A0A087X7B4_POEFO Loading...

COP9 signalosome complex subunit 4

AlphaFold DB , UniProt , Accession A0A087X7B4, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 406 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
1M77.8Confident88.5Confident99 Ų9969 Ų6949%0.48837%0.366SS..  0-33.90-63.9-64.1-87.200114.2A3 E4 V5 L36 E40M1-A3 VanDerWaalsContact C-N 3.28Å; M1-A3 PolarHBondContact O-N 3.4Å; M1-E4 WeakPolarHBondContact O-CB 3.39Å; M1-E4 PolarHBondContact O-N 3.39Å; M1-E4 VanDerWaalsContact O-N 3.11Å; M1-V5 PolarHBondContact O-N 3.12Å; M1-L36 HydrophobicContact CB-CD1 4.05Å; M1-L36 HydrophobicContact CB-CD2 3.8Å; M1-L36 HydrophobicContact CG-CD2 4.12Å; M1-E40 WeakPolarHBondContact CB-OE2 3.5Å; M1-E40 PolarHBondContact N-OE1 3Å
2A79.2Confident88.7Confident15 Ų1565 Ų6512%0.12435%0.345CS..Hα-helixtrans-60.2-31.2-17900000115.1V5 R6 E43 S44A2-V5 PolarHBondContact O-N 3.45Å; A2-R6 PolarHBondContact O-N 3.39Å; A2-R6 VanDerWaalsContact O-N 3.08Å; A2-E43 HydrophobicContact CB-CB 3.92Å; A2-S44 WeakPolarHBondContact CA-OG 3.44Å; A2-S44 WeakPolarHBondContact CB-OG 3.35Å
3A84.9Confident88.6Confident79 Ų7963.8 Ų63.865%0.65334%0.337SS*.Hα-helixtrans-66.2-36.2175.300000112.9M1 R6 Q7M1-A3 VanDerWaalsContact C-N 3.28Å; M1-A3 PolarHBondContact O-N 3.4Å; A3-R6 PolarHBondContact O-N 3.06Å; A3-Q7 PolarHBondContact O-N 2.97Å
4E89.6Confident88.1Confident89 Ų8967.9 Ų67.942%0.41636%0.36SS..Hα-helixtrans-64.3-44.9172.9-81.5-175.2170.700110.8M1 R6 Q7 E8 K32M1-E4 WeakPolarHBondContact O-CB 3.39Å; M1-E4 PolarHBondContact O-N 3.39Å; M1-E4 VanDerWaalsContact O-N 3.11Å; E4-R6 VanDerWaalsContact C-N 3.31Å; E4-R6 PolarHBondContact O-N 2.82Å; E4-Q7 WeakPolarHBondContact O-CB 3.36Å; E4-Q7 PolarHBondContact O-N 2.99Å; E4-E8 WeakPolarHBondContact O-CG 3.48Å; E4-E8 PolarHBondContact O-N 2.83Å; E4-K32 IonicContact OE2-NZ 3.16Å; E4-K32 PolarHBondContact OE2-NZ 3.24Å
5V90.1Very high88Confident0 Ų066.2 Ų66.20%036%0.355CS..Hα-helixtrans-57.4-45.8177.4173.40000110.7M1 A2 Q7 E8 L9 I29M1-V5 PolarHBondContact O-N 3.12Å; A2-V5 PolarHBondContact O-N 3.45Å; V5-Q7 VanDerWaalsContact C-N 3.31Å; V5-Q7 PolarHBondContact O-N 3.4Å; V5-E8 PolarHBondContact O-N 3.41Å; V5-L9 HydrophobicContact CG1-CD1 3.86Å; V5-L9 HydrophobicContact CG1-CG 4.41Å; V5-L9 WeakPolarHBondContact O-CB 3.45Å; V5-L9 WeakPolarHBondContact O-CG 3.44Å; V5-L9 PolarHBondContact O-N 3.07Å; V5-I29 HydrophobicContact CG1-CG2 3.81Å
6R92.3Very high87.1Confident101 Ų10171.1 Ų71.138%0.38139%0.389SS..Hα-helixtrans-59.1-41.6174.6-76.2179.6-171.6-99.65.3112.1A2 A3 E4 A10 E43 A47 E50A2-R6 PolarHBondContact O-N 3.39Å; A2-R6 VanDerWaalsContact O-N 3.08Å; A3-R6 PolarHBondContact O-N 3.06Å; E4-R6 VanDerWaalsContact C-N 3.31Å; E4-R6 PolarHBondContact O-N 2.82Å; R6-A10 WeakPolarHBondContact O-CB 3.38Å; R6-A10 PolarHBondContact O-N 3.45Å; R6-E43 IonicContact NH2-OE2 3.86Å; R6-E43 PolarHBondContact NH2-OE2 3.11Å; R6-A47 HydrophobicContact CG-CB 3.4Å; R6-E50 IonicContact CZ-OE2 3.74Å; R6-E50 IonicContact NH1-OE2 2.82Å; R6-E50 PolarHBondContact NH1-OE2 3.04Å; R6-E50 IonicContact NH2-OE2 3.68Å
7Q91.4Very high86.7Confident123 Ų12369.6 Ų69.658%0.57539%0.394SS*.Hα-helixtrans-67.9-44.7179.7-170.7178.48.700112.2A3 E4 V5 A10 Q11A3-Q7 PolarHBondContact O-N 2.97Å; E4-Q7 WeakPolarHBondContact O-CB 3.36Å; E4-Q7 PolarHBondContact O-N 2.99Å; V5-Q7 VanDerWaalsContact C-N 3.31Å; V5-Q7 PolarHBondContact O-N 3.4Å; Q7-A10 PolarHBondContact O-N 3.04Å; Q7-Q11 WeakPolarHBondContact O-CG 3.24Å; Q7-Q11 PolarHBondContact O-N 3.03Å
8E92.4Very high86.7Confident57 Ų5768.9 Ų68.927%0.26639%0.394SS..Hα-helixtrans-61.2-43.9176.7-70.6173.1-160.300111.1E4 V5 Q11 L12 I29 K32E4-E8 WeakPolarHBondContact O-CG 3.48Å; E4-E8 PolarHBondContact O-N 2.83Å; V5-E8 PolarHBondContact O-N 3.41Å; E8-Q11 PolarHBondContact O-N 3.04Å; E8-L12 PolarHBondContact O-N 3.47Å; E8-I29 HydrophobicContact CB-CD1 3.81Å; E8-I29 HydrophobicContact CB-CG1 4.33Å; E8-K32 IonicContact OE1-NZ 3.01Å; E8-K32 PolarHBondContact OE1-NZ 2.98Å
9L93.4Very high86.7Confident6 Ų671.3 Ų71.33%0.03140%0.401CS..Hα-helixtrans-62.6-42.9175.7-69.5168.9000112.2V5 Q11 L12 M13 Y26 I29 A47 F48 A51V5-L9 HydrophobicContact CG1-CD1 3.86Å; V5-L9 HydrophobicContact CG1-CG 4.41Å; V5-L9 WeakPolarHBondContact O-CB 3.45Å; V5-L9 WeakPolarHBondContact O-CG 3.44Å; V5-L9 PolarHBondContact O-N 3.07Å; L9-Q11 VanDerWaalsContact C-N 3.32Å; L9-Q11 PolarHBondContact O-N 3.49Å; L9-L12 PolarHBondContact O-N 3.31Å; L9-M13 PolarHBondContact O-N 3.3Å; L9-Y26 HydrophobicContact CD2-CD1 3.6Å; L9-Y26 HydrophobicContact CD2-CE1 3.66Å; L9-I29 HydrophobicContact CD2-CB 4.47Å; L9-I29 HydrophobicContact CD2-CD1 4.11Å; L9-I29 HydrophobicContact CD2-CG2 3.92Å; L9-I29 HydrophobicContact CG-CG2 4.03Å; L9-A47 HydrophobicContact CD1-CB 4.34Å; L9-F48 HydrophobicContact CD1-CB 4.45Å; L9-F48 HydrophobicContact CD1-CD2 4.43Å; L9-F48 HydrophobicContact CD2-CD2 3.95Å; L9-F48 HydrophobicContact CD2-CE2 4.28Å; L9-A51 HydrophobicContact CB-CB 3.99Å; L9-A51 HydrophobicContact CD1-CB 4.01Å; L9-A51 HydrophobicContact CD2-CB 4.15Å; L9-A51 HydrophobicContact CG-CB 4.27Å
10A91.5Very high86.8Confident58 Ų5876.6 Ų76.648%0.47942%0.419SS..Hα-helixtrans-64.5-35.8178.800000112.5R6 Q7 L12 M13R6-A10 WeakPolarHBondContact O-CB 3.38Å; R6-A10 PolarHBondContact O-N 3.45Å; Q7-A10 PolarHBondContact O-N 3.04Å; A10-L12 VanDerWaalsContact C-N 3.35Å; A10-M13 WeakPolarHBondContact O-CB 3.46Å; A10-M13 PolarHBondContact O-N 3.36Å
11Q90.9Very high87Confident132 Ų13277.3 Ų77.362%0.61742%0.423SS*.Hα-helixtrans-65.6-37.1175.9-72.51746.300112.3Q7 E8 L9 M13Q7-Q11 WeakPolarHBondContact O-CG 3.24Å; Q7-Q11 PolarHBondContact O-N 3.03Å; E8-Q11 PolarHBondContact O-N 3.04Å; L9-Q11 VanDerWaalsContact C-N 3.32Å; L9-Q11 PolarHBondContact O-N 3.49Å; Q11-M13 VanDerWaalsContact C-N 3.33Å
12L90.6Very high87.6Confident21 Ų2173.6 Ų73.611%0.1141%0.405CS..Hα-helixtrans-75.2-21.1179.2-68.1-176.2000113.6E8 L9 A10 N14 S15 L22 K25 Y26 I29E8-L12 PolarHBondContact O-N 3.47Å; L9-L12 PolarHBondContact O-N 3.31Å; A10-L12 VanDerWaalsContact C-N 3.35Å; L12-N14 VanDerWaalsContact C-N 3.26Å; L12-N14 PolarHBondContact O-N 3.27Å; L12-S15 WeakPolarHBondContact O-CB 3.47Å; L12-S15 PolarHBondContact O-N 3.23Å; L12-S15 VanDerWaalsContact O-N 3.12Å; L12-L22 HydrophobicContact CB-CD1 4.07Å; L12-L22 HydrophobicContact CD2-CD1 4.04Å; L12-L22 HydrophobicContact CG-CD1 4.45Å; L12-K25 HydrophobicContact CD1-CB 3.79Å; L12-K25 HydrophobicContact CD2-CB 4.24Å; L12-K25 HydrophobicContact CD2-CD 3.79Å; L12-Y26 HydrophobicContact CB-CE1 3.92Å; L12-Y26 HydrophobicContact CB-CE2 4.17Å; L12-Y26 HydrophobicContact CD1-CD1 3.96Å; L12-Y26 HydrophobicContact CD1-CD2 4.4Å; L12-Y26 HydrophobicContact CD1-CE1 3.99Å; L12-Y26 HydrophobicContact CD1-CE2 4.43Å; L12-Y26 HydrophobicContact CD1-CG 4.15Å; L12-I29 HydrophobicContact CD1-CD1 3.47Å; L12-I29 VanDerWaalsContact CD1-CD1 3.47Å; L12-I29 HydrophobicContact CG-CD1 4.42Å
13M87.3Confident88.3Confident50 Ų5073.6 Ų73.625%0.24640%0.404CS..Hα-helixtrans-60-33.8-175.2-166.9172.568.700113.4L9 A10 Q11 N54 N56 V57L9-M13 PolarHBondContact O-N 3.3Å; A10-M13 WeakPolarHBondContact O-CB 3.46Å; A10-M13 PolarHBondContact O-N 3.36Å; Q11-M13 VanDerWaalsContact C-N 3.33Å; M13-N54 HydrophobicContact SD-CB 4.19Å; M13-N54 PolarHBondContact SD-ND2 3.42Å; M13-N54 VanDerWaalsContact SD-ND2 3.39Å; M13-N56 HydrophobicContact CG-CB 3.71Å; M13-N56 HydrophobicContact SD-CB 4.24Å; M13-V57 HydrophobicContact CG-CG2 4.13Å
14N82.6Confident88.7Confident121 Ų12172 Ų7265%0.64739%0.391SS*.THydrogen-bonded Turntrans-108.713.4178.6-63-36000112.9L12 T16L12-N14 VanDerWaalsContact C-N 3.26Å; L12-N14 PolarHBondContact O-N 3.27Å; N14-T16 PolarHBondContact O-N 3.34Å
15S85.4Confident88.9Confident42 Ų4272.6 Ų72.629%0.29439%0.392SS..  trans-75123.9-175.6174.80000111.5L12 G17L12-S15 WeakPolarHBondContact O-CB 3.47Å; L12-S15 PolarHBondContact O-N 3.23Å; L12-S15 VanDerWaalsContact O-N 3.12Å; S15-G17 PolarHBondContact O-N 3.44Å
16T73.9Confident89.1Confident145 Ų14572.6 Ų72.689%0.8939%0.393SS*.  trans-86.499.5171.755.70000109.9N14N14-T16 PolarHBondContact O-N 3.34Å
17G79.8Confident89.2Confident46 Ų4671.6 Ų71.647%0.47439%0.389SS..  trans-150.1172.9177.400000111.6S15S15-G17 PolarHBondContact O-N 3.44Å
18S87.6Confident89.4Confident57 Ų5772.2 Ų72.240%0.39939%0.392SS..  trans-62.6147.117586.50000110.3K20 D21 L22S18-K20 PolarHBondContact O-N 3.36Å; S18-D21 WeakPolarHBondContact CB-OD2 3.43Å; S18-D21 PolarHBondContact O-N 3.27Å; S18-D21 PolarHBondContact OG-N 3.27Å; S18-D21 PolarHBondContact OG-OD2 2.97Å; S18-L22 WeakPolarHBondContact O-CB 3.5Å; S18-L22 PolarHBondContact O-N 3.19Å
19H86.4Confident89.5Confident114 Ų11470 Ų7053%0.52838%0.382SS..Hα-helixtrans-56.5-33.9177.9-71.2171000112.4A23 I61H19-A23 VanDerWaalsContact O-CB 3.24Å; H19-A23 WeakPolarHBondContact O-CB 3.39Å; H19-A23 PolarHBondContact O-N 3.11Å; H19-I61 HydrophobicContact CB-CD1 4.49Å
20K88.4Confident89.6Confident176 Ų17669.8 Ų69.877%0.76538%0.381SS*.Hα-helixtrans-67.2-46.5179.7-168.9-178.3-179.9-176.80111.4S18 A24S18-K20 PolarHBondContact O-N 3.36Å; K20-A24 WeakPolarHBondContact O-CB 3.44Å; K20-A24 PolarHBondContact O-N 3.08Å
21D90.5Very high89.7Confident93 Ų9371.9 Ų71.950%0.49738%0.38SS..Hα-helixtrans-69.8-40.1-178.9-57-36000111.1S18 A24 K25S18-D21 WeakPolarHBondContact CB-OD2 3.43Å; S18-D21 PolarHBondContact O-N 3.27Å; S18-D21 PolarHBondContact OG-N 3.27Å; S18-D21 PolarHBondContact OG-OD2 2.97Å; D21-A24 PolarHBondContact O-N 3.27Å; D21-K25 WeakPolarHBondContact O-CG 3.45Å; D21-K25 PolarHBondContact O-N 2.81Å
22L91.8Very high89.9Confident21 Ų2168.6 Ų68.611%0.1136%0.364CS..Hα-helixtrans-65.7-44.5178.8-171.958.2000111.2L12 S18 A24 K25 Y26 I61L12-L22 HydrophobicContact CB-CD1 4.07Å; L12-L22 HydrophobicContact CD2-CD1 4.04Å; L12-L22 HydrophobicContact CG-CD1 4.45Å; S18-L22 WeakPolarHBondContact O-CB 3.5Å; S18-L22 PolarHBondContact O-N 3.19Å; L22-A24 VanDerWaalsContact C-N 3.33Å; L22-A24 PolarHBondContact O-N 2.84Å; L22-K25 PolarHBondContact O-N 2.86Å; L22-Y26 HydrophobicContact CD1-CD2 4.2Å; L22-Y26 HydrophobicContact CD1-CE2 3.76Å; L22-Y26 HydrophobicContact CD2-CE2 4.26Å; L22-Y26 HydrophobicContact CG-CD2 4.02Å; L22-Y26 HydrophobicContact CG-CE2 3.7Å; L22-Y26 WeakPolarHBondContact O-CD2 3.34Å; L22-Y26 PolarHBondContact O-N 2.74Å; L22-I61 HydrophobicContact CB-CD1 4.03Å; L22-I61 HydrophobicContact CD2-CD1 3.59Å; L22-I61 HydrophobicContact CG-CD1 3.92Å
23A92.8Very high90Very high14 Ų1467.6 Ų67.612%0.11636%0.359CS..Hα-helixtrans-62.1-38.4174.700000112.5H19 Y26 R27H19-A23 VanDerWaalsContact O-CB 3.24Å; H19-A23 WeakPolarHBondContact O-CB 3.39Å; H19-A23 PolarHBondContact O-N 3.11Å; A23-Y26 PolarHBondContact O-N 3.41Å; A23-R27 WeakPolarHBondContact O-CB 3.21Å; A23-R27 PolarHBondContact O-N 3.44Å
24A93.2Very high90.2Very high45 Ų4566.7 Ų66.737%0.37236%0.355SS..Hα-helixtrans-64.1-42.3176.500000112.3K20 D21 L22 R27 Q28K20-A24 WeakPolarHBondContact O-CB 3.44Å; K20-A24 PolarHBondContact O-N 3.08Å; D21-A24 PolarHBondContact O-N 3.27Å; L22-A24 VanDerWaalsContact C-N 3.33Å; L22-A24 PolarHBondContact O-N 2.84Å; A24-R27 PolarHBondContact O-N 2.97Å; A24-Q28 PolarHBondContact O-N 2.96Å; A24-Q28 VanDerWaalsContact O-N 3.07Å
25K94.1Very high90.6Very high102 Ų10268.5 Ų68.544%0.44336%0.359SS..Hα-helixtrans-63.1-44.8175.7-70.1179.9-176.1-178.10111.9L12 D21 L22 R27 Q28 I29L12-K25 HydrophobicContact CD1-CB 3.79Å; L12-K25 HydrophobicContact CD2-CB 4.24Å; L12-K25 HydrophobicContact CD2-CD 3.79Å; D21-K25 WeakPolarHBondContact O-CG 3.45Å; D21-K25 PolarHBondContact O-N 2.81Å; L22-K25 PolarHBondContact O-N 2.86Å; K25-R27 VanDerWaalsContact C-N 3.29Å; K25-R27 PolarHBondContact O-N 3.31Å; K25-Q28 PolarHBondContact O-N 3.1Å; K25-I29 WeakPolarHBondContact O-CG1 3.33Å; K25-I29 PolarHBondContact O-N 3.01Å
26Y95.3Very high90.9Very high1 Ų167.6 Ų67.60%0.00435%0.351CS..Hα-helixtrans-61-38174.3-81.3-64.8000112.7L9 L12 L22 A23 I29 L30 M52 I61 L65L9-Y26 HydrophobicContact CD2-CD1 3.6Å; L9-Y26 HydrophobicContact CD2-CE1 3.66Å; L12-Y26 HydrophobicContact CB-CE1 3.92Å; L12-Y26 HydrophobicContact CB-CE2 4.17Å; L12-Y26 HydrophobicContact CD1-CD1 3.96Å; L12-Y26 HydrophobicContact CD1-CD2 4.4Å; L12-Y26 HydrophobicContact CD1-CE1 3.99Å; L12-Y26 HydrophobicContact CD1-CE2 4.43Å; L12-Y26 HydrophobicContact CD1-CG 4.15Å; L22-Y26 HydrophobicContact CD1-CD2 4.2Å; L22-Y26 HydrophobicContact CD1-CE2 3.76Å; L22-Y26 HydrophobicContact CD2-CE2 4.26Å; L22-Y26 HydrophobicContact CG-CD2 4.02Å; L22-Y26 HydrophobicContact CG-CE2 3.7Å; L22-Y26 WeakPolarHBondContact O-CD2 3.34Å; L22-Y26 PolarHBondContact O-N 2.74Å; A23-Y26 PolarHBondContact O-N 3.41Å; Y26-I29 PolarHBondContact O-N 2.95Å; Y26-L30 PolarHBondContact O-N 3.32Å; Y26-M52 HydrophobicContact CD1-CE 3.58Å; Y26-M52 HydrophobicContact CE1-CE 3.5Å; Y26-M52 HydrophobicContact CE2-CE 4.45Å; Y26-M52 HydrophobicContact CG-CE 4.12Å; Y26-I61 HydrophobicContact CD2-CG2 3.89Å; Y26-I61 HydrophobicContact CE2-CG2 4.14Å; Y26-L65 HydrophobicContact CD1-CD1 4.44Å; Y26-L65 HydrophobicContact CD2-CD1 3.81Å; Y26-L65 HydrophobicContact CG-CD1 3.62Å
27R95.1Very high91.6Very high79 Ų7965.1 Ų65.130%0.29834%0.336SS..Hα-helixtrans-64.8-38.8177.5-167.5172.8-66.1108.8-1.9112.3A23 A24 K25 I29 L30 E31 L65 D68A23-R27 WeakPolarHBondContact O-CB 3.21Å; A23-R27 PolarHBondContact O-N 3.44Å; A24-R27 PolarHBondContact O-N 2.97Å; K25-R27 VanDerWaalsContact C-N 3.29Å; K25-R27 PolarHBondContact O-N 3.31Å; R27-I29 VanDerWaalsContact C-N 3.32Å; R27-I29 PolarHBondContact O-N 3.49Å; R27-L30 WeakPolarHBondContact O-CB 3.36Å; R27-L30 PolarHBondContact O-N 3.11Å; R27-E31 WeakPolarHBondContact O-CG 3.41Å; R27-E31 PolarHBondContact O-N 3.23Å; R27-L65 HydrophobicContact CB-CD2 4.31Å; R27-D68 IonicContact CZ-OD2 3.54Å; R27-D68 VanDerWaalsContact CZ-OD2 3.23Å; R27-D68 IonicContact NE-OD2 3.5Å; R27-D68 PolarHBondContact NE-OD2 3.24Å; R27-D68 IonicContact NH2-OD2 2.77Å; R27-D68 PolarHBondContact NH2-OD2 3.23Å
28Q94.9Very high91.9Very high136 Ų13669.3 Ų69.364%0.63635%0.347SS*.Hα-helixtrans-61.6-40.5172.9-75.6-179.5-1400112.3A24 K25 L30 E31 K32A24-Q28 PolarHBondContact O-N 2.96Å; A24-Q28 VanDerWaalsContact O-N 3.07Å; K25-Q28 PolarHBondContact O-N 3.1Å; Q28-L30 VanDerWaalsContact C-N 3.34Å; Q28-E31 PolarHBondContact O-N 3.37Å; Q28-K32 WeakPolarHBondContact O-CB 3.37Å; Q28-K32 PolarHBondContact O-N 3.08Å
29I95Very high92Very high12 Ų1270.1 Ų70.16%0.06236%0.357CS..Hα-helixtrans-65.7-41.1176.2-61.2170.7000110.5V5 E8 L9 L12 K25 Y26 R27 K32 A33V5-I29 HydrophobicContact CG1-CG2 3.81Å; E8-I29 HydrophobicContact CB-CD1 3.81Å; E8-I29 HydrophobicContact CB-CG1 4.33Å; L9-I29 HydrophobicContact CD2-CB 4.47Å; L9-I29 HydrophobicContact CD2-CD1 4.11Å; L9-I29 HydrophobicContact CD2-CG2 3.92Å; L9-I29 HydrophobicContact CG-CG2 4.03Å; L12-I29 HydrophobicContact CD1-CD1 3.47Å; L12-I29 VanDerWaalsContact CD1-CD1 3.47Å; L12-I29 HydrophobicContact CG-CD1 4.42Å; K25-I29 WeakPolarHBondContact O-CG1 3.33Å; K25-I29 PolarHBondContact O-N 3.01Å; Y26-I29 PolarHBondContact O-N 2.95Å; R27-I29 VanDerWaalsContact C-N 3.32Å; R27-I29 PolarHBondContact O-N 3.49Å; I29-K32 PolarHBondContact O-N 3.36Å; I29-A33 WeakPolarHBondContact O-CB 3.44Å; I29-A33 PolarHBondContact O-N 3.39Å
