G100 M101 E104 A105 I108Q92-L96 WeakPolarHBondContact O-CG 3.4Å; Q92-L96 PolarHBondContact O-N 3.45Å; A93-L96 WeakPolarHBondContact O-CB 3.11Å; A93-L96 PolarHBondContact O-N 2.88Å; A93-L96 VanDerWaalsContact O-N 3.12Å; L96-A98 PolarHBondContact O-N 2.95Å; L96-N99 CarbonylContact O-C 3.32Å; L96-N99 PolarHBondContact O-N 2.72Å; L96-N99 VanDerWaalsContact O-N 3.16Å; L96-G100 PolarHBondContact O-N 3.48Å; L96-G100 VanDerWaalsContact O-N 3.11Å; L96-M101 HydrophobicContact CB-CB 4.11Å; L96-M101 HydrophobicContact CD2-CB 3.86Å; L96-M101 HydrophobicContact CD2-CE 3.99Å; L96-M101 HydrophobicContact CD2-CG 4.4Å; L96-M101 HydrophobicContact CD2-SD 3.71Å; L96-M101 PolarHBondContact O-N 3.12Å; L96-E104 HydrophobicContact CD1-CB 3.87Å; L96-E104 HydrophobicContact CD2-CB 4.34Å; L96-A105 HydrophobicContact CB-CB 3.97Å; L96-I108 HydrophobicContact CD1-CD1 3.49Å; L96-I108 VanDerWaalsContact CD1-CD1 3.49Å; L96-I108 HydrophobicContact CD1-CG1 4.4Å
97E96.7Very high96.6Very high24 Ų2450.5 Ų50.511%0.11226%0.263CS..Hα-helixtrans-58.7-46.9173.7-67.8174.5125.200111.8A93 M94 N95 N99 G100 L102 A105 Y109 R125 S129A93-E97 WeakPolarHBondContact O-CG 3.47Å; A93-E97 PolarHBondContact O-N 3.34Å; M94-E97 WeakPolarHBondContact CA-OE2 3.45Å; M94-E97 PolarHBondContact O-N 2.97Å; N95-E97 VanDerWaalsContact C-N 3.32Å; E97-N99 PolarHBondContact O-N 2.79Å; E97-G100 PolarHBondContact O-N 2.97Å; E97-L102 HydrophobicContact CB-CD2 4.35Å; E97-L102 HydrophobicContact CG-CD2 4.29Å; E97-A105 HydrophobicContact CG-CB 3.7Å; E97-Y109 HydrophobicContact CG-CE2 4.33Å; E97-Y109 PolarHBondContact OE1-OH 3.13Å; E97-Y109 PolarHBondContact OE2-OH 3.26Å; E97-R125 IonicContact OE1-CZ 3.08Å; E97-R125 IonicContact OE1-NE 2.65Å; E97-R125 PolarHBondContact OE1-NE 2.95Å; E97-R125 IonicContact OE1-NH2 2.73Å; E97-R125 PolarHBondContact OE1-NH2 3.43Å; E97-R125 IonicContact OE2-CZ 2.74Å; E97-R125 VanDerWaalsContact OE2-CZ 3.25Å; E97-R125 IonicContact OE2-NE 3.04Å; E97-R125 PolarHBondContact OE2-NE 3.32Å; E97-R125 IonicContact OE2-NH2 2.6Å; E97-R125 PolarHBondContact OE2-NH2 3.33Å; E97-S129 PolarHBondContact OE1-OG 3.35Å
98A95.3Very high96.9Very high47 Ų4747.1 Ų47.139%0.38825%0.252SS..Hα-helixtrans-62.4-27.817800000113L63 M68 M94 N95 L96L63-A98 HydrophobicContact CB-CB 4.33Å; L63-A98 HydrophobicContact CD2-CB 3.99Å; M68-A98 HydrophobicContact CE-CB 4.32Å; M94-A98 WeakPolarHBondContact O-CB 3.48Å; M94-A98 PolarHBondContact O-N 3.27Å; N95-A98 PolarHBondContact O-N 3.28Å; L96-A98 PolarHBondContact O-N 2.95Å
99N95.1Very high97Very high84 Ų8446.9 Ų46.945%0.44925%0.251SS..THydrogen-bonded Turntrans-91.85.9175.3-69.7-65.3000113.3N95 L96 E97 M101N95-N99 PolarHBondContact ND2-ND2 2.99Å; N95-N99 PolarHBondContact O-N 3.41Å; N95-N99 PolarHBondContact O-ND2 3.22Å; N95-N99 PolarHBondContact OD1-ND2 3.44Å; L96-N99 CarbonylContact O-C 3.32Å; L96-N99 PolarHBondContact O-N 2.72Å; L96-N99 VanDerWaalsContact O-N 3.16Å; E97-N99 PolarHBondContact O-N 2.79Å; N99-M101 HydrophobicContact CB-CG 4.48Å; N99-M101 PolarHBondContact O-N 2.71Å
100G95.4Very high97.1Very high55 Ų5547 Ų4757%0.56725%0.252SS*.THydrogen-bonded Turntrans74.46.3179.800000115.2L96 E97 L102L96-G100 PolarHBondContact O-N 3.48Å; L96-G100 VanDerWaalsContact O-N 3.11Å; E97-G100 PolarHBondContact O-N 2.97Å; G100-L102 PolarHBondContact O-N 3.37Å
101M97.9Very high97.2Very high80 Ų8046.6 Ų46.639%0.39426%0.257SS..  trans-81.762.3177.7-63-178.47000110.6L96 N99 L103 E104 A105L96-M101 HydrophobicContact CB-CB 4.11Å; L96-M101 HydrophobicContact CD2-CB 3.86Å; L96-M101 HydrophobicContact CD2-CE 3.99Å; L96-M101 HydrophobicContact CD2-CG 4.4Å; L96-M101 HydrophobicContact CD2-SD 3.71Å; L96-M101 PolarHBondContact O-N 3.12Å; N99-M101 HydrophobicContact CB-CG 4.48Å; N99-M101 PolarHBondContact O-N 2.71Å; M101-L103 PolarHBondContact O-N 2.86Å; M101-E104 VanDerWaalsContact C-OE2 3.29Å; M101-E104 WeakPolarHBondContact CA-OE2 3.26Å; M101-E104 HydrophobicContact CB-CB 4.47Å; M101-E104 WeakPolarHBondContact CB-OE2 3.34Å; M101-E104 HydrophobicContact CE-CG 4.05Å; M101-E104 WeakPolarHBondContact CE-OE1 3.39Å; M101-A105 PolarHBondContact O-N 3.45Å; M101-A105 VanDerWaalsContact O-N 3.07Å
102L98.3Very high97.2Very high31 Ų3146.3 Ų46.316%0.16226%0.255CS..Hα-helixtrans-70.7-31.3-168.6-61.8177000113.4E97 G100 A105 I106 A132 L133E97-L102 HydrophobicContact CB-CD2 4.35Å; E97-L102 HydrophobicContact CG-CD2 4.29Å; G100-L102 PolarHBondContact O-N 3.37Å; L102-A105 PolarHBondContact O-N 3.43Å; L102-I106 WeakPolarHBondContact O-CD1 3.11Å; L102-I106 VanDerWaalsContact O-CG1 3.23Å; L102-I106 WeakPolarHBondContact O-CG1 3.29Å; L102-I106 PolarHBondContact O-N 2.95Å; L102-A132 HydrophobicContact CD1-CB 3.7Å; L102-L133 HydrophobicContact CB-CD1 3.85Å; L102-L133 HydrophobicContact CB-CD2 4.02Å; L102-L133 HydrophobicContact CB-CG 3.85Å; L102-L133 HydrophobicContact CD1-CD2 3.97Å; L102-L133 HydrophobicContact CD1-CG 3.82Å
103L98Very high97.1Very high100 Ų10043.9 Ų43.952%0.52424%0.244SC..Hα-helixtrans-69.1-40.9179.1-71174.1000111.2M101 I106 H107 L133M101-L103 PolarHBondContact O-N 2.86Å; L103-I106 PolarHBondContact O-N 3.28Å; L103-H107 PolarHBondContact O-N 2.81Å; L103-L133 HydrophobicContact CD2-CD1 3.65Å; L103-L133 HydrophobicContact CG-CD1 4.08Å
104E98.2Very high96.9Very high89 Ų8952.3 Ų52.342%0.41628%0.281SS..Hα-helixtrans-67.2-41.1175.7-61.587.4160.500110.7L96 M101 I106 H107 I108L96-E104 HydrophobicContact CD1-CB 3.87Å; L96-E104 HydrophobicContact CD2-CB 4.34Å; M101-E104 VanDerWaalsContact C-OE2 3.29Å; M101-E104 WeakPolarHBondContact CA-OE2 3.26Å; M101-E104 HydrophobicContact CB-CB 4.47Å; M101-E104 WeakPolarHBondContact CB-OE2 3.34Å; M101-E104 HydrophobicContact CE-CG 4.05Å; M101-E104 WeakPolarHBondContact CE-OE1 3.39Å; E104-I106 PolarHBondContact O-N 3.49Å; E104-H107 PolarHBondContact O-N 3.29Å; E104-I108 PolarHBondContact O-N 3.38Å; E104-I108 VanDerWaalsContact O-N 3.13Å
105A98.3Very high96.8Very high0 Ų054.9 Ų54.90%030%0.298CS..Hα-helixtrans-59.2-45.2172.700000111.7L96 E97 M101 L102 H107 I108 Y109L96-A105 HydrophobicContact CB-CB 3.97Å; E97-A105 HydrophobicContact CG-CB 3.7Å; M101-A105 PolarHBondContact O-N 3.45Å; M101-A105 VanDerWaalsContact O-N 3.07Å; L102-A105 PolarHBondContact O-N 3.43Å; A105-H107 VanDerWaalsContact C-N 3.33Å; A105-H107 PolarHBondContact O-N 3.4Å; A105-I108 PolarHBondContact O-N 2.79Å; A105-I108 VanDerWaalsContact O-N 3.16Å; A105-Y109 HydrophobicContact CB-CE2 4.11Å; A105-Y109 WeakPolarHBondContact O-CD2 3.36Å; A105-Y109 PolarHBondContact O-N 2.98Å
106I98.3Very high96.5Very high16 Ų1654.2 Ų54.28%0.08230%0.295CS..Hα-helixtrans-58-44.4175.6-73.2162.3000111.3L102 L103 E104 I108 Y109 D110 K126 L130 L133L102-I106 WeakPolarHBondContact O-CD1 3.11Å; L102-I106 VanDerWaalsContact O-CG1 3.23Å; L102-I106 WeakPolarHBondContact O-CG1 3.29Å; L102-I106 PolarHBondContact O-N 2.95Å; L103-I106 PolarHBondContact O-N 3.28Å; E104-I106 PolarHBondContact O-N 3.49Å; I106-I108 VanDerWaalsContact C-N 3.27Å; I106-I108 PolarHBondContact O-N 3.49Å; I106-Y109 PolarHBondContact O-N 2.87Å; I106-Y109 VanDerWaalsContact O-N 3.1Å; I106-D110 PolarHBondContact O-N 3.4Å; I106-K126 HydrophobicContact CG2-CG 4.34Å; I106-L130 HydrophobicContact CD1-CD2 3.71Å; I106-L130 HydrophobicContact CD1-CG 3.96Å; I106-L133 HydrophobicContact CD1-CD1 3.65Å
107H98.1Very high96.2Very high128 Ų12855.8 Ų55.859%0.59331%0.307SS*.Hα-helixtrans-59-41.2177.7-175.464.4000112L103 E104 A105 D110 T111L103-H107 PolarHBondContact O-N 2.81Å; E104-H107 PolarHBondContact O-N 3.29Å; A105-H107 VanDerWaalsContact C-N 3.33Å; A105-H107 PolarHBondContact O-N 3.4Å; H107-D110 PolarHBondContact O-N 3.47Å; H107-T111 PolarHBondContact O-N 2.95Å; H107-T111 VanDerWaalsContact O-N 3.15Å; H107-T111 PolarHBondContact O-OG1 2.99Å
108I98Very high95.8Very high24 Ų2459.3 Ų59.312%0.12333%0.33CS..Hα-helixtrans-64.8-43.4174.8-65.9-175.9000111.3L89 Q92 A93 L96 E104 A105 I106 D110 T111 L112L89-I108 HydrophobicContact CD1-CB 4.43Å; L89-I108 HydrophobicContact CD1-CD1 4.11Å; L89-I108 HydrophobicContact CD1-CG1 4.22Å; L89-I108 HydrophobicContact CD1-CG2 3.45Å; L89-I108 VanDerWaalsContact CD1-CG2 3.45Å; L89-I108 HydrophobicContact CD2-CG2 4.11Å; L89-I108 HydrophobicContact CG-CG2 3.4Å; L89-I108 VanDerWaalsContact CG-CG2 3.4Å; L89-I108 WeakPolarHBondContact O-CG2 3.29Å; Q92-I108 HydrophobicContact CB-CD1 4.26Å; A93-I108 HydrophobicContact CB-CB 4Å; A93-I108 HydrophobicContact CB-CD1 4.41Å; A93-I108 HydrophobicContact CB-CG2 3.73Å; L96-I108 HydrophobicContact CD1-CD1 3.49Å; L96-I108 VanDerWaalsContact CD1-CD1 3.49Å; L96-I108 HydrophobicContact CD1-CG1 4.4Å; E104-I108 PolarHBondContact O-N 3.38Å; E104-I108 VanDerWaalsContact O-N 3.13Å; A105-I108 PolarHBondContact O-N 2.79Å; A105-I108 VanDerWaalsContact O-N 3.16Å; I106-I108 VanDerWaalsContact C-N 3.27Å; I106-I108 PolarHBondContact O-N 3.49Å; I108-D110 VanDerWaalsContact C-N 3.31Å; I108-D110 PolarHBondContact O-N 3.14Å; I108-T111 WeakPolarHBondContact O-CB 3.38Å; I108-T111 PolarHBondContact O-N 2.97Å; I108-T111 VanDerWaalsContact O-N 3.16Å; I108-L112 HydrophobicContact CG2-CD1 3.85Å; I108-L112 HydrophobicContact CG2-CG 4.3Å; I108-L112 WeakPolarHBondContact O-CG 3.34Å; I108-L112 PolarHBondContact O-N 2.97Å
109Y97.7Very high95.6Very high3 Ų358.2 Ų58.21%0.01232%0.318CS..Hα-helixtrans-62.5-37.4176.7-67.7-52000112.5A93 E97 A105 I106 T111 L112 I113 N122 R125 K126A93-Y109 HydrophobicContact CB-CD1 4.28Å; A93-Y109 HydrophobicContact CB-CE1 3.62Å; A93-Y109 HydrophobicContact CB-CE2 4Å; A93-Y109 VanDerWaalsContact CB-CZ 3.44Å; E97-Y109 HydrophobicContact CG-CE2 4.33Å; E97-Y109 PolarHBondContact OE1-OH 3.13Å; E97-Y109 PolarHBondContact OE2-OH 3.26Å; A105-Y109 HydrophobicContact CB-CE2 4.11Å; A105-Y109 WeakPolarHBondContact O-CD2 3.36Å; A105-Y109 PolarHBondContact O-N 2.98Å; I106-Y109 PolarHBondContact O-N 2.87Å; I106-Y109 VanDerWaalsContact O-N 3.1Å; Y109-T111 VanDerWaalsContact C-N 3.33Å; Y109-T111 PolarHBondContact O-N 3.01Å; Y109-L112 HydrophobicContact CD1-CD1 3.89Å; Y109-L112 HydrophobicContact CE1-CD1 4.31Å; Y109-L112 PolarHBondContact O-N 3.05Å; Y109-I113 VanDerWaalsContact O-CB 3.32Å; Y109-I113 WeakPolarHBondContact O-CB 3.32Å; Y109-I113 WeakPolarHBondContact O-CD1 3.24Å; Y109-I113 WeakPolarHBondContact O-CG1 3.49Å; Y109-I113 PolarHBondContact O-N 3.35Å; Y109-N122 HydrophobicContact CD1-CB 4.47Å; Y109-R125 HydrophobicContact CD1-CB 4.15Å; Y109-R125 HydrophobicContact CD2-CB 4.11Å; Y109-R125 HydrophobicContact CE1-CB 3.61Å; Y109-R125 HydrophobicContact CE1-CG 4.1Å; Y109-R125 HydrophobicContact CE2-CB 3.55Å; Y109-R125 HydrophobicContact CG-CB 4.4Å; Y109-K126 HydrophobicContact CD2-CB 4.4Å; Y109-K126 HydrophobicContact CG-CB 4.4Å
110D96.9Very high95.3Very high47 Ų4756.5 Ų56.525%0.25131%0.311SS..Hα-helixtrans-60.3-42.4172.7-78.5-33.7000112I106 H107 I108 K114 K126I106-D110 PolarHBondContact O-N 3.4Å; H107-D110 PolarHBondContact O-N 3.47Å; I108-D110 VanDerWaalsContact C-N 3.31Å; I108-D110 PolarHBondContact O-N 3.14Å; D110-K114 WeakPolarHBondContact O-CB 3.41Å; D110-K114 VanDerWaalsContact O-CG 3.27Å; D110-K114 WeakPolarHBondContact O-CG 3.44Å; D110-K114 PolarHBondContact O-N 3.34Å; D110-K126 VanDerWaalsContact OD1-CE 3.23Å; D110-K126 WeakPolarHBondContact OD1-CE 3.35Å; D110-K126 IonicContact OD1-NZ 3.09Å; D110-K126 PolarHBondContact OD1-NZ 3.21Å
111T96.8Very high95.1Very high57 Ų5759.1 Ų59.135%0.3531%0.311SS..Hα-helixtrans-62.8-45.9173.8-56.30000111.4L89 H107 I108 Y109 I113 K114 V115L89-T111 HydrophobicContact CD2-CG2 4.22Å; H107-T111 PolarHBondContact O-N 2.95Å; H107-T111 VanDerWaalsContact O-N 3.15Å; H107-T111 PolarHBondContact O-OG1 2.99Å; I108-T111 WeakPolarHBondContact O-CB 3.38Å; I108-T111 PolarHBondContact O-N 2.97Å; I108-T111 VanDerWaalsContact O-N 3.16Å; Y109-T111 VanDerWaalsContact C-N 3.33Å; Y109-T111 PolarHBondContact O-N 3.01Å; T111-I113 PolarHBondContact O-N 2.88Å; T111-K114 PolarHBondContact O-N 3.06Å; T111-V115 WeakPolarHBondContact O-CG2 3.46Å; T111-V115 PolarHBondContact O-N 2.75Å; T111-V115 VanDerWaalsContact O-N 3.09Å
112L96.1Very high94.9Very high1 Ų155.4 Ų55.41%0.00529%0.293CS..Hα-helixtrans-62.5-42.8179.5-74164.8000112.4Q86 L89 R90 I108 Y109 K114 V115 D116 N122Q86-L112 HydrophobicContact CB-CD2 3.97Å; Q86-L112 HydrophobicContact CG-CD2 4.46Å; Q86-L112 WeakPolarHBondContact O-CD2 3.45Å; L89-L112 HydrophobicContact CB-CD2 4.1Å; L89-L112 HydrophobicContact CD2-CD2 3.82Å; L89-L112 HydrophobicContact CD2-CG 3.92Å; L89-L112 HydrophobicContact CG-CD1 4.43Å; L89-L112 HydrophobicContact CG-CD2 4.06Å; L89-L112 HydrophobicContact CG-CG 4.13Å; R90-L112 HydrophobicContact CB-CD1 4.33Å; R90-L112 HydrophobicContact CG-CD1 3.5Å; R90-L112 VanDerWaalsContact CG-CD1 3.5Å; R90-L112 HydrophobicContact CG-CD2 3.96Å; R90-L112 HydrophobicContact CG-CG 4.37Å; I108-L112 HydrophobicContact CG2-CD1 3.85Å; I108-L112 HydrophobicContact CG2-CG 4.3Å; I108-L112 WeakPolarHBondContact O-CG 3.34Å; I108-L112 PolarHBondContact O-N 2.97Å; Y109-L112 HydrophobicContact CD1-CD1 3.89Å; Y109-L112 HydrophobicContact CE1-CD1 4.31Å; Y109-L112 PolarHBondContact O-N 3.05Å; L112-K114 VanDerWaalsContact C-N 3.35Å; L112-V115 PolarHBondContact O-N 3.16Å; L112-D116 PolarHBondContact O-N 3.42Å; L112-N122 HydrophobicContact CB-CB 4.39Å
113I94.5Very high94.7Very high19 Ų1954.4 Ų54.410%0.09729%0.288CS..Hα-helixtrans-63.4-40.1176.7-74.3164.7000111.2Y109 T111 V115 D116 P117 N122 Y123 K126Y109-I113 VanDerWaalsContact O-CB 3.32Å; Y109-I113 WeakPolarHBondContact O-CB 3.32Å; Y109-I113 WeakPolarHBondContact O-CD1 3.24Å; Y109-I113 WeakPolarHBondContact O-CG1 3.49Å; Y109-I113 PolarHBondContact O-N 3.35Å; T111-I113 PolarHBondContact O-N 2.88Å; I113-V115 VanDerWaalsContact C-N 3.33Å; I113-D116 CarbonylContact O-C 3.54Å; I113-P117 VanDerWaalsContact O-CA 3.27Å; I113-P117 WeakPolarHBondContact O-CA 3.4Å; I113-P117 VanDerWaalsContact O-N 3.11Å; I113-N122 HydrophobicContact CD1-CB 4.44Å; I113-N122 HydrophobicContact CG1-CB 3.75Å; I113-Y123 HydrophobicContact CB-CE1 4.48Å; I113-Y123 HydrophobicContact CD1-CD1 3.74Å; I113-Y123 HydrophobicContact CD1-CE1 3.95Å; I113-Y123 HydrophobicContact CD1-CG 4.08Å; I113-Y123 HydrophobicContact CG1-CD1 4.19Å; I113-Y123 HydrophobicContact CG1-CD2 4.26Å; I113-Y123 HydrophobicContact CG1-CE1 4.09Å; I113-Y123 HydrophobicContact CG1-CE2 4.18Å; I113-Y123 HydrophobicContact CG1-CG 4.28Å; I113-Y123 HydrophobicContact CG2-CD1 4.45Å; I113-Y123 HydrophobicContact CG2-CE1 3.57Å; I113-Y123 HydrophobicContact CG2-CE2 4.19Å; I113-Y123 VanDerWaalsContact CG2-CZ 3.43Å; I113-Y123 VanDerWaalsContact CG2-OH 3.27Å; I113-Y123 WeakPolarHBondContact CG2-OH 3.29Å; I113-K126 HydrophobicContact CD1-CB 4.45Å; I113-K126 HydrophobicContact CD1-CD 3.89Å
114K94.4Very high94.4Very high176 Ų17652.5 Ų52.577%0.76528%0.275SS*.Hα-helixtrans-64.8-37.4176.1-75.7172-177.3176.70112.4D110 T111 L112D110-K114 WeakPolarHBondContact O-CB 3.41Å; D110-K114 VanDerWaalsContact O-CG 3.27Å; D110-K114 WeakPolarHBondContact O-CG 3.44Å; D110-K114 PolarHBondContact O-N 3.34Å; T111-K114 PolarHBondContact O-N 3.06Å; L112-K114 VanDerWaalsContact C-N 3.35Å
115V94.2Very high94.3Very high89 Ų8952.8 Ų52.854%0.53927%0.272SS..Hα-helixtrans-76.4-42.5-179.1173.70000111.4Q86 T111 L112 I113Q86-V115 HydrophobicContact CG-CG1 3.95Å; T111-V115 WeakPolarHBondContact O-CG2 3.46Å; T111-V115 PolarHBondContact O-N 2.75Å; T111-V115 VanDerWaalsContact O-N 3.09Å; L112-V115 PolarHBondContact O-N 3.16Å; I113-V115 VanDerWaalsContact C-N 3.33Å
116D91.8Very high94.3Very high39 Ų3953.4 Ų53.421%0.20928%0.275CS..  trans-135.189.8177.817910.3000110.4L112 I113 T118 N119L112-D116 PolarHBondContact O-N 3.42Å; I113-D116 CarbonylContact O-C 3.54Å; D116-T118 PolarHBondContact O-N 3.48Å; D116-T118 WeakPolarHBondContact OD1-CB 3.46Å; D116-T118 PolarHBondContact OD1-N 3.14Å; D116-T118 PolarHBondContact OD1-OG1 3.35Å; D116-N119 WeakPolarHBondContact OD2-CB 3.41Å
117P90Very high94.2Very high62 Ų6253 Ų5340%0.40327%0.273SS..THydrogen-bonded Turntrans-73.7-2.5178.430.8-35.6000112.8I113 Y123 F150I113-P117 VanDerWaalsContact O-CA 3.27Å; I113-P117 WeakPolarHBondContact O-CA 3.4Å; I113-P117 VanDerWaalsContact O-N 3.11Å; P117-Y123 WeakPolarHBondContact O-CE2 3.28Å; P117-F150 WeakPolarHBondContact O-CE2 3.41Å; P117-F150 WeakPolarHBondContact O-CZ 3.38Å
118T89.3Confident94.2Very high98 Ų9849.1 Ų49.160%0.60126%0.263SS*.THydrogen-bonded Turntrans-91.2-6.9-178.572.40000113.5D116 P120D116-T118 PolarHBondContact O-N 3.48Å; D116-T118 WeakPolarHBondContact OD1-CB 3.46Å; D116-T118 PolarHBondContact OD1-N 3.14Å; D116-T118 PolarHBondContact OD1-OG1 3.35Å; T118-P120 WeakPolarHBondContact O-CD 3.36Å
119N90.1Very high94.2Very high25 Ų2548 Ų4813%0.13426%0.257CS..  trans-93.8101.6-176.4-169.6-26.9000112R90 D116 L121 N122 Y123R90-N119 PolarHBondContact NH1-ND2 3.39Å; D116-N119 WeakPolarHBondContact OD2-CB 3.41Å; N119-L121 PolarHBondContact O-N 2.9Å; N119-L121 VanDerWaalsContact O-N 3.16Å; N119-L121 VanDerWaalsContact OD1-CB 3.29Å; N119-L121 WeakPolarHBondContact OD1-CB 3.27Å; N119-L121 PolarHBondContact OD1-N 3.14Å; N119-L121 VanDerWaalsContact OD1-N 3.09Å; N119-N122 PolarHBondContact O-N 2.56Å; N119-Y123 WeakPolarHBondContact O-CD2 3.45Å
120P88.7Confident94.2Very high47 Ų4748 Ų4831%0.30526%0.257SS..Hα-helixtrans-64.6-22.2-177.427.5-36.4000113.2T118 N122 Y123 K124T118-P120 WeakPolarHBondContact O-CD 3.36Å; P120-N122 VanDerWaalsContact C-N 3.32Å; P120-N122 PolarHBondContact O-N 3.06Å; P120-Y123 PolarHBondContact O-N 3.45Å; P120-K124 WeakPolarHBondContact O-CG 3.42Å; P120-K124 PolarHBondContact O-N 3.07Å
121L90.7Very high94.2Very high110 Ų11047.2 Ų47.258%0.57625%0.254SS*.Hα-helixtrans-64.1-38.2-178.2-61.9173.5000111.6N119 K124 R125N119-L121 PolarHBondContact O-N 2.9Å; N119-L121 VanDerWaalsContact O-N 3.16Å; N119-L121 VanDerWaalsContact OD1-CB 3.29Å; N119-L121 WeakPolarHBondContact OD1-CB 3.27Å; N119-L121 PolarHBondContact OD1-N 3.14Å; N119-L121 VanDerWaalsContact OD1-N 3.09Å; L121-K124 PolarHBondContact O-N 3.42Å; L121-R125 WeakPolarHBondContact O-CG 3.41Å; L121-R125 PolarHBondContact O-N 3.2Å
122N93.8Very high94.2Very high2 Ų248 Ų481%0.01127%0.267CS..Hα-helixtrans-65.9-40.7-179.9-61.7-34.1000111.3R90 Y109 L112 I113 N119 P120 K126R90-N122 VanDerWaalsContact CD-OD1 3.27Å; R90-N122 WeakPolarHBondContact CD-OD1 3.31Å; Y109-N122 HydrophobicContact CD1-CB 4.47Å; L112-N122 HydrophobicContact CB-CB 4.39Å; I113-N122 HydrophobicContact CD1-CB 4.44Å; I113-N122 HydrophobicContact CG1-CB 3.75Å; N119-N122 PolarHBondContact O-N 2.56Å; P120-N122 VanDerWaalsContact C-N 3.32Å; P120-N122 PolarHBondContact O-N 3.06Å; N122-K126 WeakPolarHBondContact O-CB 3.28Å; N122-K126 PolarHBondContact O-N 3.11Å
123Y93.9Very high94.3Very high11 Ų1151.2 Ų51.24%0.04328%0.284CS..Hα-helixtrans-61.9-47.7174-68.1-84.3000111.5I113 P117 N119 P120 R125 K126 V127 H146 F150I113-Y123 HydrophobicContact CB-CE1 4.48Å; I113-Y123 HydrophobicContact CD1-CD1 3.74Å; I113-Y123 HydrophobicContact CD1-CE1 3.95Å; I113-Y123 HydrophobicContact CD1-CG 4.08Å; I113-Y123 HydrophobicContact CG1-CD1 4.19Å; I113-Y123 HydrophobicContact CG1-CD2 4.26Å; I113-Y123 HydrophobicContact CG1-CE1 4.09Å; I113-Y123 HydrophobicContact CG1-CE2 4.18Å; I113-Y123 HydrophobicContact CG1-CG 4.28Å; I113-Y123 HydrophobicContact CG2-CD1 4.45Å; I113-Y123 HydrophobicContact CG2-CE1 3.57Å; I113-Y123 HydrophobicContact CG2-CE2 4.19Å; I113-Y123 VanDerWaalsContact CG2-CZ 3.43Å; I113-Y123 VanDerWaalsContact CG2-OH 3.27Å; I113-Y123 WeakPolarHBondContact CG2-OH 3.29Å; P117-Y123 WeakPolarHBondContact O-CE2 3.28Å; N119-Y123 WeakPolarHBondContact O-CD2 3.45Å; P120-Y123 PolarHBondContact O-N 3.45Å; Y123-R125 VanDerWaalsContact C-N 3.35Å; Y123-R125 PolarHBondContact O-N 2.98Å; Y123-K126 PolarHBondContact O-N 2.88Å; Y123-V127 WeakPolarHBondContact O-CG2 3.35Å; Y123-V127 PolarHBondContact O-N 3.24Å; Y123-H146 HydrophobicContact CD1-CB 4.34Å; Y123-H146 AromaticContact CD2-ND1 3.7Å; Y123-H146 AromaticContact CG-ND1 3.55Å; Y123-F150 HydrophobicContact CE2-CE2 4.4Å
124K93.7Very high94.4Very high60 Ų6052.4 Ų52.426%0.26130%0.301SS..Hα-helixtrans-60-42179.8-71.6177.6179.7-176.10112.2P120 L121 V127 A128 D153 E155P120-K124 WeakPolarHBondContact O-CG 3.42Å; P120-K124 PolarHBondContact O-N 3.07Å; L121-K124 PolarHBondContact O-N 3.42Å; K124-V127 PolarHBondContact O-N 3.4Å; K124-A128 WeakPolarHBondContact O-CB 3.38Å; K124-A128 PolarHBondContact O-N 3.11Å; K124-D153 WeakPolarHBondContact CE-OD1 3.35Å; K124-D153 WeakPolarHBondContact CE-OD2 3.5Å; K124-D153 IonicContact NZ-OD1 3.05Å; K124-D153 PolarHBondContact NZ-OD1 3.41Å; K124-D153 IonicContact NZ-OD2 3.78Å; K124-D153 PolarHBondContact NZ-OD2 2.89Å; K124-E155 IonicContact NZ-OE2 3.36Å; K124-E155 PolarHBondContact NZ-OE2 3.32Å
125R95.5Very high94.6Very high95 Ų9547.3 Ų47.336%0.35828%0.279SS..Hα-helixtrans-67.6-42.1176.2-64.2-54.9-64179.7-8.7112.8E97 Y109 L121 Y123 V127 A128 S129E97-R125 IonicContact OE1-CZ 3.08Å; E97-R125 IonicContact OE1-NE 2.65Å; E97-R125 PolarHBondContact OE1-NE 2.95Å; E97-R125 IonicContact OE1-NH2 2.73Å; E97-R125 PolarHBondContact OE1-NH2 3.43Å; E97-R125 IonicContact OE2-CZ 2.74Å; E97-R125 VanDerWaalsContact OE2-CZ 3.25Å; E97-R125 IonicContact OE2-NE 3.04Å; E97-R125 PolarHBondContact OE2-NE 3.32Å; E97-R125 IonicContact OE2-NH2 2.6Å; E97-R125 PolarHBondContact OE2-NH2 3.33Å; Y109-R125 HydrophobicContact CD1-CB 4.15Å; Y109-R125 HydrophobicContact CD2-CB 4.11Å; Y109-R125 HydrophobicContact CE1-CB 3.61Å; Y109-R125 HydrophobicContact CE1-CG 4.1Å; Y109-R125 HydrophobicContact CE2-CB 3.55Å; Y109-R125 HydrophobicContact CG-CB 4.4Å; L121-R125 WeakPolarHBondContact O-CG 3.41Å; L121-R125 PolarHBondContact O-N 3.2Å; Y123-R125 VanDerWaalsContact C-N 3.35Å; Y123-R125 PolarHBondContact O-N 2.98Å; R125-V127 PolarHBondContact O-N 2.96Å; R125-A128 PolarHBondContact O-N 3.07Å; R125-S129 PolarHBondContact O-N 3.25Å; R125-S129 PolarHBondContact O-OG 3.44Å
126K97.4Very high94.8Very high13 Ų1343.9 Ų43.96%0.05726%0.258CS..Hα-helixtrans-56.9-49.4173.3-179.1-179.7174.3-175.30111.4I106 Y109 D110 I113 N122 Y123 S129 L130 E142I106-K126 HydrophobicContact CG2-CG 4.34Å; Y109-K126 HydrophobicContact CD2-CB 4.4Å; Y109-K126 HydrophobicContact CG-CB 4.4Å; D110-K126 VanDerWaalsContact OD1-CE 3.23Å; D110-K126 WeakPolarHBondContact OD1-CE 3.35Å; D110-K126 IonicContact OD1-NZ 3.09Å; D110-K126 PolarHBondContact OD1-NZ 3.21Å; I113-K126 HydrophobicContact CD1-CB 4.45Å; I113-K126 HydrophobicContact CD1-CD 3.89Å; N122-K126 WeakPolarHBondContact O-CB 3.28Å; N122-K126 PolarHBondContact O-N 3.11Å; Y123-K126 PolarHBondContact O-N 2.88Å; K126-S129 PolarHBondContact O-N 3.4Å; K126-L130 HydrophobicContact CG-CD1 4.14Å; K126-L130 WeakPolarHBondContact O-CG 3.37Å; K126-L130 PolarHBondContact O-N 2.97Å; K126-E142 HydrophobicContact CD-CG 4.46Å; K126-E142 VanDerWaalsContact CE-CD 3.4Å; K126-E142 WeakPolarHBondContact CE-OE2 3.47Å; K126-E142 IonicContact NZ-OE1 2.71Å; K126-E142 PolarHBondContact NZ-OE1 3.1Å; K126-E142 IonicContact NZ-OE2 2.7Å; K126-E142 PolarHBondContact NZ-OE2 3.15Å
127V97.3Very high95Very high7 Ų747.7 Ų47.74%0.04228%0.275CS..Hα-helixtrans-59.9-47.8178169.70000110.8Y123 K124 R125 S129 L130 V131 A139 E142 L143 E159Y123-V127 WeakPolarHBondContact O-CG2 3.35Å; Y123-V127 PolarHBondContact O-N 3.24Å; K124-V127 PolarHBondContact O-N 3.4Å; R125-V127 PolarHBondContact O-N 2.96Å; V127-S129 VanDerWaalsContact C-N 3.31Å; V127-S129 PolarHBondContact O-N 3.48Å; V127-L130 WeakPolarHBondContact O-CB 3.16Å; V127-L130 PolarHBondContact O-N 2.88Å; V127-L130 VanDerWaalsContact O-N 3.14Å; V127-V131 HydrophobicContact CG1-CG2 4.38Å; V127-V131 WeakPolarHBondContact O-CG2 3.45Å; V127-V131 PolarHBondContact O-N 2.91Å; V127-A139 HydrophobicContact CG1-CB 4.41Å; V127-E142 HydrophobicContact CG2-CB 4.06Å; V127-L143 HydrophobicContact CG1-CD1 3.83Å; V127-L143 HydrophobicContact CG1-CD2 4.21Å; V127-L143 HydrophobicContact CG1-CG 3.93Å; V127-L143 HydrophobicContact CG2-CD2 4.07Å; V127-L143 HydrophobicContact CG2-CG 3.86Å; V127-E159 HydrophobicContact CG1-CG 4.15Å
128A96.8Very high95.4Very high46 Ų4649 Ų4938%0.3828%0.275SS..Hα-helixtrans-57.5-43176.900000112.5K124 R125 V131 A132K124-A128 WeakPolarHBondContact O-CB 3.38Å; K124-A128 PolarHBondContact O-N 3.11Å; R125-A128 PolarHBondContact O-N 3.07Å; A128-V131 PolarHBondContact O-N 3.34Å; A128-A132 WeakPolarHBondContact O-CB 3.4Å; A128-A132 PolarHBondContact O-N 3.29Å
129S98.1Very high95.8Very high1 Ų144.4 Ų44.41%0.00725%0.247CC..Hα-helixtrans-63.5-41.9175.5-70.30000112.4E97 R125 K126 V127 A132 L133E97-S129 PolarHBondContact OE1-OG 3.35Å; R125-S129 PolarHBondContact O-N 3.25Å; R125-S129 PolarHBondContact O-OG 3.44Å; K126-S129 PolarHBondContact O-N 3.4Å; V127-S129 VanDerWaalsContact C-N 3.31Å; V127-S129 PolarHBondContact O-N 3.48Å; S129-A132 PolarHBondContact O-N 3.08Å; S129-L133 WeakPolarHBondContact O-CG 3.45Å; S129-L133 PolarHBondContact O-N 3.11Å
130L98.4Very high96.2Very high2 Ų243.6 Ų43.61%0.0124%0.242CC..Hα-helixtrans-63.6-42.4175.8-72.4168.2000112I106 K126 V127 L133 G134 K135 E138 A139 E142I106-L130 HydrophobicContact CD1-CD2 3.71Å; I106-L130 HydrophobicContact CD1-CG 3.96Å; K126-L130 HydrophobicContact CG-CD1 4.14Å; K126-L130 WeakPolarHBondContact O-CG 3.37Å; K126-L130 PolarHBondContact O-N 2.97Å; V127-L130 WeakPolarHBondContact O-CB 3.16Å; V127-L130 PolarHBondContact O-N 2.88Å; V127-L130 VanDerWaalsContact O-N 3.14Å; L130-L133 PolarHBondContact O-N 3.32Å; L130-G134 PolarHBondContact O-N 3.47Å; L130-K135 HydrophobicContact CB-CB 4.38Å; L130-K135 HydrophobicContact CD2-CB 3.99Å; L130-K135 HydrophobicContact CD2-CD 3.76Å; L130-K135 WeakPolarHBondContact O-CB 3.26Å; L130-K135 PolarHBondContact O-N 3.32Å; L130-E138 HydrophobicContact CD1-CB 4.24Å; L130-E138 HydrophobicContact CD2-CB 3.98Å; L130-A139 HydrophobicContact CB-CB 3.92Å; L130-A139 HydrophobicContact CD1-CB 4.49Å; L130-E142 HydrophobicContact CD1-CG 3.83Å
131V97.6Very high96.7Very high31 Ų3147.8 Ų47.819%0.18826%0.256CS..Hα-helixtrans-63.6-42.5177.1172.80000111V127 A128 L133 G134 A139 L163V127-V131 HydrophobicContact CG1-CG2 4.38Å; V127-V131 WeakPolarHBondContact O-CG2 3.45Å; V127-V131 PolarHBondContact O-N 2.91Å; A128-V131 PolarHBondContact O-N 3.34Å; V131-L133 VanDerWaalsContact C-N 3.3Å; V131-L133 PolarHBondContact O-N 3.38Å; V131-G134 PolarHBondContact O-N 3.39Å; V131-A139 HydrophobicContact CG2-CB 3.84Å; V131-L163 HydrophobicContact CG2-CD1 4.26Å; V131-L163 HydrophobicContact CG2-CD2 3.74Å
132A96.7Very high96.9Very high74 Ų7444.4 Ų44.461%0.61224%0.237SC*.Hα-helixtrans-63.2-34.9176.300000112.7L102 A128 S129 G134L102-A132 HydrophobicContact CD1-CB 3.7Å; A128-A132 WeakPolarHBondContact O-CB 3.4Å; A128-A132 PolarHBondContact O-N 3.29Å; S129-A132 PolarHBondContact O-N 3.08Å; A132-G134 PolarHBondContact O-N 3.35Å
133L97.7Very high97.1Very high68 Ų6844.6 Ų44.636%0.35624%0.238SC..THydrogen-bonded Turntrans-75.5-3.2172.7-72.5170.5000114L102 L103 I106 S129 L130 V131 K135L102-L133 HydrophobicContact CB-CD1 3.85Å; L102-L133 HydrophobicContact CB-CD2 4.02Å; L102-L133 HydrophobicContact CB-CG 3.85Å; L102-L133 HydrophobicContact CD1-CD2 3.97Å; L102-L133 HydrophobicContact CD1-CG 3.82Å; L103-L133 HydrophobicContact CD2-CD1 3.65Å; L103-L133 HydrophobicContact CG-CD1 4.08Å; I106-L133 HydrophobicContact CD1-CD1 3.65Å; S129-L133 WeakPolarHBondContact O-CG 3.45Å; S129-L133 PolarHBondContact O-N 3.11Å; L130-L133 PolarHBondContact O-N 3.32Å; V131-L133 VanDerWaalsContact C-N 3.3Å; V131-L133 PolarHBondContact O-N 3.38Å; L133-K135 HydrophobicContact CB-CD 4.12Å; L133-K135 HydrophobicContact CB-CG 4.05Å; L133-K135 HydrophobicContact CD1-CD 4.17Å; L133-K135 PolarHBondContact O-N 3.16Å
134G96.7Very high97.2Very high45 Ų4546.3 Ų46.346%0.46425%0.251SS..THydrogen-bonded Turntrans72.99.4-174.700000114.2L130 V131 A132 V136L130-G134 PolarHBondContact O-N 3.47Å; V131-G134 PolarHBondContact O-N 3.39Å; A132-G134 PolarHBondContact O-N 3.35Å; G134-V136 PolarHBondContact O-N 3.31Å
135K97.8Very high97.2Very high69 Ų6947 Ų4730%0.326%0.258SS..  trans-79.557.3178.2-67.2176.9149.6-132.50111.5L130 L133 Q137 E138 A139L130-K135 HydrophobicContact CB-CB 4.38Å; L130-K135 HydrophobicContact CD2-CB 3.99Å; L130-K135 HydrophobicContact CD2-CD 3.76Å; L130-K135 WeakPolarHBondContact O-CB 3.26Å; L130-K135 PolarHBondContact O-N 3.32Å; L133-K135 HydrophobicContact CB-CD 4.12Å; L133-K135 HydrophobicContact CB-CG 4.05Å; L133-K135 HydrophobicContact CD1-CD 4.17Å; L133-K135 PolarHBondContact O-N 3.16Å; K135-Q137 VanDerWaalsContact C-N 3.34Å; K135-Q137 PolarHBondContact O-N 2.97Å; K135-E138 HydrophobicContact CB-CB 4.22Å; K135-E138 HydrophobicContact CB-CG 4.44Å; K135-E138 VanDerWaalsContact CD-OE1 3.29Å; K135-E138 WeakPolarHBondContact CD-OE1 3.42Å; K135-E138 VanDerWaalsContact CE-OE1 3.26Å; K135-E138 WeakPolarHBondContact CE-OE1 2.99Å; K135-E138 VanDerWaalsContact NZ-CD 3.34Å; K135-E138 IonicContact NZ-OE1 3.63Å; K135-E138 PolarHBondContact NZ-OE1 3Å; K135-E138 IonicContact NZ-OE2 2.62Å; K135-E138 PolarHBondContact NZ-OE2 3.42Å; K135-E138 PolarHBondContact O-N 2.89Å; K135-A139 PolarHBondContact O-N 3.09Å
136V97.9Very high97.1Very high17 Ų1742.6 Ų42.610%0.10324%0.241CC..Hα-helixtrans-60.2-40.2-171178.10000112.5G134 A139 I140 L163 V167G134-V136 PolarHBondContact O-N 3.31Å; V136-A139 PolarHBondContact O-N 3.21Å; V136-I140 HydrophobicContact CG1-CD1 4.03Å; V136-I140 HydrophobicContact CG1-CG1 4.49Å; V136-I140 WeakPolarHBondContact O-CG1 3.46Å; V136-I140 PolarHBondContact O-N 3.3Å; V136-L163 HydrophobicContact CG1-CB 4.4Å; V136-L163 HydrophobicContact CG1-CD2 4.25Å; V136-V167 HydrophobicContact CB-CG1 4.48Å; V136-V167 HydrophobicContact CG1-CG1 3.59Å
137Q97.8Very high97Very high119 Ų11942.4 Ų42.456%0.55624%0.241SC*.Hα-helixtrans-67.8-37.9179.6-65.9-62.5-25.800112.6K135 I140 K141K135-Q137 VanDerWaalsContact C-N 3.34Å; K135-Q137 PolarHBondContact O-N 2.97Å; Q137-I140 PolarHBondContact O-N 3.5Å; Q137-K141 PolarHBondContact O-N 2.6Å; Q137-K141 VanDerWaalsContact O-N 3.07Å
138E97.8Very high96.9Very high90 Ų9046.6 Ų46.642%0.42127%0.27SS..Hα-helixtrans-64.9-44.1173.4-66.2174.6-12100110.1L130 K135 I140 K141 E142L130-E138 HydrophobicContact CD1-CB 4.24Å; L130-E138 HydrophobicContact CD2-CB 3.98Å; K135-E138 HydrophobicContact CB-CB 4.22Å; K135-E138 HydrophobicContact CB-CG 4.44Å; K135-E138 VanDerWaalsContact CD-OE1 3.29Å; K135-E138 WeakPolarHBondContact CD-OE1 3.42Å; K135-E138 VanDerWaalsContact CE-OE1 3.26Å; K135-E138 WeakPolarHBondContact CE-OE1 2.99Å; K135-E138 VanDerWaalsContact NZ-CD 3.34Å; K135-E138 IonicContact NZ-OE1 3.63Å; K135-E138 PolarHBondContact NZ-OE1 3Å; K135-E138 IonicContact NZ-OE2 2.62Å; K135-E138 PolarHBondContact NZ-OE2 3.42Å; K135-E138 PolarHBondContact O-N 2.89Å; E138-I140 PolarHBondContact O-N 3.37Å; E138-K141 WeakPolarHBondContact O-CB 3.25Å; E138-K141 PolarHBondContact O-N 2.73Å; E138-E142 WeakPolarHBondContact O-CG 3.21Å; E138-E142 PolarHBondContact O-N 3.4Å
139A98.3Very high96.6Very high0 Ų050.3 Ų50.30%028%0.278CS..Hα-helixtrans-60-42.2176.400000112.9V127 L130 V131 K135 V136 E142 L143 L163V127-A139 HydrophobicContact CG1-CB 4.41Å; L130-A139 HydrophobicContact CB-CB 3.92Å; L130-A139 HydrophobicContact CD1-CB 4.49Å; V131-A139 HydrophobicContact CG2-CB 3.84Å; K135-A139 PolarHBondContact O-N 3.09Å; V136-A139 PolarHBondContact O-N 3.21Å; A139-E142 PolarHBondContact O-N 3.06Å; A139-L143 PolarHBondContact O-N 3.18Å; A139-L163 HydrophobicContact CB-CD1 3.76Å
140I98.5Very high96.3Very high8 Ų853.2 Ų53.24%0.04129%0.29CS..Hα-helixtrans-59.5-47.6174.4-72.8169.1000110.6V136 Q137 E138 E142 L143 C144 L160 L163 Y164 V167V136-I140 HydrophobicContact CG1-CD1 4.03Å; V136-I140 HydrophobicContact CG1-CG1 4.49Å; V136-I140 WeakPolarHBondContact O-CG1 3.46Å; V136-I140 PolarHBondContact O-N 3.3Å; Q137-I140 PolarHBondContact O-N 3.5Å; E138-I140 PolarHBondContact O-N 3.37Å; I140-E142 PolarHBondContact O-N 2.95Å; I140-L143 PolarHBondContact O-N 2.96Å; I140-C144 PolarHBondContact O-N 3.32Å; I140-C144 PolarHBondContact O-SG 3.38Å; I140-L160 HydrophobicContact CB-CD1 4.45Å; I140-L160 HydrophobicContact CG1-CD1 4.39Å; I140-L160 HydrophobicContact CG2-CD1 4.09Å; I140-L163 HydrophobicContact CD1-CB 4.13Å; I140-L163 HydrophobicContact CG1-CB 3.68Å; I140-L163 HydrophobicContact CG1-CD1 4.03Å; I140-Y164 HydrophobicContact CD1-CD1 4.14Å; I140-Y164 HydrophobicContact CD1-CE1 4.22Å; I140-Y164 HydrophobicContact CG2-CE1 3.67Å; I140-V167 HydrophobicContact CD1-CG1 4.38Å; I140-V167 HydrophobicContact CD1-CG2 4.04Å
141K97.4Very high96Very high135 Ų13559 Ų5959%0.58732%0.319SS*.Hα-helixtrans-58.6-47.8179-175.6-174.3179.2-170.50111.4Q137 E138 L143 C144 D145Q137-K141 PolarHBondContact O-N 2.6Å; Q137-K141 VanDerWaalsContact O-N 3.07Å; E138-K141 WeakPolarHBondContact O-CB 3.25Å; E138-K141 PolarHBondContact O-N 2.73Å; K141-L143 VanDerWaalsContact C-N 3.34Å; K141-L143 PolarHBondContact O-N 3Å; K141-C144 PolarHBondContact O-N 3.45Å; K141-D145 PolarHBondContact O-N 3.3Å
142E96Very high95.8Very high39 Ų3963.8 Ų63.818%0.18234%0.344CS..Hα-helixtrans-62.2-40179.4-67.4-64.6154.100112.6K126 V127 L130 E138 A139 I140 D145 H146K126-E142 HydrophobicContact CD-CG 4.46Å; K126-E142 VanDerWaalsContact CE-CD 3.4Å; K126-E142 WeakPolarHBondContact CE-OE2 3.47Å; K126-E142 IonicContact NZ-OE1 2.71Å; K126-E142 PolarHBondContact NZ-OE1 3.1Å; K126-E142 IonicContact NZ-OE2 2.7Å; K126-E142 PolarHBondContact NZ-OE2 3.15Å; V127-E142 HydrophobicContact CG2-CB 4.06Å; L130-E142 HydrophobicContact CD1-CG 3.83Å; E138-E142 WeakPolarHBondContact O-CG 3.21Å; E138-E142 PolarHBondContact O-N 3.4Å; A139-E142 PolarHBondContact O-N 3.06Å; I140-E142 PolarHBondContact O-N 2.95Å; E142-D145 PolarHBondContact O-N 3.16Å; E142-H146 VanDerWaalsContact O-CB 3.31Å; E142-H146 WeakPolarHBondContact O-CB 3.31Å; E142-H146 PolarHBondContact O-N 3.38Å
143L97.3Very high95.6Very high7 Ų761.3 Ų61.34%0.03732%0.32CS..Hα-helixtrans-68.1-39.3175.8-79167.6000112.6V127 A139 I140 K141 H146 L147 A156 E159 L160 L163V127-L143 HydrophobicContact CG1-CD1 3.83Å; V127-L143 HydrophobicContact CG1-CD2 4.21Å; V127-L143 HydrophobicContact CG1-CG 3.93Å; V127-L143 HydrophobicContact CG2-CD2 4.07Å; V127-L143 HydrophobicContact CG2-CG 3.86Å; A139-L143 PolarHBondContact O-N 3.18Å; I140-L143 PolarHBondContact O-N 2.96Å; K141-L143 VanDerWaalsContact C-N 3.34Å; K141-L143 PolarHBondContact O-N 3Å; L143-H146 PolarHBondContact O-N 2.9Å; L143-L147 VanDerWaalsContact O-CB 3.31Å; L143-L147 WeakPolarHBondContact O-CB 3.45Å; L143-L147 WeakPolarHBondContact O-CG 3.35Å; L143-L147 PolarHBondContact O-N 3.47Å; L143-A156 HydrophobicContact CD2-CB 3.91Å; L143-E159 HydrophobicContact CD1-CB 4.11Å; L143-E159 HydrophobicContact CD1-CG 3.77Å; L143-L160 HydrophobicContact CB-CB 4.33Å; L143-L160 HydrophobicContact CB-CD1 4.02Å; L143-L160 HydrophobicContact CD1-CB 4.11Å; L143-L160 HydrophobicContact CD1-CD1 4.36Å; L143-L163 HydrophobicContact CD1-CD1 3.57Å