30L95.1Very high92.2Very high1 Ų168.7 Ų68.71%0.00535%0.351CS..Hα-helixtrans-60.7-47175.2176.156.5000111.5Y26 R27 Q28 K32 A33 I34 L45 F48 F69Y26-L30 PolarHBondContact O-N 3.32Å; R27-L30 WeakPolarHBondContact O-CB 3.36Å; R27-L30 PolarHBondContact O-N 3.11Å; Q28-L30 VanDerWaalsContact C-N 3.34Å; L30-K32 VanDerWaalsContact C-N 3.34Å; L30-K32 PolarHBondContact O-N 3.07Å; L30-A33 WeakPolarHBondContact O-CB 3.35Å; L30-A33 PolarHBondContact O-N 2.99Å; L30-A33 VanDerWaalsContact O-N 3.15Å; L30-I34 HydrophobicContact CD1-CD1 3.83Å; L30-I34 HydrophobicContact CD1-CG1 4.1Å; L30-I34 HydrophobicContact CG-CD1 3.8Å; L30-I34 WeakPolarHBondContact O-CD1 3.35Å; L30-I34 VanDerWaalsContact O-CG1 3.29Å; L30-I34 WeakPolarHBondContact O-CG1 3.5Å; L30-I34 PolarHBondContact O-N 3.37Å; L30-L45 HydrophobicContact CD1-CD2 4.44Å; L30-F48 HydrophobicContact CB-CD2 4.26Å; L30-F48 HydrophobicContact CB-CE2 3.7Å; L30-F48 HydrophobicContact CB-CZ 3.87Å; L30-F48 HydrophobicContact CD1-CD1 4.19Å; L30-F48 HydrophobicContact CD1-CD2 4.44Å; L30-F48 HydrophobicContact CD1-CE1 4.18Å; L30-F48 HydrophobicContact CD1-CE2 4.45Å; L30-F48 HydrophobicContact CD1-CG 4.32Å; L30-F48 HydrophobicContact CD1-CZ 4.31Å; L30-F48 HydrophobicContact CD2-CE1 4.19Å; L30-F48 HydrophobicContact CD2-CZ 4.04Å; L30-F48 HydrophobicContact CG-CE2 4.49Å; L30-F48 HydrophobicContact CG-CZ 4.29Å; L30-F69 HydrophobicContact CD1-CD2 3.69Å; L30-F69 HydrophobicContact CD1-CE2 4.45Å; L30-F69 HydrophobicContact CD2-CB 4.2Å
31E93.9Very high92.4Very high102 Ų10261.4 Ų61.448%0.47732%0.319SS..Hα-helixtrans-59-44.2175.5-74.6172.5-168.600111.5R27 Q28 A33 I34 Q35R27-E31 WeakPolarHBondContact O-CG 3.41Å; R27-E31 PolarHBondContact O-N 3.23Å; Q28-E31 PolarHBondContact O-N 3.37Å; E31-A33 VanDerWaalsContact C-N 3.33Å; E31-A33 PolarHBondContact O-N 3.2Å; E31-I34 PolarHBondContact O-N 2.96Å; E31-Q35 WeakPolarHBondContact O-CG 3.39Å; E31-Q35 PolarHBondContact O-N 3.03Å; E31-Q35 VanDerWaalsContact O-N 3.15Å
32K93.5Very high92.5Very high62 Ų6258.9 Ų58.927%0.2731%0.306SS..Hα-helixtrans-58-45.3173.8-177.1179.2172.8-177.50111E4 E8 Q28 I29 L30 I34 Q35E4-K32 IonicContact OE2-NZ 3.16Å; E4-K32 PolarHBondContact OE2-NZ 3.24Å; E8-K32 IonicContact OE1-NZ 3.01Å; E8-K32 PolarHBondContact OE1-NZ 2.98Å; Q28-K32 WeakPolarHBondContact O-CB 3.37Å; Q28-K32 PolarHBondContact O-N 3.08Å; I29-K32 PolarHBondContact O-N 3.36Å; L30-K32 VanDerWaalsContact C-N 3.34Å; L30-K32 PolarHBondContact O-N 3.07Å; K32-I34 PolarHBondContact O-N 3.3Å; K32-Q35 PolarHBondContact O-N 3.37Å
33A93.3Very high92.6Very high0 Ų061.3 Ų61.30%032%0.317CS..Hα-helixtrans-65-36.9179.400000113I29 L30 E31 L36 L45I29-A33 WeakPolarHBondContact O-CB 3.44Å; I29-A33 PolarHBondContact O-N 3.39Å; L30-A33 WeakPolarHBondContact O-CB 3.35Å; L30-A33 PolarHBondContact O-N 2.99Å; L30-A33 VanDerWaalsContact O-N 3.15Å; E31-A33 VanDerWaalsContact C-N 3.33Å; E31-A33 PolarHBondContact O-N 3.2Å; A33-L36 PolarHBondContact O-N 3.38Å; A33-L45 HydrophobicContact CB-CD2 4.49Å
34I91.7Very high92.7Very high32 Ų3260.7 Ų60.716%0.16431%0.311CS..Hα-helixtrans-68.4-34.7178.2-68.6160.9000111.6L30 E31 K32 L36 Q41 L45 H72L30-I34 HydrophobicContact CD1-CD1 3.83Å; L30-I34 HydrophobicContact CD1-CG1 4.1Å; L30-I34 HydrophobicContact CG-CD1 3.8Å; L30-I34 WeakPolarHBondContact O-CD1 3.35Å; L30-I34 VanDerWaalsContact O-CG1 3.29Å; L30-I34 WeakPolarHBondContact O-CG1 3.5Å; L30-I34 PolarHBondContact O-N 3.37Å; E31-I34 PolarHBondContact O-N 2.96Å; K32-I34 PolarHBondContact O-N 3.3Å; I34-L36 VanDerWaalsContact C-N 3.26Å; I34-L36 PolarHBondContact O-N 3.37Å; I34-Q41 PolarHBondContact O-NE2 2.87Å; I34-L45 HydrophobicContact CG1-CD2 4.25Å; I34-H72 HydrophobicContact CD1-CB 3.68Å; I34-H72 HydrophobicContact CG1-CB 4.41Å
35Q91Very high92.8Very high159 Ų15958.6 Ų58.674%0.74329%0.294SS*.THydrogen-bonded Turntrans-75.2-11.7179.8-65.8-65.4-25.200114E31 K32E31-Q35 WeakPolarHBondContact O-CG 3.39Å; E31-Q35 PolarHBondContact O-N 3.03Å; E31-Q35 VanDerWaalsContact O-N 3.15Å; K32-Q35 PolarHBondContact O-N 3.37Å
36L91.2Very high92.9Very high23 Ų2355.9 Ų55.912%0.1228%0.282CS..  trans-70.8160.3172.5-61.2175.9000110.7M1 A33 I34 Q41 S44M1-L36 HydrophobicContact CB-CD1 4.05Å; M1-L36 HydrophobicContact CB-CD2 3.8Å; M1-L36 HydrophobicContact CG-CD2 4.12Å; A33-L36 PolarHBondContact O-N 3.38Å; I34-L36 VanDerWaalsContact C-N 3.26Å; I34-L36 PolarHBondContact O-N 3.37Å; L36-Q41 HydrophobicContact CB-CB 4.16Å; L36-Q41 WeakPolarHBondContact O-CB 3.21Å; L36-Q41 VanDerWaalsContact O-CG 3.23Å; L36-Q41 WeakPolarHBondContact O-CG 3.4Å; L36-Q41 PolarHBondContact O-NE2 3.06Å; L36-Q41 VanDerWaalsContact O-NE2 3.12Å; L36-S44 WeakPolarHBondContact CD1-OG 3.33Å
37T88.8Confident92.9Very high92 Ų9256 Ų5656%0.56428%0.284SS*.  trans-115.1160.8178.461.40000112.1E40 Q41T37-E40 PolarHBondContact O-N 3.48Å; T37-Q41 PolarHBondContact O-N 3.01Å
38D86.3Confident93Very high134 Ų13452.3 Ų52.372%0.71727%0.269SS*.Hα-helixtrans55.2-136.6169-50.8-54.6000114.1E40 Q41 L42D38-E40 VanDerWaalsContact C-N 3.26Å; D38-E40 PolarHBondContact O-N 3.11Å; D38-Q41 WeakPolarHBondContact O-CB 3.46Å; D38-Q41 PolarHBondContact O-N 3.49Å; D38-L42 PolarHBondContact O-N 3.44Å
39A89.1Confident93.1Very high74 Ų7445.8 Ų45.861%0.61224%0.239SC*.Hα-helixtrans-63.8-30.2-176.900000112.9L42 E43A39-L42 PolarHBondContact O-N 2.92Å; A39-E43 PolarHBondContact O-N 3.41Å
40E90.8Very high93.2Very high85 Ų8548.3 Ų48.340%0.39725%0.251SS..Hα-helixtrans-69.7-36177.6-64.5-154.3127.100111.7M1 T37 D38 S44M1-E40 WeakPolarHBondContact CB-OE2 3.5Å; M1-E40 PolarHBondContact N-OE1 3Å; T37-E40 PolarHBondContact O-N 3.48Å; D38-E40 VanDerWaalsContact C-N 3.26Å; D38-E40 PolarHBondContact O-N 3.11Å; E40-S44 VanDerWaalsContact O-CB 3.28Å; E40-S44 WeakPolarHBondContact O-CB 3.3Å; E40-S44 PolarHBondContact O-N 2.85Å; E40-S44 PolarHBondContact O-OG 2.89Å
41Q92.4Very high93.2Very high22 Ų2249 Ų4910%0.10326%0.256CS..Hα-helixtrans-62.2-51.8173.5-163.5-172.84600110.3I34 L36 T37 D38 E43 S44 L45I34-Q41 PolarHBondContact O-NE2 2.87Å; L36-Q41 HydrophobicContact CB-CB 4.16Å; L36-Q41 WeakPolarHBondContact O-CB 3.21Å; L36-Q41 VanDerWaalsContact O-CG 3.23Å; L36-Q41 WeakPolarHBondContact O-CG 3.4Å; L36-Q41 PolarHBondContact O-NE2 3.06Å; L36-Q41 VanDerWaalsContact O-NE2 3.12Å; T37-Q41 PolarHBondContact O-N 3.01Å; D38-Q41 WeakPolarHBondContact O-CB 3.46Å; D38-Q41 PolarHBondContact O-N 3.49Å; Q41-E43 PolarHBondContact O-N 3.28Å; Q41-S44 PolarHBondContact O-N 2.82Å; Q41-L45 HydrophobicContact CG-CD1 4.11Å; Q41-L45 HydrophobicContact CG-CG 4.5Å; Q41-L45 VanDerWaalsContact O-CG 3.28Å; Q41-L45 WeakPolarHBondContact O-CG 3.44Å; Q41-L45 PolarHBondContact O-N 3.39Å
42L92.8Very high93.3Very high40 Ų4044.1 Ų44.121%0.20923%0.233CC..Hα-helixtrans-58-48-179179.861.5000112.1D38 A39 S44 L45 K46 T80 A83 V84D38-L42 PolarHBondContact O-N 3.44Å; A39-L42 PolarHBondContact O-N 2.92Å; L42-S44 VanDerWaalsContact C-N 3.33Å; L42-S44 PolarHBondContact O-N 3.45Å; L42-L45 PolarHBondContact O-N 3.31Å; L42-K46 WeakPolarHBondContact O-CG 3.22Å; L42-K46 PolarHBondContact O-N 3.43Å; L42-T80 HydrophobicContact CD1-CG2 4.29Å; L42-A83 HydrophobicContact CD1-CB 4.33Å; L42-V84 HydrophobicContact CD1-CG2 3.51Å
43E94.7Very high93.4Very high73 Ų7342.1 Ų42.134%0.34123%0.226SC..Hα-helixtrans-65.1-35.8178.6-79.7-59.4131.800112.8A2 R6 A39 Q41 K46 A47A2-E43 HydrophobicContact CB-CB 3.92Å; R6-E43 IonicContact NH2-OE2 3.86Å; R6-E43 PolarHBondContact NH2-OE2 3.11Å; A39-E43 PolarHBondContact O-N 3.41Å; Q41-E43 PolarHBondContact O-N 3.28Å; E43-K46 PolarHBondContact O-N 3.25Å; E43-K46 IonicContact OE1-NZ 3.12Å; E43-A47 WeakPolarHBondContact O-CB 3.27Å; E43-A47 PolarHBondContact O-N 3.49Å
44S94.6Very high93.4Very high0 Ų044.7 Ų44.70%024%0.24CC..Hα-helixtrans-70.2-39.4177.7-580000112.1A2 L36 E40 Q41 L42 A47 F48A2-S44 WeakPolarHBondContact CA-OG 3.44Å; A2-S44 WeakPolarHBondContact CB-OG 3.35Å; L36-S44 WeakPolarHBondContact CD1-OG 3.33Å; E40-S44 VanDerWaalsContact O-CB 3.28Å; E40-S44 WeakPolarHBondContact O-CB 3.3Å; E40-S44 PolarHBondContact O-N 2.85Å; E40-S44 PolarHBondContact O-OG 2.89Å; Q41-S44 PolarHBondContact O-N 2.82Å; L42-S44 VanDerWaalsContact C-N 3.33Å; L42-S44 PolarHBondContact O-N 3.45Å; S44-A47 WeakPolarHBondContact O-CB 3.46Å; S44-A47 PolarHBondContact O-N 3Å; S44-F48 PolarHBondContact O-N 3.18Å
45L95.6Very high93.4Very high1 Ų150.8 Ų50.81%0.00527%0.268CS..Hα-helixtrans-66.3-40.1174.9-64.6172.7000111.4L30 A33 I34 Q41 L42 F48 V49 F69 L73 L76 V84L30-L45 HydrophobicContact CD1-CD2 4.44Å; A33-L45 HydrophobicContact CB-CD2 4.49Å; I34-L45 HydrophobicContact CG1-CD2 4.25Å; Q41-L45 HydrophobicContact CG-CD1 4.11Å; Q41-L45 HydrophobicContact CG-CG 4.5Å; Q41-L45 VanDerWaalsContact O-CG 3.28Å; Q41-L45 WeakPolarHBondContact O-CG 3.44Å; Q41-L45 PolarHBondContact O-N 3.39Å; L42-L45 PolarHBondContact O-N 3.31Å; L45-F48 WeakPolarHBondContact O-CB 3.44Å; L45-F48 PolarHBondContact O-N 3.17Å; L45-V49 WeakPolarHBondContact O-CG2 3.24Å; L45-V49 PolarHBondContact O-N 3.4Å; L45-V49 VanDerWaalsContact O-N 3.09Å; L45-F69 HydrophobicContact CB-CE2 4.08Å; L45-F69 HydrophobicContact CB-CZ 4.39Å; L45-F69 HydrophobicContact CD2-CD2 4.38Å; L45-F69 HydrophobicContact CD2-CE2 3.7Å; L45-F69 HydrophobicContact CG-CE2 4.42Å; L45-L73 HydrophobicContact CD1-CD2 4.48Å; L45-L76 HydrophobicContact CD1-CD1 3.61Å; L45-V84 HydrophobicContact CB-CG2 4.29Å; L45-V84 HydrophobicContact CD1-CG2 4.12Å
46K95.9Very high93.4Very high46 Ų4647.9 Ų47.920%0.226%0.258CS..Hα-helixtrans-62-45.3172.7-72.9-179.1-177.1172.40112L42 E43 F48 V49 E50 F87L42-K46 WeakPolarHBondContact O-CG 3.22Å; L42-K46 PolarHBondContact O-N 3.43Å; E43-K46 PolarHBondContact O-N 3.25Å; E43-K46 IonicContact OE1-NZ 3.12Å; K46-F48 VanDerWaalsContact C-N 3.27Å; K46-F48 PolarHBondContact O-N 3.32Å; K46-V49 PolarHBondContact O-N 3.32Å; K46-E50 WeakPolarHBondContact O-CG 3.41Å; K46-E50 PolarHBondContact O-N 3Å; K46-F87 HydrophobicContact CB-CD1 4Å; K46-F87 HydrophobicContact CB-CE1 3.56Å; K46-F87 HydrophobicContact CB-CE2 4.43Å; K46-F87 HydrophobicContact CB-CZ 3.79Å; K46-F87 HydrophobicContact CD-CD1 4.44Å; K46-F87 HydrophobicContact CD-CD2 4.05Å; K46-F87 HydrophobicContact CD-CE1 4.44Å; K46-F87 HydrophobicContact CD-CE2 4.04Å; K46-F87 HydrophobicContact CD-CG 4.22Å; K46-F87 HydrophobicContact CD-CZ 4.23Å; K46-F87 HydrophobicContact CG-CD1 3.66Å; K46-F87 HydrophobicContact CG-CD2 4.16Å; K46-F87 HydrophobicContact CG-CE1 3.74Å; K46-F87 HydrophobicContact CG-CE2 4.22Å; K46-F87 HydrophobicContact CG-CG 3.86Å; K46-F87 HydrophobicContact CG-CZ 4Å; K46-F87 WeakPolarHBondContact O-CE1 3.43Å
47A95.8Very high93.5Very high4 Ų447.2 Ų47.23%0.03325%0.254CS..Hα-helixtrans-58.8-39.9175.500000112.3R6 L9 E43 S44 E50 A51R6-A47 HydrophobicContact CG-CB 3.4Å; L9-A47 HydrophobicContact CD1-CB 4.34Å; E43-A47 WeakPolarHBondContact O-CB 3.27Å; E43-A47 PolarHBondContact O-N 3.49Å; S44-A47 WeakPolarHBondContact O-CB 3.46Å; S44-A47 PolarHBondContact O-N 3Å; A47-E50 PolarHBondContact O-N 3.33Å; A47-A51 PolarHBondContact O-N 3.19Å
48F96.6Very high93.7Very high0 Ų045.1 Ų45.10%024%0.243CC..Hα-helixtrans-60.8-46.7175.6-169.3-94.9000111.8L9 L30 S44 L45 K46 E50 A51 M52 L65 F69L9-F48 HydrophobicContact CD1-CB 4.45Å; L9-F48 HydrophobicContact CD1-CD2 4.43Å; L9-F48 HydrophobicContact CD2-CD2 3.95Å; L9-F48 HydrophobicContact CD2-CE2 4.28Å; L30-F48 HydrophobicContact CB-CD2 4.26Å; L30-F48 HydrophobicContact CB-CE2 3.7Å; L30-F48 HydrophobicContact CB-CZ 3.87Å; L30-F48 HydrophobicContact CD1-CD1 4.19Å; L30-F48 HydrophobicContact CD1-CD2 4.44Å; L30-F48 HydrophobicContact CD1-CE1 4.18Å; L30-F48 HydrophobicContact CD1-CE2 4.45Å; L30-F48 HydrophobicContact CD1-CG 4.32Å; L30-F48 HydrophobicContact CD1-CZ 4.31Å; L30-F48 HydrophobicContact CD2-CE1 4.19Å; L30-F48 HydrophobicContact CD2-CZ 4.04Å; L30-F48 HydrophobicContact CG-CE2 4.49Å; L30-F48 HydrophobicContact CG-CZ 4.29Å; S44-F48 PolarHBondContact O-N 3.18Å; L45-F48 WeakPolarHBondContact O-CB 3.44Å; L45-F48 PolarHBondContact O-N 3.17Å; K46-F48 VanDerWaalsContact C-N 3.27Å; K46-F48 PolarHBondContact O-N 3.32Å; F48-E50 PolarHBondContact O-N 3.33Å; F48-A51 PolarHBondContact O-N 3.48Å; F48-M52 HydrophobicContact CD1-CG 3.98Å; F48-M52 HydrophobicContact CE1-CG 3.67Å; F48-M52 HydrophobicContact CE1-SD 4.3Å; F48-M52 HydrophobicContact CZ-CG 4.12Å; F48-M52 HydrophobicContact CZ-SD 4.19Å; F48-M52 WeakPolarHBondContact O-CG 3.21Å; F48-M52 PolarHBondContact O-N 3.06Å; F48-L65 HydrophobicContact CE1-CB 4.33Å; F48-L65 HydrophobicContact CZ-CB 4.03Å; F48-L65 HydrophobicContact CZ-CD1 4.48Å; F48-L65 HydrophobicContact CZ-CD2 4.37Å; F48-F69 AromaticContact CD1-CD2 3.88Å; F48-F69 HydrophobicContact CD1-CD2 3.88Å; F48-F69 HydrophobicContact CD1-CE2 4.29Å; F48-F69 HydrophobicContact CD1-CG 4.43Å; F48-F69 HydrophobicContact CE1-CB 4.28Å; F48-F69 HydrophobicContact CE1-CD2 4.28Å
49V97Very high94Very high0 Ų041.1 Ų41.10%022%0.222CC..Hα-helixtrans-59.2-47.3175.7170.20000111.3L45 K46 A51 M52 V53 F69 F87 T88 K91L45-V49 WeakPolarHBondContact O-CG2 3.24Å; L45-V49 PolarHBondContact O-N 3.4Å; L45-V49 VanDerWaalsContact O-N 3.09Å; K46-V49 PolarHBondContact O-N 3.32Å; V49-A51 VanDerWaalsContact C-N 3.27Å; V49-A51 PolarHBondContact O-N 3.34Å; V49-M52 PolarHBondContact O-N 2.63Å; V49-M52 VanDerWaalsContact O-N 3.11Å; V49-V53 HydrophobicContact CG1-CG1 4.5Å; V49-V53 WeakPolarHBondContact O-CG2 3.21Å; V49-V53 PolarHBondContact O-N 2.77Å; V49-F69 HydrophobicContact CG2-CE1 3.77Å; V49-F69 HydrophobicContact CG2-CE2 4.35Å; V49-F69 HydrophobicContact CG2-CZ 3.59Å; V49-F87 HydrophobicContact CB-CD1 4.33Å; V49-F87 HydrophobicContact CB-CE1 4.13Å; V49-F87 HydrophobicContact CG1-CD1 4.18Å; V49-F87 HydrophobicContact CG1-CE1 4.1Å; V49-T88 HydrophobicContact CG1-CG2 4.05Å; V49-T88 HydrophobicContact CG2-CG2 4.1Å; V49-T88 WeakPolarHBondContact CG2-OG1 3.46Å; V49-K91 HydrophobicContact CG1-CB 3.9Å; V49-K91 HydrophobicContact CG1-CG 4.3Å
50E96.4Very high94.2Very high65 Ų6542.2 Ų42.230%0.30422%0.221SC..Hα-helixtrans-57.9-39.6178.3-71.2179.7152.300112.2R6 K46 A47 F48 V53 N54 F87 K91R6-E50 IonicContact CZ-OE2 3.74Å; R6-E50 IonicContact NH1-OE2 2.82Å; R6-E50 PolarHBondContact NH1-OE2 3.04Å; R6-E50 IonicContact NH2-OE2 3.68Å; K46-E50 WeakPolarHBondContact O-CG 3.41Å; K46-E50 PolarHBondContact O-N 3Å; A47-E50 PolarHBondContact O-N 3.33Å; F48-E50 PolarHBondContact O-N 3.33Å; E50-V53 WeakPolarHBondContact O-CG2 3.48Å; E50-N54 PolarHBondContact O-N 2.77Å; E50-F87 HydrophobicContact CG-CE1 4.11Å; E50-F87 HydrophobicContact CG-CZ 3.87Å; E50-K91 IonicContact OE1-NZ 3.75Å
51A95.6Very high94.4Very high14 Ų1438.4 Ų38.412%0.11620%0.203CC..Hα-helixtrans-66.9-42.4175.200000112L9 A47 F48 V49 V53 N54 V57L9-A51 HydrophobicContact CB-CB 3.99Å; L9-A51 HydrophobicContact CD1-CB 4.01Å; L9-A51 HydrophobicContact CD2-CB 4.15Å; L9-A51 HydrophobicContact CG-CB 4.27Å; A47-A51 PolarHBondContact O-N 3.19Å; F48-A51 PolarHBondContact O-N 3.48Å; V49-A51 VanDerWaalsContact C-N 3.27Å; V49-A51 PolarHBondContact O-N 3.34Å; A51-V53 PolarHBondContact O-N 3.11Å; A51-N54 VanDerWaalsContact O-CB 3.24Å; A51-N54 WeakPolarHBondContact O-CB 3.24Å; A51-N54 PolarHBondContact O-N 3.36Å; A51-V57 WeakPolarHBondContact O-CG2 3.49Å
52M95.6Very high94.6Very high0 Ų037.4 Ų37.40%020%0.198CC..Hα-helixtrans-70.2-31-177.2-68.4-56.998.400113.7Y26 F48 V49 N54 V57 S62 L65 L66Y26-M52 HydrophobicContact CD1-CE 3.58Å; Y26-M52 HydrophobicContact CE1-CE 3.5Å; Y26-M52 HydrophobicContact CE2-CE 4.45Å; Y26-M52 HydrophobicContact CG-CE 4.12Å; F48-M52 HydrophobicContact CD1-CG 3.98Å; F48-M52 HydrophobicContact CE1-CG 3.67Å; F48-M52 HydrophobicContact CE1-SD 4.3Å; F48-M52 HydrophobicContact CZ-CG 4.12Å; F48-M52 HydrophobicContact CZ-SD 4.19Å; F48-M52 WeakPolarHBondContact O-CG 3.21Å; F48-M52 PolarHBondContact O-N 3.06Å; V49-M52 PolarHBondContact O-N 2.63Å; V49-M52 VanDerWaalsContact O-N 3.11Å; M52-N54 VanDerWaalsContact C-N 3.3Å; M52-V57 HydrophobicContact CE-CG1 4.47Å; M52-S62 WeakPolarHBondContact O-CB 3.17Å; M52-S62 PolarHBondContact O-OG 3.49Å; M52-L65 HydrophobicContact CE-CD1 4.08Å; M52-L65 HydrophobicContact SD-CB 3.72Å; M52-L65 HydrophobicContact SD-CD1 3.46Å; M52-L65 WeakPolarHBondContact SD-CD1 3.43Å; M52-L65 HydrophobicContact SD-CG 4.28Å; M52-L66 HydrophobicContact CB-CD1 4.15Å; M52-L66 HydrophobicContact CB-CD2 3.96Å; M52-L66 HydrophobicContact CB-CG 3.9Å; M52-L66 HydrophobicContact CG-CD2 4.26Å; M52-L66 HydrophobicContact CG-CG 4.24Å
53V95.4Very high94.7Very high21 Ų2140.5 Ų40.513%0.12721%0.207CC..Hα-helixtrans-82.8-8.3177-58.70000113.3V49 E50 A51 K91 I92 R95V49-V53 HydrophobicContact CG1-CG1 4.5Å; V49-V53 WeakPolarHBondContact O-CG2 3.21Å; V49-V53 PolarHBondContact O-N 2.77Å; E50-V53 WeakPolarHBondContact O-CG2 3.48Å; A51-V53 PolarHBondContact O-N 3.11Å; V53-K91 HydrophobicContact CG1-CB 4.48Å; V53-K91 HydrophobicContact CG2-CB 4.31Å; V53-I92 HydrophobicContact CG1-CG1 3.67Å; V53-R95 PolarHBondContact O-NH1 2.8Å
54N94.1Very high94.7Very high53 Ų5341.4 Ų41.428%0.28321%0.211SC..SBendtrans-61.6141.7178.7-163.7-67.6000111.4M13 E50 A51 M52 N56 V57 R95M13-N54 HydrophobicContact SD-CB 4.19Å; M13-N54 PolarHBondContact SD-ND2 3.42Å; M13-N54 VanDerWaalsContact SD-ND2 3.39Å; E50-N54 PolarHBondContact O-N 2.77Å; A51-N54 VanDerWaalsContact O-CB 3.24Å; A51-N54 WeakPolarHBondContact O-CB 3.24Å; A51-N54 PolarHBondContact O-N 3.36Å; M52-N54 VanDerWaalsContact C-N 3.3Å; N54-N56 VanDerWaalsContact C-N 3.27Å; N54-N56 PolarHBondContact O-N 3.46Å; N54-N56 WeakPolarHBondContact OD1-CB 3.5Å; N54-N56 PolarHBondContact OD1-N 2.68Å; N54-N56 PolarHBondContact OD1-ND2 3.18Å; N54-V57 HydrophobicContact CB-CG2 4.39Å; N54-V57 PolarHBondContact O-N 3.01Å; N54-R95 PolarHBondContact O-NH1 3.26Å; N54-R95 VanDerWaalsContact O-NH1 3.08Å
55E92.4Very high94.8Very high160 Ų16041.4 Ų41.475%0.74821%0.211SC*.THydrogen-bonded Turntrans-69.8-23.9-178-64.6-176.4175.500113.3V57E55-V57 PolarHBondContact O-N 3.04Å
56N91.1Very high94.9Very high99 Ų9941.4 Ų41.453%0.52921%0.211SC..THydrogen-bonded Turntrans-73.3-17.4177.7-61.3-43.7000112.8M13 N54M13-N56 HydrophobicContact CG-CB 3.71Å; M13-N56 HydrophobicContact SD-CB 4.24Å; N54-N56 VanDerWaalsContact C-N 3.27Å; N54-N56 PolarHBondContact O-N 3.46Å; N54-N56 WeakPolarHBondContact OD1-CB 3.5Å; N54-N56 PolarHBondContact OD1-N 2.68Å; N54-N56 PolarHBondContact OD1-ND2 3.18Å
57V92.4Very high94.9Very high8 Ų841.8 Ų41.85%0.04822%0.217CC..SBendtrans-91.7127.4177.5-173.60000109.7M13 A51 M52 N54 E55 L59 I61 S62M13-V57 HydrophobicContact CG-CG2 4.13Å; A51-V57 WeakPolarHBondContact O-CG2 3.49Å; M52-V57 HydrophobicContact CE-CG1 4.47Å; N54-V57 HydrophobicContact CB-CG2 4.39Å; N54-V57 PolarHBondContact O-N 3.01Å; E55-V57 PolarHBondContact O-N 3.04Å; V57-L59 PolarHBondContact O-N 3.27Å; V57-I61 HydrophobicContact CG1-CB 4.41Å; V57-I61 HydrophobicContact CG1-CG2 4.2Å; V57-S62 WeakPolarHBondContact CG1-OG 3.2Å
58S93.1Very high94.8Very high48 Ų4842.9 Ų42.934%0.33622%0.223SC..  trans-58.2133.2178.6174.30000111.7V60 I61 S62S58-V60 PolarHBondContact O-N 3.4Å; S58-V60 VanDerWaalsContact O-N 3.1Å; S58-I61 PolarHBondContact O-N 2.93Å; S58-S62 PolarHBondContact O-N 2.79Å; S58-S62 PolarHBondContact O-OG 3.08Å
59L93.6Very high94.8Very high51 Ų5142.9 Ų42.927%0.26722%0.223SC..Hα-helixtrans-55.4-30.8178.8-76.4177.3000113.5V57 I61 R63 F99V57-L59 PolarHBondContact O-N 3.27Å; L59-I61 VanDerWaalsContact C-N 3.32Å; L59-R63 WeakPolarHBondContact O-CB 3.49Å; L59-R63 WeakPolarHBondContact O-CD 3.28Å; L59-R63 WeakPolarHBondContact O-CG 3.28Å; L59-R63 PolarHBondContact O-N 2.93Å; L59-F99 HydrophobicContact CD2-CE1 3.95Å; L59-F99 HydrophobicContact CD2-CE2 4.06Å; L59-F99 HydrophobicContact CD2-CZ 3.51Å
60V93.4Very high94.7Very high97 Ų9743 Ų4359%0.58822%0.224SC*.Hα-helixtrans-63.5-42.5177.5178.50000110.6S58 Q64S58-V60 PolarHBondContact O-N 3.4Å; S58-V60 VanDerWaalsContact O-N 3.1Å; V60-Q64 PolarHBondContact O-N 3.26Å
61I94.1Very high94.6Very high5 Ų544.1 Ų44.13%0.02624%0.235CC..Hα-helixtrans-73-49.1179-66.4-179.3000109.7H19 L22 Y26 V57 S58 L59 R63 Q64 L65H19-I61 HydrophobicContact CB-CD1 4.49Å; L22-I61 HydrophobicContact CB-CD1 4.03Å; L22-I61 HydrophobicContact CD2-CD1 3.59Å; L22-I61 HydrophobicContact CG-CD1 3.92Å; Y26-I61 HydrophobicContact CD2-CG2 3.89Å; Y26-I61 HydrophobicContact CE2-CG2 4.14Å; V57-I61 HydrophobicContact CG1-CB 4.41Å; V57-I61 HydrophobicContact CG1-CG2 4.2Å; S58-I61 PolarHBondContact O-N 2.93Å; L59-I61 VanDerWaalsContact C-N 3.32Å; I61-R63 PolarHBondContact O-N 3.25Å; I61-Q64 PolarHBondContact O-N 2.98Å; I61-L65 HydrophobicContact CG2-CD1 3.44Å; I61-L65 VanDerWaalsContact CG2-CD1 3.44Å; I61-L65 HydrophobicContact CG2-CG 4.38Å; I61-L65 WeakPolarHBondContact O-CB 3.33Å; I61-L65 WeakPolarHBondContact O-CG 3.46Å; I61-L65 PolarHBondContact O-N 3.38Å
62S95.6Very high94.5Very high0 Ų046.6 Ų46.60%024%0.244CC..Hα-helixtrans-58.8-44.5179.8-58.70000112.5M52 V57 S58 L66M52-S62 WeakPolarHBondContact O-CB 3.17Å; M52-S62 PolarHBondContact O-OG 3.49Å; V57-S62 WeakPolarHBondContact CG1-OG 3.2Å; S58-S62 PolarHBondContact O-N 2.79Å; S58-S62 PolarHBondContact O-OG 3.08Å; S62-L66 VanDerWaalsContact O-CB 3.22Å; S62-L66 WeakPolarHBondContact O-CB 3.47Å; S62-L66 VanDerWaalsContact O-CG 3.24Å; S62-L66 WeakPolarHBondContact O-CG 3.38Å; S62-L66 PolarHBondContact O-N 3.34Å
63R95.7Very high94.4Very high105 Ų10546.6 Ų46.640%0.39624%0.244SC..Hα-helixtrans-62.7-48178.5-75.7171.3176.5171.5-2.6111.7L59 I61 L65 L66 T67 S98 F99 Q102L59-R63 WeakPolarHBondContact O-CB 3.49Å; L59-R63 WeakPolarHBondContact O-CD 3.28Å; L59-R63 WeakPolarHBondContact O-CG 3.28Å; L59-R63 PolarHBondContact O-N 2.93Å; I61-R63 PolarHBondContact O-N 3.25Å; R63-L65 PolarHBondContact O-N 2.82Å; R63-L66 PolarHBondContact O-N 3.2Å; R63-T67 WeakPolarHBondContact O-CB 3.22Å; R63-T67 PolarHBondContact O-N 2.88Å; R63-T67 PolarHBondContact O-OG1 2.83Å; R63-S98 VanDerWaalsContact CZ-O 3.26Å; R63-S98 PolarHBondContact NE-O 2.95Å; R63-S98 PolarHBondContact NH2-O 3.12Å; R63-F99 HydrophobicContact CG-CD1 4.08Å; R63-F99 HydrophobicContact CG-CE1 4.16Å; R63-Q102 PolarHBondContact O-NE2 3.41Å
64Q95.7Very high94.4Very high93 Ų9348.7 Ų48.744%0.43526%0.258SS..Hα-helixtrans-59.7-48.8179.1-179.264.160.100111.2V60 I61 T67 D68V60-Q64 PolarHBondContact O-N 3.26Å; I61-Q64 PolarHBondContact O-N 2.98Å; Q64-T67 WeakPolarHBondContact O-CB 3.43Å; Q64-T67 PolarHBondContact O-N 3.43Å; Q64-D68 PolarHBondContact NE2-OD1 2.92Å; Q64-D68 VanDerWaalsContact O-CG 3.27Å; Q64-D68 PolarHBondContact O-N 3.32Å
65L96.4Very high94.4Very high0 Ų052.5 Ų52.50%028%0.278CS..Hα-helixtrans-71.2-35-176.7-72166.3000112.9Y26 R27 F48 M52 I61 R63 T67 D68 F69Y26-L65 HydrophobicContact CD1-CD1 4.44Å; Y26-L65 HydrophobicContact CD2-CD1 3.81Å; Y26-L65 HydrophobicContact CG-CD1 3.62Å; R27-L65 HydrophobicContact CB-CD2 4.31Å; F48-L65 HydrophobicContact CE1-CB 4.33Å; F48-L65 HydrophobicContact CZ-CB 4.03Å; F48-L65 HydrophobicContact CZ-CD1 4.48Å; F48-L65 HydrophobicContact CZ-CD2 4.37Å; M52-L65 HydrophobicContact CE-CD1 4.08Å; M52-L65 HydrophobicContact SD-CB 3.72Å; M52-L65 HydrophobicContact SD-CD1 3.46Å; M52-L65 WeakPolarHBondContact SD-CD1 3.43Å; M52-L65 HydrophobicContact SD-CG 4.28Å; I61-L65 HydrophobicContact CG2-CD1 3.44Å; I61-L65 VanDerWaalsContact CG2-CD1 3.44Å; I61-L65 HydrophobicContact CG2-CG 4.38Å; I61-L65 WeakPolarHBondContact O-CB 3.33Å; I61-L65 WeakPolarHBondContact O-CG 3.46Å; I61-L65 PolarHBondContact O-N 3.38Å; R63-L65 PolarHBondContact O-N 2.82Å; L65-T67 VanDerWaalsContact C-N 3.33Å; L65-D68 PolarHBondContact O-N 3.36Å; L65-F69 WeakPolarHBondContact O-CB 3.49Å; L65-F69 PolarHBondContact O-N 2.65Å
66L96.6Very high94.4Very high1 Ų145.9 Ų45.91%0.00525%0.248CC..Hα-helixtrans-68.4-34.2173-75.3171.9000111.6M52 S62 R63 F69 C70 I92 F99 Q102M52-L66 HydrophobicContact CB-CD1 4.15Å; M52-L66 HydrophobicContact CB-CD2 3.96Å; M52-L66 HydrophobicContact CB-CG 3.9Å; M52-L66 HydrophobicContact CG-CD2 4.26Å; M52-L66 HydrophobicContact CG-CG 4.24Å; S62-L66 VanDerWaalsContact O-CB 3.22Å; S62-L66 WeakPolarHBondContact O-CB 3.47Å; S62-L66 VanDerWaalsContact O-CG 3.24Å; S62-L66 WeakPolarHBondContact O-CG 3.38Å; S62-L66 PolarHBondContact O-N 3.34Å; R63-L66 PolarHBondContact O-N 3.2Å; L66-F69 HydrophobicContact CD2-CD1 4.47Å; L66-C70 WeakPolarHBondContact O-CB 3.45Å; L66-C70 PolarHBondContact O-N 3.46Å; L66-C70 PolarHBondContact O-SG 3.09Å; L66-I92 HydrophobicContact CD1-CD1 4.18Å; L66-F99 HydrophobicContact CD1-CD1 3.78Å; L66-F99 HydrophobicContact CD1-CE1 3.77Å; L66-F99 HydrophobicContact CD1-CZ 4.49Å; L66-Q102 HydrophobicContact CB-CG 3.73Å
67T96Very high94.6Very high53 Ų5345.1 Ų45.133%0.32525%0.248SC..Hα-helixtrans-63.4-50.1170.8-64.10000110.6R63 Q64 L65 F69 C70 T71 Q102R63-T67 WeakPolarHBondContact O-CB 3.22Å; R63-T67 PolarHBondContact O-N 2.88Å; R63-T67 PolarHBondContact O-OG1 2.83Å; Q64-T67 WeakPolarHBondContact O-CB 3.43Å; Q64-T67 PolarHBondContact O-N 3.43Å; L65-T67 VanDerWaalsContact C-N 3.33Å; T67-F69 VanDerWaalsContact C-N 3.33Å; T67-F69 PolarHBondContact O-N 3.15Å; T67-C70 PolarHBondContact O-N 3.28Å; T67-T71 PolarHBondContact O-N 3.39Å; T67-Q102 PolarHBondContact OG1-NE2 2.99Å
68D94.8Very high94.7Very high27 Ų2747.6 Ų47.614%0.14426%0.261CS..Hα-helixtrans-57.2-47.3176.4-63.6-3.8000110.6R27 Q64 L65 C70 T71 H72R27-D68 IonicContact CZ-OD2 3.54Å; R27-D68 VanDerWaalsContact CZ-OD2 3.23Å; R27-D68 IonicContact NE-OD2 3.5Å; R27-D68 PolarHBondContact NE-OD2 3.24Å; R27-D68 IonicContact NH2-OD2 2.77Å; R27-D68 PolarHBondContact NH2-OD2 3.23Å; Q64-D68 PolarHBondContact NE2-OD1 2.92Å; Q64-D68 VanDerWaalsContact O-CG 3.27Å; Q64-D68 PolarHBondContact O-N 3.32Å; L65-D68 PolarHBondContact O-N 3.36Å; D68-C70 VanDerWaalsContact C-N 3.34Å; D68-C70 PolarHBondContact O-N 3.07Å; D68-T71 PolarHBondContact O-N 3.21Å; D68-T71 PolarHBondContact O-OG1 2.96Å; D68-H72 PolarHBondContact O-CD2 3.26Å
69F95.4Very high94.7Very high1 Ų149 Ų490%0.00428%0.276CS..Hα-helixtrans-53.5-47.5175.5174.5-100.8000112.2L30 L45 F48 V49 L65 L66 T67 T71 H72 L73 V84L30-F69 HydrophobicContact CD1-CD2 3.69Å; L30-F69 HydrophobicContact CD1-CE2 4.45Å; L30-F69 HydrophobicContact CD2-CB 4.2Å; L45-F69 HydrophobicContact CB-CE2 4.08Å; L45-F69 HydrophobicContact CB-CZ 4.39Å; L45-F69 HydrophobicContact CD2-CD2 4.38Å; L45-F69 HydrophobicContact CD2-CE2 3.7Å; L45-F69 HydrophobicContact CG-CE2 4.42Å; F48-F69 AromaticContact CD1-CD2 3.88Å; F48-F69 HydrophobicContact CD1-CD2 3.88Å; F48-F69 HydrophobicContact CD1-CE2 4.29Å; F48-F69 HydrophobicContact CD1-CG 4.43Å; F48-F69 HydrophobicContact CE1-CB 4.28Å; F48-F69 HydrophobicContact CE1-CD2 4.28Å; V49-F69 HydrophobicContact CG2-CE1 3.77Å; V49-F69 HydrophobicContact CG2-CE2 4.35Å; V49-F69 HydrophobicContact CG2-CZ 3.59Å; L65-F69 WeakPolarHBondContact O-CB 3.49Å; L65-F69 PolarHBondContact O-N 2.65Å; L66-F69 HydrophobicContact CD2-CD1 4.47Å; T67-F69 VanDerWaalsContact C-N 3.33Å; T67-F69 PolarHBondContact O-N 3.15Å; F69-T71 PolarHBondContact O-N 3.45Å; F69-H72 PolarHBondContact O-N 3.18Å; F69-L73 HydrophobicContact CD1-CD1 3.92Å; F69-L73 HydrophobicContact CD1-CG 4.29Å; F69-L73 HydrophobicContact CE1-CD1 3.52Å; F69-L73 HydrophobicContact CE1-CD2 4.12Å; F69-L73 HydrophobicContact CE1-CG 4.09Å; F69-L73 HydrophobicContact CE2-CD2 4.14Å; F69-L73 HydrophobicContact CZ-CD1 4.09Å; F69-L73 HydrophobicContact CZ-CD2 3.86Å; F69-L73 HydrophobicContact CZ-CG 4.35Å; F69-L73 PolarHBondContact O-N 3.41Å; F69-V84 HydrophobicContact CE1-CG1 3.97Å; F69-V84 HydrophobicContact CZ-CG1 3.47Å; F69-V84 VanDerWaalsContact CZ-CG1 3.47Å
70C94.8Very high94.7Very high3 Ų348.1 Ų48.12%0.0227%0.273CS..Hα-helixtrans-61.4-27.3178.9-69.50000113.1L66 T67 D68 H72 P74 I106L66-C70 WeakPolarHBondContact O-CB 3.45Å; L66-C70 PolarHBondContact O-N 3.46Å; L66-C70 PolarHBondContact O-SG 3.09Å; T67-C70 PolarHBondContact O-N 3.28Å; D68-C70 VanDerWaalsContact C-N 3.34Å; D68-C70 PolarHBondContact O-N 3.07Å; C70-H72 VanDerWaalsContact C-N 3.33Å; C70-P74 WeakPolarHBondContact O-CD 3.43Å; C70-I106 VanDerWaalsContact SG-CG1 3.57Å
71T94.9Very high94.9Very high88 Ų8843.6 Ų43.654%0.5425%0.245SC..Hα-helixtrans-74-22.1176.470.20000113.6T67 D68 F69T67-T71 PolarHBondContact O-N 3.39Å; D68-T71 PolarHBondContact O-N 3.21Å; D68-T71 PolarHBondContact O-OG1 2.96Å; F69-T71 PolarHBondContact O-N 3.45Å
72H93.9Very high95Very high65 Ų6544.6 Ų44.630%0.30125%0.25SC..Hα-helixtrans-87.4-30.1179-70-73.7000113.3I34 D68 F69 C70 P74 N75I34-H72 HydrophobicContact CD1-CB 3.68Å; I34-H72 HydrophobicContact CG1-CB 4.41Å; D68-H72 PolarHBondContact O-CD2 3.26Å; F69-H72 PolarHBondContact O-N 3.18Å; C70-H72 VanDerWaalsContact C-N 3.33Å; H72-P74 VanDerWaalsContact C-CD 3.46Å; H72-N75 WeakPolarHBondContact O-CB 3.24Å; H72-N75 PolarHBondContact O-N 2.98Å; H72-N75 VanDerWaalsContact O-N 3.1Å
73L93.7Very high95Very high1 Ų146.6 Ų46.61%0.00527%0.266CS..G310 helixtrans-57.9-36.9-176.7-64.1-176.2000115.1L45 F69 N75 L76 V84 Y85L45-L73 HydrophobicContact CD1-CD2 4.48Å; F69-L73 HydrophobicContact CD1-CD1 3.92Å; F69-L73 HydrophobicContact CD1-CG 4.29Å; F69-L73 HydrophobicContact CE1-CD1 3.52Å; F69-L73 HydrophobicContact CE1-CD2 4.12Å; F69-L73 HydrophobicContact CE1-CG 4.09Å; F69-L73 HydrophobicContact CE2-CD2 4.14Å; F69-L73 HydrophobicContact CZ-CD1 4.09Å; F69-L73 HydrophobicContact CZ-CD2 3.86Å; F69-L73 HydrophobicContact CZ-CG 4.35Å; F69-L73 PolarHBondContact O-N 3.41Å; L73-N75 PolarHBondContact O-N 3.35Å; L73-N75 VanDerWaalsContact O-N 3.12Å; L73-L76 HydrophobicContact CD2-CD1 3.72Å; L73-L76 WeakPolarHBondContact O-CB 3.47Å; L73-L76 PolarHBondContact O-N 2.98Å; L73-V84 HydrophobicContact CD1-CG1 3.95Å; L73-V84 HydrophobicContact CD2-CB 4.37Å; L73-V84 HydrophobicContact CD2-CG1 3.75Å; L73-Y85 HydrophobicContact CB-CE1 3.89Å; L73-Y85 HydrophobicContact CB-CE2 4.47Å; L73-Y85 VanDerWaalsContact CB-OH 3.29Å; L73-Y85 WeakPolarHBondContact CB-OH 3.49Å; L73-Y85 HydrophobicContact CD1-CD1 3.59Å; L73-Y85 HydrophobicContact CD1-CE1 3.23Å; L73-Y85 HydrophobicContact CG-CE1 4.21Å
74P94.6Very high95.1Very high65 Ų6541.6 Ų41.642%0.42225%0.247SC..G310 helixtrans-62.6-16.5176.4-25.735.6000114.8C70 H72C70-P74 WeakPolarHBondContact O-CD 3.43Å; H72-P74 VanDerWaalsContact C-CD 3.46Å
75N93.6Very high95.2Very high132 Ų13237.2 Ų37.271%0.70623%0.227SC*.G310 helixtrans-86.6-9.2177.6-56.2-43.9000112.6H72 L73H72-N75 WeakPolarHBondContact O-CB 3.24Å; H72-N75 PolarHBondContact O-N 2.98Å; H72-N75 VanDerWaalsContact O-N 3.1Å; L73-N75 PolarHBondContact O-N 3.35Å; L73-N75 VanDerWaalsContact O-N 3.12Å