144C97Very high95.4Very high47 Ų4761.4 Ų61.432%0.31832%0.319SS..Hα-helixtrans-61.2-45.9173.3-75.70000111.4I140 K141 H146 L147 S148 Y164I140-C144 PolarHBondContact O-N 3.32Å; I140-C144 PolarHBondContact O-SG 3.38Å; K141-C144 PolarHBondContact O-N 3.45Å; C144-H146 VanDerWaalsContact C-N 3.33Å; C144-H146 PolarHBondContact O-N 3Å; C144-L147 PolarHBondContact O-N 3.24Å; C144-S148 PolarHBondContact O-N 3.36Å; C144-Y164 PolarHBondContact SG-OH 3.31Å; C144-Y164 VanDerWaalsContact SG-OH 3.38Å
145D93.7Very high95.3Very high73 Ų7365.4 Ų65.439%0.3933%0.325SS..Hα-helixtrans-64-38.7177.5-71.9-11.4000111.4K141 E142 S148K141-D145 PolarHBondContact O-N 3.3Å; E142-D145 PolarHBondContact O-N 3.16Å; D145-S148 PolarHBondContact O-OG 2.94Å
146H93.6Very high95.2Very high3 Ų362.3 Ų62.31%0.01431%0.312CS..Hα-helixtrans-64.6-51.3175176.872.3000112.1Y123 E142 L143 C144 S148 K149 F150 D153Y123-H146 HydrophobicContact CD1-CB 4.34Å; Y123-H146 AromaticContact CD2-ND1 3.7Å; Y123-H146 AromaticContact CG-ND1 3.55Å; E142-H146 VanDerWaalsContact O-CB 3.31Å; E142-H146 WeakPolarHBondContact O-CB 3.31Å; E142-H146 PolarHBondContact O-N 3.38Å; L143-H146 PolarHBondContact O-N 2.9Å; C144-H146 VanDerWaalsContact C-N 3.33Å; C144-H146 PolarHBondContact O-N 3Å; H146-S148 PolarHBondContact O-N 2.69Å; H146-K149 PolarHBondContact O-N 3.07Å; H146-F150 AromaticContact CE1-CD2 3.36Å; H146-F150 WeakPolarHBondContact CE1-CD2 3.28Å; H146-F150 AromaticContact CE1-CG 3.86Å; H146-F150 AromaticContact ND1-CD2 3.39Å; H146-F150 WeakPolarHBondContact ND1-CD2 3.44Å; H146-F150 PolarHBondContact O-N 3.11Å; H146-D153 IonicContact CD2-OD2 2.67Å; H146-D153 IonicContact CE1-OD2 2.75Å; H146-D153 IonicContact NE2-OD2 2.87Å; H146-D153 PolarHBondContact NE2-OD2 3.4Å
147L95.2Very high95.2Very high10 Ų1062.7 Ų62.75%0.05231%0.312CS..Hα-helixtrans-66.6-24.5-178.4-75.2168.1000112.9L143 C144 K149 M151 D153 A156 W157 L160L143-L147 VanDerWaalsContact O-CB 3.31Å; L143-L147 WeakPolarHBondContact O-CB 3.45Å; L143-L147 WeakPolarHBondContact O-CG 3.35Å; L143-L147 PolarHBondContact O-N 3.47Å; C144-L147 PolarHBondContact O-N 3.24Å; L147-K149 PolarHBondContact O-N 3.11Å; L147-M151 WeakPolarHBondContact O-CA 3.4Å; L147-M151 PolarHBondContact O-N 3.42Å; L147-D153 HydrophobicContact CD2-CB 4.49Å; L147-A156 HydrophobicContact CD1-CB 4.37Å; L147-A156 HydrophobicContact CD2-CB 3.7Å; L147-A156 HydrophobicContact CG-CB 4.01Å; L147-W157 HydrophobicContact CB-CZ2 4.4Å; L147-W157 HydrophobicContact CD1-CD2 3.81Å; L147-W157 HydrophobicContact CD1-CE3 3.75Å; L147-W157 HydrophobicContact CD1-CG 4.36Å; L147-W157 HydrophobicContact CD1-CH2 4.29Å; L147-W157 HydrophobicContact CD1-CZ2 4.35Å; L147-W157 HydrophobicContact CD1-CZ3 4Å; L147-W157 HydrophobicContact CD2-CD2 3.94Å; L147-W157 HydrophobicContact CD2-CG 4.02Å; L147-W157 HydrophobicContact CD2-CZ2 4.19Å; L147-W157 HydrophobicContact CG-CD2 4.48Å; L147-L160 HydrophobicContact CD1-CB 4.24Å; L147-L160 HydrophobicContact CD1-CD2 3.53Å
148S94Very high95.2Very high94 Ų9459.1 Ų59.166%0.65730%0.298SS*.THydrogen-bonded Turntrans-62.4-23.5170.679.60000113.3C144 D145 H146C144-S148 PolarHBondContact O-N 3.36Å; D145-S148 PolarHBondContact O-OG 2.94Å; H146-S148 PolarHBondContact O-N 2.69Å
149K91.2Very high95.2Very high124 Ų12457.7 Ų57.754%0.53929%0.291SS..THydrogen-bonded Turntrans-104.8-35.9179.8-58.9166.4-169.7167.40112.1H146 L147H146-K149 PolarHBondContact O-N 3.07Å; L147-K149 PolarHBondContact O-N 3.11Å
150F91.7Very high95.2Very high62 Ų6257.9 Ų57.927%0.27229%0.293SS..  trans-122.861-174.6-56.6-76.2000111.3P117 Y123 H146 N152 D153P117-F150 WeakPolarHBondContact O-CE2 3.41Å; P117-F150 WeakPolarHBondContact O-CZ 3.38Å; Y123-F150 HydrophobicContact CE2-CE2 4.4Å; H146-F150 AromaticContact CE1-CD2 3.36Å; H146-F150 WeakPolarHBondContact CE1-CD2 3.28Å; H146-F150 AromaticContact CE1-CG 3.86Å; H146-F150 AromaticContact ND1-CD2 3.39Å; H146-F150 WeakPolarHBondContact ND1-CD2 3.44Å; H146-F150 PolarHBondContact O-N 3.11Å; F150-N152 PolarHBondContact O-N 3.2Å; F150-D153 HydrophobicContact CB-CB 4.34Å; F150-D153 WeakPolarHBondContact O-CB 3.49Å; F150-D153 PolarHBondContact O-N 3.08Å
151M93.1Very high95.2Very high123 Ų12357.6 Ų57.661%0.60629%0.291SS*.THydrogen-bonded Turntrans-58.7-22.9-176.6-175.416852.400114.2L147 D153 W157L147-M151 WeakPolarHBondContact O-CA 3.4Å; L147-M151 PolarHBondContact O-N 3.42Å; M151-D153 VanDerWaalsContact C-N 3.33Å; M151-W157 HydrophobicContact CG-CZ2 4.37Å; M151-W157 PolarHBondContact O-NE1 3.44Å
152N92.6Very high95.2Very high133 Ų13356.3 Ų56.371%0.71129%0.287SS*.THydrogen-bonded Turntrans-85.73.3176.9-66.6-23.4000113.9F150 H154F150-N152 PolarHBondContact O-N 3.2Å; N152-H154 PolarHBondContact O-CE1 3.49Å; N152-H154 PolarHBondContact O-N 3.23Å; N152-H154 PolarHBondContact O-ND1 2.82Å
153D93.4Very high95.3Very high21 Ų2154.7 Ų54.711%0.11228%0.28CS..  trans-78.585.5176.7-167.6-10.8000110.9K124 H146 L147 F150 M151 E155 A156 W157K124-D153 WeakPolarHBondContact CE-OD1 3.35Å; K124-D153 WeakPolarHBondContact CE-OD2 3.5Å; K124-D153 IonicContact NZ-OD1 3.05Å; K124-D153 PolarHBondContact NZ-OD1 3.41Å; K124-D153 IonicContact NZ-OD2 3.78Å; K124-D153 PolarHBondContact NZ-OD2 2.89Å; H146-D153 IonicContact CD2-OD2 2.67Å; H146-D153 IonicContact CE1-OD2 2.75Å; H146-D153 IonicContact NE2-OD2 2.87Å; H146-D153 PolarHBondContact NE2-OD2 3.4Å; L147-D153 HydrophobicContact CD2-CB 4.49Å; F150-D153 HydrophobicContact CB-CB 4.34Å; F150-D153 WeakPolarHBondContact O-CB 3.49Å; F150-D153 PolarHBondContact O-N 3.08Å; M151-D153 VanDerWaalsContact C-N 3.33Å; D153-E155 PolarHBondContact O-N 3.04Å; D153-E155 PolarHBondContact OD1-N 2.92Å; D153-A156 HydrophobicContact CB-CB 3.98Å; D153-A156 WeakPolarHBondContact O-CB 3.34Å; D153-A156 PolarHBondContact O-N 3.13Å; D153-A156 VanDerWaalsContact O-N 3.08Å; D153-A156 PolarHBondContact OD1-N 3.24Å; D153-W157 PolarHBondContact O-N 3.28Å
154H93.2Very high95.4Very high71 Ų7155 Ų5533%0.32928%0.281SS..Hα-helixtrans-56.8-33.6-178.9-55.692.6000113.8N152 A156 W157 V158 S183N152-H154 PolarHBondContact O-CE1 3.49Å; N152-H154 PolarHBondContact O-N 3.23Å; N152-H154 PolarHBondContact O-ND1 2.82Å; H154-A156 VanDerWaalsContact C-N 3.35Å; H154-W157 PolarHBondContact O-N 3.36Å; H154-V158 WeakPolarHBondContact O-CG2 3.24Å; H154-V158 PolarHBondContact O-N 3.12Å; H154-V158 VanDerWaalsContact O-N 3.16Å; H154-S183 WeakPolarHBondContact CD2-CB 3.31Å; H154-S183 PolarHBondContact CD2-OG 3.37Å; H154-S183 VanDerWaalsContact CD2-OG 3.3Å; H154-S183 WeakPolarHBondContact NE2-CB 3.32Å
155E93.6Very high95.5Very high129 Ų12954.9 Ų54.960%0.60328%0.276SS*.Hα-helixtrans-69.6-37.3178.7-65.5178.9164.400110.8K124 D153 V158 E159K124-E155 IonicContact NZ-OE2 3.36Å; K124-E155 PolarHBondContact NZ-OE2 3.32Å; D153-E155 PolarHBondContact O-N 3.04Å; D153-E155 PolarHBondContact OD1-N 2.92Å; E155-V158 PolarHBondContact O-N 2.92Å; E155-E159 PolarHBondContact O-N 2.97Å
156A96.3Very high95.6Very high3 Ų358.2 Ų58.23%0.02528%0.283CS..Hα-helixtrans-65.7-36.717500000112.1L143 L147 D153 H154 E159 L160L143-A156 HydrophobicContact CD2-CB 3.91Å; L147-A156 HydrophobicContact CD1-CB 4.37Å; L147-A156 HydrophobicContact CD2-CB 3.7Å; L147-A156 HydrophobicContact CG-CB 4.01Å; D153-A156 HydrophobicContact CB-CB 3.98Å; D153-A156 WeakPolarHBondContact O-CB 3.34Å; D153-A156 PolarHBondContact O-N 3.13Å; D153-A156 VanDerWaalsContact O-N 3.08Å; D153-A156 PolarHBondContact OD1-N 3.24Å; H154-A156 VanDerWaalsContact C-N 3.35Å; A156-E159 PolarHBondContact O-N 3.06Å; A156-L160 VanDerWaalsContact O-CB 3.28Å; A156-L160 WeakPolarHBondContact O-CB 3.42Å; A156-L160 PolarHBondContact O-N 3.33Å
157W97.9Very high95.8Very high25 Ų2560.2 Ų60.210%0.09530%0.296CS..Hα-helixtrans-62.9-41.7172.5-75.3114.2000112.9L147 M151 D153 H154 L160 C161 F175 C176 E179 M180L147-W157 HydrophobicContact CB-CZ2 4.4Å; L147-W157 HydrophobicContact CD1-CD2 3.81Å; L147-W157 HydrophobicContact CD1-CE3 3.75Å; L147-W157 HydrophobicContact CD1-CG 4.36Å; L147-W157 HydrophobicContact CD1-CH2 4.29Å; L147-W157 HydrophobicContact CD1-CZ2 4.35Å; L147-W157 HydrophobicContact CD1-CZ3 4Å; L147-W157 HydrophobicContact CD2-CD2 3.94Å; L147-W157 HydrophobicContact CD2-CG 4.02Å; L147-W157 HydrophobicContact CD2-CZ2 4.19Å; L147-W157 HydrophobicContact CG-CD2 4.48Å; M151-W157 HydrophobicContact CG-CZ2 4.37Å; M151-W157 PolarHBondContact O-NE1 3.44Å; D153-W157 PolarHBondContact O-N 3.28Å; H154-W157 PolarHBondContact O-N 3.36Å; W157-L160 HydrophobicContact CE3-CD2 4.45Å; W157-L160 HydrophobicContact CZ3-CD2 4.34Å; W157-L160 PolarHBondContact O-N 3.35Å; W157-C161 WeakPolarHBondContact O-CB 3.35Å; W157-C161 PolarHBondContact O-N 2.9Å; W157-F175 AromaticContact CH2-CE1 3.89Å; W157-F175 HydrophobicContact CH2-CE1 3.89Å; W157-F175 HydrophobicContact CZ3-CD1 4.26Å; W157-F175 AromaticContact CZ3-CE1 3.94Å; W157-F175 HydrophobicContact CZ3-CE1 3.94Å; W157-C176 HydrophobicContact CE3-CB 4.12Å; W157-E179 HydrophobicContact CD2-CB 4.05Å; W157-E179 HydrophobicContact CD2-CG 4.43Å; W157-E179 HydrophobicContact CE3-CB 4.25Å; W157-E179 HydrophobicContact CE3-CG 4.34Å; W157-E179 HydrophobicContact CG-CB 4.5Å; W157-E179 HydrophobicContact CH2-CG 3.95Å; W157-E179 HydrophobicContact CZ2-CB 4.39Å; W157-E179 HydrophobicContact CZ2-CG 4.02Å; W157-E179 HydrophobicContact CZ3-CG 4.11Å; W157-M180 HydrophobicContact CB-CG 3.93Å; W157-M180 HydrophobicContact CB-SD 4.49Å
158V97.3Very high95.9Very high45 Ų4567.1 Ų67.127%0.27333%0.326SS..Hα-helixtrans-61.6-48.9176.4172.70000110.5H154 E155 C161 Q162 M180H154-V158 WeakPolarHBondContact O-CG2 3.24Å; H154-V158 PolarHBondContact O-N 3.12Å; H154-V158 VanDerWaalsContact O-N 3.16Å; E155-V158 PolarHBondContact O-N 2.92Å; V158-C161 WeakPolarHBondContact O-CB 3.34Å; V158-C161 PolarHBondContact O-N 3Å; V158-Q162 WeakPolarHBondContact O-CG 3.17Å; V158-Q162 PolarHBondContact O-N 3.07Å; V158-Q162 VanDerWaalsContact O-N 3.07Å; V158-M180 HydrophobicContact CB-CE 4.42Å; V158-M180 HydrophobicContact CG2-CE 3.59Å; V158-M180 HydrophobicContact CG2-SD 4.05Å
159E97.7Very high96.2Very high59 Ų5964.2 Ų64.228%0.27630%0.303SS..Hα-helixtrans-61.9-46.5178.9-171.664.6-158.400110.9V127 L143 E155 A156 C161 Q162 L163V127-E159 HydrophobicContact CG1-CG 4.15Å; L143-E159 HydrophobicContact CD1-CB 4.11Å; L143-E159 HydrophobicContact CD1-CG 3.77Å; E155-E159 PolarHBondContact O-N 2.97Å; A156-E159 PolarHBondContact O-N 3.06Å; E159-C161 VanDerWaalsContact C-N 3.32Å; E159-C161 PolarHBondContact O-N 3.37Å; E159-Q162 WeakPolarHBondContact O-CB 3.34Å; E159-Q162 PolarHBondContact O-N 3.39Å; E159-Q162 VanDerWaalsContact O-N 3.11Å; E159-L163 WeakPolarHBondContact O-CG 3.38Å; E159-L163 PolarHBondContact O-N 2.92Å
160L98.5Very high96.5Very high5 Ų560.8 Ų60.83%0.02629%0.288CS..Hα-helixtrans-60.7-41.9179.1-177.459000111.9I140 L143 L147 A156 W157 Q162 L163 Y164I140-L160 HydrophobicContact CB-CD1 4.45Å; I140-L160 HydrophobicContact CG1-CD1 4.39Å; I140-L160 HydrophobicContact CG2-CD1 4.09Å; L143-L160 HydrophobicContact CB-CB 4.33Å; L143-L160 HydrophobicContact CB-CD1 4.02Å; L143-L160 HydrophobicContact CD1-CB 4.11Å; L143-L160 HydrophobicContact CD1-CD1 4.36Å; L147-L160 HydrophobicContact CD1-CB 4.24Å; L147-L160 HydrophobicContact CD1-CD2 3.53Å; A156-L160 VanDerWaalsContact O-CB 3.28Å; A156-L160 WeakPolarHBondContact O-CB 3.42Å; A156-L160 PolarHBondContact O-N 3.33Å; W157-L160 HydrophobicContact CE3-CD2 4.45Å; W157-L160 HydrophobicContact CZ3-CD2 4.34Å; W157-L160 PolarHBondContact O-N 3.35Å; L160-Q162 PolarHBondContact O-N 2.98Å; L160-L163 PolarHBondContact O-N 3.44Å; L160-Y164 HydrophobicContact CD1-CD2 3.95Å; L160-Y164 HydrophobicContact CD1-CE2 3.46Å; L160-Y164 VanDerWaalsContact CD1-CE2 3.46Å; L160-Y164 HydrophobicContact CD2-CE2 3.84Å; L160-Y164 HydrophobicContact CG-CD2 3.82Å; L160-Y164 HydrophobicContact CG-CE2 3.45Å; L160-Y164 VanDerWaalsContact CG-CE2 3.45Å; L160-Y164 WeakPolarHBondContact O-CD2 3.46Å; L160-Y164 PolarHBondContact O-N 3.39Å
161C98.6Very high96.8Very high2 Ų261.9 Ų61.91%0.01430%0.301CS..Hα-helixtrans-57.1-48.8173.4-177.60000111.3W157 V158 E159 L163 Y164 L165 C176 L177 M180W157-C161 WeakPolarHBondContact O-CB 3.35Å; W157-C161 PolarHBondContact O-N 2.9Å; V158-C161 WeakPolarHBondContact O-CB 3.34Å; V158-C161 PolarHBondContact O-N 3Å; E159-C161 VanDerWaalsContact C-N 3.32Å; E159-C161 PolarHBondContact O-N 3.37Å; C161-L163 VanDerWaalsContact C-N 3.32Å; C161-L163 PolarHBondContact O-N 3.26Å; C161-Y164 PolarHBondContact O-N 3.01Å; C161-L165 WeakPolarHBondContact O-CG 3.14Å; C161-L165 PolarHBondContact O-N 2.93Å; C161-C176 HydrophobicContact CB-CB 3.66Å; C161-L177 VanDerWaalsContact SG-CG 3.59Å; C161-M180 HydrophobicContact CB-SD 4.14Å
162Q98.1Very high97.1Very high108 Ų10861.4 Ų61.451%0.50529%0.293SS..Hα-helixtrans-61.5-39.9179.5-69.9-179.915.600112.3V158 E159 L160 L165 R166V158-Q162 WeakPolarHBondContact O-CG 3.17Å; V158-Q162 PolarHBondContact O-N 3.07Å; V158-Q162 VanDerWaalsContact O-N 3.07Å; E159-Q162 WeakPolarHBondContact O-CB 3.34Å; E159-Q162 PolarHBondContact O-N 3.39Å; E159-Q162 VanDerWaalsContact O-N 3.11Å; L160-Q162 PolarHBondContact O-N 2.98Å; Q162-L165 PolarHBondContact O-N 3.11Å; Q162-R166 WeakPolarHBondContact O-CB 3.18Å; Q162-R166 PolarHBondContact O-N 3.45Å
163L98.5Very high97.4Very high4 Ų455 Ų552%0.02126%0.259CS..Hα-helixtrans-67.1-40.7176.6-62.8-178.3000112.1V131 V136 A139 I140 L143 E159 L160 C161 L165 R166 V167V131-L163 HydrophobicContact CG2-CD1 4.26Å; V131-L163 HydrophobicContact CG2-CD2 3.74Å; V136-L163 HydrophobicContact CG1-CB 4.4Å; V136-L163 HydrophobicContact CG1-CD2 4.25Å; A139-L163 HydrophobicContact CB-CD1 3.76Å; I140-L163 HydrophobicContact CD1-CB 4.13Å; I140-L163 HydrophobicContact CG1-CB 3.68Å; I140-L163 HydrophobicContact CG1-CD1 4.03Å; L143-L163 HydrophobicContact CD1-CD1 3.57Å; E159-L163 WeakPolarHBondContact O-CG 3.38Å; E159-L163 PolarHBondContact O-N 2.92Å; L160-L163 PolarHBondContact O-N 3.44Å; C161-L163 VanDerWaalsContact C-N 3.32Å; C161-L163 PolarHBondContact O-N 3.26Å; L163-L165 VanDerWaalsContact C-N 3.35Å; L163-L165 PolarHBondContact O-N 2.9Å; L163-R166 WeakPolarHBondContact O-CB 2.83Å; L163-R166 PolarHBondContact O-N 3.09Å; L163-V167 PolarHBondContact O-N 3.09Å
164Y98.8Very high97.6Very high15 Ų1554.1 Ų54.16%0.05925%0.254CS..Hα-helixtrans-62.6-41174.1-77.8-47.1000112.4I140 C144 L160 C161 R166 V167 F168 D169 R172I140-Y164 HydrophobicContact CD1-CD1 4.14Å; I140-Y164 HydrophobicContact CD1-CE1 4.22Å; I140-Y164 HydrophobicContact CG2-CE1 3.67Å; C144-Y164 PolarHBondContact SG-OH 3.31Å; C144-Y164 VanDerWaalsContact SG-OH 3.38Å; L160-Y164 HydrophobicContact CD1-CD2 3.95Å; L160-Y164 HydrophobicContact CD1-CE2 3.46Å; L160-Y164 VanDerWaalsContact CD1-CE2 3.46Å; L160-Y164 HydrophobicContact CD2-CE2 3.84Å; L160-Y164 HydrophobicContact CG-CD2 3.82Å; L160-Y164 HydrophobicContact CG-CE2 3.45Å; L160-Y164 VanDerWaalsContact CG-CE2 3.45Å; L160-Y164 WeakPolarHBondContact O-CD2 3.46Å; L160-Y164 PolarHBondContact O-N 3.39Å; C161-Y164 PolarHBondContact O-N 3.01Å; Y164-R166 VanDerWaalsContact C-N 3.31Å; Y164-R166 PolarHBondContact O-N 2.62Å; Y164-V167 HydrophobicContact CD1-CG2 4.47Å; Y164-V167 CarbonylContact O-C 3.16Å; Y164-V167 WeakPolarHBondContact O-CG2 3.41Å; Y164-V167 PolarHBondContact O-N 3.32Å; Y164-F168 PolarHBondContact O-N 3.33Å; Y164-F168 VanDerWaalsContact O-N 3.15Å; Y164-D169 HydrophobicContact CD1-CB 3.94Å; Y164-D169 HydrophobicContact CG-CB 4.49Å; Y164-D169 PolarHBondContact O-N 2.95Å; Y164-R172 HydrophobicContact CD1-CB 3.83Å; Y164-R172 HydrophobicContact CD2-CB 3.64Å; Y164-R172 HydrophobicContact CE1-CB 3.81Å; Y164-R172 HydrophobicContact CE1-CG 4.35Å; Y164-R172 HydrophobicContact CE2-CB 3.6Å; Y164-R172 HydrophobicContact CG-CB 3.77Å
165L98.2Very high97.9Very high43 Ų4355.6 Ų55.623%0.22526%0.26CS..Hα-helixtrans-61.1-40173.3-67.7174.1000112C161 Q162 L163 V167 F168 F170 A173 L193 V197C161-L165 WeakPolarHBondContact O-CG 3.14Å; C161-L165 PolarHBondContact O-N 2.93Å; Q162-L165 PolarHBondContact O-N 3.11Å; L163-L165 VanDerWaalsContact C-N 3.35Å; L163-L165 PolarHBondContact O-N 2.9Å; L165-V167 PolarHBondContact O-N 3.06Å; L165-F168 PolarHBondContact O-N 3.37Å; L165-F168 VanDerWaalsContact O-N 3.11Å; L165-F170 HydrophobicContact CD2-CD1 4.18Å; L165-F170 HydrophobicContact CD2-CE1 4.46Å; L165-A173 HydrophobicContact CD2-CB 3.63Å; L165-A173 HydrophobicContact CG-CB 3.87Å; L165-L193 HydrophobicContact CD1-CD1 4.26Å; L165-L193 HydrophobicContact CD1-CD2 4.38Å; L165-V197 HydrophobicContact CD2-CG2 3.63Å
166R97Very high98.1Very high143 Ų14349.5 Ų49.554%0.5423%0.231SC..Hα-helixtrans-63.6-29.2178.5-174173.4179.3176.8-1.3113.2Q162 L163 Y164Q162-R166 WeakPolarHBondContact O-CB 3.18Å; Q162-R166 PolarHBondContact O-N 3.45Å; L163-R166 WeakPolarHBondContact O-CB 2.83Å; L163-R166 PolarHBondContact O-N 3.09Å; Y164-R166 VanDerWaalsContact C-N 3.31Å; Y164-R166 PolarHBondContact O-N 2.62Å
167V97.7Very high98.2Very high45 Ų4549.4 Ų49.427%0.27323%0.23SC..THydrogen-bonded Turntrans-100.113.1176.3-56.50000113.1V136 I140 L163 Y164 L165 D169V136-V167 HydrophobicContact CB-CG1 4.48Å; V136-V167 HydrophobicContact CG1-CG1 3.59Å; I140-V167 HydrophobicContact CD1-CG1 4.38Å; I140-V167 HydrophobicContact CD1-CG2 4.04Å; L163-V167 PolarHBondContact O-N 3.09Å; Y164-V167 HydrophobicContact CD1-CG2 4.47Å; Y164-V167 CarbonylContact O-C 3.16Å; Y164-V167 WeakPolarHBondContact O-CG2 3.41Å; Y164-V167 PolarHBondContact O-N 3.32Å; L165-V167 PolarHBondContact O-N 3.06Å; V167-D169 HydrophobicContact CG2-CB 4.11Å; V167-D169 PolarHBondContact O-N 3.35Å
168F97.8Very high98.2Very high155 Ų15551.2 Ų51.268%0.6824%0.24SC*.THydrogen-bonded Turntrans58.624.2-179.8-50.9-76.8000114.7Y164 L165 F170Y164-F168 PolarHBondContact O-N 3.33Å; Y164-F168 VanDerWaalsContact O-N 3.15Å; L165-F168 PolarHBondContact O-N 3.37Å; L165-F168 VanDerWaalsContact O-N 3.11Å; F168-F170 VanDerWaalsContact C-N 3.33Å; F168-F170 HydrophobicContact CB-CE2 4.11Å; F168-F170 HydrophobicContact CB-CZ 4.09Å; F168-F170 AromaticContact CD1-CZ 3.92Å; F168-F170 HydrophobicContact CD1-CZ 3.92Å; F168-F170 WeakPolarHBondContact O-CD2 3.34Å; F168-F170 PolarHBondContact O-N 3.33Å; F168-F170 VanDerWaalsContact O-N 3.1Å
169D98.4Very high98.2Very high34 Ų3451.5 Ų51.518%0.18224%0.238CC..  trans-86.277.6172.9-160.3-59000110.9Y164 V167 P171 R172 A173Y164-D169 HydrophobicContact CD1-CB 3.94Å; Y164-D169 HydrophobicContact CG-CB 4.49Å; Y164-D169 PolarHBondContact O-N 2.95Å; V167-D169 HydrophobicContact CG2-CB 4.11Å; V167-D169 PolarHBondContact O-N 3.35Å; D169-P171 WeakPolarHBondContact OD1-CD 3.44Å; D169-R172 VanDerWaalsContact OD1-CB 3.24Å; D169-R172 WeakPolarHBondContact OD1-CB 3.44Å; D169-R172 WeakPolarHBondContact OD1-CG 3.49Å; D169-R172 PolarHBondContact OD1-N 2.93Å; D169-R172 IonicContact OD1-NE 3.06Å; D169-R172 PolarHBondContact OD1-NE 3.45Å; D169-R172 IonicContact OD2-CZ 3.6Å; D169-R172 IonicContact OD2-NE 3.34Å; D169-R172 PolarHBondContact OD2-NE 3.43Å; D169-R172 IonicContact OD2-NH2 3.89Å; D169-R172 PolarHBondContact OD2-NH2 3.47Å; D169-A173 VanDerWaalsContact O-CB 3.31Å; D169-A173 WeakPolarHBondContact O-CB 3.23Å; D169-A173 PolarHBondContact O-N 3.41Å
170F98.5Very high98.3Very high52 Ų5249 Ų4923%0.22823%0.227CC..Hα-helixtrans-63.4-38.2-179.5-53.7-62.3000114.1L165 F168 A173 A174 V197 T200 Q201L165-F170 HydrophobicContact CD2-CD1 4.18Å; L165-F170 HydrophobicContact CD2-CE1 4.46Å; F168-F170 VanDerWaalsContact C-N 3.33Å; F168-F170 HydrophobicContact CB-CE2 4.11Å; F168-F170 HydrophobicContact CB-CZ 4.09Å; F168-F170 AromaticContact CD1-CZ 3.92Å; F168-F170 HydrophobicContact CD1-CZ 3.92Å; F168-F170 WeakPolarHBondContact O-CD2 3.34Å; F168-F170 PolarHBondContact O-N 3.33Å; F168-F170 VanDerWaalsContact O-N 3.1Å; F170-A173 PolarHBondContact O-N 3.01Å; F170-A174 WeakPolarHBondContact O-CB 3.4Å; F170-A174 PolarHBondContact O-N 3.3Å; F170-V197 HydrophobicContact CB-CG1 3.96Å; F170-V197 HydrophobicContact CD1-CG1 4.43Å; F170-V197 WeakPolarHBondContact O-CG1 3.44Å; F170-T200 HydrophobicContact CD1-CG2 4.11Å; F170-T200 HydrophobicContact CD2-CG2 4.15Å; F170-T200 HydrophobicContact CE1-CG2 3.69Å; F170-T200 HydrophobicContact CE2-CG2 3.73Å; F170-T200 HydrophobicContact CG-CG2 4.32Å; F170-T200 HydrophobicContact CZ-CG2 3.47Å; F170-T200 VanDerWaalsContact CZ-CG2 3.47Å; F170-Q201 HydrophobicContact CB-CG 3.56Å; F170-Q201 HydrophobicContact CG-CG 4.45Å
171P98.4Very high98.2Very high84 Ų8449.5 Ų49.555%0.54523%0.229SC..Hα-helixtrans-58.3-47.9175.7-24.834.5000113.1D169 A174 F175 Q201D169-P171 WeakPolarHBondContact OD1-CD 3.44Å; P171-A174 PolarHBondContact O-N 3.22Å; P171-F175 PolarHBondContact O-N 3.35Å; P171-F175 VanDerWaalsContact O-N 3.16Å; P171-Q201 VanDerWaalsContact CA-NE2 3.3Å
172R98.5Very high98.2Very high113 Ų11355.6 Ų55.643%0.42626%0.261SS..Hα-helixtrans-74.3-33.4179.9-66.5-176.9-81.5177.4-5112.1Y164 D169 A174 F175 C176Y164-R172 HydrophobicContact CD1-CB 3.83Å; Y164-R172 HydrophobicContact CD2-CB 3.64Å; Y164-R172 HydrophobicContact CE1-CB 3.81Å; Y164-R172 HydrophobicContact CE1-CG 4.35Å; Y164-R172 HydrophobicContact CE2-CB 3.6Å; Y164-R172 HydrophobicContact CG-CB 3.77Å; D169-R172 VanDerWaalsContact OD1-CB 3.24Å; D169-R172 WeakPolarHBondContact OD1-CB 3.44Å; D169-R172 WeakPolarHBondContact OD1-CG 3.49Å; D169-R172 PolarHBondContact OD1-N 2.93Å; D169-R172 IonicContact OD1-NE 3.06Å; D169-R172 PolarHBondContact OD1-NE 3.45Å; D169-R172 IonicContact OD2-CZ 3.6Å; D169-R172 IonicContact OD2-NE 3.34Å; D169-R172 PolarHBondContact OD2-NE 3.43Å; D169-R172 IonicContact OD2-NH2 3.89Å; D169-R172 PolarHBondContact OD2-NH2 3.47Å; R172-A174 VanDerWaalsContact C-N 3.33Å; R172-A174 PolarHBondContact O-N 2.89Å; R172-F175 PolarHBondContact O-N 3.46Å; R172-C176 PolarHBondContact O-N 2.88Å; R172-C176 VanDerWaalsContact O-N 3.11Å; R172-C176 PolarHBondContact O-SG 3.44Å
173A98.7Very high98.1Very high0 Ų052.7 Ų52.70%025%0.252CS..Hα-helixtrans-61.4-40.7170.900000112.4L165 D169 F170 C176 L177L165-A173 HydrophobicContact CD2-CB 3.63Å; L165-A173 HydrophobicContact CG-CB 3.87Å; D169-A173 VanDerWaalsContact O-CB 3.31Å; D169-A173 WeakPolarHBondContact O-CB 3.23Å; D169-A173 PolarHBondContact O-N 3.41Å; F170-A173 PolarHBondContact O-N 3.01Å; A173-C176 PolarHBondContact O-N 2.97Å; A173-L177 WeakPolarHBondContact O-CG 3.44Å; A173-L177 PolarHBondContact O-N 3.49Å; A173-L177 VanDerWaalsContact O-N 3.08Å
174A98.6Very high98Very high1 Ų157.4 Ų57.41%0.00827%0.273CS..Hα-helixtrans-62.9-41.6176.100000111.8F170 P171 R172 L177 E178 Y194 V197F170-A174 WeakPolarHBondContact O-CB 3.4Å; F170-A174 PolarHBondContact O-N 3.3Å; P171-A174 PolarHBondContact O-N 3.22Å; R172-A174 VanDerWaalsContact C-N 3.33Å; R172-A174 PolarHBondContact O-N 2.89Å; A174-L177 WeakPolarHBondContact O-CB 3.46Å; A174-L177 PolarHBondContact O-N 3.38Å; A174-L177 VanDerWaalsContact O-N 3.16Å; A174-E178 WeakPolarHBondContact O-CG 3.28Å; A174-E178 PolarHBondContact O-N 2.94Å; A174-Y194 HydrophobicContact CB-CD2 4.4Å; A174-Y194 HydrophobicContact CB-CE2 4Å; A174-V197 HydrophobicContact CB-CG1 3.93Å
175F98.3Very high97.9Very high103 Ų10360.1 Ų60.145%0.45229%0.292SS..Hα-helixtrans-59.4-46.6174.4178.3-99.1000111.9W157 P171 R172 L177 E178 E179W157-F175 AromaticContact CH2-CE1 3.89Å; W157-F175 HydrophobicContact CH2-CE1 3.89Å; W157-F175 HydrophobicContact CZ3-CD1 4.26Å; W157-F175 AromaticContact CZ3-CE1 3.94Å; W157-F175 HydrophobicContact CZ3-CE1 3.94Å; P171-F175 PolarHBondContact O-N 3.35Å; P171-F175 VanDerWaalsContact O-N 3.16Å; R172-F175 PolarHBondContact O-N 3.46Å; F175-L177 PolarHBondContact O-N 3.03Å; F175-E178 WeakPolarHBondContact O-CB 3.23Å; F175-E178 PolarHBondContact O-N 3.35Å; F175-E178 VanDerWaalsContact O-N 3.14Å; F175-E179 HydrophobicContact CE1-CG 4.24Å; F175-E179 HydrophobicContact CZ-CG 4.29Å; F175-E179 PolarHBondContact O-N 3.27Å
176C98.6Very high97.9Very high1 Ų164.8 Ų64.81%0.00732%0.316CS..Hα-helixtrans-59.5-37.7175.5-60.10000112.3W157 C161 R172 A173 E179 M180W157-C176 HydrophobicContact CE3-CB 4.12Å; C161-C176 HydrophobicContact CB-CB 3.66Å; R172-C176 PolarHBondContact O-N 2.88Å; R172-C176 VanDerWaalsContact O-N 3.11Å; R172-C176 PolarHBondContact O-SG 3.44Å; A173-C176 PolarHBondContact O-N 2.97Å; C176-E179 PolarHBondContact O-N 3.12Å; C176-M180 WeakPolarHBondContact O-CG 3.33Å; C176-M180 PolarHBondContact O-N 3.37Å
177L98.6Very high97.9Very high0 Ų060 Ų600%030%0.303CS..Hα-helixtrans-68.5-33.5177.6-74.2160.8000112.8C161 A173 A174 F175 M180 I181 L193 Y194 V197C161-L177 VanDerWaalsContact SG-CG 3.59Å; A173-L177 WeakPolarHBondContact O-CG 3.44Å; A173-L177 PolarHBondContact O-N 3.49Å; A173-L177 VanDerWaalsContact O-N 3.08Å; A174-L177 WeakPolarHBondContact O-CB 3.46Å; A174-L177 PolarHBondContact O-N 3.38Å; A174-L177 VanDerWaalsContact O-N 3.16Å; F175-L177 PolarHBondContact O-N 3.03Å; L177-M180 HydrophobicContact CD2-CE 4.09Å; L177-M180 HydrophobicContact CD2-SD 4.19Å; L177-M180 PolarHBondContact O-N 3.4Å; L177-I181 WeakPolarHBondContact O-CB 3.36Å; L177-I181 WeakPolarHBondContact O-CG1 3.35Å; L177-I181 PolarHBondContact O-N 3.02Å; L177-L193 HydrophobicContact CD1-CD2 4.5Å; L177-L193 HydrophobicContact CD1-CG 3.94Å; L177-L193 HydrophobicContact CD2-CB 4.08Å; L177-L193 HydrophobicContact CD2-CD2 3.85Å; L177-L193 HydrophobicContact CD2-CG 3.9Å; L177-Y194 HydrophobicContact CB-CD2 3.71Å; L177-Y194 HydrophobicContact CB-CG 4.38Å; L177-Y194 HydrophobicContact CD1-CD2 4.44Å; L177-V197 HydrophobicContact CD1-CB 4.3Å; L177-V197 HydrophobicContact CD1-CG2 3.71Å
178E98.3Very high98Very high63 Ų6361.4 Ų61.429%0.29430%0.304SS..Hα-helixtrans-61.4-48.2173.2-71.9159-172.200110.3A174 F175 M180 I181 L182 Y194 K198A174-E178 WeakPolarHBondContact O-CG 3.28Å; A174-E178 PolarHBondContact O-N 2.94Å; F175-E178 WeakPolarHBondContact O-CB 3.23Å; F175-E178 PolarHBondContact O-N 3.35Å; F175-E178 VanDerWaalsContact O-N 3.14Å; E178-M180 VanDerWaalsContact C-N 3.33Å; E178-M180 PolarHBondContact O-N 2.7Å; E178-I181 PolarHBondContact O-N 3.2Å; E178-I181 VanDerWaalsContact O-N 3.14Å; E178-L182 WeakPolarHBondContact O-CG 3.37Å; E178-L182 PolarHBondContact O-N 2.71Å; E178-Y194 HydrophobicContact CG-CD2 4.34Å; E178-Y194 HydrophobicContact CG-CE2 3.5Å; E178-Y194 VanDerWaalsContact OE1-CE2 3.26Å; E178-Y194 WeakPolarHBondContact OE1-CE2 3.41Å; E178-Y194 VanDerWaalsContact OE1-CZ 3.29Å; E178-Y194 PolarHBondContact OE1-OH 2.98Å; E178-K198 IonicContact OE1-NZ 2.72Å
179E97.6Very high98Very high51 Ų5155.6 Ų55.624%0.23829%0.285CS..Hα-helixtrans-60.1-40.6174.6-63.9-57.7136.400112.4W157 F175 C176 I181 L182 S183W157-E179 HydrophobicContact CD2-CB 4.05Å; W157-E179 HydrophobicContact CD2-CG 4.43Å; W157-E179 HydrophobicContact CE3-CB 4.25Å; W157-E179 HydrophobicContact CE3-CG 4.34Å; W157-E179 HydrophobicContact CG-CB 4.5Å; W157-E179 HydrophobicContact CH2-CG 3.95Å; W157-E179 HydrophobicContact CZ2-CB 4.39Å; W157-E179 HydrophobicContact CZ2-CG 4.02Å; W157-E179 HydrophobicContact CZ3-CG 4.11Å; F175-E179 HydrophobicContact CE1-CG 4.24Å; F175-E179 HydrophobicContact CZ-CG 4.29Å; F175-E179 PolarHBondContact O-N 3.27Å; C176-E179 PolarHBondContact O-N 3.12Å; E179-I181 PolarHBondContact O-N 2.9Å; E179-L182 PolarHBondContact O-N 2.98Å; E179-S183 PolarHBondContact O-N 3.28Å; E179-S183 PolarHBondContact O-OG 2.97Å
180M97.9Very high98Very high8 Ų855.6 Ų55.64%0.03928%0.283CS..Hα-helixtrans-65.8-36175.8-69.6166.855.400112.7W157 V158 C161 C176 L177 E178 S183 K184 F190W157-M180 HydrophobicContact CB-CG 3.93Å; W157-M180 HydrophobicContact CB-SD 4.49Å; V158-M180 HydrophobicContact CB-CE 4.42Å; V158-M180 HydrophobicContact CG2-CE 3.59Å; V158-M180 HydrophobicContact CG2-SD 4.05Å; C161-M180 HydrophobicContact CB-SD 4.14Å; C176-M180 WeakPolarHBondContact O-CG 3.33Å; C176-M180 PolarHBondContact O-N 3.37Å; L177-M180 HydrophobicContact CD2-CE 4.09Å; L177-M180 HydrophobicContact CD2-SD 4.19Å; L177-M180 PolarHBondContact O-N 3.4Å; E178-M180 VanDerWaalsContact C-N 3.33Å; E178-M180 PolarHBondContact O-N 2.7Å; M180-S183 WeakPolarHBondContact CA-OG 3.44Å; M180-S183 PolarHBondContact O-OG 2.85Å; M180-K184 PolarHBondContact O-N 2.84Å; M180-F190 HydrophobicContact CB-CD2 3.84Å; M180-F190 HydrophobicContact CB-CE2 3.92Å; M180-F190 HydrophobicContact CB-CG 4.22Å; M180-F190 HydrophobicContact CB-CZ 4.4Å; M180-F190 HydrophobicContact CE-CD1 3.42Å; M180-F190 VanDerWaalsContact CE-CD1 3.42Å; M180-F190 HydrophobicContact CE-CD2 4.38Å; M180-F190 HydrophobicContact CE-CE1 3.2Å; M180-F190 HydrophobicContact CE-CE2 4.18Å; M180-F190 HydrophobicContact CE-CG 4.03Å; M180-F190 HydrophobicContact CE-CZ 3.61Å; M180-F190 VanDerWaalsContact O-CD2 3.25Å; M180-F190 WeakPolarHBondContact O-CD2 3.37Å; M180-F190 WeakPolarHBondContact O-CE2 3.34Å
181I98.1Very high98Very high15 Ų1553.5 Ų53.58%0.07727%0.274CS..Hα-helixtrans-72.3-41176.5-71.3168.3000110.8L177 E178 E179 S183 K184 P185 F190 Y194 Y213L177-I181 WeakPolarHBondContact O-CB 3.36Å; L177-I181 WeakPolarHBondContact O-CG1 3.35Å; L177-I181 PolarHBondContact O-N 3.02Å; E178-I181 PolarHBondContact O-N 3.2Å; E178-I181 VanDerWaalsContact O-N 3.14Å; E179-I181 PolarHBondContact O-N 2.9Å; I181-S183 VanDerWaalsContact C-N 3.28Å; I181-S183 PolarHBondContact O-N 3.44Å; I181-K184 CarbonylContact O-C 3.59Å; I181-K184 PolarHBondContact O-N 3.44Å; I181-P185 WeakPolarHBondContact O-CA 3.41Å; I181-P185 WeakPolarHBondContact O-CB 3.34Å; I181-P185 WeakPolarHBondContact O-CD 3.43Å; I181-F190 HydrophobicContact CD1-CB 4.44Å; I181-F190 HydrophobicContact CG1-CB 3.66Å; I181-Y194 HydrophobicContact CD1-CD1 4.41Å; I181-Y194 HydrophobicContact CD1-CG 4.09Å; I181-Y213 HydrophobicContact CD1-CD1 4.07Å; I181-Y213 HydrophobicContact CD1-CE1 3.71Å
182L97.1Very high98Very high130 Ų13050.4 Ų50.468%0.68125%0.252SS*.Hα-helixtrans-58.7-42.3175.8-72174.9000111.4E178 E179E178-L182 WeakPolarHBondContact O-CG 3.37Å; E178-L182 PolarHBondContact O-N 2.71Å; E179-L182 PolarHBondContact O-N 2.98Å
183S96Very high98Very high46 Ų4647.2 Ų47.232%0.32224%0.244SC..Hα-helixtrans-73.9-38.5179.751.40000114.5H154 E179 M180 I181H154-S183 WeakPolarHBondContact CD2-CB 3.31Å; H154-S183 PolarHBondContact CD2-OG 3.37Å; H154-S183 VanDerWaalsContact CD2-OG 3.3Å; H154-S183 WeakPolarHBondContact NE2-CB 3.32Å; E179-S183 PolarHBondContact O-N 3.28Å; E179-S183 PolarHBondContact O-OG 2.97Å; M180-S183 WeakPolarHBondContact CA-OG 3.44Å; M180-S183 PolarHBondContact O-OG 2.85Å; I181-S183 VanDerWaalsContact C-N 3.28Å; I181-S183 PolarHBondContact O-N 3.44Å
184K96.4Very high98Very high104 Ų10447.8 Ų47.845%0.45225%0.246SC..  trans-134.271-178.7-57.7-177.5-179.7176.10111.8M180 I181 L186 T187 F190M180-K184 PolarHBondContact O-N 2.84Å; I181-K184 CarbonylContact O-C 3.59Å; I181-K184 PolarHBondContact O-N 3.44Å; K184-L186 PolarHBondContact O-N 3.01Å; K184-T187 VanDerWaalsContact CB-OG1 3.28Å; K184-T187 WeakPolarHBondContact CB-OG1 3.28Å; K184-T187 VanDerWaalsContact O-CB 3.31Å; K184-T187 WeakPolarHBondContact O-CB 3.5Å; K184-T187 PolarHBondContact O-N 3.29Å; K184-T187 PolarHBondContact O-OG1 2.88Å; K184-T187 VanDerWaalsContact O-OG1 3.06Å; K184-F190 HydrophobicContact CB-CD2 4.41Å; K184-F190 HydrophobicContact CB-CE2 3.98Å; K184-F190 HydrophobicContact CD-CE2 4.31Å
185P97.4Very high98Very high71 Ų7147.7 Ų47.746%0.46125%0.245SC..THydrogen-bonded Turntrans-66.2-15.7-170.324.8-35.6000114.8I181 T187 H191I181-P185 WeakPolarHBondContact O-CA 3.41Å; I181-P185 WeakPolarHBondContact O-CB 3.34Å; I181-P185 WeakPolarHBondContact O-CD 3.43Å; P185-T187 VanDerWaalsContact C-N 3.35Å; P185-H191 PolarHBondContact O-NE2 3.39Å
186L98Very high98Very high141 Ų14144.4 Ų44.474%0.73823%0.232SC*.THydrogen-bonded Turntrans-89.20.4176-59.7179.8000113.3K184 Y188 L220K184-L186 PolarHBondContact O-N 3.01Å; L186-Y188 PolarHBondContact O-N 3.29Å; L186-Y188 VanDerWaalsContact O-N 3.14Å; L186-L220 HydrophobicContact CD2-CD2 4.01Å
187T97.8Very high98Very high42 Ų4244.6 Ų44.626%0.25823%0.232SC..  trans-81.493.7179-51.60000110.4K184 P185 A189 F190 H191K184-T187 VanDerWaalsContact CB-OG1 3.28Å; K184-T187 WeakPolarHBondContact CB-OG1 3.28Å; K184-T187 VanDerWaalsContact O-CB 3.31Å; K184-T187 WeakPolarHBondContact O-CB 3.5Å; K184-T187 PolarHBondContact O-N 3.29Å; K184-T187 PolarHBondContact O-OG1 2.88Å; K184-T187 VanDerWaalsContact O-OG1 3.06Å; P185-T187 VanDerWaalsContact C-N 3.35Å; T187-A189 HydrophobicContact CG2-CB 4.25Å; T187-A189 PolarHBondContact O-N 3.19Å; T187-F190 HydrophobicContact CG2-CD1 3.86Å; T187-F190 HydrophobicContact CG2-CD2 3.78Å; T187-F190 HydrophobicContact CG2-CE1 3.95Å; T187-F190 HydrophobicContact CG2-CE2 3.9Å; T187-F190 HydrophobicContact CG2-CG 3.77Å; T187-F190 HydrophobicContact CG2-CZ 3.98Å; T187-F190 PolarHBondContact O-N 3.39Å; T187-H191 PolarHBondContact O-CD2 3.46Å
188Y98.2Very high98Very high75 Ų7545.6 Ų45.629%0.29424%0.237SC..Hα-helixtrans-52-32.8-179.879.6-85.2000113.5L186 F190 H191 M192 K221L186-Y188 PolarHBondContact O-N 3.29Å; L186-Y188 VanDerWaalsContact O-N 3.14Å; Y188-F190 VanDerWaalsContact C-N 3.28Å; Y188-F190 PolarHBondContact O-N 3.01Å; Y188-H191 PolarHBondContact O-N 3.47Å; Y188-M192 WeakPolarHBondContact O-CB 3.37Å; Y188-M192 PolarHBondContact O-N 3.01Å; Y188-K221 HydrophobicContact CD1-CB 4.16Å; Y188-K221 HydrophobicContact CD1-CD 4Å; Y188-K221 HydrophobicContact CD2-CB 3.93Å; Y188-K221 HydrophobicContact CD2-CD 3.78Å; Y188-K221 HydrophobicContact CD2-CG 4.49Å; Y188-K221 HydrophobicContact CE1-CD 3.66Å; Y188-K221 HydrophobicContact CE2-CB 4.44Å; Y188-K221 HydrophobicContact CE2-CD 3.41Å; Y188-K221 VanDerWaalsContact CE2-CD 3.41Å; Y188-K221 HydrophobicContact CG-CB 3.78Å; Y188-K221 HydrophobicContact CG-CD 4.06Å; Y188-K221 PolarHBondContact OH-NZ 2.96Å
189A98.1Very high98Very high33 Ų3343.4 Ų43.427%0.27323%0.228SC..Hα-helixtrans-64.3-31.8-179.200000112.7T187 L193T187-A189 HydrophobicContact CG2-CB 4.25Å; T187-A189 PolarHBondContact O-N 3.19Å; A189-L193 WeakPolarHBondContact O-CB 3.45Å; A189-L193 PolarHBondContact O-N 3.3Å