76L93.2Very high95.2Very high21 Ų2140.9 Ų40.911%0.1124%0.243CC..SBendtrans-83.5159.8177.4-57.6179.9000110.6L45 L73 D78 T80 A81L45-L76 HydrophobicContact CD1-CD1 3.61Å; L73-L76 HydrophobicContact CD2-CD1 3.72Å; L73-L76 WeakPolarHBondContact O-CB 3.47Å; L73-L76 PolarHBondContact O-N 2.98Å; L76-D78 PolarHBondContact O-N 3.39Å; L76-T80 HydrophobicContact CD1-CG2 4.49Å; L76-A81 HydrophobicContact CB-CB 4.32Å
77P94.6Very high95.3Very high83 Ų8342.2 Ų42.254%0.53925%0.249SC..  trans-55.8139.4170-2434.3000111.6A79 T80 A81P77-A79 PolarHBondContact O-N 3.49Å; P77-A79 VanDerWaalsContact O-N 3.12Å; P77-T80 PolarHBondContact O-N 3.41Å; P77-A81 PolarHBondContact O-N 3.27Å
78D94.9Very high95.4Very high60 Ų6039.7 Ų39.732%0.32123%0.234SC..Hα-helixtrans-52.6-39.6-173.9-78.2-18.2000112.8L76 K82 I113 K116L76-D78 PolarHBondContact O-N 3.39Å; D78-K82 WeakPolarHBondContact O-CB 3.45Å; D78-K82 PolarHBondContact O-N 3.46Å; D78-I113 HydrophobicContact CB-CG2 3.93Å; D78-K116 IonicContact OD1-NZ 3.88Å; D78-K116 IonicContact OD2-NZ 2.76Å
79A93.6Very high95.5Very high77 Ų7739.3 Ų39.364%0.63623%0.232SC*.Hα-helixtrans-62.8-43.9176.900000113P77 A83P77-A79 PolarHBondContact O-N 3.49Å; P77-A79 VanDerWaalsContact O-N 3.12Å; A79-A83 PolarHBondContact O-N 2.96Å; A79-A83 VanDerWaalsContact O-N 3.14Å
80T94.3Very high95.6Very high34 Ų3445.6 Ų45.621%0.20926%0.261CS..Hα-helixtrans-69.3-47.5177.9-53.20000110.4L42 L76 P77 K82 A83 V84L42-T80 HydrophobicContact CD1-CG2 4.29Å; L76-T80 HydrophobicContact CD1-CG2 4.49Å; P77-T80 PolarHBondContact O-N 3.41Å; T80-K82 PolarHBondContact O-N 2.88Å; T80-A83 PolarHBondContact O-N 3.3Å; T80-V84 WeakPolarHBondContact O-CG2 3.16Å; T80-V84 PolarHBondContact O-N 2.88Å
81A95.9Very high95.8Very high1 Ų149 Ų491%0.00828%0.276CS..Hα-helixtrans-58.5-46.8178.200000111.2L76 P77 A83 V84 Y85 I113L76-A81 HydrophobicContact CB-CB 4.32Å; P77-A81 PolarHBondContact O-N 3.27Å; A81-A83 PolarHBondContact O-N 2.96Å; A81-V84 PolarHBondContact O-N 3.49Å; A81-Y85 HydrophobicContact CB-CD2 4.36Å; A81-Y85 HydrophobicContact CB-CE2 3.98Å; A81-Y85 WeakPolarHBondContact O-CD2 3.49Å; A81-Y85 PolarHBondContact O-N 2.97Å; A81-I113 HydrophobicContact CB-CD1 3.93Å
82K96.6Very high95.8Very high27 Ų2744.9 Ų44.912%0.11725%0.25CS..Hα-helixtrans-57.8-46.3176.2177.2174-76.7179.20112.3D78 T80 V84 Y85 H86 L110 I113 Y114 E117D78-K82 WeakPolarHBondContact O-CB 3.45Å; D78-K82 PolarHBondContact O-N 3.46Å; T80-K82 PolarHBondContact O-N 2.88Å; K82-V84 VanDerWaalsContact C-N 3.33Å; K82-V84 PolarHBondContact O-N 2.81Å; K82-Y85 PolarHBondContact O-N 3.49Å; K82-H86 PolarHBondContact O-CD2 3.24Å; K82-H86 VanDerWaalsContact O-CD2 3.27Å; K82-H86 PolarHBondContact O-N 3.04Å; K82-H86 VanDerWaalsContact O-N 3.08Å; K82-L110 HydrophobicContact CB-CD1 4.41Å; K82-L110 HydrophobicContact CG-CD1 3.91Å; K82-I113 HydrophobicContact CB-CD1 4.35Å; K82-I113 HydrophobicContact CB-CG2 4.45Å; K82-I113 VanDerWaalsContact CE-CG2 3.5Å; K82-Y114 HydrophobicContact CD-CE1 4.2Å; K82-Y114 VanDerWaalsContact NZ-CD1 3.26Å; K82-Y114 VanDerWaalsContact NZ-CE1 3.3Å; K82-E117 IonicContact NZ-OE1 3.92Å; K82-E117 PolarHBondContact NZ-OE1 2.91Å; K82-E117 IonicContact NZ-OE2 3.62Å; K82-E117 PolarHBondContact NZ-OE2 2.65Å
83A96.3Very high95.9Very high41 Ų4146.8 Ų46.834%0.33926%0.259SS..Hα-helixtrans-61.7-41.4177.100000112L42 A79 T80 A81 F87L42-A83 HydrophobicContact CD1-CB 4.33Å; A79-A83 PolarHBondContact O-N 2.96Å; A79-A83 VanDerWaalsContact O-N 3.14Å; T80-A83 PolarHBondContact O-N 3.3Å; A81-A83 PolarHBondContact O-N 2.96Å; A83-F87 WeakPolarHBondContact O-CB 3.24Å; A83-F87 PolarHBondContact O-N 3.1Å; A83-F87 VanDerWaalsContact O-N 3.11Å
84V96.8Very high96Very high0 Ų052.3 Ų52.30%030%0.295CS..Hα-helixtrans-67.2-42.7176.9175.70000111.4L42 L45 F69 L73 T80 A81 K82 F87 T88L42-V84 HydrophobicContact CD1-CG2 3.51Å; L45-V84 HydrophobicContact CB-CG2 4.29Å; L45-V84 HydrophobicContact CD1-CG2 4.12Å; F69-V84 HydrophobicContact CE1-CG1 3.97Å; F69-V84 HydrophobicContact CZ-CG1 3.47Å; F69-V84 VanDerWaalsContact CZ-CG1 3.47Å; L73-V84 HydrophobicContact CD1-CG1 3.95Å; L73-V84 HydrophobicContact CD2-CB 4.37Å; L73-V84 HydrophobicContact CD2-CG1 3.75Å; T80-V84 WeakPolarHBondContact O-CG2 3.16Å; T80-V84 PolarHBondContact O-N 2.88Å; A81-V84 PolarHBondContact O-N 3.49Å; K82-V84 VanDerWaalsContact C-N 3.33Å; K82-V84 PolarHBondContact O-N 2.81Å; V84-F87 PolarHBondContact O-N 3.46Å; V84-T88 WeakPolarHBondContact O-CB 3.32Å; V84-T88 PolarHBondContact O-N 3.03Å; V84-T88 PolarHBondContact O-OG1 3.43Å
85Y97.9Very high96Very high2 Ų251.8 Ų51.81%0.00829%0.285CS..Hα-helixtrans-61.3-46.8178.3-72.9-49.1000112.4L73 A81 K82 T88 L89 I106 H109 L110 I113L73-Y85 HydrophobicContact CB-CE1 3.89Å; L73-Y85 HydrophobicContact CB-CE2 4.47Å; L73-Y85 VanDerWaalsContact CB-OH 3.29Å; L73-Y85 WeakPolarHBondContact CB-OH 3.49Å; L73-Y85 HydrophobicContact CD1-CD1 3.59Å; L73-Y85 HydrophobicContact CD1-CE1 3.23Å; L73-Y85 HydrophobicContact CG-CE1 4.21Å; A81-Y85 HydrophobicContact CB-CD2 4.36Å; A81-Y85 HydrophobicContact CB-CE2 3.98Å; A81-Y85 WeakPolarHBondContact O-CD2 3.49Å; A81-Y85 PolarHBondContact O-N 2.97Å; K82-Y85 PolarHBondContact O-N 3.49Å; Y85-T88 PolarHBondContact O-N 2.97Å; Y85-L89 WeakPolarHBondContact O-CG 3.37Å; Y85-L89 PolarHBondContact O-N 3.24Å; Y85-I106 HydrophobicContact CD1-CB 4.16Å; Y85-I106 HydrophobicContact CD1-CG1 4.14Å; Y85-I106 HydrophobicContact CD1-CG2 3.57Å; Y85-I106 HydrophobicContact CE1-CG1 4.43Å; Y85-I106 HydrophobicContact CE1-CG2 4.43Å; Y85-I106 HydrophobicContact CG-CG2 4.09Å; Y85-H109 HydrophobicContact CE1-CB 4.12Å; Y85-H109 HydrophobicContact CE2-CB 3.88Å; Y85-H109 VanDerWaalsContact CZ-CB 3.49Å; Y85-H109 VanDerWaalsContact OH-CB 3.23Å; Y85-H109 WeakPolarHBondContact OH-CB 3.33Å; Y85-L110 HydrophobicContact CD2-CB 4.19Å; Y85-L110 HydrophobicContact CD2-CD1 4.39Å; Y85-L110 HydrophobicContact CG-CB 4.28Å; Y85-I113 HydrophobicContact CD2-CD1 3.94Å; Y85-I113 HydrophobicContact CE2-CD1 3.75Å
86H97.9Very high96Very high76 Ų7647.6 Ų47.635%0.35226%0.264SS..Hα-helixtrans-60.1-48.3175.8-80.7-59.9000112.1K82 T88 L89 E90 Y114K82-H86 PolarHBondContact O-CD2 3.24Å; K82-H86 VanDerWaalsContact O-CD2 3.27Å; K82-H86 PolarHBondContact O-N 3.04Å; K82-H86 VanDerWaalsContact O-N 3.08Å; H86-T88 VanDerWaalsContact C-N 3.26Å; H86-T88 PolarHBondContact O-N 2.85Å; H86-L89 PolarHBondContact O-N 3.19Å; H86-E90 PolarHBondContact O-N 3.18Å; H86-Y114 PolarHBondContact CE1-OH 3.49Å; H86-Y114 VanDerWaalsContact CE1-OH 3.27Å; H86-Y114 AromaticContact NE2-CE2 3.91Å; H86-Y114 AromaticContact NE2-CZ 3.65Å; H86-Y114 PolarHBondContact NE2-OH 3.29Å
87F98Very high96Very high30 Ų3051.6 Ų51.613%0.13228%0.284CS..Hα-helixtrans-58.6-40.9176.6-178.2-93.8000111.8K46 V49 E50 A83 V84 E90 K91K46-F87 HydrophobicContact CB-CD1 4Å; K46-F87 HydrophobicContact CB-CE1 3.56Å; K46-F87 HydrophobicContact CB-CE2 4.43Å; K46-F87 HydrophobicContact CB-CZ 3.79Å; K46-F87 HydrophobicContact CD-CD1 4.44Å; K46-F87 HydrophobicContact CD-CD2 4.05Å; K46-F87 HydrophobicContact CD-CE1 4.44Å; K46-F87 HydrophobicContact CD-CE2 4.04Å; K46-F87 HydrophobicContact CD-CG 4.22Å; K46-F87 HydrophobicContact CD-CZ 4.23Å; K46-F87 HydrophobicContact CG-CD1 3.66Å; K46-F87 HydrophobicContact CG-CD2 4.16Å; K46-F87 HydrophobicContact CG-CE1 3.74Å; K46-F87 HydrophobicContact CG-CE2 4.22Å; K46-F87 HydrophobicContact CG-CG 3.86Å; K46-F87 HydrophobicContact CG-CZ 4Å; K46-F87 WeakPolarHBondContact O-CE1 3.43Å; V49-F87 HydrophobicContact CB-CD1 4.33Å; V49-F87 HydrophobicContact CB-CE1 4.13Å; V49-F87 HydrophobicContact CG1-CD1 4.18Å; V49-F87 HydrophobicContact CG1-CE1 4.1Å; E50-F87 HydrophobicContact CG-CE1 4.11Å; E50-F87 HydrophobicContact CG-CZ 3.87Å; A83-F87 WeakPolarHBondContact O-CB 3.24Å; A83-F87 PolarHBondContact O-N 3.1Å; A83-F87 VanDerWaalsContact O-N 3.11Å; V84-F87 PolarHBondContact O-N 3.46Å; F87-E90 PolarHBondContact O-N 3.11Å; F87-K91 HydrophobicContact CD1-CG 4.08Å; F87-K91 HydrophobicContact CE1-CG 3.67Å; F87-K91 VanDerWaalsContact CE2-CE 3.49Å; F87-K91 HydrophobicContact CE2-CG 4.21Å; F87-K91 HydrophobicContact CZ-CD 4.21Å; F87-K91 HydrophobicContact CZ-CG 3.77Å; F87-K91 WeakPolarHBondContact O-CB 3.41Å; F87-K91 WeakPolarHBondContact O-CG 3.46Å; F87-K91 PolarHBondContact O-N 3.32Å
88T97.7Very high96Very high0 Ų049.3 Ų49.30%027%0.27CS..Hα-helixtrans-65.8-44.1179.4-52.10000111.5V49 V84 Y85 H86 E90 K91 I92 I106V49-T88 HydrophobicContact CG1-CG2 4.05Å; V49-T88 HydrophobicContact CG2-CG2 4.1Å; V49-T88 WeakPolarHBondContact CG2-OG1 3.46Å; V84-T88 WeakPolarHBondContact O-CB 3.32Å; V84-T88 PolarHBondContact O-N 3.03Å; V84-T88 PolarHBondContact O-OG1 3.43Å; Y85-T88 PolarHBondContact O-N 2.97Å; H86-T88 VanDerWaalsContact C-N 3.26Å; H86-T88 PolarHBondContact O-N 2.85Å; T88-E90 PolarHBondContact O-N 3.06Å; T88-K91 PolarHBondContact O-N 2.99Å; T88-I92 HydrophobicContact CG2-CD1 3.64Å; T88-I92 HydrophobicContact CG2-CG1 4.3Å; T88-I92 VanDerWaalsContact O-CB 3.3Å; T88-I92 WeakPolarHBondContact O-CB 3.49Å; T88-I92 VanDerWaalsContact O-CG1 3.27Å; T88-I92 WeakPolarHBondContact O-CG1 3.48Å; T88-I92 PolarHBondContact O-N 3.26Å; T88-I106 HydrophobicContact CG2-CD1 3.46Å; T88-I106 VanDerWaalsContact CG2-CD1 3.46Å
89L97.6Very high96.1Very high18 Ų1846.4 Ų46.49%0.09426%0.255CS..Hα-helixtrans-61.9-42.7175.5-70.7176000111.9Y85 H86 I92 Q93 V103 I106 R107 L110Y85-L89 WeakPolarHBondContact O-CG 3.37Å; Y85-L89 PolarHBondContact O-N 3.24Å; H86-L89 PolarHBondContact O-N 3.19Å; L89-I92 PolarHBondContact O-N 3.02Å; L89-Q93 PolarHBondContact O-N 3.23Å; L89-V103 HydrophobicContact CD2-CG1 4.02Å; L89-V103 HydrophobicContact CD2-CG2 4.41Å; L89-I106 HydrophobicContact CD1-CG2 4.02Å; L89-I106 HydrophobicContact CD2-CB 4.25Å; L89-I106 HydrophobicContact CD2-CG2 3.74Å; L89-I106 HydrophobicContact CG-CG2 3.64Å; L89-R107 HydrophobicContact CD1-CG 4.15Å; L89-R107 HydrophobicContact CD2-CG 4.17Å; L89-L110 HydrophobicContact CD1-CD2 3.92Å
90E97.7Very high96.1Very high134 Ų13443.6 Ų43.663%0.62623%0.228SC*.Hα-helixtrans-61.6-46.9177.6-170.8-172.316300111.7H86 F87 T88 Q93H86-E90 PolarHBondContact O-N 3.18Å; F87-E90 PolarHBondContact O-N 3.11Å; T88-E90 PolarHBondContact O-N 3.06Å; E90-Q93 WeakPolarHBondContact O-CB 3.46Å; E90-Q93 PolarHBondContact O-N 3.39Å
91K97.4Very high96.1Very high74 Ų7446.9 Ų46.932%0.32224%0.241SC..Hα-helixtrans-71.4-30-179.7-67.9-57.7-175.3-176.60113.6V49 E50 V53 F87 T88 P94V49-K91 HydrophobicContact CG1-CB 3.9Å; V49-K91 HydrophobicContact CG1-CG 4.3Å; E50-K91 IonicContact OE1-NZ 3.75Å; V53-K91 HydrophobicContact CG1-CB 4.48Å; V53-K91 HydrophobicContact CG2-CB 4.31Å; F87-K91 HydrophobicContact CD1-CG 4.08Å; F87-K91 HydrophobicContact CE1-CG 3.67Å; F87-K91 VanDerWaalsContact CE2-CE 3.49Å; F87-K91 HydrophobicContact CE2-CG 4.21Å; F87-K91 HydrophobicContact CZ-CD 4.21Å; F87-K91 HydrophobicContact CZ-CG 3.77Å; F87-K91 WeakPolarHBondContact O-CB 3.41Å; F87-K91 WeakPolarHBondContact O-CG 3.46Å; F87-K91 PolarHBondContact O-N 3.32Å; T88-K91 PolarHBondContact O-N 2.99Å; K91-P94 WeakPolarHBondContact O-CD 3.42Å
92I96.4Very high96Very high1 Ų147.2 Ų47.21%0.00524%0.243CC..Hα-helixtrans-77.7-25.3175.9-72.2177.7000111.6V53 L66 T88 L89 P94 R95 V96 F99 V103 I106V53-I92 HydrophobicContact CG1-CG1 3.67Å; L66-I92 HydrophobicContact CD1-CD1 4.18Å; T88-I92 HydrophobicContact CG2-CD1 3.64Å; T88-I92 HydrophobicContact CG2-CG1 4.3Å; T88-I92 VanDerWaalsContact O-CB 3.3Å; T88-I92 WeakPolarHBondContact O-CB 3.49Å; T88-I92 VanDerWaalsContact O-CG1 3.27Å; T88-I92 WeakPolarHBondContact O-CG1 3.48Å; T88-I92 PolarHBondContact O-N 3.26Å; L89-I92 PolarHBondContact O-N 3.02Å; I92-P94 VanDerWaalsContact C-CD 3.42Å; I92-P94 VanDerWaalsContact O-N 3.13Å; I92-R95 CarbonylContact O-C 3.45Å; I92-R95 VanDerWaalsContact O-C 3.22Å; I92-R95 WeakPolarHBondContact O-CA 3.13Å; I92-R95 PolarHBondContact O-N 3.23Å; I92-V96 PolarHBondContact O-N 3.14Å; I92-F99 HydrophobicContact CD1-CB 4.42Å; I92-F99 HydrophobicContact CG2-CB 3.71Å; I92-F99 HydrophobicContact CG2-CD2 4.06Å; I92-F99 HydrophobicContact CG2-CG 4.24Å; I92-V103 HydrophobicContact CG2-CG2 3.59Å; I92-I106 HydrophobicContact CD1-CD1 4.21Å
93Q95.2Very high96Very high106 Ų10646.1 Ų46.150%0.49524%0.238SC..G310 helixtrans-48.2-44.1-171.8-169.662.827.300115.1L89 E90 R95 V96L89-Q93 PolarHBondContact O-N 3.23Å; E90-Q93 WeakPolarHBondContact O-CB 3.46Å; E90-Q93 PolarHBondContact O-N 3.39Å; Q93-R95 PolarHBondContact O-N 2.72Å; Q93-V96 WeakPolarHBondContact O-CB 3.47Å; Q93-V96 WeakPolarHBondContact O-CG1 3.22Å; Q93-V96 PolarHBondContact O-N 3.44Å
94P96.4Very high96Very high116 Ų11644.3 Ų44.375%0.75322%0.223SC*.G310 helixtrans-62.5-24.9178.1-22.735.2000114K91 I92K91-P94 WeakPolarHBondContact O-CD 3.42Å; I92-P94 VanDerWaalsContact C-CD 3.42Å; I92-P94 VanDerWaalsContact O-N 3.13Å
95R94.7Very high96Very high54 Ų5446.2 Ų46.220%0.20424%0.237CC..G310 helixtrans-119.625.4-179.1-60.6179.870.1-170.46.7111.8V53 N54 I92 Q93 I97 S98 F99V53-R95 PolarHBondContact O-NH1 2.8Å; N54-R95 PolarHBondContact O-NH1 3.26Å; N54-R95 VanDerWaalsContact O-NH1 3.08Å; I92-R95 CarbonylContact O-C 3.45Å; I92-R95 VanDerWaalsContact O-C 3.22Å; I92-R95 WeakPolarHBondContact O-CA 3.13Å; I92-R95 PolarHBondContact O-N 3.23Å; Q93-R95 PolarHBondContact O-N 2.72Å; R95-I97 VanDerWaalsContact C-N 3.25Å; R95-I97 PolarHBondContact O-N 3.1Å; R95-I97 VanDerWaalsContact O-N 3.11Å; R95-S98 WeakPolarHBondContact O-CB 3.32Å; R95-S98 PolarHBondContact O-N 3.27Å; R95-F99 HydrophobicContact CB-CD2 4.1Å; R95-F99 HydrophobicContact CB-CE2 3.96Å; R95-F99 WeakPolarHBondContact O-CD2 3.23Å
96V93.8Very high96Very high45 Ų4546.2 Ų46.227%0.27324%0.237SC..G310 helixtrans-52.3-39.3-171.464.10000113.6I92 Q93 S98 F99 E100 V103I92-V96 PolarHBondContact O-N 3.14Å; Q93-V96 WeakPolarHBondContact O-CB 3.47Å; Q93-V96 WeakPolarHBondContact O-CG1 3.22Å; Q93-V96 PolarHBondContact O-N 3.44Å; V96-S98 PolarHBondContact O-N 2.98Å; V96-F99 CarbonylContact O-C 3.22Å; V96-F99 PolarHBondContact O-N 2.91Å; V96-F99 VanDerWaalsContact O-N 3.11Å; V96-E100 PolarHBondContact O-N 2.83Å; V96-V103 HydrophobicContact CG2-CG2 4.16Å
97I92.8Very high96Very high105 Ų10544.5 Ų44.554%0.53823%0.227SC..G310 helixtrans-61.1-32.4178.8-54.2173.7000111.2R95 F99 Q136R95-I97 VanDerWaalsContact C-N 3.25Å; R95-I97 PolarHBondContact O-N 3.1Å; R95-I97 VanDerWaalsContact O-N 3.11Å; I97-F99 VanDerWaalsContact C-N 3.33Å; I97-F99 PolarHBondContact O-N 3.44Å; I97-Q136 HydrophobicContact CG2-CG 4.18Å
98S94.7Very high96Very high34 Ų3444.6 Ų44.624%0.23823%0.228CC..G310 helixtrans-76.4-19.4-179.8-62.60000113.5R63 R95 V96R63-S98 VanDerWaalsContact CZ-O 3.26Å; R63-S98 PolarHBondContact NE-O 2.95Å; R63-S98 PolarHBondContact NH2-O 3.12Å; R95-S98 WeakPolarHBondContact O-CB 3.32Å; R95-S98 PolarHBondContact O-N 3.27Å; V96-S98 PolarHBondContact O-N 2.98Å