190F98.3Very high98Very high34 Ų3445 Ų4515%0.14924%0.242CC..Hα-helixtrans-73-43.1177.5-61-16.6000111.1M180 I181 K184 T187 Y188 M192 L193 Y194M180-F190 HydrophobicContact CB-CD2 3.84Å; M180-F190 HydrophobicContact CB-CE2 3.92Å; M180-F190 HydrophobicContact CB-CG 4.22Å; M180-F190 HydrophobicContact CB-CZ 4.4Å; M180-F190 HydrophobicContact CE-CD1 3.42Å; M180-F190 VanDerWaalsContact CE-CD1 3.42Å; M180-F190 HydrophobicContact CE-CD2 4.38Å; M180-F190 HydrophobicContact CE-CE1 3.2Å; M180-F190 HydrophobicContact CE-CE2 4.18Å; M180-F190 HydrophobicContact CE-CG 4.03Å; M180-F190 HydrophobicContact CE-CZ 3.61Å; M180-F190 VanDerWaalsContact O-CD2 3.25Å; M180-F190 WeakPolarHBondContact O-CD2 3.37Å; M180-F190 WeakPolarHBondContact O-CE2 3.34Å; I181-F190 HydrophobicContact CD1-CB 4.44Å; I181-F190 HydrophobicContact CG1-CB 3.66Å; K184-F190 HydrophobicContact CB-CD2 4.41Å; K184-F190 HydrophobicContact CB-CE2 3.98Å; K184-F190 HydrophobicContact CD-CE2 4.31Å; T187-F190 HydrophobicContact CG2-CD1 3.86Å; T187-F190 HydrophobicContact CG2-CD2 3.78Å; T187-F190 HydrophobicContact CG2-CE1 3.95Å; T187-F190 HydrophobicContact CG2-CE2 3.9Å; T187-F190 HydrophobicContact CG2-CG 3.77Å; T187-F190 HydrophobicContact CG2-CZ 3.98Å; T187-F190 PolarHBondContact O-N 3.39Å; Y188-F190 VanDerWaalsContact C-N 3.28Å; Y188-F190 PolarHBondContact O-N 3.01Å; F190-M192 VanDerWaalsContact C-N 3.34Å; F190-M192 PolarHBondContact O-N 3.19Å; F190-L193 PolarHBondContact O-N 3.46Å; F190-Y194 VanDerWaalsContact O-CB 3.28Å; F190-Y194 WeakPolarHBondContact O-CB 3.38Å; F190-Y194 PolarHBondContact O-N 3.49Å
191H98.7Very high98Very high8 Ų847.3 Ų47.34%0.03725%0.252CS..Hα-helixtrans-60.2-44.4173.3-63.2-76.1000111.9P185 T187 Y188 Y194 A195 Y213 A217P185-H191 PolarHBondContact O-NE2 3.39Å; T187-H191 PolarHBondContact O-CD2 3.46Å; Y188-H191 PolarHBondContact O-N 3.47Å; H191-Y194 PolarHBondContact O-N 3.2Å; H191-A195 WeakPolarHBondContact O-CB 3.31Å; H191-A195 PolarHBondContact O-N 2.92Å; H191-Y213 HydrophobicContact CB-CD1 4.17Å; H191-Y213 AromaticContact ND1-CD1 3.35Å; H191-Y213 VanDerWaalsContact ND1-CD1 3.35Å; H191-Y213 WeakPolarHBondContact ND1-CD1 3.29Å; H191-Y213 AromaticContact ND1-CE1 3.58Å; H191-A217 HydrophobicContact CB-CB 3.98Å
192M98.6Very high97.8Very high19 Ų1947.2 Ų47.29%0.09426%0.255CS..Hα-helixtrans-61.3-50.2177.3-178.4-172.473.400111.5Y188 F190 Y194 A195 E196 A217 R226 A227Y188-M192 WeakPolarHBondContact O-CB 3.37Å; Y188-M192 PolarHBondContact O-N 3.01Å; F190-M192 VanDerWaalsContact C-N 3.34Å; F190-M192 PolarHBondContact O-N 3.19Å; M192-Y194 PolarHBondContact O-N 2.93Å; M192-A195 WeakPolarHBondContact O-CB 3.01Å; M192-A195 PolarHBondContact O-N 2.97Å; M192-E196 WeakPolarHBondContact O-CG 3.49Å; M192-E196 PolarHBondContact O-N 3.33Å; M192-A217 HydrophobicContact CB-CB 4Å; M192-R226 HydrophobicContact CE-CG 4.23Å; M192-R226 HydrophobicContact SD-CB 3.76Å; M192-R226 HydrophobicContact SD-CG 3.64Å; M192-A227 HydrophobicContact CG-CB 4.08Å; M192-A227 HydrophobicContact SD-CB 4.3Å
193L98.5Very high97.7Very high47 Ų4743.1 Ų43.125%0.24624%0.244CC..Hα-helixtrans-66.6-37.9-179.5-176.755.4000111.9L165 L177 A189 F190 A195 E196 V197L165-L193 HydrophobicContact CD1-CD1 4.26Å; L165-L193 HydrophobicContact CD1-CD2 4.38Å; L177-L193 HydrophobicContact CD1-CD2 4.5Å; L177-L193 HydrophobicContact CD1-CG 3.94Å; L177-L193 HydrophobicContact CD2-CB 4.08Å; L177-L193 HydrophobicContact CD2-CD2 3.85Å; L177-L193 HydrophobicContact CD2-CG 3.9Å; A189-L193 WeakPolarHBondContact O-CB 3.45Å; A189-L193 PolarHBondContact O-N 3.3Å; F190-L193 PolarHBondContact O-N 3.46Å; L193-A195 VanDerWaalsContact C-N 3.34Å; L193-A195 PolarHBondContact O-N 3.25Å; L193-E196 WeakPolarHBondContact O-CB 3.38Å; L193-E196 PolarHBondContact O-N 2.99Å; L193-V197 WeakPolarHBondContact O-CG2 3.47Å; L193-V197 PolarHBondContact O-N 3.26Å
194Y98.8Very high97.7Very high11 Ų1143.2 Ų43.24%0.04324%0.24CC..Hα-helixtrans-60.4-44.7173.6-176-108.7000111.9A174 L177 E178 I181 F190 H191 M192 E196 V197 K198 I209 Y213A174-Y194 HydrophobicContact CB-CD2 4.4Å; A174-Y194 HydrophobicContact CB-CE2 4Å; L177-Y194 HydrophobicContact CB-CD2 3.71Å; L177-Y194 HydrophobicContact CB-CG 4.38Å; L177-Y194 HydrophobicContact CD1-CD2 4.44Å; E178-Y194 HydrophobicContact CG-CD2 4.34Å; E178-Y194 HydrophobicContact CG-CE2 3.5Å; E178-Y194 VanDerWaalsContact OE1-CE2 3.26Å; E178-Y194 WeakPolarHBondContact OE1-CE2 3.41Å; E178-Y194 VanDerWaalsContact OE1-CZ 3.29Å; E178-Y194 PolarHBondContact OE1-OH 2.98Å; I181-Y194 HydrophobicContact CD1-CD1 4.41Å; I181-Y194 HydrophobicContact CD1-CG 4.09Å; F190-Y194 VanDerWaalsContact O-CB 3.28Å; F190-Y194 WeakPolarHBondContact O-CB 3.38Å; F190-Y194 PolarHBondContact O-N 3.49Å; H191-Y194 PolarHBondContact O-N 3.2Å; M192-Y194 PolarHBondContact O-N 2.93Å; Y194-E196 VanDerWaalsContact C-N 3.34Å; Y194-E196 PolarHBondContact O-N 3.36Å; Y194-V197 PolarHBondContact O-N 2.94Å; Y194-K198 HydrophobicContact CD1-CG 4.31Å; Y194-K198 HydrophobicContact CE1-CG 4.02Å; Y194-K198 HydrophobicContact CE2-CD 4.47Å; Y194-K198 VanDerWaalsContact CE2-CE 3.43Å; Y194-K198 HydrophobicContact CE2-CG 4.37Å; Y194-K198 WeakPolarHBondContact O-CG 3.37Å; Y194-K198 PolarHBondContact O-N 2.86Å; Y194-K198 WeakPolarHBondContact OH-CE 3.4Å; Y194-I209 HydrophobicContact CD1-CG2 4.47Å; Y194-I209 HydrophobicContact CE1-CG2 3.61Å; Y194-Y213 AromaticContact CD1-CD1 3.61Å; Y194-Y213 HydrophobicContact CD1-CD1 3.61Å; Y194-Y213 AromaticContact CD1-CD2 3.61Å; Y194-Y213 HydrophobicContact CD1-CD2 3.61Å; Y194-Y213 AromaticContact CD1-CE1 3.79Å; Y194-Y213 HydrophobicContact CD1-CE1 3.79Å; Y194-Y213 AromaticContact CD1-CE2 3.79Å; Y194-Y213 HydrophobicContact CD1-CE2 3.79Å; Y194-Y213 AromaticContact CD1-CG 3.51Å; Y194-Y213 HydrophobicContact CD1-CG 3.51Å; Y194-Y213 AromaticContact CD1-CZ 3.85Å; Y194-Y213 HydrophobicContact CE1-CD1 4.23Å; Y194-Y213 AromaticContact CE1-CD2 3.59Å; Y194-Y213 HydrophobicContact CE1-CD2 3.59Å; Y194-Y213 HydrophobicContact CE1-CE1 4.07Å; Y194-Y213 AromaticContact CE1-CE2 3.39Å; Y194-Y213 HydrophobicContact CE1-CE2 3.39Å; Y194-Y213 HydrophobicContact CE1-CG 4Å; Y194-Y213 AromaticContact CE1-CZ 3.63Å
195A98.8Very high97.7Very high0 Ų045.9 Ų45.90%025%0.254CS..Hα-helixtrans-61.4-40.2174.700000112.6H191 M192 L193 K198 C199 A210 Y214H191-A195 WeakPolarHBondContact O-CB 3.31Å; H191-A195 PolarHBondContact O-N 2.92Å; M192-A195 WeakPolarHBondContact O-CB 3.01Å; M192-A195 PolarHBondContact O-N 2.97Å; L193-A195 VanDerWaalsContact C-N 3.34Å; L193-A195 PolarHBondContact O-N 3.25Å; A195-K198 PolarHBondContact O-N 2.98Å; A195-C199 VanDerWaalsContact O-CB 3.27Å; A195-C199 WeakPolarHBondContact O-CB 3.41Å; A195-C199 PolarHBondContact O-N 3.33Å; A195-A210 HydrophobicContact CB-CB 4.38Å; A195-A210 WeakPolarHBondContact CB-O 3.33Å; A195-A210 WeakPolarHBondContact O-CB 3.41Å; A195-Y214 HydrophobicContact CB-CD1 3.6Å; A195-Y214 HydrophobicContact CB-CD2 3.67Å; A195-Y214 HydrophobicContact CB-CE1 3.63Å; A195-Y214 HydrophobicContact CB-CE2 3.7Å; A195-Y214 HydrophobicContact CB-CG 3.6Å
196E98.6Very high97.8Very high34 Ų3444.3 Ų44.316%0.15924%0.242CC..Hα-helixtrans-60.8-45.1174.7-72.8173.5-169.200112.1M192 L193 Y194 C199 T200 Y214 R226M192-E196 WeakPolarHBondContact O-CG 3.49Å; M192-E196 PolarHBondContact O-N 3.33Å; L193-E196 WeakPolarHBondContact O-CB 3.38Å; L193-E196 PolarHBondContact O-N 2.99Å; Y194-E196 VanDerWaalsContact C-N 3.34Å; Y194-E196 PolarHBondContact O-N 3.36Å; E196-C199 PolarHBondContact O-N 3.09Å; E196-T200 WeakPolarHBondContact O-CB 3.3Å; E196-T200 PolarHBondContact O-N 3.48Å; E196-T200 PolarHBondContact O-OG1 3.26Å; E196-Y214 WeakPolarHBondContact CA-OH 3.46Å; E196-Y214 HydrophobicContact CG-CE1 4.13Å; E196-Y214 VanDerWaalsContact CG-OH 3.29Å; E196-Y214 WeakPolarHBondContact CG-OH 3.31Å; E196-R226 WeakPolarHBondContact OE1-CG 3.42Å; E196-R226 IonicContact OE1-CZ 2.67Å; E196-R226 IonicContact OE1-NE 3.56Å; E196-R226 PolarHBondContact OE1-NE 3.26Å; E196-R226 IonicContact OE1-NH2 3.12Å; E196-R226 PolarHBondContact OE1-NH2 3.18Å; E196-R226 IonicContact OE2-CZ 2.69Å; E196-R226 IonicContact OE2-NE 3.41Å; E196-R226 IonicContact OE2-NH2 3.47Å; E196-R226 PolarHBondContact OE2-NH2 3.01Å
197V98.6Very high97.8Very high4 Ų437.6 Ų37.62%0.02421%0.207CC..Hα-helixtrans-63.4-47.1177.7175.10000110.8L165 F170 A174 L177 L193 Y194 C199 T200 Q201L165-V197 HydrophobicContact CD2-CG2 3.63Å; F170-V197 HydrophobicContact CB-CG1 3.96Å; F170-V197 HydrophobicContact CD1-CG1 4.43Å; F170-V197 WeakPolarHBondContact O-CG1 3.44Å; A174-V197 HydrophobicContact CB-CG1 3.93Å; L177-V197 HydrophobicContact CD1-CB 4.3Å; L177-V197 HydrophobicContact CD1-CG2 3.71Å; L193-V197 WeakPolarHBondContact O-CG2 3.47Å; L193-V197 PolarHBondContact O-N 3.26Å; Y194-V197 PolarHBondContact O-N 2.94Å; V197-C199 VanDerWaalsContact C-N 3.35Å; V197-C199 PolarHBondContact O-N 2.99Å; V197-T200 WeakPolarHBondContact O-CB 3.44Å; V197-T200 PolarHBondContact O-N 3.32Å; V197-T200 VanDerWaalsContact O-N 3.13Å; V197-Q201 WeakPolarHBondContact O-CG 3.43Å; V197-Q201 PolarHBondContact O-N 3.05Å
198K98.7Very high97.8Very high22 Ų2238.2 Ų38.210%0.09621%0.207CC..Hα-helixtrans-61.9-41.6176.5-67.3-58.8-175.3-176.80112.1E178 Y194 A195 T200 Q201 G202 N206 I209 A210E178-K198 IonicContact OE1-NZ 2.72Å; Y194-K198 HydrophobicContact CD1-CG 4.31Å; Y194-K198 HydrophobicContact CE1-CG 4.02Å; Y194-K198 HydrophobicContact CE2-CD 4.47Å; Y194-K198 VanDerWaalsContact CE2-CE 3.43Å; Y194-K198 HydrophobicContact CE2-CG 4.37Å; Y194-K198 WeakPolarHBondContact O-CG 3.37Å; Y194-K198 PolarHBondContact O-N 2.86Å; Y194-K198 WeakPolarHBondContact OH-CE 3.4Å; A195-K198 PolarHBondContact O-N 2.98Å; K198-T200 VanDerWaalsContact C-N 3.26Å; K198-T200 PolarHBondContact O-N 2.97Å; K198-Q201 VanDerWaalsContact CD-OE1 3.25Å; K198-Q201 PolarHBondContact O-N 3.28Å; K198-G202 PolarHBondContact O-N 2.94Å; K198-N206 HydrophobicContact CB-CB 4.25Å; K198-N206 VanDerWaalsContact O-CB 3.28Å; K198-N206 WeakPolarHBondContact O-CB 3.41Å; K198-I209 HydrophobicContact CD-CG2 4.4Å; K198-I209 HydrophobicContact CG-CB 4.43Å; K198-I209 HydrophobicContact CG-CG2 3.88Å; K198-A210 HydrophobicContact CB-CB 4.02Å
199C97.9Very high97.8Very high17 Ų1737.3 Ų37.312%0.11521%0.206CC..Hα-helixtrans-60.9-38.1175.3-160.30000111.7A195 E196 V197 G202 A210 Q237A195-C199 VanDerWaalsContact O-CB 3.27Å; A195-C199 WeakPolarHBondContact O-CB 3.41Å; A195-C199 PolarHBondContact O-N 3.33Å; E196-C199 PolarHBondContact O-N 3.09Å; V197-C199 VanDerWaalsContact C-N 3.35Å; V197-C199 PolarHBondContact O-N 2.99Å; C199-G202 PolarHBondContact O-N 3.14Å; C199-A210 HydrophobicContact CB-CB 4.11Å; C199-Q237 PolarHBondContact SG-OE1 3.11Å
200T97.2Very high97.8Very high84 Ų8435.7 Ų35.752%0.51519%0.193SC..Hα-helixtrans-68.7-39.6177.5-56.30000112.4F170 E196 V197 K198 G202F170-T200 HydrophobicContact CD1-CG2 4.11Å; F170-T200 HydrophobicContact CD2-CG2 4.15Å; F170-T200 HydrophobicContact CE1-CG2 3.69Å; F170-T200 HydrophobicContact CE2-CG2 3.73Å; F170-T200 HydrophobicContact CG-CG2 4.32Å; F170-T200 HydrophobicContact CZ-CG2 3.47Å; F170-T200 VanDerWaalsContact CZ-CG2 3.47Å; E196-T200 WeakPolarHBondContact O-CB 3.3Å; E196-T200 PolarHBondContact O-N 3.48Å; E196-T200 PolarHBondContact O-OG1 3.26Å; V197-T200 WeakPolarHBondContact O-CB 3.44Å; V197-T200 PolarHBondContact O-N 3.32Å; V197-T200 VanDerWaalsContact O-N 3.13Å; K198-T200 VanDerWaalsContact C-N 3.26Å; K198-T200 PolarHBondContact O-N 2.97Å; T200-G202 PolarHBondContact O-N 3.02Å
201Q97.2Very high97.8Very high56 Ų5635.1 Ų35.126%0.26219%0.191SC..Hα-helixtrans-60.9-28.5174.4-70.7-176.5-52.800112.5F170 P171 V197 K198F170-Q201 HydrophobicContact CB-CG 3.56Å; F170-Q201 HydrophobicContact CG-CG 4.45Å; P171-Q201 VanDerWaalsContact CA-NE2 3.3Å; V197-Q201 WeakPolarHBondContact O-CG 3.43Å; V197-Q201 PolarHBondContact O-N 3.05Å; K198-Q201 VanDerWaalsContact CD-OE1 3.25Å; K198-Q201 PolarHBondContact O-N 3.28Å
202G94.5Very high97.7Very high13 Ų1340.1 Ų40.113%0.13422%0.217CC..  trans65.7-171.9178.800000113.2K198 C199 T200 N206K198-G202 PolarHBondContact O-N 2.94Å; C199-G202 PolarHBondContact O-N 3.14Å; T200-G202 PolarHBondContact O-N 3.02Å; G202-N206 VanDerWaalsContact O-CB 3.29Å; G202-N206 WeakPolarHBondContact O-CB 3.29Å; G202-N206 PolarHBondContact O-ND2 3.29Å
203G95.9Very high97.8Very high44 Ų4442 Ų4245%0.45422%0.224SC..SBendtrans78.7152.4-167.700000112.2E205 N206 L207G203-E205 PolarHBondContact O-N 3.16Å; G203-N206 PolarHBondContact O-N 3.21Å; G203-L207 VanDerWaalsContact O-CG 3.32Å; G203-L207 WeakPolarHBondContact O-CG 3.49Å; G203-L207 PolarHBondContact O-N 2.79Å; G203-L207 VanDerWaalsContact O-N 3.09Å
204M96.3Very high97.8Very high49 Ų4940.2 Ų40.224%0.24121%0.214CC..Hα-helixtrans-67.9-36.4-171.6-80.5-51.4-44.700113.6L207 E208 A238 K241 V242 F250M204-L207 HydrophobicContact CE-CB 4.38Å; M204-L207 PolarHBondContact O-N 3.3Å; M204-L207 HydrophobicContact SD-CD1 3.95Å; M204-E208 HydrophobicContact CE-CG 4.48Å; M204-E208 WeakPolarHBondContact O-CG 3.41Å; M204-E208 PolarHBondContact O-N 2.91Å; M204-A238 HydrophobicContact CE-CB 4.23Å; M204-K241 HydrophobicContact CG-CB 4.22Å; M204-K241 HydrophobicContact SD-CB 3.49Å; M204-K241 WeakPolarHBondContact SD-CB 3.33Å; M204-K241 HydrophobicContact SD-CD 3.87Å; M204-K241 HydrophobicContact SD-CG 4.33Å; M204-V242 HydrophobicContact CE-CG1 3.16Å; M204-V242 HydrophobicContact SD-CG1 3.85Å; M204-F250 HydrophobicContact CE-CE2 4.34Å
205E96.5Very high97.7Very high159 Ų15941.7 Ų41.774%0.74323%0.225SC*.Hα-helixtrans-60.3-47.8177.3-64.3175.9178.400111.1G203 L207 E208 I209G203-E205 PolarHBondContact O-N 3.16Å; E205-L207 VanDerWaalsContact C-N 3.34Å; E205-L207 PolarHBondContact O-N 2.99Å; E205-E208 PolarHBondContact O-N 2.65Å; E205-I209 WeakPolarHBondContact O-CG1 3.5Å; E205-I209 PolarHBondContact O-N 2.82Å; E205-I209 VanDerWaalsContact O-N 3.07Å
206N98.2Very high97.7Very high38 Ų3844.9 Ų44.920%0.20324%0.24CC..Hα-helixtrans-68.5-32.1178.1-63.6-46.2000112.5K198 G202 G203 I209 A210K198-N206 HydrophobicContact CB-CB 4.25Å; K198-N206 VanDerWaalsContact O-CB 3.28Å; K198-N206 WeakPolarHBondContact O-CB 3.41Å; G202-N206 VanDerWaalsContact O-CB 3.29Å; G202-N206 WeakPolarHBondContact O-CB 3.29Å; G202-N206 PolarHBondContact O-ND2 3.29Å; G203-N206 PolarHBondContact O-N 3.21Å; N206-I209 PolarHBondContact O-N 3.04Å; N206-A210 VanDerWaalsContact O-CB 3.29Å; N206-A210 WeakPolarHBondContact O-CB 3.38Å; N206-A210 PolarHBondContact O-N 3.21Å
207L97.9Very high97.7Very high0 Ų043.2 Ų43.20%023%0.232CC..Hα-helixtrans-67.1-36.7174-70173.8000112.1G203 M204 E205 A210 K211 C234 Q237 A238 K241G203-L207 VanDerWaalsContact O-CG 3.32Å; G203-L207 WeakPolarHBondContact O-CG 3.49Å; G203-L207 PolarHBondContact O-N 2.79Å; G203-L207 VanDerWaalsContact O-N 3.09Å; M204-L207 HydrophobicContact CE-CB 4.38Å; M204-L207 PolarHBondContact O-N 3.3Å; M204-L207 HydrophobicContact SD-CD1 3.95Å; E205-L207 VanDerWaalsContact C-N 3.34Å; E205-L207 PolarHBondContact O-N 2.99Å; L207-A210 PolarHBondContact O-N 3.35Å; L207-K211 WeakPolarHBondContact O-CB 3.49Å; L207-K211 PolarHBondContact O-N 3.2Å; L207-C234 PolarHBondContact O-SG 3.48Å; L207-C234 VanDerWaalsContact O-SG 3.35Å; L207-Q237 HydrophobicContact CD1-CG 4.16Å; L207-Q237 HydrophobicContact CD2-CG 4.4Å; L207-A238 HydrophobicContact CD1-CB 4.23Å; L207-K241 HydrophobicContact CD1-CD 4.44Å
208E97.4Very high97.7Very high56 Ų5643.3 Ų43.326%0.26223%0.232SC..Hα-helixtrans-66.5-39.7174.3-74.5180-160.100111.9M204 E205 L212 K246 F250M204-E208 HydrophobicContact CE-CG 4.48Å; M204-E208 WeakPolarHBondContact O-CG 3.41Å; M204-E208 PolarHBondContact O-N 2.91Å; E205-E208 PolarHBondContact O-N 2.65Å; E208-L212 PolarHBondContact O-N 2.9Å; E208-K246 VanDerWaalsContact CD-NZ 3.32Å; E208-K246 WeakPolarHBondContact OE1-CD 3.49Å; E208-K246 WeakPolarHBondContact OE1-CE 3.49Å; E208-K246 IonicContact OE1-NZ 3.25Å; E208-K246 PolarHBondContact OE1-NZ 3.17Å; E208-K246 IonicContact OE2-NZ 3.28Å; E208-K246 PolarHBondContact OE2-NZ 3.39Å; E208-K246 VanDerWaalsContact OE2-NZ 3.12Å; E208-F250 HydrophobicContact CG-CE2 4.43Å; E208-F250 HydrophobicContact CG-CZ 4.28Å
209I98.3Very high97.7Very high55 Ų5550.2 Ų50.228%0.28226%0.262SS..Hα-helixtrans-65.1-48.1173.1-63.3167.9000110.3Y194 K198 E205 N206 K211 L212 Y213Y194-I209 HydrophobicContact CD1-CG2 4.47Å; Y194-I209 HydrophobicContact CE1-CG2 3.61Å; K198-I209 HydrophobicContact CD-CG2 4.4Å; K198-I209 HydrophobicContact CG-CB 4.43Å; K198-I209 HydrophobicContact CG-CG2 3.88Å; E205-I209 WeakPolarHBondContact O-CG1 3.5Å; E205-I209 PolarHBondContact O-N 2.82Å; E205-I209 VanDerWaalsContact O-N 3.07Å; N206-I209 PolarHBondContact O-N 3.04Å; I209-K211 VanDerWaalsContact C-N 3.32Å; I209-K211 PolarHBondContact O-N 3.26Å; I209-L212 WeakPolarHBondContact O-CB 3.49Å; I209-L212 PolarHBondContact O-N 2.98Å; I209-L212 VanDerWaalsContact O-N 3.09Å; I209-Y213 HydrophobicContact CG2-CD2 3.74Å; I209-Y213 HydrophobicContact CG2-CE2 3.9Å; I209-Y213 WeakPolarHBondContact O-CD2 3.41Å; I209-Y213 PolarHBondContact O-N 3.06Å
210A98.6Very high97.7Very high0 Ų052.2 Ų52.20%027%0.272CS..Hα-helixtrans-57-46.5179.800000111.4A195 K198 C199 N206 L207 L212 Y213 Y214A195-A210 HydrophobicContact CB-CB 4.38Å; A195-A210 WeakPolarHBondContact CB-O 3.33Å; A195-A210 WeakPolarHBondContact O-CB 3.41Å; K198-A210 HydrophobicContact CB-CB 4.02Å; C199-A210 HydrophobicContact CB-CB 4.11Å; N206-A210 VanDerWaalsContact O-CB 3.29Å; N206-A210 WeakPolarHBondContact O-CB 3.38Å; N206-A210 PolarHBondContact O-N 3.21Å; L207-A210 PolarHBondContact O-N 3.35Å; A210-L212 VanDerWaalsContact C-N 3.34Å; A210-L212 PolarHBondContact O-N 3.2Å; A210-Y213 PolarHBondContact O-N 3.02Å; A210-Y214 HydrophobicContact CB-CD2 4.41Å; A210-Y214 HydrophobicContact CB-CE2 4.21Å; A210-Y214 WeakPolarHBondContact O-CD2 3.23Å; A210-Y214 PolarHBondContact O-N 3.07Å