99F95.8Very high95.9Very high0 Ų047.8 Ų47.80%024%0.243CC..G310 helixtrans-126.228.6-171.1-62-73.6000112.5L59 R63 L66 I92 R95 V96 I97 E101 Q102 V103L59-F99 HydrophobicContact CD2-CE1 3.95Å; L59-F99 HydrophobicContact CD2-CE2 4.06Å; L59-F99 HydrophobicContact CD2-CZ 3.51Å; R63-F99 HydrophobicContact CG-CD1 4.08Å; R63-F99 HydrophobicContact CG-CE1 4.16Å; L66-F99 HydrophobicContact CD1-CD1 3.78Å; L66-F99 HydrophobicContact CD1-CE1 3.77Å; L66-F99 HydrophobicContact CD1-CZ 4.49Å; I92-F99 HydrophobicContact CD1-CB 4.42Å; I92-F99 HydrophobicContact CG2-CB 3.71Å; I92-F99 HydrophobicContact CG2-CD2 4.06Å; I92-F99 HydrophobicContact CG2-CG 4.24Å; R95-F99 HydrophobicContact CB-CD2 4.1Å; R95-F99 HydrophobicContact CB-CE2 3.96Å; R95-F99 WeakPolarHBondContact O-CD2 3.23Å; V96-F99 CarbonylContact O-C 3.22Å; V96-F99 PolarHBondContact O-N 2.91Å; V96-F99 VanDerWaalsContact O-N 3.11Å; I97-F99 VanDerWaalsContact C-N 3.33Å; I97-F99 PolarHBondContact O-N 3.44Å; F99-E101 VanDerWaalsContact C-N 3.29Å; F99-E101 PolarHBondContact O-N 3.43Å; F99-Q102 HydrophobicContact CB-CB 4.47Å; F99-Q102 PolarHBondContact O-N 3.31Å; F99-Q102 VanDerWaalsContact O-N 3.11Å; F99-Q102 PolarHBondContact O-OE1 3.36Å; F99-V103 VanDerWaalsContact O-CG2 3.32Å; F99-V103 WeakPolarHBondContact O-CG2 3.32Å; F99-V103 PolarHBondContact O-N 3.46Å
100E94.6Very high96Very high17 Ų1746.9 Ų46.98%0.07924%0.238CC..Hα-helixtrans-56.4-39.5-173.2-167.3-179.713800113.5V96 V103 A104 P131 G135 Q136 K137V96-E100 PolarHBondContact O-N 2.83Å; E100-V103 PolarHBondContact O-N 3.36Å; E100-A104 PolarHBondContact O-N 3.37Å; E100-P131 HydrophobicContact CG-CG 3.85Å; E100-G135 WeakPolarHBondContact OE1-CA 3.46Å; E100-G135 WeakPolarHBondContact OE2-CA 3.47Å; E100-Q136 PolarHBondContact OE1-N 3.11Å; E100-Q136 PolarHBondContact OE2-N 3.19Å; E100-K137 HydrophobicContact CG-CB 4.42Å; E100-K137 WeakPolarHBondContact OE1-CB 3.47Å; E100-K137 PolarHBondContact OE1-N 3.42Å; E100-K137 PolarHBondContact OE2-N 3.4Å
101E93.4Very high96Very high104 Ų10440.5 Ų40.549%0.48621%0.208SC..Hα-helixtrans-64.7-44.9177-175.7172.5164.800112.1F99 A104 S105 K137F99-E101 VanDerWaalsContact C-N 3.29Å; F99-E101 PolarHBondContact O-N 3.43Å; E101-A104 PolarHBondContact O-N 3.15Å; E101-S105 PolarHBondContact O-N 2.92Å; E101-S105 VanDerWaalsContact O-N 3.07Å; E101-K137 IonicContact OE2-NZ 2.82Å
102Q95.2Very high96Very high7 Ų739.3 Ų39.33%0.03321%0.207CC..Hα-helixtrans-65.9-41.1177.1-67.369.334.100110.7R63 L66 T67 F99 A104 S105 I106R63-Q102 PolarHBondContact O-NE2 3.41Å; L66-Q102 HydrophobicContact CB-CG 3.73Å; T67-Q102 PolarHBondContact OG1-NE2 2.99Å; F99-Q102 HydrophobicContact CB-CB 4.47Å; F99-Q102 PolarHBondContact O-N 3.31Å; F99-Q102 VanDerWaalsContact O-N 3.11Å; F99-Q102 PolarHBondContact O-OE1 3.36Å; Q102-A104 VanDerWaalsContact C-N 3.34Å; Q102-A104 PolarHBondContact O-N 3.49Å; Q102-S105 PolarHBondContact O-N 2.77Å; Q102-I106 WeakPolarHBondContact O-CB 3.49Å; Q102-I106 WeakPolarHBondContact O-CD1 3.06Å; Q102-I106 VanDerWaalsContact O-CG1 3.24Å; Q102-I106 WeakPolarHBondContact O-CG1 3.37Å; Q102-I106 PolarHBondContact O-N 2.7Å
103V96.4Very high96.1Very high4 Ų439.6 Ų39.62%0.02421%0.209CC..Hα-helixtrans-61-43.4177169.60000111.1L89 I92 V96 F99 E100 I106 R107L89-V103 HydrophobicContact CD2-CG1 4.02Å; L89-V103 HydrophobicContact CD2-CG2 4.41Å; I92-V103 HydrophobicContact CG2-CG2 3.59Å; V96-V103 HydrophobicContact CG2-CG2 4.16Å; F99-V103 VanDerWaalsContact O-CG2 3.32Å; F99-V103 WeakPolarHBondContact O-CG2 3.32Å; F99-V103 PolarHBondContact O-N 3.46Å; E100-V103 PolarHBondContact O-N 3.36Å; V103-I106 PolarHBondContact O-N 3.01Å; V103-R107 HydrophobicContact CG1-CG 4.44Å; V103-R107 WeakPolarHBondContact O-CB 3.36Å; V103-R107 VanDerWaalsContact O-CG 3.25Å; V103-R107 WeakPolarHBondContact O-CG 3.33Å; V103-R107 PolarHBondContact O-N 3.41Å
104A96.1Very high96.2Very high3 Ų335.9 Ų35.93%0.02519%0.19CC..Hα-helixtrans-62.2-46.6175.700000111.7E100 E101 Q102 I106 R107 Q108 I130 Y139E100-A104 PolarHBondContact O-N 3.37Å; E101-A104 PolarHBondContact O-N 3.15Å; Q102-A104 VanDerWaalsContact C-N 3.34Å; Q102-A104 PolarHBondContact O-N 3.49Å; A104-I106 PolarHBondContact O-N 3.28Å; A104-R107 PolarHBondContact O-N 3.21Å; A104-Q108 VanDerWaalsContact O-CG 3.27Å; A104-Q108 WeakPolarHBondContact O-CG 3.24Å; A104-Q108 PolarHBondContact O-N 3.37Å; A104-I130 HydrophobicContact CB-CG2 3.95Å; A104-Y139 HydrophobicContact CB-CE1 4.16Å; A104-Y139 WeakPolarHBondContact CB-OH 3.46Å
105S96.3Very high96.3Very high41 Ų4133.6 Ų33.629%0.28717%0.17SC..Hα-helixtrans-59.4-47.1176.7175.90000112.4E101 Q102 R107 Q108 H109E101-S105 PolarHBondContact O-N 2.92Å; E101-S105 VanDerWaalsContact O-N 3.07Å; Q102-S105 PolarHBondContact O-N 2.77Å; S105-R107 PolarHBondContact O-N 3.5Å; S105-Q108 PolarHBondContact O-N 2.9Å; S105-H109 PolarHBondContact O-CD2 3.45Å; S105-H109 PolarHBondContact O-N 2.96Å
106I97.6Very high96.4Very high1 Ų137.9 Ų37.91%0.00519%0.19CC..Hα-helixtrans-59.5-47.2177.4-70.9161.9000110.9C70 Y85 T88 L89 I92 Q102 V103 A104 Q108 H109 L110C70-I106 VanDerWaalsContact SG-CG1 3.57Å; Y85-I106 HydrophobicContact CD1-CB 4.16Å; Y85-I106 HydrophobicContact CD1-CG1 4.14Å; Y85-I106 HydrophobicContact CD1-CG2 3.57Å; Y85-I106 HydrophobicContact CE1-CG1 4.43Å; Y85-I106 HydrophobicContact CE1-CG2 4.43Å; Y85-I106 HydrophobicContact CG-CG2 4.09Å; T88-I106 HydrophobicContact CG2-CD1 3.46Å; T88-I106 VanDerWaalsContact CG2-CD1 3.46Å; L89-I106 HydrophobicContact CD1-CG2 4.02Å; L89-I106 HydrophobicContact CD2-CB 4.25Å; L89-I106 HydrophobicContact CD2-CG2 3.74Å; L89-I106 HydrophobicContact CG-CG2 3.64Å; I92-I106 HydrophobicContact CD1-CD1 4.21Å; Q102-I106 WeakPolarHBondContact O-CB 3.49Å; Q102-I106 WeakPolarHBondContact O-CD1 3.06Å; Q102-I106 VanDerWaalsContact O-CG1 3.24Å; Q102-I106 WeakPolarHBondContact O-CG1 3.37Å; Q102-I106 PolarHBondContact O-N 2.7Å; V103-I106 PolarHBondContact O-N 3.01Å; A104-I106 PolarHBondContact O-N 3.28Å; I106-Q108 VanDerWaalsContact C-N 3.35Å; I106-Q108 PolarHBondContact O-N 2.94Å; I106-H109 PolarHBondContact O-N 3.34Å; I106-L110 VanDerWaalsContact O-CB 3.25Å; I106-L110 WeakPolarHBondContact O-CB 3.17Å; I106-L110 PolarHBondContact O-N 3.48Å
107R98.2Very high96.5Very high41 Ų4140.9 Ų40.916%0.15520%0.201CC..Hα-helixtrans-63.2-39.5-179.9-74.4176.1176.5-73.9-4.4112.1L89 V103 A104 S105 L110 A111 V126 G129 I130L89-R107 HydrophobicContact CD1-CG 4.15Å; L89-R107 HydrophobicContact CD2-CG 4.17Å; V103-R107 HydrophobicContact CG1-CG 4.44Å; V103-R107 WeakPolarHBondContact O-CB 3.36Å; V103-R107 VanDerWaalsContact O-CG 3.25Å; V103-R107 WeakPolarHBondContact O-CG 3.33Å; V103-R107 PolarHBondContact O-N 3.41Å; A104-R107 PolarHBondContact O-N 3.21Å; S105-R107 PolarHBondContact O-N 3.5Å; R107-L110 PolarHBondContact O-N 2.92Å; R107-A111 VanDerWaalsContact O-CB 3.25Å; R107-A111 WeakPolarHBondContact O-CB 3.29Å; R107-A111 PolarHBondContact O-N 3.17Å; R107-V126 HydrophobicContact CB-CG1 3.78Å; R107-V126 WeakPolarHBondContact CD-O 3.47Å; R107-V126 HydrophobicContact CG-CG1 3.99Å; R107-V126 PolarHBondContact NH1-O 3.33Å; R107-V126 WeakPolarHBondContact O-CG1 3.42Å; R107-G129 PolarHBondContact NE-O 3.02Å; R107-I130 HydrophobicContact CB-CD1 3.87Å; R107-I130 HydrophobicContact CB-CG1 3.69Å; R107-I130 HydrophobicContact CG-CG1 4.26Å
108Q97.4Very high96.7Very high31 Ų3137.4 Ų37.415%0.14519%0.191CC..Hα-helixtrans-61.2-46.3176.6-71.5-69.9-6.900112.3A104 S105 I106 T112 I130 Y143 T147A104-Q108 VanDerWaalsContact O-CG 3.27Å; A104-Q108 WeakPolarHBondContact O-CG 3.24Å; A104-Q108 PolarHBondContact O-N 3.37Å; S105-Q108 PolarHBondContact O-N 2.9Å; I106-Q108 VanDerWaalsContact C-N 3.35Å; I106-Q108 PolarHBondContact O-N 2.94Å; Q108-T112 PolarHBondContact O-N 3.45Å; Q108-T112 PolarHBondContact O-OG1 3.49Å; Q108-I130 HydrophobicContact CG-CD1 4.12Å; Q108-Y143 HydrophobicContact CG-CE2 4.46Å; Q108-Y143 WeakPolarHBondContact CG-OH 3.5Å; Q108-Y143 PolarHBondContact NE2-OH 3.46Å; Q108-Y143 VanDerWaalsContact NE2-OH 3.12Å; Q108-T147 PolarHBondContact NE2-OG1 3.34Å
109H96.9Very high96.8Very high67 Ų6738.3 Ų38.331%0.3119%0.193SC..Hα-helixtrans-69.4-43.8178-68.9-57.8000112.3Y85 S105 I106 A111 T112 I113Y85-H109 HydrophobicContact CE1-CB 4.12Å; Y85-H109 HydrophobicContact CE2-CB 3.88Å; Y85-H109 VanDerWaalsContact CZ-CB 3.49Å; Y85-H109 VanDerWaalsContact OH-CB 3.23Å; Y85-H109 WeakPolarHBondContact OH-CB 3.33Å; S105-H109 PolarHBondContact O-CD2 3.45Å; S105-H109 PolarHBondContact O-N 2.96Å; I106-H109 PolarHBondContact O-N 3.34Å; H109-A111 VanDerWaalsContact C-N 3.34Å; H109-A111 PolarHBondContact O-N 3.36Å; H109-T112 WeakPolarHBondContact O-CB 3.3Å; H109-T112 PolarHBondContact O-N 3.36Å; H109-T112 VanDerWaalsContact O-N 3.11Å; H109-I113 PolarHBondContact O-N 3.05Å; H109-I113 VanDerWaalsContact O-N 3.09Å
110L98.1Very high97Very high0 Ų042.2 Ų42.20%021%0.208CC..Hα-helixtrans-60.5-42.5177.6177.959.8000112.1K82 Y85 L89 I106 R107 T112 I113 Y114 V126K82-L110 HydrophobicContact CB-CD1 4.41Å; K82-L110 HydrophobicContact CG-CD1 3.91Å; Y85-L110 HydrophobicContact CD2-CB 4.19Å; Y85-L110 HydrophobicContact CD2-CD1 4.39Å; Y85-L110 HydrophobicContact CG-CB 4.28Å; L89-L110 HydrophobicContact CD1-CD2 3.92Å; I106-L110 VanDerWaalsContact O-CB 3.25Å; I106-L110 WeakPolarHBondContact O-CB 3.17Å; I106-L110 PolarHBondContact O-N 3.48Å; R107-L110 PolarHBondContact O-N 2.92Å; L110-T112 VanDerWaalsContact C-N 3.28Å; L110-T112 PolarHBondContact O-N 2.88Å; L110-I113 PolarHBondContact O-N 3.21Å; L110-Y114 HydrophobicContact CD1-CD2 4.11Å; L110-Y114 HydrophobicContact CD1-CE2 3.75Å; L110-Y114 HydrophobicContact CD2-CE2 4.38Å; L110-Y114 HydrophobicContact CG-CD2 4.1Å; L110-Y114 HydrophobicContact CG-CE2 3.87Å; L110-Y114 WeakPolarHBondContact O-CD2 3.36Å; L110-Y114 PolarHBondContact O-N 2.99Å; L110-Y114 VanDerWaalsContact O-N 3.15Å; L110-V126 HydrophobicContact CB-CG1 4.08Å; L110-V126 HydrophobicContact CD2-CG1 4.01Å; L110-V126 HydrophobicContact CD2-CG2 3.94Å; L110-V126 HydrophobicContact CG-CG1 4.07Å; L110-V126 HydrophobicContact CG-CG2 4.15Å
111A98.3Very high97.1Very high0 Ų046.4 Ų46.40%022%0.223CC..Hα-helixtrans-62.4-36.8175.300000112.1R107 H109 I113 Y114 E115 A123 V126 L127R107-A111 VanDerWaalsContact O-CB 3.25Å; R107-A111 WeakPolarHBondContact O-CB 3.29Å; R107-A111 PolarHBondContact O-N 3.17Å; H109-A111 VanDerWaalsContact C-N 3.34Å; H109-A111 PolarHBondContact O-N 3.36Å; A111-I113 VanDerWaalsContact C-N 3.32Å; A111-I113 PolarHBondContact O-N 3.21Å; A111-Y114 PolarHBondContact O-N 3.18Å; A111-E115 WeakPolarHBondContact O-CB 3.25Å; A111-E115 PolarHBondContact O-N 3.04Å; A111-A123 WeakPolarHBondContact O-CB 3.27Å; A111-V126 HydrophobicContact CB-CB 4.29Å; A111-V126 HydrophobicContact CB-CG1 4.06Å; A111-L127 HydrophobicContact CB-CD1 4.11Å; A111-L127 HydrophobicContact CB-CD2 3.59Å; A111-L127 HydrophobicContact CB-CG 3.54Å
112T97.8Very high97.3Very high48 Ų4844.2 Ų44.229%0.29422%0.215SC..Hα-helixtrans-66-34.2176.6-55.90000111.9Q108 H109 L110 K116 K150Q108-T112 PolarHBondContact O-N 3.45Å; Q108-T112 PolarHBondContact O-OG1 3.49Å; H109-T112 WeakPolarHBondContact O-CB 3.3Å; H109-T112 PolarHBondContact O-N 3.36Å; H109-T112 VanDerWaalsContact O-N 3.11Å; L110-T112 VanDerWaalsContact C-N 3.28Å; L110-T112 PolarHBondContact O-N 2.88Å; T112-K116 WeakPolarHBondContact O-CG 3.25Å; T112-K116 PolarHBondContact O-N 3.18Å; T112-K116 VanDerWaalsContact O-N 3.13Å; T112-K150 PolarHBondContact OG1-NZ 3.46Å
113I97.9Very high97.5Very high8 Ų843.9 Ų43.94%0.04121%0.213CC..Hα-helixtrans-66.7-46.6173.3-61.6171.9000110.5D78 A81 K82 Y85 H109 L110 A111 E115 K116 E117D78-I113 HydrophobicContact CB-CG2 3.93Å; A81-I113 HydrophobicContact CB-CD1 3.93Å; K82-I113 HydrophobicContact CB-CD1 4.35Å; K82-I113 HydrophobicContact CB-CG2 4.45Å; K82-I113 VanDerWaalsContact CE-CG2 3.5Å; Y85-I113 HydrophobicContact CD2-CD1 3.94Å; Y85-I113 HydrophobicContact CE2-CD1 3.75Å; H109-I113 PolarHBondContact O-N 3.05Å; H109-I113 VanDerWaalsContact O-N 3.09Å; L110-I113 PolarHBondContact O-N 3.21Å; A111-I113 VanDerWaalsContact C-N 3.32Å; A111-I113 PolarHBondContact O-N 3.21Å; I113-E115 VanDerWaalsContact C-N 3.31Å; I113-E115 PolarHBondContact O-N 2.88Å; I113-K116 PolarHBondContact O-N 3.32Å; I113-E117 WeakPolarHBondContact CG2-OE1 3.25Å; I113-E117 PolarHBondContact O-N 3.36Å
114Y98.4Very high97.6Very high28 Ų2843.7 Ų43.711%0.1121%0.212CC..Hα-helixtrans-60.9-39.7176.7-78.5-60.1000112.9K82 H86 L110 A111 K116 E117 G118 D119 N122 V126K82-Y114 HydrophobicContact CD-CE1 4.2Å; K82-Y114 VanDerWaalsContact NZ-CD1 3.26Å; K82-Y114 VanDerWaalsContact NZ-CE1 3.3Å; H86-Y114 PolarHBondContact CE1-OH 3.49Å; H86-Y114 VanDerWaalsContact CE1-OH 3.27Å; H86-Y114 AromaticContact NE2-CE2 3.91Å; H86-Y114 AromaticContact NE2-CZ 3.65Å; H86-Y114 PolarHBondContact NE2-OH 3.29Å; L110-Y114 HydrophobicContact CD1-CD2 4.11Å; L110-Y114 HydrophobicContact CD1-CE2 3.75Å; L110-Y114 HydrophobicContact CD2-CE2 4.38Å; L110-Y114 HydrophobicContact CG-CD2 4.1Å; L110-Y114 HydrophobicContact CG-CE2 3.87Å; L110-Y114 WeakPolarHBondContact O-CD2 3.36Å; L110-Y114 PolarHBondContact O-N 2.99Å; L110-Y114 VanDerWaalsContact O-N 3.15Å; A111-Y114 PolarHBondContact O-N 3.18Å; Y114-K116 PolarHBondContact O-N 3.07Å; Y114-E117 PolarHBondContact O-N 3.41Å; Y114-G118 PolarHBondContact O-N 2.95Å; Y114-D119 HydrophobicContact CD1-CB 3.92Å; Y114-D119 PolarHBondContact O-N 2.84Å; Y114-N122 HydrophobicContact CD1-CB 3.85Å; Y114-N122 HydrophobicContact CD2-CB 4.13Å; Y114-N122 HydrophobicContact CE1-CB 3.86Å; Y114-N122 HydrophobicContact CE2-CB 4.12Å; Y114-N122 HydrophobicContact CG-CB 3.98Å; Y114-V126 HydrophobicContact CD2-CG2 4.06Å; Y114-V126 HydrophobicContact CE2-CG2 3.87Å
115E97.5Very high97.7Very high68 Ų6848.1 Ų48.132%0.31823%0.232SC..Hα-helixtrans-60-43.3175-175.3179.3-163.800112.1A111 I113 E117 G118 W120 A123 K150 L154A111-E115 WeakPolarHBondContact O-CB 3.25Å; A111-E115 PolarHBondContact O-N 3.04Å; I113-E115 VanDerWaalsContact C-N 3.31Å; I113-E115 PolarHBondContact O-N 2.88Å; E115-E117 VanDerWaalsContact C-N 3.28Å; E115-E117 PolarHBondContact O-N 2.7Å; E115-G118 PolarHBondContact O-N 3.25Å; E115-G118 VanDerWaalsContact O-N 3.14Å; E115-W120 HydrophobicContact CG-CE3 4.48Å; E115-W120 HydrophobicContact CG-CZ3 3.92Å; E115-W120 VanDerWaalsContact O-CZ3 3.31Å; E115-W120 WeakPolarHBondContact O-CZ3 3.43Å; E115-A123 HydrophobicContact CB-CB 4.48Å; E115-K150 WeakPolarHBondContact OE2-CE 3.41Å; E115-K150 IonicContact OE2-NZ 3.23Å; E115-K150 PolarHBondContact OE2-NZ 3.13Å; E115-L154 HydrophobicContact CB-CD2 4.31Å; E115-L154 HydrophobicContact CG-CD2 4.05Å
116K96.8Very high97.8Very high143 Ų14346.9 Ų46.962%0.62222%0.223SC*.Hα-helixtrans-62.9-33.5176-72.9174.1-177.4179.10113.2D78 T112 I113 Y114 G118D78-K116 IonicContact OD1-NZ 3.88Å; D78-K116 IonicContact OD2-NZ 2.76Å; T112-K116 WeakPolarHBondContact O-CG 3.25Å; T112-K116 PolarHBondContact O-N 3.18Å; T112-K116 VanDerWaalsContact O-N 3.13Å; I113-K116 PolarHBondContact O-N 3.32Å; Y114-K116 PolarHBondContact O-N 3.07Å; K116-G118 VanDerWaalsContact C-N 3.26Å
117E96.7Very high97.8Very high108 Ų10846.8 Ų46.851%0.50522%0.223SC..THydrogen-bonded Turntrans-81.5-4.3178.6-68.9175.7-158.300113.1K82 I113 Y114 E115 D119K82-E117 IonicContact NZ-OE1 3.92Å; K82-E117 PolarHBondContact NZ-OE1 2.91Å; K82-E117 IonicContact NZ-OE2 3.62Å; K82-E117 PolarHBondContact NZ-OE2 2.65Å; I113-E117 WeakPolarHBondContact CG2-OE1 3.25Å; I113-E117 PolarHBondContact O-N 3.36Å; Y114-E117 PolarHBondContact O-N 3.41Å; E115-E117 VanDerWaalsContact C-N 3.28Å; E115-E117 PolarHBondContact O-N 2.7Å; E117-D119 VanDerWaalsContact C-N 3.29Å