211K98.1Very high97.7Very high22 Ų2252.1 Ų52.110%0.09626%0.264CS..Hα-helixtrans-51.6-51.5173.3178.5-158.669.9178.40111.5L207 I209 Y213 Y214 C215 L231 E249 F250 L253L207-K211 WeakPolarHBondContact O-CB 3.49Å; L207-K211 PolarHBondContact O-N 3.2Å; I209-K211 VanDerWaalsContact C-N 3.32Å; I209-K211 PolarHBondContact O-N 3.26Å; K211-Y213 PolarHBondContact O-N 3.27Å; K211-Y214 PolarHBondContact O-N 2.94Å; K211-C215 PolarHBondContact O-N 2.89Å; K211-C215 PolarHBondContact O-SG 3.47Å; K211-L231 HydrophobicContact CG-CD1 4.16Å; K211-E249 IonicContact NZ-OE1 3.93Å; K211-E249 PolarHBondContact NZ-OE1 3.49Å; K211-E249 IonicContact NZ-OE2 3.17Å; K211-E249 PolarHBondContact NZ-OE2 2.67Å; K211-F250 HydrophobicContact CB-CE1 3.96Å; K211-F250 HydrophobicContact CB-CZ 4.42Å; K211-F250 HydrophobicContact CD-CD1 4.08Å; K211-F250 HydrophobicContact CD-CE1 3.6Å; K211-F250 HydrophobicContact CD-CZ 3.86Å; K211-F250 HydrophobicContact CG-CD1 4.5Å; K211-F250 HydrophobicContact CG-CE1 3.95Å; K211-L253 HydrophobicContact CD-CD1 3.55Å; K211-L253 HydrophobicContact CG-CD1 3.68Å
212L98.3Very high97.6Very high112 Ų11253.3 Ų53.359%0.58628%0.276SS*.Hα-helixtrans-59.5-46.5-178.8-179.865.5000111.9E208 I209 A210 C215 Q216E208-L212 PolarHBondContact O-N 2.9Å; I209-L212 WeakPolarHBondContact O-CB 3.49Å; I209-L212 PolarHBondContact O-N 2.98Å; I209-L212 VanDerWaalsContact O-N 3.09Å; A210-L212 VanDerWaalsContact C-N 3.34Å; A210-L212 PolarHBondContact O-N 3.2Å; L212-C215 WeakPolarHBondContact O-CB 3.39Å; L212-C215 PolarHBondContact O-N 3.25Å; L212-Q216 PolarHBondContact O-N 3.46Å
213Y98.7Very high97.5Very high60 Ų6058.3 Ų58.324%0.23530%0.3CS..Hα-helixtrans-75.5-30.3-177.1-83-92.6000113.4I181 H191 Y194 I209 A210 K211 Q216 A217I181-Y213 HydrophobicContact CD1-CD1 4.07Å; I181-Y213 HydrophobicContact CD1-CE1 3.71Å; H191-Y213 HydrophobicContact CB-CD1 4.17Å; H191-Y213 AromaticContact ND1-CD1 3.35Å; H191-Y213 VanDerWaalsContact ND1-CD1 3.35Å; H191-Y213 WeakPolarHBondContact ND1-CD1 3.29Å; H191-Y213 AromaticContact ND1-CE1 3.58Å; Y194-Y213 AromaticContact CD1-CD1 3.61Å; Y194-Y213 HydrophobicContact CD1-CD1 3.61Å; Y194-Y213 AromaticContact CD1-CD2 3.61Å; Y194-Y213 HydrophobicContact CD1-CD2 3.61Å; Y194-Y213 AromaticContact CD1-CE1 3.79Å; Y194-Y213 HydrophobicContact CD1-CE1 3.79Å; Y194-Y213 AromaticContact CD1-CE2 3.79Å; Y194-Y213 HydrophobicContact CD1-CE2 3.79Å; Y194-Y213 AromaticContact CD1-CG 3.51Å; Y194-Y213 HydrophobicContact CD1-CG 3.51Å; Y194-Y213 AromaticContact CD1-CZ 3.85Å; Y194-Y213 HydrophobicContact CE1-CD1 4.23Å; Y194-Y213 AromaticContact CE1-CD2 3.59Å; Y194-Y213 HydrophobicContact CE1-CD2 3.59Å; Y194-Y213 HydrophobicContact CE1-CE1 4.07Å; Y194-Y213 AromaticContact CE1-CE2 3.39Å; Y194-Y213 HydrophobicContact CE1-CE2 3.39Å; Y194-Y213 HydrophobicContact CE1-CG 4Å; Y194-Y213 AromaticContact CE1-CZ 3.63Å; I209-Y213 HydrophobicContact CG2-CD2 3.74Å; I209-Y213 HydrophobicContact CG2-CE2 3.9Å; I209-Y213 WeakPolarHBondContact O-CD2 3.41Å; I209-Y213 PolarHBondContact O-N 3.06Å; A210-Y213 PolarHBondContact O-N 3.02Å; K211-Y213 PolarHBondContact O-N 3.27Å; Y213-Q216 PolarHBondContact O-N 3.01Å; Y213-A217 WeakPolarHBondContact O-CB 3.32Å; Y213-A217 PolarHBondContact O-N 3.48Å
214Y98.7Very high97.5Very high9 Ų956.7 Ų56.74%0.03528%0.282CS..Hα-helixtrans-63-44.6167.2-77.1-54.5000111.5A195 E196 A210 K211 Q216 A217 L218 A227 G230 L231 C234A195-Y214 HydrophobicContact CB-CD1 3.6Å; A195-Y214 HydrophobicContact CB-CD2 3.67Å; A195-Y214 HydrophobicContact CB-CE1 3.63Å; A195-Y214 HydrophobicContact CB-CE2 3.7Å; A195-Y214 HydrophobicContact CB-CG 3.6Å; E196-Y214 WeakPolarHBondContact CA-OH 3.46Å; E196-Y214 HydrophobicContact CG-CE1 4.13Å; E196-Y214 VanDerWaalsContact CG-OH 3.29Å; E196-Y214 WeakPolarHBondContact CG-OH 3.31Å; A210-Y214 HydrophobicContact CB-CD2 4.41Å; A210-Y214 HydrophobicContact CB-CE2 4.21Å; A210-Y214 WeakPolarHBondContact O-CD2 3.23Å; A210-Y214 PolarHBondContact O-N 3.07Å; K211-Y214 PolarHBondContact O-N 2.94Å; Y214-Q216 VanDerWaalsContact C-N 3.29Å; Y214-Q216 PolarHBondContact O-N 2.79Å; Y214-A217 PolarHBondContact O-N 3.45Å; Y214-L218 WeakPolarHBondContact O-CG 3.31Å; Y214-L218 PolarHBondContact O-N 3.19Å; Y214-A227 HydrophobicContact CD1-CB 4.37Å; Y214-G230 WeakPolarHBondContact CE2-O 3.33Å; Y214-G230 VanDerWaalsContact CZ-CA 3.43Å; Y214-L231 HydrophobicContact CD2-CB 4.39Å; Y214-L231 HydrophobicContact CG-CB 4.2Å; Y214-C234 HydrophobicContact CD2-CB 4.22Å; Y214-C234 HydrophobicContact CE2-CB 4.06Å
215C98.3Very high97.4Very high41 Ų4156 Ų5628%0.27728%0.283SS..Hα-helixtrans-59.4-41174.5-70.80000111.5K211 L212 L218 K219K211-C215 PolarHBondContact O-N 2.89Å; K211-C215 PolarHBondContact O-SG 3.47Å; L212-C215 WeakPolarHBondContact O-CB 3.39Å; L212-C215 PolarHBondContact O-N 3.25Å; C215-L218 PolarHBondContact O-N 3.39Å; C215-K219 WeakPolarHBondContact O-CB 3.39Å; C215-K219 PolarHBondContact O-N 3.34Å
216Q98.4Very high97.5Very high67 Ų6755.5 Ų55.531%0.31328%0.275SS..Hα-helixtrans-64.8-42.3175.8-177.262.46.200112.3L212 Y213 Y214 L218 K219 L220L212-Q216 PolarHBondContact O-N 3.46Å; Y213-Q216 PolarHBondContact O-N 3.01Å; Y214-Q216 VanDerWaalsContact C-N 3.29Å; Y214-Q216 PolarHBondContact O-N 2.79Å; Q216-L218 VanDerWaalsContact C-N 3.32Å; Q216-L218 PolarHBondContact O-N 3.25Å; Q216-K219 PolarHBondContact O-N 3.04Å; Q216-L220 WeakPolarHBondContact O-CG 3.48Å; Q216-L220 PolarHBondContact O-N 2.92Å; Q216-L220 VanDerWaalsContact O-N 3.12Å
217A98.6Very high97.5Very high0 Ų053.7 Ų53.70%027%0.265CS..Hα-helixtrans-60.1-42.4174.500000111.6H191 M192 Y213 Y214 L220 K221 A227H191-A217 HydrophobicContact CB-CB 3.98Å; M192-A217 HydrophobicContact CB-CB 4Å; Y213-A217 WeakPolarHBondContact O-CB 3.32Å; Y213-A217 PolarHBondContact O-N 3.48Å; Y214-A217 PolarHBondContact O-N 3.45Å; A217-L220 PolarHBondContact O-N 3.05Å; A217-K221 PolarHBondContact O-N 3.45Å; A217-A227 HydrophobicContact CB-CB 4.12Å
218L98.3Very high97.4Very high6 Ų653.7 Ų53.73%0.03127%0.265CS..Hα-helixtrans-70.8-32.1177.3-69.4171.9000112.9Y214 C215 Q216 L220 K221 P222 C224 A227 S228 L231 W256Y214-L218 WeakPolarHBondContact O-CG 3.31Å; Y214-L218 PolarHBondContact O-N 3.19Å; C215-L218 PolarHBondContact O-N 3.39Å; Q216-L218 VanDerWaalsContact C-N 3.32Å; Q216-L218 PolarHBondContact O-N 3.25Å; L218-L220 VanDerWaalsContact C-N 3.3Å; L218-L220 PolarHBondContact O-N 3Å; L218-K221 CarbonylContact O-C 3.58Å; L218-K221 PolarHBondContact O-N 3.39Å; L218-P222 WeakPolarHBondContact O-CA 3.13Å; L218-P222 WeakPolarHBondContact O-CD 3.41Å; L218-P222 WeakPolarHBondContact O-CG 3.27Å; L218-C224 HydrophobicContact CD2-CB 4.27Å; L218-A227 HydrophobicContact CD2-CB 3.76Å; L218-A227 HydrophobicContact CG-CB 3.94Å; L218-S228 VanDerWaalsContact CD2-OG 3.31Å; L218-S228 WeakPolarHBondContact CD2-OG 3.36Å; L218-L231 HydrophobicContact CD1-CD2 3.83Å; L218-W256 HydrophobicContact CD1-CH2 4.05Å; L218-W256 HydrophobicContact CD1-CZ3 3.82Å
219K97.8Very high97.4Very high166 Ų16653.7 Ų53.772%0.72226%0.263SS*.Hα-helixtrans-62.4-39.4171.4-176.1176.7179.2179.80111.8C215 Q216C215-K219 WeakPolarHBondContact O-CB 3.39Å; C215-K219 PolarHBondContact O-N 3.34Å; Q216-K219 PolarHBondContact O-N 3.04Å
220L98.2Very high97.3Very high60 Ų6051.5 Ų51.531%0.31425%0.254SS..Hα-helixtrans-78.8-32.9177.9-66.3170.5000112.7L186 Q216 A217 L218L186-L220 HydrophobicContact CD2-CD2 4.01Å; Q216-L220 WeakPolarHBondContact O-CG 3.48Å; Q216-L220 PolarHBondContact O-N 2.92Å; Q216-L220 VanDerWaalsContact O-N 3.12Å; A217-L220 PolarHBondContact O-N 3.05Å; L218-L220 VanDerWaalsContact C-N 3.3Å; L218-L220 PolarHBondContact O-N 3Å
221K97.3Very high97.3Very high82 Ų8251.5 Ų51.536%0.35725%0.254SS..  trans-140.988.3176.9-171.6176.6178.7170.10111Y188 A217 L218 N223 C224Y188-K221 HydrophobicContact CD1-CB 4.16Å; Y188-K221 HydrophobicContact CD1-CD 4Å; Y188-K221 HydrophobicContact CD2-CB 3.93Å; Y188-K221 HydrophobicContact CD2-CD 3.78Å; Y188-K221 HydrophobicContact CD2-CG 4.49Å; Y188-K221 HydrophobicContact CE1-CD 3.66Å; Y188-K221 HydrophobicContact CE2-CB 4.44Å; Y188-K221 HydrophobicContact CE2-CD 3.41Å; Y188-K221 VanDerWaalsContact CE2-CD 3.41Å; Y188-K221 HydrophobicContact CG-CB 3.78Å; Y188-K221 HydrophobicContact CG-CD 4.06Å; Y188-K221 PolarHBondContact OH-NZ 2.96Å; A217-K221 PolarHBondContact O-N 3.45Å; L218-K221 CarbonylContact O-C 3.58Å; L218-K221 PolarHBondContact O-N 3.39Å; K221-N223 VanDerWaalsContact C-N 3.3Å; K221-N223 PolarHBondContact O-N 3.44Å; K221-C224 HydrophobicContact CB-CB 4.2Å; K221-C224 HydrophobicContact CD-CB 4.04Å; K221-C224 HydrophobicContact CG-CB 3.97Å; K221-C224 VanDerWaalsContact O-CB 3.24Å; K221-C224 WeakPolarHBondContact O-CB 3.29Å; K221-C224 PolarHBondContact O-N 2.89Å; K221-C224 VanDerWaalsContact O-N 3.14Å
222P95.3Very high97.2Very high80 Ų8050.9 Ų50.952%0.51925%0.251SS..THydrogen-bonded Turntrans-58.3-36-174.8-29.336.3000114.8L218 C224L218-P222 WeakPolarHBondContact O-CA 3.13Å; L218-P222 WeakPolarHBondContact O-CD 3.41Å; L218-P222 WeakPolarHBondContact O-CG 3.27Å; P222-C224 VanDerWaalsContact C-N 3.26Å; P222-C224 PolarHBondContact O-N 2.82Å
223N93.1Very high97.1Very high119 Ų11950.6 Ų50.664%0.63625%0.248SC*.THydrogen-bonded Turntrans-89.421.3-177.6-63.5-6.9000113.2K221 A225 L264K221-N223 VanDerWaalsContact C-N 3.3Å; K221-N223 PolarHBondContact O-N 3.44Å; N223-A225 PolarHBondContact O-N 3.37Å; N223-A225 VanDerWaalsContact O-N 3.07Å; N223-L264 HydrophobicContact CB-CD1 3.8Å
224C95.5Very high97Very high10 Ų1047.8 Ų47.87%0.06824%0.237CC..  trans-78.290.5179.1-1720000111L218 K221 P222 R226 A227 S228L218-C224 HydrophobicContact CD2-CB 4.27Å; K221-C224 HydrophobicContact CB-CB 4.2Å; K221-C224 HydrophobicContact CD-CB 4.04Å; K221-C224 HydrophobicContact CG-CB 3.97Å; K221-C224 VanDerWaalsContact O-CB 3.24Å; K221-C224 WeakPolarHBondContact O-CB 3.29Å; K221-C224 PolarHBondContact O-N 2.89Å; K221-C224 VanDerWaalsContact O-N 3.14Å; P222-C224 VanDerWaalsContact C-N 3.26Å; P222-C224 PolarHBondContact O-N 2.82Å; C224-R226 PolarHBondContact O-N 2.85Å; C224-R226 VanDerWaalsContact O-N 3.11Å; C224-A227 HydrophobicContact CB-CB 3.97Å; C224-A227 PolarHBondContact O-N 3.34Å; C224-S228 PolarHBondContact O-N 3.35Å; C224-S228 PolarHBondContact O-OG 2.97Å
225A94.3Very high96.9Very high33 Ų3347.3 Ų47.327%0.27324%0.235SC..Hα-helixtrans-51.3-39.7-179.400000113.3N223 S228 W229 L264N223-A225 PolarHBondContact O-N 3.37Å; N223-A225 VanDerWaalsContact O-N 3.07Å; A225-S228 PolarHBondContact O-N 3.16Å; A225-W229 WeakPolarHBondContact O-CB 3.39Å; A225-W229 PolarHBondContact O-N 2.86Å; A225-L264 HydrophobicContact CB-CD2 3.73Å
226R97.3Very high96.7Very high149 Ų14947.2 Ų47.256%0.56223%0.233SC*.Hα-helixtrans-64.1-44.3179.2-176169.6174.8164.1-1.2112.2M192 E196 C224 G230M192-R226 HydrophobicContact CE-CG 4.23Å; M192-R226 HydrophobicContact SD-CB 3.76Å; M192-R226 HydrophobicContact SD-CG 3.64Å; E196-R226 WeakPolarHBondContact OE1-CG 3.42Å; E196-R226 IonicContact OE1-CZ 2.67Å; E196-R226 IonicContact OE1-NE 3.56Å; E196-R226 PolarHBondContact OE1-NE 3.26Å; E196-R226 IonicContact OE1-NH2 3.12Å; E196-R226 PolarHBondContact OE1-NH2 3.18Å; E196-R226 IonicContact OE2-CZ 2.69Å; E196-R226 IonicContact OE2-NE 3.41Å; E196-R226 IonicContact OE2-NH2 3.47Å; E196-R226 PolarHBondContact OE2-NH2 3.01Å; C224-R226 PolarHBondContact O-N 2.85Å; C224-R226 VanDerWaalsContact O-N 3.11Å; R226-G230 PolarHBondContact O-N 3.46Å
227A98.1Very high96.5Very high0 Ų047.4 Ų47.40%023%0.234CC..Hα-helixtrans-67.3-37.7175.400000111.9M192 Y214 A217 L218 C224 G230 L231M192-A227 HydrophobicContact CG-CB 4.08Å; M192-A227 HydrophobicContact SD-CB 4.3Å; Y214-A227 HydrophobicContact CD1-CB 4.37Å; A217-A227 HydrophobicContact CB-CB 4.12Å; L218-A227 HydrophobicContact CD2-CB 3.76Å; L218-A227 HydrophobicContact CG-CB 3.94Å; C224-A227 HydrophobicContact CB-CB 3.97Å; C224-A227 PolarHBondContact O-N 3.34Å; A227-G230 PolarHBondContact O-N 3.4Å; A227-L231 WeakPolarHBondContact O-CB 3.26Å; A227-L231 PolarHBondContact O-N 2.64Å
228S96.9Very high96.4Very high0 Ų047.4 Ų47.40%023%0.234CC..Hα-helixtrans-64.3-45.6175.9-56.10000112L218 C224 A225 G230 L231 Y232 V257 L261L218-S228 VanDerWaalsContact CD2-OG 3.31Å; L218-S228 WeakPolarHBondContact CD2-OG 3.36Å; C224-S228 PolarHBondContact O-N 3.35Å; C224-S228 PolarHBondContact O-OG 2.97Å; A225-S228 PolarHBondContact O-N 3.16Å; S228-G230 VanDerWaalsContact C-N 3.34Å; S228-G230 PolarHBondContact O-N 3.09Å; S228-L231 PolarHBondContact O-N 3.32Å; S228-Y232 WeakPolarHBondContact O-CB 3.49Å; S228-Y232 PolarHBondContact O-N 2.96Å; S228-V257 WeakPolarHBondContact O-CG2 3.41Å; S228-L261 VanDerWaalsContact CB-CD2 3.46Å
229W96.6Very high96.2Very high56 Ų5647.2 Ų47.221%0.21223%0.233CC..Hα-helixtrans-64.1-39.2173.8-80.8116000112.3A225 Y232 M233 L261 Y265 I283 M286 L287A225-W229 WeakPolarHBondContact O-CB 3.39Å; A225-W229 PolarHBondContact O-N 2.86Å; W229-Y232 AromaticContact CE3-CD1 3.96Å; W229-Y232 HydrophobicContact CE3-CD1 3.96Å; W229-Y232 HydrophobicContact CE3-CG 4.31Å; W229-Y232 AromaticContact CZ3-CD1 3.98Å; W229-Y232 HydrophobicContact CZ3-CD1 3.98Å; W229-Y232 HydrophobicContact CZ3-CE1 4.11Å; W229-Y232 HydrophobicContact CZ3-CG 4.41Å; W229-Y232 WeakPolarHBondContact O-CB 3.14Å; W229-Y232 PolarHBondContact O-N 2.68Å; W229-M233 WeakPolarHBondContact O-CG 3.23Å; W229-M233 PolarHBondContact O-N 3.26Å; W229-L261 HydrophobicContact CD2-CD1 4.05Å; W229-L261 HydrophobicContact CD2-CD2 4.21Å; W229-L261 HydrophobicContact CE3-CD1 4.09Å; W229-L261 HydrophobicContact CG-CD2 4.19Å; W229-L261 HydrophobicContact CZ2-CD1 4.5Å; W229-L261 HydrophobicContact CZ3-CD1 4.33Å; W229-Y265 HydrophobicContact CZ2-CE2 4.02Å; W229-Y265 AromaticContact NE1-CE2 3.62Å; W229-Y265 AromaticContact NE1-CZ 3.71Å; W229-Y265 PolarHBondContact NE1-OH 2.98Å; W229-I283 HydrophobicContact CH2-CG2 4.41Å; W229-I283 HydrophobicContact CZ2-CG2 4.25Å; W229-M286 HydrophobicContact CH2-SD 3.72Å; W229-M286 HydrophobicContact CZ3-SD 3.69Å; W229-L287 HydrophobicContact CH2-CD2 4.31Å; W229-L287 HydrophobicContact CZ3-CD2 4.39Å
230G97.5Very high96Very high9 Ų943.9 Ų43.99%0.09323%0.228CC..Hα-helixtrans-59.8-46.1174.100000112.6Y214 R226 A227 S228 M233 C234Y214-G230 WeakPolarHBondContact CE2-O 3.33Å; Y214-G230 VanDerWaalsContact CZ-CA 3.43Å; R226-G230 PolarHBondContact O-N 3.46Å; A227-G230 PolarHBondContact O-N 3.4Å; S228-G230 VanDerWaalsContact C-N 3.34Å; S228-G230 PolarHBondContact O-N 3.09Å; G230-M233 PolarHBondContact O-N 2.77Å; G230-C234 VanDerWaalsContact O-CB 3.26Å; G230-C234 WeakPolarHBondContact O-CB 3.49Å; G230-C234 PolarHBondContact O-N 2.87Å
231L97.8Very high95.8Very high0 Ų046.5 Ų46.50%024%0.237CC..Hα-helixtrans-64.1-42.4175.7-178.658.7000112K211 Y214 L218 A227 S228 C234 C235 W256 V257K211-L231 HydrophobicContact CG-CD1 4.16Å; Y214-L231 HydrophobicContact CD2-CB 4.39Å; Y214-L231 HydrophobicContact CG-CB 4.2Å; L218-L231 HydrophobicContact CD1-CD2 3.83Å; A227-L231 WeakPolarHBondContact O-CB 3.26Å; A227-L231 PolarHBondContact O-N 2.64Å; S228-L231 PolarHBondContact O-N 3.32Å; L231-C234 PolarHBondContact O-N 3.07Å; L231-C235 PolarHBondContact O-N 2.95Å; L231-C235 PolarHBondContact O-SG 3.47Å; L231-W256 HydrophobicContact CD2-CE3 4.4Å; L231-W256 HydrophobicContact CD2-CZ3 4.07Å; L231-V257 HydrophobicContact CB-CG2 4.21Å; L231-V257 HydrophobicContact CD2-CB 4.14Å; L231-V257 HydrophobicContact CD2-CG2 4.1Å; L231-V257 HydrophobicContact CG-CB 4.43Å; L231-V257 HydrophobicContact CG-CG2 4.35Å
232Y96Very high95.6Very high9 Ų943.3 Ų43.34%0.03523%0.225CC..Hα-helixtrans-55.9-52.9174.7172.7-89.8000111S228 W229 C234 C235 V236 L254 V257 M286 L287 T290S228-Y232 WeakPolarHBondContact O-CB 3.49Å; S228-Y232 PolarHBondContact O-N 2.96Å; W229-Y232 AromaticContact CE3-CD1 3.96Å; W229-Y232 HydrophobicContact CE3-CD1 3.96Å; W229-Y232 HydrophobicContact CE3-CG 4.31Å; W229-Y232 AromaticContact CZ3-CD1 3.98Å; W229-Y232 HydrophobicContact CZ3-CD1 3.98Å; W229-Y232 HydrophobicContact CZ3-CE1 4.11Å; W229-Y232 HydrophobicContact CZ3-CG 4.41Å; W229-Y232 WeakPolarHBondContact O-CB 3.14Å; W229-Y232 PolarHBondContact O-N 2.68Å; Y232-C234 VanDerWaalsContact C-N 3.34Å; Y232-C234 PolarHBondContact O-N 3.3Å; Y232-C235 PolarHBondContact O-N 3.26Å; Y232-V236 HydrophobicContact CD1-CG2 4.31Å; Y232-V236 HydrophobicContact CE1-CG2 3.97Å; Y232-V236 HydrophobicContact CE2-CG2 4.37Å; Y232-V236 WeakPolarHBondContact O-CG2 3.44Å; Y232-V236 PolarHBondContact O-N 2.96Å; Y232-L254 HydrophobicContact CD2-CD1 3.44Å; Y232-L254 VanDerWaalsContact CD2-CD1 3.44Å; Y232-L254 HydrophobicContact CE2-CD1 3.69Å; Y232-L254 HydrophobicContact CG-CD1 4.21Å; Y232-V257 HydrophobicContact CD2-CG1 4.41Å; Y232-M286 PolarHBondContact OH-O 3.09Å; Y232-L287 HydrophobicContact CD2-CD2 3.93Å; Y232-L287 HydrophobicContact CE2-CD2 3.58Å; Y232-T290 HydrophobicContact CE2-CG2 4.25Å; Y232-T290 WeakPolarHBondContact OH-CG2 3.5Å; Y232-T290 PolarHBondContact OH-OG1 3.43Å
233M95.4Very high95.5Very high107 Ų10744.2 Ų44.253%0.52723%0.233SC..Hα-helixtrans-63.2-40.6179.9-68.4-57.6-65.600112W229 G230 C235 V236 Q237W229-M233 WeakPolarHBondContact O-CG 3.23Å; W229-M233 PolarHBondContact O-N 3.26Å; G230-M233 PolarHBondContact O-N 2.77Å; M233-C235 PolarHBondContact O-N 3.16Å; M233-V236 PolarHBondContact O-N 2.87Å; M233-Q237 WeakPolarHBondContact O-CB 3.43Å; M233-Q237 PolarHBondContact O-N 3.02Å
234C97.3Very high95.6Very high0 Ų041 Ų410%023%0.227CC..Hα-helixtrans-58.4-46.3175-178.80000111.4L207 Y214 G230 L231 Y232 Q237 A238L207-C234 PolarHBondContact O-SG 3.48Å; L207-C234 VanDerWaalsContact O-SG 3.35Å; Y214-C234 HydrophobicContact CD2-CB 4.22Å; Y214-C234 HydrophobicContact CE2-CB 4.06Å; G230-C234 VanDerWaalsContact O-CB 3.26Å; G230-C234 WeakPolarHBondContact O-CB 3.49Å; G230-C234 PolarHBondContact O-N 2.87Å; L231-C234 PolarHBondContact O-N 3.07Å; Y232-C234 VanDerWaalsContact C-N 3.34Å; Y232-C234 PolarHBondContact O-N 3.3Å; C234-Q237 PolarHBondContact O-N 2.83Å; C234-A238 VanDerWaalsContact O-CB 3.27Å; C234-A238 WeakPolarHBondContact O-CB 3.08Å; C234-A238 PolarHBondContact O-N 2.88Å
235C96.3Very high95.5Very high0 Ų047.5 Ų47.50%026%0.257CS..Hα-helixtrans-64.5-47177.5-64.40000111.9L231 Y232 M233 Q237 A238 I239 F250 L254L231-C235 PolarHBondContact O-N 2.95Å; L231-C235 PolarHBondContact O-SG 3.47Å; Y232-C235 PolarHBondContact O-N 3.26Å; M233-C235 PolarHBondContact O-N 3.16Å; C235-Q237 VanDerWaalsContact C-N 3.26Å; C235-Q237 PolarHBondContact O-N 3.11Å; C235-A238 PolarHBondContact O-N 3.41Å; C235-A238 VanDerWaalsContact O-N 3.16Å; C235-I239 HydrophobicContact CB-CD1 4.44Å; C235-I239 WeakPolarHBondContact O-CD1 3.23Å; C235-I239 WeakPolarHBondContact O-CG1 3.2Å; C235-I239 PolarHBondContact O-N 3.41Å; C235-F250 HydrophobicContact CB-CD1 4.25Å; C235-L254 HydrophobicContact CB-CB 3.94Å; C235-L254 HydrophobicContact CB-CD1 4.06Å; C235-L254 HydrophobicContact CB-CG 4.49Å
236V94.2Very high95.4Very high38 Ų3850.6 Ų50.623%0.2326%0.264CS..Hα-helixtrans-58.1-40.2177.8171.10000111.4Y232 M233 P240 L254 T290 I292Y232-V236 HydrophobicContact CD1-CG2 4.31Å; Y232-V236 HydrophobicContact CE1-CG2 3.97Å; Y232-V236 HydrophobicContact CE2-CG2 4.37Å; Y232-V236 WeakPolarHBondContact O-CG2 3.44Å; Y232-V236 PolarHBondContact O-N 2.96Å; M233-V236 PolarHBondContact O-N 2.87Å; V236-P240 WeakPolarHBondContact O-CD 3.41Å; V236-L254 HydrophobicContact CG2-CD1 3.95Å; V236-L254 HydrophobicContact CG2-CD2 4.41Å; V236-T290 HydrophobicContact CG2-CG2 3.66Å; V236-I292 HydrophobicContact CG1-CD1 4.48Å
237Q94.6Very high95.3Very high72 Ų7248 Ų4834%0.33625%0.254SS..Hα-helixtrans-72.2-33.6178.2-170.7-1771.100113.1C199 L207 M233 C234 C235 K241C199-Q237 PolarHBondContact SG-OE1 3.11Å; L207-Q237 HydrophobicContact CD1-CG 4.16Å; L207-Q237 HydrophobicContact CD2-CG 4.4Å; M233-Q237 WeakPolarHBondContact O-CB 3.43Å; M233-Q237 PolarHBondContact O-N 3.02Å; C234-Q237 PolarHBondContact O-N 2.83Å; C235-Q237 VanDerWaalsContact C-N 3.26Å; C235-Q237 PolarHBondContact O-N 3.11Å; Q237-K241 WeakPolarHBondContact O-CE 3.43Å
238A95.8Very high95.1Very high0 Ų055.1 Ų55.10%029%0.285CS..Hα-helixtrans-80.2-42-176.600000113.1M204 L207 C234 C235 K241 V242 F250M204-A238 HydrophobicContact CE-CB 4.23Å; L207-A238 HydrophobicContact CD1-CB 4.23Å; C234-A238 VanDerWaalsContact O-CB 3.27Å; C234-A238 WeakPolarHBondContact O-CB 3.08Å; C234-A238 PolarHBondContact O-N 2.88Å; C235-A238 PolarHBondContact O-N 3.41Å; C235-A238 VanDerWaalsContact O-N 3.16Å; A238-K241 WeakPolarHBondContact O-CA 3.46Å; A238-K241 WeakPolarHBondContact O-CB 3.46Å; A238-K241 PolarHBondContact O-N 3.12Å; A238-V242 WeakPolarHBondContact O-CG2 3.23Å; A238-V242 PolarHBondContact O-N 3.24Å; A238-F250 HydrophobicContact CB-CD1 3.8Å; A238-F250 HydrophobicContact CB-CD2 4.08Å; A238-F250 HydrophobicContact CB-CE1 3.54Å; A238-F250 HydrophobicContact CB-CE2 3.88Å; A238-F250 HydrophobicContact CB-CG 4.05Å; A238-F250 HydrophobicContact CB-CZ 3.59Å
239I94.8Very high95Very high2 Ų258.6 Ų58.61%0.0130%0.301CS..G310 helixtrans-54.5-43.4-170.5-69.4160.7000114.1C235 K241 V242 R247 F250 I251 L254 I292C235-I239 HydrophobicContact CB-CD1 4.44Å; C235-I239 WeakPolarHBondContact O-CD1 3.23Å; C235-I239 WeakPolarHBondContact O-CG1 3.2Å; C235-I239 PolarHBondContact O-N 3.41Å; I239-K241 PolarHBondContact O-N 2.91Å; I239-V242 PolarHBondContact O-N 2.99Å; I239-R247 HydrophobicContact CG2-CG 4.19Å; I239-F250 HydrophobicContact CD1-CB 4.23Å; I239-F250 HydrophobicContact CG1-CB 3.59Å; I239-I251 HydrophobicContact CD1-CG1 3.94Å; I239-I251 HydrophobicContact CG1-CG1 4.23Å; I239-I251 HydrophobicContact CG2-CG1 4.3Å; I239-L254 HydrophobicContact CD1-CB 4.28Å; I239-L254 HydrophobicContact CD1-CD2 3.66Å; I239-I292 HydrophobicContact CB-CG2 4.08Å; I239-I292 HydrophobicContact CD1-CG2 3.65Å; I239-I292 HydrophobicContact CG1-CG2 4.38Å; I239-I292 HydrophobicContact CG2-CG2 3.39Å
240P93.3Very high95Very high96 Ų9656 Ų5662%0.62329%0.291SS*.G310 helixtrans-64.1-19.5177.4-22.734.5000114.1V236V236-P240 WeakPolarHBondContact O-CD 3.41Å
241K93.8Very high94.8Very high114 Ų11456.2 Ų56.250%0.49629%0.291SS..G310 helixtrans-99.9-8.9-173.5-57177.5-176.3179.90113.5M204 L207 Q237 A238 I239M204-K241 HydrophobicContact CG-CB 4.22Å; M204-K241 HydrophobicContact SD-CB 3.49Å; M204-K241 WeakPolarHBondContact SD-CB 3.33Å; M204-K241 HydrophobicContact SD-CD 3.87Å; M204-K241 HydrophobicContact SD-CG 4.33Å; L207-K241 HydrophobicContact CD1-CD 4.44Å; Q237-K241 WeakPolarHBondContact O-CE 3.43Å; A238-K241 WeakPolarHBondContact O-CA 3.46Å; A238-K241 WeakPolarHBondContact O-CB 3.46Å; A238-K241 PolarHBondContact O-N 3.12Å; I239-K241 PolarHBondContact O-N 2.91Å
242V93.8Very high94.7Very high16 Ų1660.5 Ų60.510%0.09732%0.317CS..  trans-118.8154.9-177.3-64.20000112.2M204 A238 I239 K246 R247 F250M204-V242 HydrophobicContact CE-CG1 3.16Å; M204-V242 HydrophobicContact SD-CG1 3.85Å; A238-V242 WeakPolarHBondContact O-CG2 3.23Å; A238-V242 PolarHBondContact O-N 3.24Å; I239-V242 PolarHBondContact O-N 2.99Å; V242-K246 HydrophobicContact CB-CB 4.27Å; V242-R247 HydrophobicContact CG2-CB 3.84Å; V242-R247 HydrophobicContact CG2-CG 4.24Å; V242-R247 WeakPolarHBondContact O-CD 3.43Å; V242-F250 HydrophobicContact CG1-CE2 4.46Å; V242-F250 HydrophobicContact CG2-CD2 4.06Å
243S93.5Very high94.7Very high98 Ų9861.7 Ų61.769%0.68532%0.323SS*.  trans-129.3171.517662.70000111R247S243-R247 PolarHBondContact O-N 3.46Å
244G94.4Very high94.6Very high51 Ų5156.6 Ų56.653%0.52630%0.298SS..Hα-helixtrans61.6-138.9173.700000114.6K246 R247 K248G244-K246 PolarHBondContact O-N 2.98Å; G244-R247 WeakPolarHBondContact O-CB 3.19Å; G244-R247 PolarHBondContact O-N 3.19Å; G244-K248 PolarHBondContact O-N 3.1Å
245H93.9Very high94.4Very high148 Ų14861.9 Ų61.969%0.68532%0.318SS*.Hα-helixtrans-59.6-44.4-176.4-178.4-84.8000112.6R247 K248 E249H245-R247 VanDerWaalsContact C-N 3.27Å; H245-R247 PolarHBondContact O-N 3Å; H245-K248 WeakPolarHBondContact O-CB 3.17Å; H245-K248 PolarHBondContact O-N 3.49Å; H245-K248 VanDerWaalsContact O-N 3.09Å; H245-E249 PolarHBondContact O-N 3.42Å
246K92.7Very high94.3Very high97 Ų9768 Ų6842%0.42234%0.342SS..Hα-helixtrans-58-42179.2-68.5-172.2171.7-162.70111.4E208 V242 G244 K248 E249 F250E208-K246 VanDerWaalsContact CD-NZ 3.32Å; E208-K246 WeakPolarHBondContact OE1-CD 3.49Å; E208-K246 WeakPolarHBondContact OE1-CE 3.49Å; E208-K246 IonicContact OE1-NZ 3.25Å; E208-K246 PolarHBondContact OE1-NZ 3.17Å; E208-K246 IonicContact OE2-NZ 3.28Å; E208-K246 PolarHBondContact OE2-NZ 3.39Å; E208-K246 VanDerWaalsContact OE2-NZ 3.12Å; V242-K246 HydrophobicContact CB-CB 4.27Å; G244-K246 PolarHBondContact O-N 2.98Å; K246-K248 PolarHBondContact O-N 3.16Å; K246-E249 WeakPolarHBondContact O-CB 3.47Å; K246-E249 PolarHBondContact O-N 2.93Å; K246-F250 VanDerWaalsContact O-CD2 3.29Å; K246-F250 WeakPolarHBondContact O-CD2 3.48Å; K246-F250 PolarHBondContact O-N 2.75Å; K246-F250 VanDerWaalsContact O-N 3.13Å
247R94.3Very high94.3Very high94 Ų9466.2 Ų66.236%0.35533%0.331SS..Hα-helixtrans-60.4-44.7175.7-171.3179.7175.8136.8-8.2112.3I239 V242 S243 G244 H245 E249 F250 I251I239-R247 HydrophobicContact CG2-CG 4.19Å; V242-R247 HydrophobicContact CG2-CB 3.84Å; V242-R247 HydrophobicContact CG2-CG 4.24Å; V242-R247 WeakPolarHBondContact O-CD 3.43Å; S243-R247 PolarHBondContact O-N 3.46Å; G244-R247 WeakPolarHBondContact O-CB 3.19Å; G244-R247 PolarHBondContact O-N 3.19Å; H245-R247 VanDerWaalsContact C-N 3.27Å; H245-R247 PolarHBondContact O-N 3Å; R247-E249 VanDerWaalsContact C-N 3.31Å; R247-E249 PolarHBondContact O-N 3.35Å; R247-F250 PolarHBondContact O-N 2.86Å; R247-I251 HydrophobicContact CG-CD1 3.95Å; R247-I251 WeakPolarHBondContact O-CG1 3.2Å; R247-I251 PolarHBondContact O-N 3.32Å
248K94.6Very high94.2Very high150 Ų15063.7 Ų63.765%0.65232%0.32SS*.Hα-helixtrans-61.2-41.4177.6-66.8-177.6179.2-177.40111.5G244 H245 K246 I251 T252G244-K248 PolarHBondContact O-N 3.1Å; H245-K248 WeakPolarHBondContact O-CB 3.17Å; H245-K248 PolarHBondContact O-N 3.49Å; H245-K248 VanDerWaalsContact O-N 3.09Å; K246-K248 PolarHBondContact O-N 3.16Å; K248-I251 PolarHBondContact O-N 3.34Å; K248-T252 PolarHBondContact O-N 2.87Å; K248-T252 PolarHBondContact O-OG1 3.45Å; K248-T252 VanDerWaalsContact O-OG1 3.05Å
249E94.8Very high93.9Very high73 Ų7368.4 Ų68.434%0.34135%0.345SS..Hα-helixtrans-59.6-49.5177.5-167.4-168.7163.200112K211 H245 K246 R247 I251 T252 L253K211-E249 IonicContact NZ-OE1 3.93Å; K211-E249 PolarHBondContact NZ-OE1 3.49Å; K211-E249 IonicContact NZ-OE2 3.17Å; K211-E249 PolarHBondContact NZ-OE2 2.67Å; H245-E249 PolarHBondContact O-N 3.42Å; K246-E249 WeakPolarHBondContact O-CB 3.47Å; K246-E249 PolarHBondContact O-N 2.93Å; R247-E249 VanDerWaalsContact C-N 3.31Å; R247-E249 PolarHBondContact O-N 3.35Å; E249-I251 VanDerWaalsContact C-N 3.35Å; E249-I251 PolarHBondContact O-N 2.95Å; E249-T252 PolarHBondContact O-N 2.96Å; E249-L253 HydrophobicContact CG-CD1 4.42Å; E249-L253 WeakPolarHBondContact O-CG 3.32Å; E249-L253 PolarHBondContact O-N 3.25Å
250F95.5Very high93.8Very high1 Ų169.3 Ų69.30%0.00435%0.352CS..Hα-helixtrans-64.3-36.2177-80-74.6000112.8M204 E208 K211 C235 A238 I239 V242 K246 R247 L253 L254M204-F250 HydrophobicContact CE-CE2 4.34Å; E208-F250 HydrophobicContact CG-CE2 4.43Å; E208-F250 HydrophobicContact CG-CZ 4.28Å; K211-F250 HydrophobicContact CB-CE1 3.96Å; K211-F250 HydrophobicContact CB-CZ 4.42Å; K211-F250 HydrophobicContact CD-CD1 4.08Å; K211-F250 HydrophobicContact CD-CE1 3.6Å; K211-F250 HydrophobicContact CD-CZ 3.86Å; K211-F250 HydrophobicContact CG-CD1 4.5Å; K211-F250 HydrophobicContact CG-CE1 3.95Å; C235-F250 HydrophobicContact CB-CD1 4.25Å; A238-F250 HydrophobicContact CB-CD1 3.8Å; A238-F250 HydrophobicContact CB-CD2 4.08Å; A238-F250 HydrophobicContact CB-CE1 3.54Å; A238-F250 HydrophobicContact CB-CE2 3.88Å; A238-F250 HydrophobicContact CB-CG 4.05Å; A238-F250 HydrophobicContact CB-CZ 3.59Å; I239-F250 HydrophobicContact CD1-CB 4.23Å; I239-F250 HydrophobicContact CG1-CB 3.59Å; V242-F250 HydrophobicContact CG1-CE2 4.46Å; V242-F250 HydrophobicContact CG2-CD2 4.06Å; K246-F250 VanDerWaalsContact O-CD2 3.29Å; K246-F250 WeakPolarHBondContact O-CD2 3.48Å; K246-F250 PolarHBondContact O-N 2.75Å; K246-F250 VanDerWaalsContact O-N 3.13Å; R247-F250 PolarHBondContact O-N 2.86Å; F250-L253 PolarHBondContact O-N 2.74Å; F250-L254 VanDerWaalsContact O-CB 3.26Å; F250-L254 WeakPolarHBondContact O-CB 3.45Å; F250-L254 PolarHBondContact O-N 3.04Å
251I94.5Very high93.7Very high15 Ų1564.8 Ų64.88%0.07732%0.322CS..Hα-helixtrans-65.1-43.7175.1-70.3169000110.9I239 R247 K248 E249 L254 R255 I292I239-I251 HydrophobicContact CD1-CG1 3.94Å; I239-I251 HydrophobicContact CG1-CG1 4.23Å; I239-I251 HydrophobicContact CG2-CG1 4.3Å; R247-I251 HydrophobicContact CG-CD1 3.95Å; R247-I251 WeakPolarHBondContact O-CG1 3.2Å; R247-I251 PolarHBondContact O-N 3.32Å; K248-I251 PolarHBondContact O-N 3.34Å; E249-I251 VanDerWaalsContact C-N 3.35Å; E249-I251 PolarHBondContact O-N 2.95Å; I251-L254 PolarHBondContact O-N 3.46Å; I251-R255 WeakPolarHBondContact O-CG 3.49Å; I251-R255 PolarHBondContact O-N 3.13Å; I251-I292 HydrophobicContact CG1-CG2 4.42Å
252T95.2Very high93.4Very high90 Ų9062.9 Ų62.955%0.55231%0.314SS*.Hα-helixtrans-62.3-44.2177-61.10000111.4K248 E249 R255 W256K248-T252 PolarHBondContact O-N 2.87Å; K248-T252 PolarHBondContact O-OG1 3.45Å; K248-T252 VanDerWaalsContact O-OG1 3.05Å; E249-T252 PolarHBondContact O-N 2.96Å; T252-R255 PolarHBondContact O-N 3.22Å; T252-W256 PolarHBondContact O-N 3Å
253L95.3Very high93.2Very high33 Ų3368.6 Ų68.617%0.17334%0.34CS..Hα-helixtrans-65.2-39.5175.6-73.9169.7000112.3K211 E249 F250 R255 W256 V257K211-L253 HydrophobicContact CD-CD1 3.55Å; K211-L253 HydrophobicContact CG-CD1 3.68Å; E249-L253 HydrophobicContact CG-CD1 4.42Å; E249-L253 WeakPolarHBondContact O-CG 3.32Å; E249-L253 PolarHBondContact O-N 3.25Å; F250-L253 PolarHBondContact O-N 2.74Å; L253-R255 VanDerWaalsContact C-N 3.33Å; L253-R255 PolarHBondContact O-N 3.23Å; L253-W256 PolarHBondContact O-N 2.8Å; L253-V257 WeakPolarHBondContact O-CB 3.49Å; L253-V257 WeakPolarHBondContact O-CG1 3.44Å; L253-V257 PolarHBondContact O-N 2.86Å
254L94.9Very high93Very high0 Ų064.6 Ų64.60%031%0.311CS..Hα-helixtrans-60.8-42176-178.162.2000111.6Y232 C235 V236 I239 F250 I251 V257 T258 I292 V293Y232-L254 HydrophobicContact CD2-CD1 3.44Å; Y232-L254 VanDerWaalsContact CD2-CD1 3.44Å; Y232-L254 HydrophobicContact CE2-CD1 3.69Å; Y232-L254 HydrophobicContact CG-CD1 4.21Å; C235-L254 HydrophobicContact CB-CB 3.94Å; C235-L254 HydrophobicContact CB-CD1 4.06Å; C235-L254 HydrophobicContact CB-CG 4.49Å; V236-L254 HydrophobicContact CG2-CD1 3.95Å; V236-L254 HydrophobicContact CG2-CD2 4.41Å; I239-L254 HydrophobicContact CD1-CB 4.28Å; I239-L254 HydrophobicContact CD1-CD2 3.66Å; F250-L254 VanDerWaalsContact O-CB 3.26Å; F250-L254 WeakPolarHBondContact O-CB 3.45Å; F250-L254 PolarHBondContact O-N 3.04Å; I251-L254 PolarHBondContact O-N 3.46Å; L254-V257 WeakPolarHBondContact O-CG1 3.27Å; L254-T258 WeakPolarHBondContact O-CB 3.27Å; L254-T258 PolarHBondContact O-N 3.23Å; L254-T258 VanDerWaalsContact O-N 3.07Å; L254-T258 PolarHBondContact O-OG1 2.84Å; L254-I292 HydrophobicContact CD2-CB 4.33Å; L254-I292 HydrophobicContact CD2-CG2 4.43Å; L254-V293 HydrophobicContact CD2-CG2 3.94Å; L254-V293 HydrophobicContact CG-CG2 4.28Å
255R93Very high92.7Very high112 Ų11264.8 Ų64.842%0.42330%0.296SS..Hα-helixtrans-60.1-55.4173.5-74.3174.3-178.7174.12.5110.8I251 T252 L253 V257 T258 D259 V293I251-R255 WeakPolarHBondContact O-CG 3.49Å; I251-R255 PolarHBondContact O-N 3.13Å; T252-R255 PolarHBondContact O-N 3.22Å; L253-R255 VanDerWaalsContact C-N 3.33Å; L253-R255 PolarHBondContact O-N 3.23Å; R255-V257 PolarHBondContact O-N 3.46Å; R255-T258 WeakPolarHBondContact O-CB 3.48Å; R255-T258 PolarHBondContact O-N 2.82Å; R255-T258 VanDerWaalsContact O-N 3.15Å; R255-D259 PolarHBondContact O-N 3.14Å; R255-V293 HydrophobicContact CG-CG1 3.34Å; R255-V293 HydrophobicContact CG-CG2 4.45Å; R255-V293 PolarHBondContact NH2-O 2.72Å
256W94.3Very high92.3Very high129 Ų12958.8 Ų58.849%0.48927%0.271SS..Hα-helixtrans-57.5-46.5-178175.782.6000112.8L218 L231 T252 L253 T258 D259 S260L218-W256 HydrophobicContact CD1-CH2 4.05Å; L218-W256 HydrophobicContact CD1-CZ3 3.82Å; L231-W256 HydrophobicContact CD2-CE3 4.4Å; L231-W256 HydrophobicContact CD2-CZ3 4.07Å; T252-W256 PolarHBondContact O-N 3Å; L253-W256 PolarHBondContact O-N 2.8Å; W256-T258 VanDerWaalsContact C-N 3.31Å; W256-T258 PolarHBondContact O-N 3.39Å; W256-D259 PolarHBondContact O-N 2.93Å; W256-S260 WeakPolarHBondContact O-CB 3.08Å; W256-S260 PolarHBondContact O-N 3.35Å
257V94.3Very high92Very high0 Ų058.7 Ų58.70%028%0.282CS..Hα-helixtrans-70.7-30.6-178.976.30000111.9S228 L231 Y232 L253 L254 R255 L261S228-V257 WeakPolarHBondContact O-CG2 3.41Å; L231-V257 HydrophobicContact CB-CG2 4.21Å; L231-V257 HydrophobicContact CD2-CB 4.14Å; L231-V257 HydrophobicContact CD2-CG2 4.1Å; L231-V257 HydrophobicContact CG-CB 4.43Å; L231-V257 HydrophobicContact CG-CG2 4.35Å; Y232-V257 HydrophobicContact CD2-CG1 4.41Å; L253-V257 WeakPolarHBondContact O-CB 3.49Å; L253-V257 WeakPolarHBondContact O-CG1 3.44Å; L253-V257 PolarHBondContact O-N 2.86Å; L254-V257 WeakPolarHBondContact O-CG1 3.27Å; R255-V257 PolarHBondContact O-N 3.46Å; V257-L261 HydrophobicContact CG2-CD1 4.39Å; V257-L261 VanDerWaalsContact O-CB 3.29Å; V257-L261 WeakPolarHBondContact O-CB 3.45Å; V257-L261 VanDerWaalsContact O-CG 3.25Å; V257-L261 WeakPolarHBondContact O-CG 3.08Å; V257-L261 PolarHBondContact O-N 3.37Å
258T91.9Very high91.4Very high19 Ų1959.2 Ų59.212%0.11729%0.289CS..Hα-helixtrans-63.8-46.5173.8-67.40000111L254 R255 W256 L261 F262 L287L254-T258 WeakPolarHBondContact O-CB 3.27Å; L254-T258 PolarHBondContact O-N 3.23Å; L254-T258 VanDerWaalsContact O-N 3.07Å; L254-T258 PolarHBondContact O-OG1 2.84Å; R255-T258 WeakPolarHBondContact O-CB 3.48Å; R255-T258 PolarHBondContact O-N 2.82Å; R255-T258 VanDerWaalsContact O-N 3.15Å; W256-T258 VanDerWaalsContact C-N 3.31Å; W256-T258 PolarHBondContact O-N 3.39Å; T258-L261 PolarHBondContact O-N 3.47Å; T258-F262 WeakPolarHBondContact O-CB 3.34Å; T258-F262 PolarHBondContact O-N 3.2Å; T258-L287 HydrophobicContact CG2-CB 3.73Å; T258-L287 HydrophobicContact CG2-CD1 4.1Å; T258-L287 HydrophobicContact CG2-CD2 3.95Å; T258-L287 HydrophobicContact CG2-CG 4.1Å
259D90.3Very high90.5Very high98 Ų9852.7 Ų52.752%0.52426%0.262SS..Hα-helixtrans-65.3-45177.1-63.8-25.5000110.9R255 W256 L261 F262 E263R255-D259 PolarHBondContact O-N 3.14Å; W256-D259 PolarHBondContact O-N 2.93Å; D259-L261 PolarHBondContact O-N 3.15Å; D259-F262 WeakPolarHBondContact O-CB 3.48Å; D259-F262 PolarHBondContact O-N 3.12Å; D259-F262 VanDerWaalsContact O-N 3.11Å; D259-E263 WeakPolarHBondContact O-CG 3.28Å; D259-E263 PolarHBondContact O-N 3.2Å