118G96.7Very high97.8Very high33 Ų3347.5 Ų47.534%0.3423%0.231SC..THydrogen-bonded Turntrans7515.4-175.800000114.1Y114 E115 K116 W120Y114-G118 PolarHBondContact O-N 2.95Å; E115-G118 PolarHBondContact O-N 3.25Å; E115-G118 VanDerWaalsContact O-N 3.14Å; K116-G118 VanDerWaalsContact C-N 3.26Å; G118-W120 VanDerWaalsContact C-N 3.34Å; G118-W120 PolarHBondContact O-N 2.88Å; G118-W120 PolarHBondContact O-NE1 3Å
119D97.8Very high97.7Very high53 Ų5347.7 Ų47.728%0.28324%0.242SC..  trans-90.273.1176.9-168.9-16.6000110.3Y114 E117 R121 N122 A123Y114-D119 HydrophobicContact CD1-CB 3.92Å; Y114-D119 PolarHBondContact O-N 2.84Å; E117-D119 VanDerWaalsContact C-N 3.29Å; D119-R121 PolarHBondContact O-N 2.57Å; D119-N122 VanDerWaalsContact CG-ND2 3.26Å; D119-N122 PolarHBondContact O-N 2.85Å; D119-N122 WeakPolarHBondContact OD1-CB 3.44Å; D119-N122 PolarHBondContact OD1-N 3.28Å; D119-N122 PolarHBondContact OD1-ND2 2.96Å; D119-N122 VanDerWaalsContact OD1-ND2 3.1Å; D119-N122 PolarHBondContact OD2-ND2 3.48Å; D119-A123 WeakPolarHBondContact O-CB 3.38Å; D119-A123 PolarHBondContact O-N 3.31Å
120W98.1Very high97.7Very high81 Ų8144.9 Ų44.931%0.30723%0.229SC..Hα-helixtrans-61.6-42.2-171.3-45.5123.4000112.9E115 G118 A123 A124 L154 E157 D158E115-W120 HydrophobicContact CG-CE3 4.48Å; E115-W120 HydrophobicContact CG-CZ3 3.92Å; E115-W120 VanDerWaalsContact O-CZ3 3.31Å; E115-W120 WeakPolarHBondContact O-CZ3 3.43Å; G118-W120 VanDerWaalsContact C-N 3.34Å; G118-W120 PolarHBondContact O-N 2.88Å; G118-W120 PolarHBondContact O-NE1 3Å; W120-A123 PolarHBondContact O-N 3.15Å; W120-A124 WeakPolarHBondContact O-CB 3.29Å; W120-A124 PolarHBondContact O-N 2.94Å; W120-L154 HydrophobicContact CE3-CD2 3.9Å; W120-E157 HydrophobicContact CB-CB 4.27Å; W120-E157 VanDerWaalsContact CD1-O 3.31Å; W120-E157 HydrophobicContact CD2-CB 3.68Å; W120-E157 HydrophobicContact CD2-CG 4.43Å; W120-E157 HydrophobicContact CE3-CB 4.2Å; W120-E157 HydrophobicContact CG-CB 3.69Å; W120-D158 HydrophobicContact CB-CB 3.99Å
121R98Very high97.6Very high105 Ų10546.5 Ų46.540%0.39624%0.24SC..Hα-helixtrans-63.2-47.6-179.4-179156.1-74.2-143.2-11.4111.8D119 A124 Q125 D158 D160D119-R121 PolarHBondContact O-N 2.57Å; R121-A124 PolarHBondContact O-N 2.74Å; R121-Q125 VanDerWaalsContact O-CG 3.32Å; R121-Q125 WeakPolarHBondContact O-CG 3.27Å; R121-Q125 PolarHBondContact O-N 3.12Å; R121-D158 IonicContact CZ-OD2 3.92Å; R121-D158 IonicContact NE-OD1 3.14Å; R121-D158 IonicContact NE-OD2 3.97Å; R121-D158 PolarHBondContact NE-OD2 2.85Å; R121-D158 IonicContact NH2-OD2 2.79Å; R121-D158 PolarHBondContact NH2-OD2 3.48Å; R121-D160 IonicContact NH2-OD2 3.07Å; R121-D160 PolarHBondContact NH2-OD2 3.13Å
122N98.1Very high97.4Very high58 Ų5847.2 Ų47.231%0.3124%0.243SC..Hα-helixtrans-68.4-38.6178.6-74.8-41.5000111.7Y114 D119 A124 Q125 V126Y114-N122 HydrophobicContact CD1-CB 3.85Å; Y114-N122 HydrophobicContact CD2-CB 4.13Å; Y114-N122 HydrophobicContact CE1-CB 3.86Å; Y114-N122 HydrophobicContact CE2-CB 4.12Å; Y114-N122 HydrophobicContact CG-CB 3.98Å; D119-N122 VanDerWaalsContact CG-ND2 3.26Å; D119-N122 PolarHBondContact O-N 2.85Å; D119-N122 WeakPolarHBondContact OD1-CB 3.44Å; D119-N122 PolarHBondContact OD1-N 3.28Å; D119-N122 PolarHBondContact OD1-ND2 2.96Å; D119-N122 VanDerWaalsContact OD1-ND2 3.1Å; D119-N122 PolarHBondContact OD2-ND2 3.48Å; N122-A124 VanDerWaalsContact C-N 3.32Å; N122-A124 PolarHBondContact O-N 3.4Å; N122-Q125 PolarHBondContact O-N 3.06Å; N122-V126 WeakPolarHBondContact O-CB 3.42Å; N122-V126 VanDerWaalsContact O-CG2 3.24Å; N122-V126 WeakPolarHBondContact O-CG2 3.25Å; N122-V126 PolarHBondContact O-N 3.43Å
123A98.4Very high97Very high0 Ų050.3 Ų50.30%025%0.254CS..Hα-helixtrans-56.6-46.3173.400000111.8A111 E115 D119 W120 V126 L127 L154A111-A123 WeakPolarHBondContact O-CB 3.27Å; E115-A123 HydrophobicContact CB-CB 4.48Å; D119-A123 WeakPolarHBondContact O-CB 3.38Å; D119-A123 PolarHBondContact O-N 3.31Å; W120-A123 PolarHBondContact O-N 3.15Å; A123-V126 PolarHBondContact O-N 3.42Å; A123-L127 PolarHBondContact O-N 3.1Å; A123-L154 HydrophobicContact CB-CD1 3.74Å; A123-L154 HydrophobicContact CB-CD2 3.83Å; A123-L154 HydrophobicContact CB-CG 4.36Å
124A98.4Very high96.6Very high0 Ų056.2 Ų56.20%029%0.291CS..Hα-helixtrans-63.9-48.3178.900000111.5W120 R121 N122 V126 L127 V128 L154 Y155W120-A124 WeakPolarHBondContact O-CB 3.29Å; W120-A124 PolarHBondContact O-N 2.94Å; R121-A124 PolarHBondContact O-N 2.74Å; N122-A124 VanDerWaalsContact C-N 3.32Å; N122-A124 PolarHBondContact O-N 3.4Å; A124-V126 VanDerWaalsContact C-N 3.3Å; A124-V126 PolarHBondContact O-N 3.06Å; A124-L127 PolarHBondContact O-N 3.24Å; A124-V128 VanDerWaalsContact O-CG2 3.3Å; A124-V128 WeakPolarHBondContact O-CG2 3.35Å; A124-V128 PolarHBondContact O-N 3.41Å; A124-L154 HydrophobicContact CB-CB 3.87Å; A124-L154 HydrophobicContact CB-CD1 4.36Å; A124-Y155 HydrophobicContact CB-CD1 4.19Å; A124-Y155 HydrophobicContact CB-CD2 4.15Å; A124-Y155 HydrophobicContact CB-CE1 3.89Å; A124-Y155 HydrophobicContact CB-CE2 3.86Å; A124-Y155 HydrophobicContact CB-CG 4.31Å
125Q98.2Very high96.1Very high97 Ų9756.2 Ų56.245%0.45330%0.299SS..Hα-helixtrans-60.9-37.4-179.8-72.5178.17.500112.8R121 N122 L127 V128 G129R121-Q125 VanDerWaalsContact O-CG 3.32Å; R121-Q125 WeakPolarHBondContact O-CG 3.27Å; R121-Q125 PolarHBondContact O-N 3.12Å; N122-Q125 PolarHBondContact O-N 3.06Å; Q125-L127 PolarHBondContact O-N 3.22Å; Q125-V128 PolarHBondContact O-N 3.09Å; Q125-G129 PolarHBondContact O-N 3.48Å
126V98.1Very high95.7Very high14 Ų1460.5 Ų60.59%0.08532%0.319CS..Hα-helixtrans-61.1-45.1176.2168.80000111.1R107 L110 A111 Y114 N122 A123 A124 G129R107-V126 HydrophobicContact CB-CG1 3.78Å; R107-V126 WeakPolarHBondContact CD-O 3.47Å; R107-V126 HydrophobicContact CG-CG1 3.99Å; R107-V126 PolarHBondContact NH1-O 3.33Å; R107-V126 WeakPolarHBondContact O-CG1 3.42Å; L110-V126 HydrophobicContact CB-CG1 4.08Å; L110-V126 HydrophobicContact CD2-CG1 4.01Å; L110-V126 HydrophobicContact CD2-CG2 3.94Å; L110-V126 HydrophobicContact CG-CG1 4.07Å; L110-V126 HydrophobicContact CG-CG2 4.15Å; A111-V126 HydrophobicContact CB-CB 4.29Å; A111-V126 HydrophobicContact CB-CG1 4.06Å; Y114-V126 HydrophobicContact CD2-CG2 4.06Å; Y114-V126 HydrophobicContact CE2-CG2 3.87Å; N122-V126 WeakPolarHBondContact O-CB 3.42Å; N122-V126 VanDerWaalsContact O-CG2 3.24Å; N122-V126 WeakPolarHBondContact O-CG2 3.25Å; N122-V126 PolarHBondContact O-N 3.43Å; A123-V126 PolarHBondContact O-N 3.42Å; A124-V126 VanDerWaalsContact C-N 3.3Å; A124-V126 PolarHBondContact O-N 3.06Å; V126-G129 PolarHBondContact O-N 3.12Å
127L98.3Very high95.4Very high0 Ų058.4 Ų58.40%031%0.31CS..Hα-helixtrans-70.1-37.8178.1-66.2178.8000112.8A111 A123 A124 Q125 G129 I130 T147 K150 I151 L154A111-L127 HydrophobicContact CB-CD1 4.11Å; A111-L127 HydrophobicContact CB-CD2 3.59Å; A111-L127 HydrophobicContact CB-CG 3.54Å; A123-L127 PolarHBondContact O-N 3.1Å; A124-L127 PolarHBondContact O-N 3.24Å; Q125-L127 PolarHBondContact O-N 3.22Å; L127-G129 PolarHBondContact O-N 3.21Å; L127-I130 HydrophobicContact CD2-CD1 3.98Å; L127-I130 WeakPolarHBondContact O-CB 3.34Å; L127-I130 WeakPolarHBondContact O-CG1 3.48Å; L127-I130 PolarHBondContact O-N 3.38Å; L127-T147 HydrophobicContact CB-CG2 4.4Å; L127-K150 HydrophobicContact CD1-CB 4.06Å; L127-K150 HydrophobicContact CD1-CD 3.81Å; L127-K150 HydrophobicContact CD1-CG 3.69Å; L127-I151 HydrophobicContact CB-CD1 3.91Å; L127-I151 HydrophobicContact CB-CG1 3.56Å; L127-I151 HydrophobicContact CD1-CG1 4.05Å; L127-I151 HydrophobicContact CG-CG1 4.48Å; L127-L154 HydrophobicContact CD1-CD1 3.84Å
128V97.9Very high95.2Very high55 Ų5561.9 Ų61.933%0.33333%0.327SS..Hα-helixtrans-58.3-30.3174.8168.20000111.7A124 Q125 I130 I151 Y155 Y167A124-V128 VanDerWaalsContact O-CG2 3.3Å; A124-V128 WeakPolarHBondContact O-CG2 3.35Å; A124-V128 PolarHBondContact O-N 3.41Å; Q125-V128 PolarHBondContact O-N 3.09Å; V128-I130 PolarHBondContact O-N 3.37Å; V128-I151 HydrophobicContact CG2-CD1 4.07Å; V128-I151 HydrophobicContact CG2-CG1 4.38Å; V128-I151 HydrophobicContact CG2-CG2 3.95Å; V128-Y155 HydrophobicContact CG2-CE2 4.34Å; V128-Y167 VanDerWaalsContact CG1-OH 3.24Å; V128-Y167 WeakPolarHBondContact CG1-OH 3.05Å; V128-Y167 HydrophobicContact CG2-CE1 3.97Å; V128-Y167 HydrophobicContact CG2-CE2 4.01Å; V128-Y167 VanDerWaalsContact CG2-CZ 3.48Å; V128-Y167 VanDerWaalsContact CG2-OH 3.25Å; V128-Y167 WeakPolarHBondContact CG2-OH 3.36Å
129G96.2Very high95.1Very high36 Ų3661.7 Ų61.737%0.37132%0.316SS..THydrogen-bonded Turntrans-72.2-2.1175.400000115.4R107 Q125 V126 L127R107-G129 PolarHBondContact NE-O 3.02Å; Q125-G129 PolarHBondContact O-N 3.48Å; V126-G129 PolarHBondContact O-N 3.12Å; L127-G129 PolarHBondContact O-N 3.21Å
130I96.9Very high94.9Very high8 Ų864.3 Ų64.34%0.04133%0.33CS..SBendtrans-80.1122.4172.5-57.5174.5000108.6A104 R107 Q108 L127 V128 L132 T147A104-I130 HydrophobicContact CB-CG2 3.95Å; R107-I130 HydrophobicContact CB-CD1 3.87Å; R107-I130 HydrophobicContact CB-CG1 3.69Å; R107-I130 HydrophobicContact CG-CG1 4.26Å; Q108-I130 HydrophobicContact CG-CD1 4.12Å; L127-I130 HydrophobicContact CD2-CD1 3.98Å; L127-I130 WeakPolarHBondContact O-CB 3.34Å; L127-I130 WeakPolarHBondContact O-CG1 3.48Å; L127-I130 PolarHBondContact O-N 3.38Å; V128-I130 PolarHBondContact O-N 3.37Å; I130-L132 HydrophobicContact CB-CD2 4.42Å; I130-L132 HydrophobicContact CB-CG 4.46Å; I130-L132 HydrophobicContact CG2-CD2 3.67Å; I130-L132 HydrophobicContact CG2-CG 4.12Å; I130-L132 PolarHBondContact O-N 3.12Å; I130-T147 HydrophobicContact CD1-CG2 4.42Å
131P94.4Very high94.8Very high34 Ų3462.3 Ų62.322%0.22133%0.326CS..  trans-78.966.8-176.334-37000112.2E100 E133 G135E100-P131 HydrophobicContact CG-CG 3.85Å; P131-E133 VanDerWaalsContact C-N 3.25Å; P131-E133 PolarHBondContact O-N 3.05Å; P131-G135 PolarHBondContact O-N 3.39Å
132L94.2Very high94.8Very high14 Ų1459.5 Ų59.57%0.07332%0.319CS..THydrogen-bonded Turntrans-60.3-28.4-173.6-63.4174000114.7I130 Y139 Y143 K144 T147 Y148I130-L132 HydrophobicContact CB-CD2 4.42Å; I130-L132 HydrophobicContact CB-CG 4.46Å; I130-L132 HydrophobicContact CG2-CD2 3.67Å; I130-L132 HydrophobicContact CG2-CG 4.12Å; I130-L132 PolarHBondContact O-N 3.12Å; L132-Y139 HydrophobicContact CD2-CD2 4.29Å; L132-Y143 HydrophobicContact CD2-CD1 4.11Å; L132-Y143 HydrophobicContact CD2-CE1 3.79Å; L132-K144 HydrophobicContact CB-CD 4.36Å; L132-K144 HydrophobicContact CB-CG 4.47Å; L132-K144 HydrophobicContact CD2-CG 4.35Å; L132-T147 HydrophobicContact CD1-CG2 3.9Å; L132-Y148 HydrophobicContact CD1-CD1 4.06Å; L132-Y148 HydrophobicContact CD1-CE1 3.59Å; L132-Y148 HydrophobicContact CD1-CE2 4.23Å
133E90.3Very high94.7Very high114 Ų11459.7 Ų59.753%0.53332%0.316SS..THydrogen-bonded Turntrans-120-23.3-178.8-53.9-60.4158.800113.6P131 K144 Y148P131-E133 VanDerWaalsContact C-N 3.25Å; P131-E133 PolarHBondContact O-N 3.05Å; E133-K144 VanDerWaalsContact CD-NZ 3.31Å; E133-K144 WeakPolarHBondContact OE1-CD 3.17Å; E133-K144 IonicContact OE1-NZ 3.25Å; E133-K144 PolarHBondContact OE1-NZ 3.32Å; E133-K144 IonicContact OE2-NZ 3.94Å; E133-K144 PolarHBondContact OE2-NZ 3.45Å; E133-Y148 WeakPolarHBondContact CG-OH 3.27Å; E133-Y148 PolarHBondContact OE1-OH 3.12Å
134T89.6Confident94.7Very high131 Ų13161 Ų6180%0.80432%0.322SS*.THydrogen-bonded Turntrans-99.4-4.5-175.156.80000113.3
135G87.8Confident94.6Very high28 Ų2861 Ų6129%0.28932%0.322SS..SBendtrans-81.1169.6-178.200000113.9E100 P131E100-G135 WeakPolarHBondContact OE1-CA 3.46Å; E100-G135 WeakPolarHBondContact OE2-CA 3.47Å; P131-G135 PolarHBondContact O-N 3.39Å
136Q89.4Confident94.6Very high159 Ų15960.1 Ų60.174%0.74332%0.32SS*.SBendtrans-80.2-23.6171.5-66.1-171.7-10.700111.8I97 E100I97-Q136 HydrophobicContact CG2-CG 4.18Å; E100-Q136 PolarHBondContact OE1-N 3.11Å; E100-Q136 PolarHBondContact OE2-N 3.19Å
137K89.7Confident94.6Very high98 Ų9859.4 Ų59.443%0.42632%0.316SS..SBendtrans-82.3127.1-180-177.364.9174.1-1720109.8E100 E101 Y139E100-K137 HydrophobicContact CG-CB 4.42Å; E100-K137 WeakPolarHBondContact OE1-CB 3.47Å; E100-K137 PolarHBondContact OE1-N 3.42Å; E100-K137 PolarHBondContact OE2-N 3.4Å; E101-K137 IonicContact OE2-NZ 2.82Å; K137-Y139 HydrophobicContact CB-CE2 4.16Å; K137-Y139 HydrophobicContact CG-CD1 4.42Å; K137-Y139 HydrophobicContact CG-CE1 4.09Å; K137-Y139 HydrophobicContact CG-CE2 4.32Å; K137-Y139 WeakPolarHBondContact O-CD2 3.4Å; K137-Y139 PolarHBondContact O-N 3.18Å
138Q91.9Very high94.6Very high182 Ų18259.8 Ų59.885%0.8532%0.317SS*.  trans-84.9109.5169.2-162.9144.817.300110.2
139Y94.4Very high94.6Very high29 Ų2957.3 Ų57.311%0.11430%0.302CS..  trans-80.4148.7173.3-60.9-81.8000110.7A104 L132 K137 Y143A104-Y139 HydrophobicContact CB-CE1 4.16Å; A104-Y139 WeakPolarHBondContact CB-OH 3.46Å; L132-Y139 HydrophobicContact CD2-CD2 4.29Å; K137-Y139 HydrophobicContact CB-CE2 4.16Å; K137-Y139 HydrophobicContact CG-CD1 4.42Å; K137-Y139 HydrophobicContact CG-CE1 4.09Å; K137-Y139 HydrophobicContact CG-CE2 4.32Å; K137-Y139 WeakPolarHBondContact O-CD2 3.4Å; K137-Y139 PolarHBondContact O-N 3.18Å; Y139-Y143 AromaticContact CD1-CD1 3.53Å; Y139-Y143 HydrophobicContact CD1-CD1 3.53Å; Y139-Y143 AromaticContact CD1-CE1 3.52Å; Y139-Y143 HydrophobicContact CD1-CE1 3.52Å; Y139-Y143 HydrophobicContact CD1-CG 4.4Å; Y139-Y143 HydrophobicContact CE1-CD1 4.31Å; Y139-Y143 AromaticContact CE1-CE1 3.82Å; Y139-Y143 HydrophobicContact CE1-CE1 3.82Å; Y139-Y143 AromaticContact CG-CD1 3.89Å; Y139-Y143 HydrophobicContact CG-CD1 3.89Å; Y139-Y143 HydrophobicContact CG-CE1 4.13Å
140N95.4Very high94.7Very high107 Ų10757.2 Ų57.257%0.57229%0.291SS*.  trans-69.6159.8173.370.124.9000110.7D142 Y143 K144N140-D142 VanDerWaalsContact C-N 3.34Å; N140-D142 PolarHBondContact O-N 2.84Å; N140-Y143 PolarHBondContact O-N 2.76Å; N140-Y143 WeakPolarHBondContact OD1-CA 3.38Å; N140-Y143 WeakPolarHBondContact OD1-CB 3.23Å; N140-Y143 PolarHBondContact OD1-N 3.47Å; N140-K144 PolarHBondContact O-N 3.12Å
141V96.3Very high94.7Very high39 Ų3956.9 Ų56.924%0.23629%0.29CS..Hα-helixtrans-58.2-47.2-176.5177.10000111Y143 K144 L145 L174 E177V141-Y143 PolarHBondContact O-N 3.08Å; V141-K144 PolarHBondContact O-N 3.33Å; V141-L145 WeakPolarHBondContact O-CB 3.31Å; V141-L145 PolarHBondContact O-N 2.95Å; V141-L174 HydrophobicContact CG1-CB 4.1Å; V141-E177 HydrophobicContact CG1-CB 4.02Å; V141-E177 HydrophobicContact CG2-CB 4.43Å
142D96.8Very high94.9Very high47 Ų4755.2 Ų55.225%0.25128%0.279SS..Hα-helixtrans-61.9-39.6-176.6-68.211.9000112.6N140 L145 D146 S178 L183N140-D142 VanDerWaalsContact C-N 3.34Å; N140-D142 PolarHBondContact O-N 2.84Å; D142-L145 PolarHBondContact O-N 3.37Å; D142-D146 VanDerWaalsContact O-CB 3.27Å; D142-D146 WeakPolarHBondContact O-CB 3.26Å; D142-D146 PolarHBondContact O-N 2.96Å; D142-S178 WeakPolarHBondContact OD1-CB 3.27Å; D142-S178 PolarHBondContact OD1-OG 2.98Å; D142-L183 HydrophobicContact CB-CD2 4.03Å; D142-L183 WeakPolarHBondContact O-CD2 3.49Å
143Y96.7Very high95.1Very high62 Ų6258.5 Ų58.524%0.24329%0.29CS..Hα-helixtrans-65.7-43.5177-179.9-91.6000111.8Q108 L132 Y139 N140 V141 T147Q108-Y143 HydrophobicContact CG-CE2 4.46Å; Q108-Y143 WeakPolarHBondContact CG-OH 3.5Å; Q108-Y143 PolarHBondContact NE2-OH 3.46Å; Q108-Y143 VanDerWaalsContact NE2-OH 3.12Å; L132-Y143 HydrophobicContact CD2-CD1 4.11Å; L132-Y143 HydrophobicContact CD2-CE1 3.79Å; Y139-Y143 AromaticContact CD1-CD1 3.53Å; Y139-Y143 HydrophobicContact CD1-CD1 3.53Å; Y139-Y143 AromaticContact CD1-CE1 3.52Å; Y139-Y143 HydrophobicContact CD1-CE1 3.52Å; Y139-Y143 HydrophobicContact CD1-CG 4.4Å; Y139-Y143 HydrophobicContact CE1-CD1 4.31Å; Y139-Y143 AromaticContact CE1-CE1 3.82Å; Y139-Y143 HydrophobicContact CE1-CE1 3.82Å; Y139-Y143 AromaticContact CG-CD1 3.89Å; Y139-Y143 HydrophobicContact CG-CD1 3.89Å; Y139-Y143 HydrophobicContact CG-CE1 4.13Å; N140-Y143 PolarHBondContact O-N 2.76Å; N140-Y143 WeakPolarHBondContact OD1-CA 3.38Å; N140-Y143 WeakPolarHBondContact OD1-CB 3.23Å; N140-Y143 PolarHBondContact OD1-N 3.47Å; V141-Y143 PolarHBondContact O-N 3.08Å; Y143-T147 WeakPolarHBondContact O-CB 3.46Å; Y143-T147 PolarHBondContact O-N 3.21Å; Y143-T147 PolarHBondContact O-OG1 3.37Å
144K97Very high95.4Very high28 Ų2853.2 Ų53.212%0.12227%0.266CS..Hα-helixtrans-63.9-45.8176.1-64.4-161.3-62.1168.70110.5L132 E133 N140 V141 T147 Y148 L174L132-K144 HydrophobicContact CB-CD 4.36Å; L132-K144 HydrophobicContact CB-CG 4.47Å; L132-K144 HydrophobicContact CD2-CG 4.35Å; E133-K144 VanDerWaalsContact CD-NZ 3.31Å; E133-K144 WeakPolarHBondContact OE1-CD 3.17Å; E133-K144 IonicContact OE1-NZ 3.25Å; E133-K144 PolarHBondContact OE1-NZ 3.32Å; E133-K144 IonicContact OE2-NZ 3.94Å; E133-K144 PolarHBondContact OE2-NZ 3.45Å; N140-K144 PolarHBondContact O-N 3.12Å; V141-K144 PolarHBondContact O-N 3.33Å; K144-T147 PolarHBondContact O-N 3.36Å; K144-Y148 HydrophobicContact CB-CE2 4.31Å; K144-Y148 WeakPolarHBondContact O-CD2 3.45Å; K144-Y148 PolarHBondContact O-N 3.41Å; K144-L174 HydrophobicContact CB-CD1 3.7Å
145L97.5Very high95.8Very high0 Ų047.8 Ų47.80%023%0.231CC..Hα-helixtrans-60.7-52179-18056.8000111V141 D142 T147 Y148 L149 A171 Q175 L183V141-L145 WeakPolarHBondContact O-CB 3.31Å; V141-L145 PolarHBondContact O-N 2.95Å; D142-L145 PolarHBondContact O-N 3.37Å; L145-T147 VanDerWaalsContact C-N 3.33Å; L145-T147 PolarHBondContact O-N 2.94Å; L145-Y148 PolarHBondContact O-N 2.95Å; L145-L149 HydrophobicContact CD1-CD1 4.31Å; L145-L149 HydrophobicContact CD1-CD2 4.5Å; L145-L149 HydrophobicContact CD1-CG 4.17Å; L145-L149 HydrophobicContact CG-CD1 4.27Å; L145-L149 VanDerWaalsContact O-CG 3.25Å; L145-L149 WeakPolarHBondContact O-CG 3.36Å; L145-L149 PolarHBondContact O-N 3.06Å; L145-A171 HydrophobicContact CD1-CB 3.65Å; L145-Q175 HydrophobicContact CD1-CB 4.39Å; L145-Q175 HydrophobicContact CD2-CB 4.34Å; L145-L183 HydrophobicContact CB-CD2 3.95Å; L145-L183 HydrophobicContact CD2-CD2 3.65Å; L145-L183 HydrophobicContact CD2-CG 3.69Å; L145-L183 HydrophobicContact CG-CD2 3.79Å; L145-L183 HydrophobicContact CG-CG 3.85Å
146D97.7Very high96.2Very high77 Ų7746.5 Ų46.541%0.41222%0.217SC..Hα-helixtrans-57.5-44.2177.6-173.665.8000112.2D142 Y148 L149 K150 L183D142-D146 VanDerWaalsContact O-CB 3.27Å; D142-D146 WeakPolarHBondContact O-CB 3.26Å; D142-D146 PolarHBondContact O-N 2.96Å; D146-Y148 PolarHBondContact O-N 3.33Å; D146-L149 PolarHBondContact O-N 3.16Å; D146-K150 WeakPolarHBondContact O-CB 3.39Å; D146-K150 PolarHBondContact O-N 3.4Å; D146-L183 HydrophobicContact CB-CD1 4.12Å; D146-L183 HydrophobicContact CB-CD2 4.47Å
147T98Very high96.5Very high0 Ų043.1 Ų43.10%020%0.201CC..Hα-helixtrans-62.8-45177.5-55.50000111.7Q108 L127 I130 L132 Y143 K144 L145 K150 I151Q108-T147 PolarHBondContact NE2-OG1 3.34Å; L127-T147 HydrophobicContact CB-CG2 4.4Å; I130-T147 HydrophobicContact CD1-CG2 4.42Å; L132-T147 HydrophobicContact CD1-CG2 3.9Å; Y143-T147 WeakPolarHBondContact O-CB 3.46Å; Y143-T147 PolarHBondContact O-N 3.21Å; Y143-T147 PolarHBondContact O-OG1 3.37Å; K144-T147 PolarHBondContact O-N 3.36Å; L145-T147 VanDerWaalsContact C-N 3.33Å; L145-T147 PolarHBondContact O-N 2.94Å; T147-K150 PolarHBondContact O-N 3.45Å; T147-I151 HydrophobicContact CG2-CD1 4.06Å; T147-I151 VanDerWaalsContact O-CG1 3.27Å; T147-I151 WeakPolarHBondContact O-CG1 3.45Å; T147-I151 PolarHBondContact O-N 3.46Å
148Y98.3Very high96.8Very high8 Ų840.6 Ų40.63%0.03119%0.193CC..Hα-helixtrans-64.8-39.1176.4-71-45.1000112.7L132 E133 K144 L145 D146 K150 I151 A152 Y167 R170 L174L132-Y148 HydrophobicContact CD1-CD1 4.06Å; L132-Y148 HydrophobicContact CD1-CE1 3.59Å; L132-Y148 HydrophobicContact CD1-CE2 4.23Å; E133-Y148 WeakPolarHBondContact CG-OH 3.27Å; E133-Y148 PolarHBondContact OE1-OH 3.12Å; K144-Y148 HydrophobicContact CB-CE2 4.31Å; K144-Y148 WeakPolarHBondContact O-CD2 3.45Å; K144-Y148 PolarHBondContact O-N 3.41Å; L145-Y148 PolarHBondContact O-N 2.95Å; D146-Y148 PolarHBondContact O-N 3.33Å; Y148-K150 VanDerWaalsContact C-N 3.34Å; Y148-I151 HydrophobicContact CD1-CD1 4.46Å; Y148-I151 PolarHBondContact O-N 3.06Å; Y148-A152 WeakPolarHBondContact O-CB 3.48Å; Y148-A152 PolarHBondContact O-N 3.48Å; Y148-Y167 AromaticContact CD1-CD1 3.9Å; Y148-Y167 HydrophobicContact CD1-CD1 3.9Å; Y148-Y167 HydrophobicContact CE1-CD1 4.23Å; Y148-R170 HydrophobicContact CD1-CB 4.29Å; Y148-R170 HydrophobicContact CD2-CB 4.16Å; Y148-R170 HydrophobicContact CE1-CB 4.18Å; Y148-R170 HydrophobicContact CE2-CB 4.05Å; Y148-R170 HydrophobicContact CG-CB 4.29Å; Y148-L174 HydrophobicContact CD2-CD1 3.94Å; Y148-L174 HydrophobicContact CE2-CD1 3.82Å
149L97.8Very high96.8Very high2 Ų237.8 Ų37.81%0.0118%0.184CC..Hα-helixtrans-63.7-41.8175.1-68.4-176.8000111.6L145 D146 A152 R153 I168 A171 L183 H186 Y187 C190L145-L149 HydrophobicContact CD1-CD1 4.31Å; L145-L149 HydrophobicContact CD1-CD2 4.5Å; L145-L149 HydrophobicContact CD1-CG 4.17Å; L145-L149 HydrophobicContact CG-CD1 4.27Å; L145-L149 VanDerWaalsContact O-CG 3.25Å; L145-L149 WeakPolarHBondContact O-CG 3.36Å; L145-L149 PolarHBondContact O-N 3.06Å; D146-L149 PolarHBondContact O-N 3.16Å; L149-A152 PolarHBondContact O-N 3.22Å; L149-R153 VanDerWaalsContact O-CG 3.29Å; L149-R153 WeakPolarHBondContact O-CG 3.12Å; L149-R153 PolarHBondContact O-N 2.77Å; L149-I168 HydrophobicContact CD2-CD1 3.46Å; L149-I168 VanDerWaalsContact CD2-CD1 3.46Å; L149-A171 HydrophobicContact CD2-CB 4.13Å; L149-L183 HydrophobicContact CD1-CD1 3.66Å; L149-L183 HydrophobicContact CD1-CG 4.25Å; L149-H186 HydrophobicContact CD1-CB 4.17Å; L149-Y187 HydrophobicContact CD2-CD2 3.9Å; L149-Y187 HydrophobicContact CD2-CG 4.36Å; L149-C190 HydrophobicContact CD2-CB 4.27Å
150K98Very high96.9Very high34 Ų3438 Ų3815%0.14819%0.187CC..Hα-helixtrans-63.3-45.5176.4-169.2166.4-177.51660111.3T112 E115 L127 D146 T147 Y148 A152 R153 L154T112-K150 PolarHBondContact OG1-NZ 3.46Å; E115-K150 WeakPolarHBondContact OE2-CE 3.41Å; E115-K150 IonicContact OE2-NZ 3.23Å; E115-K150 PolarHBondContact OE2-NZ 3.13Å; L127-K150 HydrophobicContact CD1-CB 4.06Å; L127-K150 HydrophobicContact CD1-CD 3.81Å; L127-K150 HydrophobicContact CD1-CG 3.69Å; D146-K150 WeakPolarHBondContact O-CB 3.39Å; D146-K150 PolarHBondContact O-N 3.4Å; T147-K150 PolarHBondContact O-N 3.45Å; Y148-K150 VanDerWaalsContact C-N 3.34Å; K150-A152 PolarHBondContact O-N 3.4Å; K150-R153 PolarHBondContact O-N 3Å; K150-L154 HydrophobicContact CG-CD1 4.05Å; K150-L154 VanDerWaalsContact O-CG 3.24Å; K150-L154 WeakPolarHBondContact O-CG 3.36Å; K150-L154 PolarHBondContact O-N 2.63Å
151I98.4Very high96.9Very high1 Ų134.2 Ų34.21%0.00517%0.168CC..Hα-helixtrans-58.2-47.6174.7-67.4163.8000111.1L127 V128 T147 Y148 R153 L154 Y155 Y167L127-I151 HydrophobicContact CB-CD1 3.91Å; L127-I151 HydrophobicContact CB-CG1 3.56Å; L127-I151 HydrophobicContact CD1-CG1 4.05Å; L127-I151 HydrophobicContact CG-CG1 4.48Å; V128-I151 HydrophobicContact CG2-CD1 4.07Å; V128-I151 HydrophobicContact CG2-CG1 4.38Å; V128-I151 HydrophobicContact CG2-CG2 3.95Å; T147-I151 HydrophobicContact CG2-CD1 4.06Å; T147-I151 VanDerWaalsContact O-CG1 3.27Å; T147-I151 WeakPolarHBondContact O-CG1 3.45Å; T147-I151 PolarHBondContact O-N 3.46Å; Y148-I151 HydrophobicContact CD1-CD1 4.46Å; Y148-I151 PolarHBondContact O-N 3.06Å; I151-R153 VanDerWaalsContact C-N 3.35Å; I151-R153 PolarHBondContact O-N 3.07Å; I151-L154 PolarHBondContact O-N 2.95Å; I151-Y155 HydrophobicContact CG2-CD2 3.59Å; I151-Y155 HydrophobicContact CG2-CE2 3.44Å; I151-Y155 VanDerWaalsContact CG2-CE2 3.44Å; I151-Y155 VanDerWaalsContact O-CD2 3.31Å; I151-Y155 WeakPolarHBondContact O-CD2 3.47Å; I151-Y155 PolarHBondContact O-N 3.37Å; I151-Y167 HydrophobicContact CB-CD1 4.48Å; I151-Y167 HydrophobicContact CB-CG 4.24Å; I151-Y167 HydrophobicContact CD1-CD1 4.23Å; I151-Y167 HydrophobicContact CD1-CE1 4.35Å; I151-Y167 HydrophobicContact CG2-CD1 3.85Å; I151-Y167 HydrophobicContact CG2-CD2 3.39Å; I151-Y167 HydrophobicContact CG2-CE1 4.21Å; I151-Y167 HydrophobicContact CG2-CE2 3.84Å; I151-Y167 HydrophobicContact CG2-CG 3.43Å; I151-Y167 VanDerWaalsContact CG2-CG 3.43Å
152A98Very high96.9Very high0 Ų035.9 Ų35.90%018%0.178CC..Hα-helixtrans-62.6-40.9-179.900000112.2Y148 L149 K150 L156 A164 I168Y148-A152 WeakPolarHBondContact O-CB 3.48Å; Y148-A152 PolarHBondContact O-N 3.48Å; L149-A152 PolarHBondContact O-N 3.22Å; K150-A152 PolarHBondContact O-N 3.4Å; A152-L156 WeakPolarHBondContact O-CG 3.46Å; A152-L156 PolarHBondContact O-N 3.2Å; A152-L156 VanDerWaalsContact O-N 3.15Å; A152-A164 WeakPolarHBondContact O-CB 3.36Å; A152-I168 HydrophobicContact CB-CB 4.24Å; A152-I168 HydrophobicContact CB-CD1 4.46Å
153R97.4Very high97Very high82 Ų8237 Ų3731%0.30918%0.182SC..Hα-helixtrans-61.8-48.2174.4-73172.2-177-176.50.3111.9L149 K150 I151 Y155 L156 E157 H186L149-R153 VanDerWaalsContact O-CG 3.29Å; L149-R153 WeakPolarHBondContact O-CG 3.12Å; L149-R153 PolarHBondContact O-N 2.77Å; K150-R153 PolarHBondContact O-N 3Å; I151-R153 VanDerWaalsContact C-N 3.35Å; I151-R153 PolarHBondContact O-N 3.07Å; R153-Y155 VanDerWaalsContact C-N 3.33Å; R153-Y155 PolarHBondContact O-N 3.27Å; R153-L156 WeakPolarHBondContact O-CB 2.98Å; R153-L156 PolarHBondContact O-N 3.34Å; R153-E157 WeakPolarHBondContact O-CG 3.33Å; R153-E157 PolarHBondContact O-N 3.23Å; R153-H186 VanDerWaalsContact NH2-CB 3.26Å; R153-H186 VanDerWaalsContact NH2-CG 3.33Å; R153-H186 PolarHBondContact NH2-ND1 3.38Å
154L98.1Very high97Very high3 Ų334.1 Ų34.12%0.01617%0.17CC..Hα-helixtrans-60.3-41.7-179.5-69.1166.2000111.9E115 W120 A123 A124 L127 K150 I151 L156 E157 D158E115-L154 HydrophobicContact CB-CD2 4.31Å; E115-L154 HydrophobicContact CG-CD2 4.05Å; W120-L154 HydrophobicContact CE3-CD2 3.9Å; A123-L154 HydrophobicContact CB-CD1 3.74Å; A123-L154 HydrophobicContact CB-CD2 3.83Å; A123-L154 HydrophobicContact CB-CG 4.36Å; A124-L154 HydrophobicContact CB-CB 3.87Å; A124-L154 HydrophobicContact CB-CD1 4.36Å; L127-L154 HydrophobicContact CD1-CD1 3.84Å; K150-L154 HydrophobicContact CG-CD1 4.05Å; K150-L154 VanDerWaalsContact O-CG 3.24Å; K150-L154 WeakPolarHBondContact O-CG 3.36Å; K150-L154 PolarHBondContact O-N 2.63Å; I151-L154 PolarHBondContact O-N 2.95Å; L154-L156 VanDerWaalsContact C-N 3.31Å; L154-L156 PolarHBondContact O-N 3.42Å; L154-E157 PolarHBondContact O-N 3.26Å; L154-D158 PolarHBondContact O-N 3.39Å; L154-D158 VanDerWaalsContact O-N 3.1Å
155Y98.3Very high97Very high18 Ų1834 Ų347%0.07117%0.17CC..Hα-helixtrans-67.4-28.4174.6-78.1-57.3000113.7A124 V128 I151 R153 D158 D159 D160 Q163 Y167A124-Y155 HydrophobicContact CB-CD1 4.19Å; A124-Y155 HydrophobicContact CB-CD2 4.15Å; A124-Y155 HydrophobicContact CB-CE1 3.89Å; A124-Y155 HydrophobicContact CB-CE2 3.86Å; A124-Y155 HydrophobicContact CB-CG 4.31Å; V128-Y155 HydrophobicContact CG2-CE2 4.34Å; I151-Y155 HydrophobicContact CG2-CD2 3.59Å; I151-Y155 HydrophobicContact CG2-CE2 3.44Å; I151-Y155 VanDerWaalsContact CG2-CE2 3.44Å; I151-Y155 VanDerWaalsContact O-CD2 3.31Å; I151-Y155 WeakPolarHBondContact O-CD2 3.47Å; I151-Y155 PolarHBondContact O-N 3.37Å; R153-Y155 VanDerWaalsContact C-N 3.33Å; R153-Y155 PolarHBondContact O-N 3.27Å; Y155-D158 PolarHBondContact O-N 3.39Å; Y155-D159 PolarHBondContact O-N 2.77Å; Y155-D160 HydrophobicContact CD1-CB 4.25Å; Y155-D160 CarbonylContact O-C 3.22Å; Y155-D160 WeakPolarHBondContact O-CA 3.31Å; Y155-D160 PolarHBondContact O-N 3.11Å; Y155-Q163 HydrophobicContact CD1-CB 3.66Å; Y155-Q163 HydrophobicContact CD1-CG 4.28Å; Y155-Q163 HydrophobicContact CD2-CB 3.63Å; Y155-Q163 HydrophobicContact CE1-CB 3.9Å; Y155-Q163 HydrophobicContact CE1-CG 4.13Å; Y155-Q163 HydrophobicContact CE2-CB 3.86Å; Y155-Q163 HydrophobicContact CG-CB 3.54Å; Y155-Y167 HydrophobicContact CD2-CD2 4Å; Y155-Y167 HydrophobicContact CD2-CE2 4.27Å; Y155-Y167 AromaticContact CE2-CD2 3.76Å; Y155-Y167 HydrophobicContact CE2-CD2 3.76Å; Y155-Y167 AromaticContact CE2-CE2 3.57Å; Y155-Y167 HydrophobicContact CE2-CE2 3.57Å
156L95.2Very high97Very high1 Ų136.1 Ų36.11%0.00519%0.188CC..Hα-helixtrans-69.7-39.3171.9-72177.4000112.3A152 R153 L154 D158 D159 P161 A164 R193 V194 F197A152-L156 WeakPolarHBondContact O-CG 3.46Å; A152-L156 PolarHBondContact O-N 3.2Å; A152-L156 VanDerWaalsContact O-N 3.15Å; R153-L156 WeakPolarHBondContact O-CB 2.98Å; R153-L156 PolarHBondContact O-N 3.34Å; L154-L156 VanDerWaalsContact C-N 3.31Å; L154-L156 PolarHBondContact O-N 3.42Å; L156-D158 PolarHBondContact O-N 2.87Å; L156-D159 PolarHBondContact O-N 3.42Å; L156-P161 HydrophobicContact CD2-CB 4.22Å; L156-A164 HydrophobicContact CD2-CB 3.75Å; L156-A164 HydrophobicContact CG-CB 3.73Å; L156-R193 HydrophobicContact CD1-CB 3.77Å; L156-V194 HydrophobicContact CD1-CG2 3.89Å; L156-V194 HydrophobicContact CD2-CG2 4.17Å; L156-V194 HydrophobicContact CG-CG2 4.25Å; L156-F197 HydrophobicContact CD2-CB 3.94Å; L156-F197 HydrophobicContact CD2-CD1 4.04Å; L156-F197 HydrophobicContact CD2-CD2 4.03Å; L156-F197 HydrophobicContact CD2-CG 3.75Å
157E95.4Very high97Very high87 Ų8733.5 Ų33.541%0.40717%0.172SC..Hα-helixtrans-68.3-22175-55.9-53.3146.600112.2W120 R153 L154 D159 R193W120-E157 HydrophobicContact CB-CB 4.27Å; W120-E157 VanDerWaalsContact CD1-O 3.31Å; W120-E157 HydrophobicContact CD2-CB 3.68Å; W120-E157 HydrophobicContact CD2-CG 4.43Å; W120-E157 HydrophobicContact CE3-CB 4.2Å; W120-E157 HydrophobicContact CG-CB 3.69Å; R153-E157 WeakPolarHBondContact O-CG 3.33Å; R153-E157 PolarHBondContact O-N 3.23Å; L154-E157 PolarHBondContact O-N 3.26Å; E157-D159 VanDerWaalsContact C-N 3.33Å; E157-R193 IonicContact OE1-CZ 3.3Å; E157-R193 IonicContact OE1-NH1 3.96Å; E157-R193 PolarHBondContact OE1-NH1 3.07Å; E157-R193 IonicContact OE1-NH2 2.76Å; E157-R193 PolarHBondContact OE1-NH2 3.08Å
158D95.4Very high97Very high45 Ų4533.5 Ų33.524%0.24117%0.172CC..THydrogen-bonded Turntrans-88.510.4173.2-166.257.1000113.7W120 R121 L154 Y155 L156 D160W120-D158 HydrophobicContact CB-CB 3.99Å; R121-D158 IonicContact CZ-OD2 3.92Å; R121-D158 IonicContact NE-OD1 3.14Å; R121-D158 IonicContact NE-OD2 3.97Å; R121-D158 PolarHBondContact NE-OD2 2.85Å; R121-D158 IonicContact NH2-OD2 2.79Å; R121-D158 PolarHBondContact NH2-OD2 3.48Å; L154-D158 PolarHBondContact O-N 3.39Å; L154-D158 VanDerWaalsContact O-N 3.1Å; Y155-D158 PolarHBondContact O-N 3.39Å; L156-D158 PolarHBondContact O-N 2.87Å; D158-D160 PolarHBondContact O-N 2.91Å; D158-D160 VanDerWaalsContact O-N 3.13Å
159D93.3Very high96.9Very high124 Ų12436.5 Ų36.566%0.66319%0.189SC*.THydrogen-bonded Turntrans54.328-175.8-72.4-44.7000114.4Y155 L156 E157 P161Y155-D159 PolarHBondContact O-N 2.77Å; L156-D159 PolarHBondContact O-N 3.42Å; E157-D159 VanDerWaalsContact C-N 3.33Å; D159-P161 WeakPolarHBondContact O-CD 3.5Å