260S91.1Very high89.6Confident22 Ų2253.3 Ų53.315%0.15427%0.267CS..Hα-helixtrans-60.9-42.9176.7177.50000112.8W256 F262 E263 L264W256-S260 WeakPolarHBondContact O-CB 3.08Å; W256-S260 PolarHBondContact O-N 3.35Å; S260-F262 VanDerWaalsContact C-N 3.31Å; S260-F262 PolarHBondContact O-N 3.09Å; S260-E263 PolarHBondContact O-N 2.65Å; S260-L264 VanDerWaalsContact O-CB 3.3Å; S260-L264 WeakPolarHBondContact O-CB 3.48Å; S260-L264 PolarHBondContact O-N 2.7Å
261L91.2Very high88.4Confident0 Ų061 Ų610%030%0.296CS..Hα-helixtrans-61.2-43.2173.4-80.6167.9000110.9S228 W229 V257 T258 D259 L264 Y265 L287S228-L261 VanDerWaalsContact CB-CD2 3.46Å; W229-L261 HydrophobicContact CD2-CD1 4.05Å; W229-L261 HydrophobicContact CD2-CD2 4.21Å; W229-L261 HydrophobicContact CE3-CD1 4.09Å; W229-L261 HydrophobicContact CG-CD2 4.19Å; W229-L261 HydrophobicContact CZ2-CD1 4.5Å; W229-L261 HydrophobicContact CZ3-CD1 4.33Å; V257-L261 HydrophobicContact CG2-CD1 4.39Å; V257-L261 VanDerWaalsContact O-CB 3.29Å; V257-L261 WeakPolarHBondContact O-CB 3.45Å; V257-L261 VanDerWaalsContact O-CG 3.25Å; V257-L261 WeakPolarHBondContact O-CG 3.08Å; V257-L261 PolarHBondContact O-N 3.37Å; T258-L261 PolarHBondContact O-N 3.47Å; D259-L261 PolarHBondContact O-N 3.15Å; L261-L264 PolarHBondContact O-N 2.69Å; L261-Y265 HydrophobicContact CD2-CE2 4.1Å; L261-Y265 WeakPolarHBondContact O-CD2 3.36Å; L261-Y265 PolarHBondContact O-N 2.61Å; L261-L287 HydrophobicContact CB-CD1 4.34Å; L261-L287 HydrophobicContact CD1-CD2 4.24Å
262F87.8Confident87.6Confident75 Ų7567.2 Ų67.233%0.32933%0.33SS..Hα-helixtrans-61.8-45.8179-176.6-103.9000112.4T258 D259 S260 S266 R284T258-F262 WeakPolarHBondContact O-CB 3.34Å; T258-F262 PolarHBondContact O-N 3.2Å; D259-F262 WeakPolarHBondContact O-CB 3.48Å; D259-F262 PolarHBondContact O-N 3.12Å; D259-F262 VanDerWaalsContact O-N 3.11Å; S260-F262 VanDerWaalsContact C-N 3.31Å; S260-F262 PolarHBondContact O-N 3.09Å; F262-S266 WeakPolarHBondContact O-CB 3.47Å; F262-S266 PolarHBondContact O-N 3.22Å; F262-S266 PolarHBondContact O-OG 3.05Å; F262-R284 HydrophobicContact CD2-CG 4.11Å; F262-R284 HydrophobicContact CE2-CG 3.61Å; F262-R284 VanDerWaalsContact CE2-NE 3.27Å
263E89Confident86.7Confident135 Ų13565.8 Ų65.863%0.63132%0.319SS*.Hα-helixtrans-61.6-46.7174.8-72.2-179.9169.800111.6D259 S260 Y265 S266 S267D259-E263 WeakPolarHBondContact O-CG 3.28Å; D259-E263 PolarHBondContact O-N 3.2Å; S260-E263 PolarHBondContact O-N 2.65Å; E263-Y265 PolarHBondContact O-N 3.34Å; E263-S266 PolarHBondContact O-N 3.49Å; E263-S267 WeakPolarHBondContact O-CB 3.44Å; E263-S267 PolarHBondContact O-N 3.36Å
264L89.7Confident85.6Confident15 Ų1572 Ų728%0.07935%0.345CS..Hα-helixtrans-56.6-49.2179.9-179.463000111.3N223 A225 S260 L261 S267N223-L264 HydrophobicContact CB-CD1 3.8Å; A225-L264 HydrophobicContact CB-CD2 3.73Å; S260-L264 VanDerWaalsContact O-CB 3.3Å; S260-L264 WeakPolarHBondContact O-CB 3.48Å; S260-L264 PolarHBondContact O-N 2.7Å; L261-L264 PolarHBondContact O-N 2.69Å; L264-S267 PolarHBondContact O-OG 3.45Å
265Y87.8Confident84.6Confident54 Ų5479.1 Ų79.121%0.21238%0.375CS..Hα-helixtrans-72.5-35.4178.7-76-68.2000112.9W229 L261 E263 S267 Q268 I283W229-Y265 HydrophobicContact CZ2-CE2 4.02Å; W229-Y265 AromaticContact NE1-CE2 3.62Å; W229-Y265 AromaticContact NE1-CZ 3.71Å; W229-Y265 PolarHBondContact NE1-OH 2.98Å; L261-Y265 HydrophobicContact CD2-CE2 4.1Å; L261-Y265 WeakPolarHBondContact O-CD2 3.36Å; L261-Y265 PolarHBondContact O-N 2.61Å; E263-Y265 PolarHBondContact O-N 3.34Å; Y265-S267 VanDerWaalsContact C-N 3.3Å; Y265-S267 PolarHBondContact O-N 3.41Å; Y265-Q268 PolarHBondContact O-N 3.18Å; Y265-I283 HydrophobicContact CD1-CD1 3.89Å; Y265-I283 HydrophobicContact CD2-CD1 3.85Å; Y265-I283 HydrophobicContact CD2-CG2 4.16Å; Y265-I283 HydrophobicContact CE1-CD1 4.03Å; Y265-I283 HydrophobicContact CE2-CD1 4Å; Y265-I283 HydrophobicContact CE2-CG2 4.48Å; Y265-I283 HydrophobicContact CG-CD1 3.81Å
266S85.9Confident83.3Confident22 Ų2279 Ų7915%0.15438%0.375CS..Hα-helixtrans-65.5-34.4177.3-60.90000112.1F262 E263 Q268 V269F262-S266 WeakPolarHBondContact O-CB 3.47Å; F262-S266 PolarHBondContact O-N 3.22Å; F262-S266 PolarHBondContact O-OG 3.05Å; E263-S266 PolarHBondContact O-N 3.49Å; S266-Q268 PolarHBondContact O-N 3.19Å; S266-V269 PolarHBondContact O-N 3.13Å
267S85.8Confident82.2Confident95 Ų9576.3 Ų76.366%0.66437%0.368SS*.Hα-helixtrans-65.2-21.4175.476.50000113.8E263 L264 Y265E263-S267 WeakPolarHBondContact O-CB 3.44Å; E263-S267 PolarHBondContact O-N 3.36Å; L264-S267 PolarHBondContact O-OG 3.45Å; Y265-S267 VanDerWaalsContact C-N 3.3Å; Y265-S267 PolarHBondContact O-N 3.41Å
268Q81.7Confident81.2Confident105 Ų10584.5 Ų84.549%0.49140%0.399SS..THydrogen-bonded Turntrans-90.8-6.4178.4-63.8179.42.900112.8Y265 S266 R276Y265-Q268 PolarHBondContact O-N 3.18Å; S266-Q268 PolarHBondContact O-N 3.19Å; Q268-R276 PolarHBondContact O-NH1 3.18Å
269V76.7Confident80.3Confident14 Ų1489.2 Ų89.29%0.08542%0.42CS..  trans-84.7119.3178.5175.20000109.7S266 W271 R276 L280S266-V269 PolarHBondContact O-N 3.13Å; V269-W271 HydrophobicContact CG1-CD2 4.25Å; V269-W271 HydrophobicContact CG1-CE3 4.5Å; V269-W271 HydrophobicContact CG1-CG 4.47Å; V269-W271 PolarHBondContact O-N 3.27Å; V269-R276 HydrophobicContact CB-CB 4.44Å; V269-R276 HydrophobicContact CG1-CB 4Å; V269-R276 HydrophobicContact CG2-CB 4.17Å; V269-L280 HydrophobicContact CB-CD1 4.46Å; V269-L280 HydrophobicContact CG2-CD1 3.5Å; V269-L280 HydrophobicContact CG2-CD2 4.02Å; V269-L280 HydrophobicContact CG2-CG 3.7Å
270D76Confident79.7Confident86 Ų8685 Ų8546%0.4640%0.397SS..  trans-74.5112.2155.9-176.3-4.7000107.4N272 D273D270-N272 PolarHBondContact O-N 3.15Å; D270-N272 VanDerWaalsContact O-N 3.17Å; D270-N272 WeakPolarHBondContact OD1-CB 3.32Å; D270-N272 PolarHBondContact OD1-N 3.38Å; D270-N272 PolarHBondContact OD1-ND2 3.26Å; D270-D273 HydrophobicContact CB-CB 4.28Å; D270-D273 WeakPolarHBondContact O-CA 3.44Å; D270-D273 WeakPolarHBondContact O-CB 3.46Å; D270-D273 PolarHBondContact O-N 3.31Å
271W70.7Confident79.1Confident161 Ų16191 Ų9161%0.6142%0.416SS*.THydrogen-bonded Turntrans-66.3-13.7-177.7-69.195.6000113.3V269 D273 E277V269-W271 HydrophobicContact CG1-CD2 4.25Å; V269-W271 HydrophobicContact CG1-CE3 4.5Å; V269-W271 HydrophobicContact CG1-CG 4.47Å; V269-W271 PolarHBondContact O-N 3.27Å; W271-D273 VanDerWaalsContact C-N 3.29Å; W271-E277 HydrophobicContact CZ3-CG 4.48Å
272N77.4Confident78.5Confident147 Ų14794.9 Ų94.979%0.78644%0.441SS*.THydrogen-bonded Turntrans-77.7-17.6170.3-61.8-40.7000112.3D270D270-N272 PolarHBondContact O-N 3.15Å; D270-N272 VanDerWaalsContact O-N 3.17Å; D270-N272 WeakPolarHBondContact OD1-CB 3.32Å; D270-N272 PolarHBondContact OD1-N 3.38Å; D270-N272 PolarHBondContact OD1-ND2 3.26Å
273D76.7Confident78Confident60 Ų6092.8 Ų92.832%0.32143%0.433SS..  trans-95.593.2178.3-173-0.6000111.6D270 W271 K275 R276 E277D270-D273 HydrophobicContact CB-CB 4.28Å; D270-D273 WeakPolarHBondContact O-CA 3.44Å; D270-D273 WeakPolarHBondContact O-CB 3.46Å; D270-D273 PolarHBondContact O-N 3.31Å; W271-D273 VanDerWaalsContact C-N 3.29Å; D273-K275 PolarHBondContact O-N 2.94Å; D273-K275 WeakPolarHBondContact OD1-CB 3.43Å; D273-K275 PolarHBondContact OD1-N 3.26Å; D273-R276 HydrophobicContact CB-CB 4.49Å; D273-R276 HydrophobicContact CB-CG 4.45Å; D273-R276 PolarHBondContact O-N 3.3Å; D273-R276 IonicContact OD2-NE 2.65Å; D273-E277 PolarHBondContact O-N 3.25Å
274K72.4Confident77.4Confident163 Ų16390.2 Ų90.271%0.70942%0.418SS*.Hα-helixtrans-53.6-20.8174.5-68.6-175.2-179.9177.30113.6R278K274-R278 WeakPolarHBondContact O-CG 3.27Å
275K73.1Confident77Confident149 Ų14992.5 Ų92.565%0.64844%0.439SS*.Hα-helixtrans-72.5-39.5177.4-165.4179.3178.2-179.80111.4D273 R278 Q279D273-K275 PolarHBondContact O-N 2.94Å; D273-K275 WeakPolarHBondContact OD1-CB 3.43Å; D273-K275 PolarHBondContact OD1-N 3.26Å; K275-R278 PolarHBondContact O-N 3.16Å; K275-Q279 PolarHBondContact O-N 2.81Å
276R66.2Low76.6Confident110 Ų11094.9 Ų94.942%0.41545%0.453SS..Hα-helixtrans-70.8-37.3178.2-76.3-172.6-173.3-129.3-1112.4Q268 V269 D273 R278 Q279 L280Q268-R276 PolarHBondContact O-NH1 3.18Å; V269-R276 HydrophobicContact CB-CB 4.44Å; V269-R276 HydrophobicContact CG1-CB 4Å; V269-R276 HydrophobicContact CG2-CB 4.17Å; D273-R276 HydrophobicContact CB-CB 4.49Å; D273-R276 HydrophobicContact CB-CG 4.45Å; D273-R276 PolarHBondContact O-N 3.3Å; D273-R276 IonicContact OD2-NE 2.65Å; R276-R278 VanDerWaalsContact C-N 3.27Å; R276-R278 PolarHBondContact O-N 3.38Å; R276-Q279 WeakPolarHBondContact O-CB 3.44Å; R276-Q279 PolarHBondContact O-N 3.32Å; R276-L280 PolarHBondContact O-N 3.04Å
277E69.8Low76.2Confident73 Ų7394.5 Ų94.534%0.34145%0.449SS..Hα-helixtrans-58.7-39.9174.2-164.7-155.1144.700111.9W271 D273 Q279 L280W271-E277 HydrophobicContact CZ3-CG 4.48Å; D273-E277 PolarHBondContact O-N 3.25Å; E277-Q279 VanDerWaalsContact C-N 3.27Å; E277-Q279 PolarHBondContact O-N 2.9Å; E277-L280 PolarHBondContact O-N 2.92Å
278R73.8Confident75.6Confident171 Ų17197.9 Ų97.965%0.64545%0.452SS*.Hα-helixtrans-63-32.7176-70.7176.4-179-169.30112.5K274 K275 R276 L280 R281 P282K274-R278 WeakPolarHBondContact O-CG 3.27Å; K275-R278 PolarHBondContact O-N 3.16Å; R276-R278 VanDerWaalsContact C-N 3.27Å; R276-R278 PolarHBondContact O-N 3.38Å; R278-L280 VanDerWaalsContact C-N 3.31Å; R278-L280 PolarHBondContact O-N 3.44Å; R278-R281 PolarHBondContact O-N 2.94Å; R278-P282 WeakPolarHBondContact O-CD 3.39Å
279Q74Confident75Confident119 Ų11995.4 Ų95.456%0.55646%0.455SS*.Hα-helixtrans-71.6-23.3178-66.2174.7-1600113K275 R276 E277 P282K275-Q279 PolarHBondContact O-N 2.81Å; R276-Q279 WeakPolarHBondContact O-CB 3.44Å; R276-Q279 PolarHBondContact O-N 3.32Å; E277-Q279 VanDerWaalsContact C-N 3.27Å; E277-Q279 PolarHBondContact O-N 2.9Å; Q279-P282 WeakPolarHBondContact O-CD 3.33Å
280L76.8Confident74.5Confident8 Ų895.6 Ų95.64%0.04246%0.456CS..Hα-helixtrans-75.7-22.8173.8-66.8-172.8000113.2V269 R276 E277 R278 I283 R284V269-L280 HydrophobicContact CB-CD1 4.46Å; V269-L280 HydrophobicContact CG2-CD1 3.5Å; V269-L280 HydrophobicContact CG2-CD2 4.02Å; V269-L280 HydrophobicContact CG2-CG 3.7Å; R276-L280 PolarHBondContact O-N 3.04Å; E277-L280 PolarHBondContact O-N 2.92Å; R278-L280 VanDerWaalsContact C-N 3.31Å; R278-L280 PolarHBondContact O-N 3.44Å; L280-I283 PolarHBondContact O-N 3.16Å; L280-R284 WeakPolarHBondContact O-CB 3.5Å; L280-R284 WeakPolarHBondContact O-CG 3.48Å; L280-R284 PolarHBondContact O-N 3.43Å
281R79.2Confident73.6Confident149 Ų14999.4 Ų99.456%0.56247%0.468SS*.Hα-helixtrans-61.2-46.8-175.5-63.3-179.1-178-171.7-1.9112.8R278 I283 R284 A285R278-R281 PolarHBondContact O-N 2.94Å; R281-I283 VanDerWaalsContact C-N 3.34Å; R281-I283 PolarHBondContact O-N 3.05Å; R281-R284 PolarHBondContact O-N 3.02Å; R281-A285 WeakPolarHBondContact O-CB 3.36Å; R281-A285 PolarHBondContact O-N 3.26Å
282P78.8Confident72.9Confident82 Ų8293.5 Ų93.553%0.53245%0.448SS..Hα-helixtrans-62.6-39.3175.6-2334.5000112.8R278 Q279 A285 M286R278-P282 WeakPolarHBondContact O-CD 3.39Å; Q279-P282 WeakPolarHBondContact O-CD 3.33Å; P282-A285 PolarHBondContact O-N 3.19Å; P282-M286 WeakPolarHBondContact O-CB 3.35Å; P282-M286 PolarHBondContact O-N 2.89Å
283I77.3Confident71.7Confident31 Ų3188.1 Ų88.116%0.15942%0.421CS..Hα-helixtrans-63.9-49.3178.2-58.6176.4000109.6W229 Y265 L280 R281 A285 M286 L287W229-I283 HydrophobicContact CH2-CG2 4.41Å; W229-I283 HydrophobicContact CZ2-CG2 4.25Å; Y265-I283 HydrophobicContact CD1-CD1 3.89Å; Y265-I283 HydrophobicContact CD2-CD1 3.85Å; Y265-I283 HydrophobicContact CD2-CG2 4.16Å; Y265-I283 HydrophobicContact CE1-CD1 4.03Å; Y265-I283 HydrophobicContact CE2-CD1 4Å; Y265-I283 HydrophobicContact CE2-CG2 4.48Å; Y265-I283 HydrophobicContact CG-CD1 3.81Å; L280-I283 PolarHBondContact O-N 3.16Å; R281-I283 VanDerWaalsContact C-N 3.34Å; R281-I283 PolarHBondContact O-N 3.05Å; I283-A285 VanDerWaalsContact C-N 3.3Å; I283-A285 PolarHBondContact O-N 3.49Å; I283-M286 PolarHBondContact O-N 3.28Å; I283-L287 HydrophobicContact CG2-CD1 3.74Å; I283-L287 HydrophobicContact CG2-CG 4.23Å; I283-L287 WeakPolarHBondContact O-CB 3.27Å; I283-L287 VanDerWaalsContact O-CG 3.25Å; I283-L287 WeakPolarHBondContact O-CG 3.3Å; I283-L287 PolarHBondContact O-N 3.43Å
284R76.6Confident70.3Confident81 Ų8193.6 Ų93.631%0.30644%0.444SS..Hα-helixtrans-56.7-43.5173.7-73178.4-169.2-165-8.2111.8F262 L280 R281 K288F262-R284 HydrophobicContact CD2-CG 4.11Å; F262-R284 HydrophobicContact CE2-CG 3.61Å; F262-R284 VanDerWaalsContact CE2-NE 3.27Å; L280-R284 WeakPolarHBondContact O-CB 3.5Å; L280-R284 WeakPolarHBondContact O-CG 3.48Å; L280-R284 PolarHBondContact O-N 3.43Å; R281-R284 PolarHBondContact O-N 3.02Å; R284-K288 VanDerWaalsContact O-CB 3.28Å; R284-K288 WeakPolarHBondContact O-CB 3.36Å; R284-K288 VanDerWaalsContact O-CG 3.24Å; R284-K288 WeakPolarHBondContact O-CG 3.19Å; R284-K288 PolarHBondContact O-N 3.42Å
285A81.3Confident68.8Low63 Ų6391.5 Ų91.552%0.52145%0.45SS..Hα-helixtrans-65.3-41-179.900000111.9R281 P282 I283 G289R281-A285 WeakPolarHBondContact O-CB 3.36Å; R281-A285 PolarHBondContact O-N 3.26Å; P282-A285 PolarHBondContact O-N 3.19Å; I283-A285 VanDerWaalsContact C-N 3.3Å; I283-A285 PolarHBondContact O-N 3.49Å; A285-G289 WeakPolarHBondContact O-CA 3.33Å; A285-G289 PolarHBondContact O-N 3.13Å
286M79.3Confident68.6Low104 Ų10488.6 Ų88.651%0.51244%0.441SS..Hα-helixtrans-65.5-49176.2-174.9-176.8-68.200111.4W229 Y232 P282 I283 K288 G289 T290W229-M286 HydrophobicContact CH2-SD 3.72Å; W229-M286 HydrophobicContact CZ3-SD 3.69Å; Y232-M286 PolarHBondContact OH-O 3.09Å; P282-M286 WeakPolarHBondContact O-CB 3.35Å; P282-M286 PolarHBondContact O-N 2.89Å; I283-M286 PolarHBondContact O-N 3.28Å; M286-K288 PolarHBondContact O-N 3.18Å; M286-G289 PolarHBondContact O-N 3.35Å; M286-G289 VanDerWaalsContact O-N 3.14Å; M286-T290 PolarHBondContact O-N 3.3Å
287L76.4Confident68.7Low13 Ų1387.5 Ų87.57%0.06844%0.442CS..Hα-helixtrans-64.6-35.8-179.9-70.1180000112.9W229 Y232 T258 L261 I283 T290W229-L287 HydrophobicContact CH2-CD2 4.31Å; W229-L287 HydrophobicContact CZ3-CD2 4.39Å; Y232-L287 HydrophobicContact CD2-CD2 3.93Å; Y232-L287 HydrophobicContact CE2-CD2 3.58Å; T258-L287 HydrophobicContact CG2-CB 3.73Å; T258-L287 HydrophobicContact CG2-CD1 4.1Å; T258-L287 HydrophobicContact CG2-CD2 3.95Å; T258-L287 HydrophobicContact CG2-CG 4.1Å; L261-L287 HydrophobicContact CB-CD1 4.34Å; L261-L287 HydrophobicContact CD1-CD2 4.24Å; I283-L287 HydrophobicContact CG2-CD1 3.74Å; I283-L287 HydrophobicContact CG2-CG 4.23Å; I283-L287 WeakPolarHBondContact O-CB 3.27Å; I283-L287 VanDerWaalsContact O-CG 3.25Å; I283-L287 WeakPolarHBondContact O-CG 3.3Å; I283-L287 PolarHBondContact O-N 3.43Å; L287-T290 PolarHBondContact O-OG1 3.42Å
288K73.8Confident68.7Low166 Ų16688.3 Ų88.372%0.72245%0.447SS*.Hα-helixtrans-76.4-32.3171.5-70.9-178.7176.9-166.20112.9R284 M286 T290R284-K288 VanDerWaalsContact O-CB 3.28Å; R284-K288 WeakPolarHBondContact O-CB 3.36Å; R284-K288 VanDerWaalsContact O-CG 3.24Å; R284-K288 WeakPolarHBondContact O-CG 3.19Å; R284-K288 PolarHBondContact O-N 3.42Å; M286-K288 PolarHBondContact O-N 3.18Å; K288-T290 PolarHBondContact O-N 3.39Å
289G68.6Low68.3Low54 Ų5483.4 Ų83.456%0.55744%0.436SS*.Hα-helixtrans-66.2-20.8-177.700000113.4A285 M286 K291A285-G289 WeakPolarHBondContact O-CA 3.33Å; A285-G289 PolarHBondContact O-N 3.13Å; M286-G289 PolarHBondContact O-N 3.35Å; M286-G289 VanDerWaalsContact O-N 3.14Å; G289-K291 PolarHBondContact O-N 2.81Å
290T65.5Low68Low17 Ų1781.2 Ų81.210%0.10443%0.428CS..  trans-67.871.7163.826.90000111.2Y232 V236 M286 L287 K288 I292 V293Y232-T290 HydrophobicContact CE2-CG2 4.25Å; Y232-T290 WeakPolarHBondContact OH-CG2 3.5Å; Y232-T290 PolarHBondContact OH-OG1 3.43Å; V236-T290 HydrophobicContact CG2-CG2 3.66Å; M286-T290 PolarHBondContact O-N 3.3Å; L287-T290 PolarHBondContact O-OG1 3.42Å; K288-T290 PolarHBondContact O-N 3.39Å; T290-I292 PolarHBondContact O-N 3.37Å; T290-V293 PolarHBondContact O-N 3.2Å
291K57.1Low67.4Low166 Ų16686.1 Ų86.172%0.72245%0.454SS*.THydrogen-bonded Turntrans-57.36.1173-69.2-174.6174.9-1750115G289 V293G289-K291 PolarHBondContact O-N 2.81Å; K291-V293 PolarHBondContact O-N 2.94Å
292I57.8Low66.6Low37 Ų3781.6 Ų81.619%0.1945%0.446CS..THydrogen-bonded Turntrans-68.8-21.5174.2-55.5177.3000110.9V236 I239 I251 L254 T290V236-I292 HydrophobicContact CG1-CD1 4.48Å; I239-I292 HydrophobicContact CB-CG2 4.08Å; I239-I292 HydrophobicContact CD1-CG2 3.65Å; I239-I292 HydrophobicContact CG1-CG2 4.38Å; I239-I292 HydrophobicContact CG2-CG2 3.39Å; I251-I292 HydrophobicContact CG1-CG2 4.42Å; L254-I292 HydrophobicContact CD2-CB 4.33Å; L254-I292 HydrophobicContact CD2-CG2 4.43Å; T290-I292 PolarHBondContact O-N 3.37Å
293V51.6Low65.6Low34 Ų3481.5 Ų81.521%0.20644%0.44CS..SBendtrans-86.2-20-172.1-173.40000113.1L254 R255 T290 K291L254-V293 HydrophobicContact CD2-CG2 3.94Å; L254-V293 HydrophobicContact CG-CG2 4.28Å; R255-V293 HydrophobicContact CG-CG1 3.34Å; R255-V293 HydrophobicContact CG-CG2 4.45Å; R255-V293 PolarHBondContact NH2-O 2.72Å; T290-V293 PolarHBondContact O-N 3.2Å; K291-V293 PolarHBondContact O-N 2.94Å
294E47.9Very low64.7Low175 Ų17585.8 Ų85.882%0.81846%0.463SS*.  trans-94.44.1-174.4-68.7-176.9166.100114.8
295S40.1Very low63.6Low119 Ų11986.2 Ų86.283%0.83248%0.477SS*.  trans-112.50173.764.90000112

Retrieved 295 of 295 residues in 192.5 ms (Link to these results)

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