160D96.3Very high96.9Very high34 Ų3442.3 Ų42.318%0.18221%0.211CC..  trans-109.675.4175.8-165-24.7000111.8R121 Y155 D158 V162 Q163 A164R121-D160 IonicContact NH2-OD2 3.07Å; R121-D160 PolarHBondContact NH2-OD2 3.13Å; Y155-D160 HydrophobicContact CD1-CB 4.25Å; Y155-D160 CarbonylContact O-C 3.22Å; Y155-D160 WeakPolarHBondContact O-CA 3.31Å; Y155-D160 PolarHBondContact O-N 3.11Å; D158-D160 PolarHBondContact O-N 2.91Å; D158-D160 VanDerWaalsContact O-N 3.13Å; D160-V162 PolarHBondContact O-N 3.19Å; D160-V162 PolarHBondContact OD1-N 3.14Å; D160-Q163 HydrophobicContact CB-CB 4.5Å; D160-Q163 PolarHBondContact O-N 3.21Å; D160-Q163 PolarHBondContact OD1-N 3.38Å; D160-Q163 WeakPolarHBondContact OD2-CG 3.37Å; D160-A164 PolarHBondContact O-N 3.38Å; D160-A164 VanDerWaalsContact O-N 3.12Å
161P95.1Very high96.8Very high26 Ų2640.7 Ų40.717%0.16920%0.204CC..Hα-helixtrans-71.3-15.1-177.531.9-38.2000113.1L156 D159 E165 F197 R198L156-P161 HydrophobicContact CD2-CB 4.22Å; D159-P161 WeakPolarHBondContact O-CD 3.5Å; P161-E165 VanDerWaalsContact O-CB 3.26Å; P161-E165 WeakPolarHBondContact O-CB 3.41Å; P161-E165 PolarHBondContact O-N 3.44Å; P161-F197 HydrophobicContact CB-CB 3.66Å; P161-F197 HydrophobicContact CG-CB 4.36Å; P161-R198 HydrophobicContact CB-CG 4.08Å
162V96.9Very high96.7Very high74 Ų7442.4 Ų42.445%0.44822%0.216SC..Hα-helixtrans-70.7-48.8176.4177.60000109.6D160 E165 A166D160-V162 PolarHBondContact O-N 3.19Å; D160-V162 PolarHBondContact OD1-N 3.14Å; V162-E165 PolarHBondContact O-N 3.39Å; V162-A166 PolarHBondContact O-N 3.42Å; V162-A166 VanDerWaalsContact O-N 3.12Å
163Q97.6Very high96.5Very high72 Ų7248.7 Ų48.734%0.33625%0.249SC..Hα-helixtrans-65.7-41.7174.8-68.9-60.7-36.100111.1Y155 D160 E165 A166 Y167Y155-Q163 HydrophobicContact CD1-CB 3.66Å; Y155-Q163 HydrophobicContact CD1-CG 4.28Å; Y155-Q163 HydrophobicContact CD2-CB 3.63Å; Y155-Q163 HydrophobicContact CE1-CB 3.9Å; Y155-Q163 HydrophobicContact CE1-CG 4.13Å; Y155-Q163 HydrophobicContact CE2-CB 3.86Å; Y155-Q163 HydrophobicContact CG-CB 3.54Å; D160-Q163 HydrophobicContact CB-CB 4.5Å; D160-Q163 PolarHBondContact O-N 3.21Å; D160-Q163 PolarHBondContact OD1-N 3.38Å; D160-Q163 WeakPolarHBondContact OD2-CG 3.37Å; Q163-E165 VanDerWaalsContact C-N 3.29Å; Q163-E165 PolarHBondContact O-N 3.1Å; Q163-A166 WeakPolarHBondContact O-CB 2.92Å; Q163-A166 PolarHBondContact O-N 3.28Å; Q163-A166 VanDerWaalsContact O-N 3.08Å; Q163-Y167 VanDerWaalsContact O-CD2 3.27Å; Q163-Y167 WeakPolarHBondContact O-CD2 3.18Å; Q163-Y167 PolarHBondContact O-N 3.21Å
164A97.8Very high96.4Very high0 Ų045.5 Ų45.50%024%0.238CC..Hα-helixtrans-57.2-42.4175.100000112.4A152 L156 D160 A166 Y167 I168 V194A152-A164 WeakPolarHBondContact O-CB 3.36Å; L156-A164 HydrophobicContact CD2-CB 3.75Å; L156-A164 HydrophobicContact CG-CB 3.73Å; D160-A164 PolarHBondContact O-N 3.38Å; D160-A164 VanDerWaalsContact O-N 3.12Å; A164-A166 VanDerWaalsContact C-N 3.35Å; A164-A166 PolarHBondContact O-N 3.04Å; A164-Y167 PolarHBondContact O-N 3.19Å; A164-I168 WeakPolarHBondContact O-CB 3.42Å; A164-I168 WeakPolarHBondContact O-CG2 3.42Å; A164-I168 PolarHBondContact O-N 3.18Å; A164-V194 HydrophobicContact CB-CG2 3.91Å
165E97.4Very high96.2Very high26 Ų2646.4 Ų46.412%0.12124%0.242CC..Hα-helixtrans-61.6-39175-172.4171.7-138.200112.4P161 V162 Q163 Y167 I168 N169 V194 R198 K200P161-E165 VanDerWaalsContact O-CB 3.26Å; P161-E165 WeakPolarHBondContact O-CB 3.41Å; P161-E165 PolarHBondContact O-N 3.44Å; V162-E165 PolarHBondContact O-N 3.39Å; Q163-E165 VanDerWaalsContact C-N 3.29Å; Q163-E165 PolarHBondContact O-N 3.1Å; E165-Y167 PolarHBondContact O-N 3.13Å; E165-I168 WeakPolarHBondContact O-CG2 3.24Å; E165-N169 WeakPolarHBondContact O-CB 3.35Å; E165-N169 PolarHBondContact O-N 2.89Å; E165-N169 VanDerWaalsContact O-N 3.16Å; E165-N169 PolarHBondContact O-ND2 3.04Å; E165-V194 HydrophobicContact CB-CG1 3.71Å; E165-V194 HydrophobicContact CG-CG1 4.2Å; E165-R198 IonicContact OE2-CZ 2.77Å; E165-R198 VanDerWaalsContact OE2-CZ 3.3Å; E165-R198 IonicContact OE2-NE 2.7Å; E165-R198 PolarHBondContact OE2-NE 3.42Å; E165-R198 IonicContact OE2-NH2 3.31Å; E165-R198 PolarHBondContact OE2-NH2 3.38Å; E165-K200 IonicContact OE1-NZ 2.7Å; E165-K200 PolarHBondContact OE1-NZ 3.37Å
166A97.6Very high95.9Very high45 Ų4551.7 Ų51.737%0.37227%0.271SS..Hα-helixtrans-62.3-43.4177.800000112.5V162 Q163 A164V162-A166 PolarHBondContact O-N 3.42Å; V162-A166 VanDerWaalsContact O-N 3.12Å; Q163-A166 WeakPolarHBondContact O-CB 2.92Å; Q163-A166 PolarHBondContact O-N 3.28Å; Q163-A166 VanDerWaalsContact O-N 3.08Å; A164-A166 VanDerWaalsContact C-N 3.35Å; A164-A166 PolarHBondContact O-N 3.04Å
167Y97.8Very high95.8Very high22 Ų2258 Ų589%0.08630%0.301CS..Hα-helixtrans-81.1-33.8-177.6-71.5-77.9000113.4V128 Y148 I151 Y155 Q163 A164 E165 N169 R170 A171V128-Y167 VanDerWaalsContact CG1-OH 3.24Å; V128-Y167 WeakPolarHBondContact CG1-OH 3.05Å; V128-Y167 HydrophobicContact CG2-CE1 3.97Å; V128-Y167 HydrophobicContact CG2-CE2 4.01Å; V128-Y167 VanDerWaalsContact CG2-CZ 3.48Å; V128-Y167 VanDerWaalsContact CG2-OH 3.25Å; V128-Y167 WeakPolarHBondContact CG2-OH 3.36Å; Y148-Y167 AromaticContact CD1-CD1 3.9Å; Y148-Y167 HydrophobicContact CD1-CD1 3.9Å; Y148-Y167 HydrophobicContact CE1-CD1 4.23Å; I151-Y167 HydrophobicContact CB-CD1 4.48Å; I151-Y167 HydrophobicContact CB-CG 4.24Å; I151-Y167 HydrophobicContact CD1-CD1 4.23Å; I151-Y167 HydrophobicContact CD1-CE1 4.35Å; I151-Y167 HydrophobicContact CG2-CD1 3.85Å; I151-Y167 HydrophobicContact CG2-CD2 3.39Å; I151-Y167 HydrophobicContact CG2-CE1 4.21Å; I151-Y167 HydrophobicContact CG2-CE2 3.84Å; I151-Y167 HydrophobicContact CG2-CG 3.43Å; I151-Y167 VanDerWaalsContact CG2-CG 3.43Å; Y155-Y167 HydrophobicContact CD2-CD2 4Å; Y155-Y167 HydrophobicContact CD2-CE2 4.27Å; Y155-Y167 AromaticContact CE2-CD2 3.76Å; Y155-Y167 HydrophobicContact CE2-CD2 3.76Å; Y155-Y167 AromaticContact CE2-CE2 3.57Å; Y155-Y167 HydrophobicContact CE2-CE2 3.57Å; Q163-Y167 VanDerWaalsContact O-CD2 3.27Å; Q163-Y167 WeakPolarHBondContact O-CD2 3.18Å; Q163-Y167 PolarHBondContact O-N 3.21Å; A164-Y167 PolarHBondContact O-N 3.19Å; E165-Y167 PolarHBondContact O-N 3.13Å; Y167-N169 VanDerWaalsContact C-N 3.26Å; Y167-N169 PolarHBondContact O-N 3.32Å; Y167-R170 WeakPolarHBondContact O-CB 3.4Å; Y167-R170 PolarHBondContact O-N 3.15Å; Y167-R170 VanDerWaalsContact O-N 3.13Å; Y167-A171 PolarHBondContact O-N 2.89Å
168I97.4Very high95.8Very high0 Ų054.1 Ų54.10%028%0.283CS..Hα-helixtrans-66.7-31.2174.4-159.361.3000111.7L149 A152 A164 E165 R170 A171 S172 Y187 C190 Y191 V194L149-I168 HydrophobicContact CD2-CD1 3.46Å; L149-I168 VanDerWaalsContact CD2-CD1 3.46Å; A152-I168 HydrophobicContact CB-CB 4.24Å; A152-I168 HydrophobicContact CB-CD1 4.46Å; A164-I168 WeakPolarHBondContact O-CB 3.42Å; A164-I168 WeakPolarHBondContact O-CG2 3.42Å; A164-I168 PolarHBondContact O-N 3.18Å; E165-I168 WeakPolarHBondContact O-CG2 3.24Å; I168-R170 VanDerWaalsContact C-N 3.31Å; I168-R170 PolarHBondContact O-N 2.96Å; I168-A171 HydrophobicContact CD1-CB 4.24Å; I168-A171 WeakPolarHBondContact O-CB 3.41Å; I168-A171 PolarHBondContact O-N 3.32Å; I168-S172 PolarHBondContact O-N 3.27Å; I168-Y187 HydrophobicContact CD1-CD2 3.65Å; I168-Y187 HydrophobicContact CD1-CE2 3.84Å; I168-Y187 HydrophobicContact CG1-CD2 4.34Å; I168-Y187 HydrophobicContact CG1-CE2 4.02Å; I168-C190 HydrophobicContact CD1-CB 3.98Å; I168-Y191 HydrophobicContact CB-CD2 4.37Å; I168-Y191 HydrophobicContact CG1-CD2 3.67Å; I168-Y191 HydrophobicContact CG1-CG 4.19Å; I168-Y191 HydrophobicContact CG2-CD2 3.7Å; I168-Y191 HydrophobicContact CG2-CE2 4.05Å; I168-V194 HydrophobicContact CB-CG2 4.35Å; I168-V194 HydrophobicContact CG2-CB 4.34Å; I168-V194 HydrophobicContact CG2-CG1 4.13Å; I168-V194 HydrophobicContact CG2-CG2 4.11Å
169N96.4Very high95.7Very high70 Ų7057.3 Ų57.337%0.37431%0.309SS..Hα-helixtrans-65.5-34.1173.1-73.4-22.4000111.8E165 Y167 S172E165-N169 WeakPolarHBondContact O-CB 3.35Å; E165-N169 PolarHBondContact O-N 2.89Å; E165-N169 VanDerWaalsContact O-N 3.16Å; E165-N169 PolarHBondContact O-ND2 3.04Å; Y167-N169 VanDerWaalsContact C-N 3.26Å; Y167-N169 PolarHBondContact O-N 3.32Å; N169-S172 WeakPolarHBondContact O-CB 3.29Å; N169-S172 PolarHBondContact O-N 3.43Å; N169-S172 PolarHBondContact O-OG 3.42Å
170R96.8Very high95.7Very high124 Ų12454.5 Ų54.547%0.46829%0.294SS..Hα-helixtrans-67.2-43171.8-64.1-177.8-177.4-179.12.7111.2Y148 Y167 I168 S172 L173Y148-R170 HydrophobicContact CD1-CB 4.29Å; Y148-R170 HydrophobicContact CD2-CB 4.16Å; Y148-R170 HydrophobicContact CE1-CB 4.18Å; Y148-R170 HydrophobicContact CE2-CB 4.05Å; Y148-R170 HydrophobicContact CG-CB 4.29Å; Y167-R170 WeakPolarHBondContact O-CB 3.4Å; Y167-R170 PolarHBondContact O-N 3.15Å; Y167-R170 VanDerWaalsContact O-N 3.13Å; I168-R170 VanDerWaalsContact C-N 3.31Å; I168-R170 PolarHBondContact O-N 2.96Å; R170-S172 VanDerWaalsContact C-N 3.26Å; R170-S172 PolarHBondContact O-N 2.72Å; R170-L173 PolarHBondContact O-N 3.31Å
171A96.4Very high95.4Very high0 Ų058.5 Ų58.50%031%0.312CS..Hα-helixtrans-59.9-33.4174.100000113.2L145 L149 Y167 I168 L173 L174 Q175 Y187L145-A171 HydrophobicContact CD1-CB 3.65Å; L149-A171 HydrophobicContact CD2-CB 4.13Å; Y167-A171 PolarHBondContact O-N 2.89Å; I168-A171 HydrophobicContact CD1-CB 4.24Å; I168-A171 WeakPolarHBondContact O-CB 3.41Å; I168-A171 PolarHBondContact O-N 3.32Å; A171-L173 PolarHBondContact O-N 2.95Å; A171-L174 PolarHBondContact O-N 3.3Å; A171-Q175 PolarHBondContact O-N 3.25Å; A171-Q175 VanDerWaalsContact O-N 3.07Å; A171-Y187 HydrophobicContact CB-CD2 3.9Å; A171-Y187 HydrophobicContact CB-CE2 4.11Å
172S95.3Very high95.2Very high38 Ų3863.3 Ų63.327%0.26633%0.332SS..Hα-helixtrans-60.6-28.2179.480.20000113.9I168 N169 R170 L174 Y187I168-S172 PolarHBondContact O-N 3.27Å; N169-S172 WeakPolarHBondContact O-CB 3.29Å; N169-S172 PolarHBondContact O-N 3.43Å; N169-S172 PolarHBondContact O-OG 3.42Å; R170-S172 VanDerWaalsContact C-N 3.26Å; R170-S172 PolarHBondContact O-N 2.72Å; S172-L174 VanDerWaalsContact C-N 3.29Å; S172-Y187 WeakPolarHBondContact CA-OH 3.44Å; S172-Y187 WeakPolarHBondContact CB-OH 3.46Å
173L95.1Very high95Very high131 Ų13160.3 Ų60.369%0.68631%0.313SS*.Hα-helixtrans-72.7-25.7178.2-58.1175.9000111.7R170 A171R170-L173 PolarHBondContact O-N 3.31Å; A171-L173 PolarHBondContact O-N 2.95Å
174L94.9Very high94.8Very high15 Ų1559.1 Ų59.18%0.07931%0.308CS..Hα-helixtrans-102.1-25.4-172.1-61177.2000113.4V141 K144 Y148 A171 S172 N176 E177 S178V141-L174 HydrophobicContact CG1-CB 4.1Å; K144-L174 HydrophobicContact CB-CD1 3.7Å; Y148-L174 HydrophobicContact CD2-CD1 3.94Å; Y148-L174 HydrophobicContact CE2-CD1 3.82Å; A171-L174 PolarHBondContact O-N 3.3Å; S172-L174 VanDerWaalsContact C-N 3.29Å; L174-N176 VanDerWaalsContact C-N 3.29Å; L174-N176 PolarHBondContact O-N 2.69Å; L174-E177 WeakPolarHBondContact O-CB 3.41Å; L174-E177 PolarHBondContact O-N 2.91Å; L174-S178 PolarHBondContact O-N 3.23Å
175Q93.1Very high94.6Very high22 Ų2260.4 Ų60.410%0.10331%0.314CS..THydrogen-bonded Turntrans-60.8-32.1-169.168.786.933.700114.5L145 A171 E177 Q184 Y187L145-Q175 HydrophobicContact CD1-CB 4.39Å; L145-Q175 HydrophobicContact CD2-CB 4.34Å; A171-Q175 PolarHBondContact O-N 3.25Å; A171-Q175 VanDerWaalsContact O-N 3.07Å; Q175-E177 VanDerWaalsContact C-N 3.31Å; Q175-Q184 WeakPolarHBondContact O-CG 3.25Å; Q175-Q184 PolarHBondContact O-NE2 2.86Å; Q175-Y187 HydrophobicContact CB-CD1 3.85Å; Q175-Y187 HydrophobicContact CB-CD2 4.36Å; Q175-Y187 HydrophobicContact CB-CE1 4.2Å; Q175-Y187 HydrophobicContact CB-CG 3.96Å; Q175-Y187 HydrophobicContact CG-CD1 3.77Å; Q175-Y187 HydrophobicContact CG-CE1 3.61Å; Q175-Y187 HydrophobicContact CG-CE2 4.46Å; Q175-Y187 HydrophobicContact CG-CG 4.29Å
176N92.3Very high94.3Very high130 Ų13062.3 Ų62.370%0.69532%0.323SS*.THydrogen-bonded Turntrans-74.4-21.5176.4-76.7-37.3000113.1L174L174-N176 VanDerWaalsContact C-N 3.29Å; L174-N176 PolarHBondContact O-N 2.69Å
177E94.4Very high94.2Very high133 Ų13361 Ų6162%0.62131%0.309SS*.THydrogen-bonded Turntrans-86.7-22.8-179.2-61.9178.2-173.600112V141 L174 Q175V141-E177 HydrophobicContact CG1-CB 4.02Å; V141-E177 HydrophobicContact CG2-CB 4.43Å; L174-E177 WeakPolarHBondContact O-CB 3.41Å; L174-E177 PolarHBondContact O-N 2.91Å; Q175-E177 VanDerWaalsContact C-N 3.31Å
178S94.1Very high94Very high5 Ų563.2 Ų63.24%0.03532%0.319CS..  trans-67.5131.4174.8162.40000110.8D142 L174 N180 Q184D142-S178 WeakPolarHBondContact OD1-CB 3.27Å; D142-S178 PolarHBondContact OD1-OG 2.98Å; L174-S178 PolarHBondContact O-N 3.23Å; S178-N180 VanDerWaalsContact C-N 3.31Å; S178-N180 PolarHBondContact OG-N 3.28Å; S178-N180 VanDerWaalsContact OG-N 3.09Å; S178-N180 PolarHBondContact OG-O 2.82Å; S178-Q184 PolarHBondContact O-NE2 3.07Å
179S93.1Very high93.9Very high112 Ų11265.8 Ų65.878%0.78333%0.334SS*.  trans-83.4-7.7169.354.60000113.2E181S179-E181 PolarHBondContact O-N 2.9Å
180N93.9Very high93.9Very high66 Ų6662.6 Ų62.635%0.35332%0.317SS..  trans-83.1101.8-179.3-173.6-26.5000111S178 Q182 L183 Q184S178-N180 VanDerWaalsContact C-N 3.31Å; S178-N180 PolarHBondContact OG-N 3.28Å; S178-N180 VanDerWaalsContact OG-N 3.09Å; S178-N180 PolarHBondContact OG-O 2.82Å; N180-Q182 VanDerWaalsContact C-N 3.31Å; N180-Q182 PolarHBondContact O-N 3.07Å; N180-Q182 WeakPolarHBondContact OD1-CB 3.47Å; N180-Q182 PolarHBondContact OD1-N 3.02Å; N180-Q182 VanDerWaalsContact OD1-N 3.11Å; N180-L183 HydrophobicContact CB-CB 3.92Å; N180-L183 PolarHBondContact O-N 3.18Å; N180-L183 PolarHBondContact OD1-N 3.29Å; N180-Q184 WeakPolarHBondContact O-CG 3.1Å; N180-Q184 PolarHBondContact O-N 3.22Å; N180-Q184 VanDerWaalsContact O-N 3.11Å
181E90.7Very high93.9Very high118 Ų11859.3 Ų59.355%0.55131%0.305SS*.Hα-helixtrans-62-36.9-179.5-64.3-171.9174.100112.9S179 L183 Q184 I185 I216S179-E181 PolarHBondContact O-N 2.9Å; E181-L183 VanDerWaalsContact C-N 3.33Å; E181-L183 PolarHBondContact O-N 2.95Å; E181-Q184 WeakPolarHBondContact O-CB 3.42Å; E181-Q184 PolarHBondContact O-N 3.19Å; E181-I185 VanDerWaalsContact O-CG1 3.31Å; E181-I185 WeakPolarHBondContact O-CG1 3.39Å; E181-I185 PolarHBondContact O-N 3.15Å; E181-I216 HydrophobicContact CB-CD1 3.93Å; E181-I216 WeakPolarHBondContact OE2-CD1 2.93Å
182Q91.1Very high93.9Very high126 Ų12659.3 Ų59.359%0.58931%0.305SS*.Hα-helixtrans-64.8-40.5178.7-173.8168.26.100111.1N180 I185 H186N180-Q182 VanDerWaalsContact C-N 3.31Å; N180-Q182 PolarHBondContact O-N 3.07Å; N180-Q182 WeakPolarHBondContact OD1-CB 3.47Å; N180-Q182 PolarHBondContact OD1-N 3.02Å; N180-Q182 VanDerWaalsContact OD1-N 3.11Å; Q182-I185 PolarHBondContact O-N 3.31Å; Q182-H186 PolarHBondContact O-CD2 2.89Å; Q182-H186 PolarHBondContact O-N 2.99Å
183L92.8Very high94Very high11 Ų1160.5 Ų60.56%0.05830%0.304CS..Hα-helixtrans-66.7-37.2176.3-166.460.1000112D142 L145 D146 L149 N180 E181 I185 H186 Y187D142-L183 HydrophobicContact CB-CD2 4.03Å; D142-L183 WeakPolarHBondContact O-CD2 3.49Å; L145-L183 HydrophobicContact CB-CD2 3.95Å; L145-L183 HydrophobicContact CD2-CD2 3.65Å; L145-L183 HydrophobicContact CD2-CG 3.69Å; L145-L183 HydrophobicContact CG-CD2 3.79Å; L145-L183 HydrophobicContact CG-CG 3.85Å; D146-L183 HydrophobicContact CB-CD1 4.12Å; D146-L183 HydrophobicContact CB-CD2 4.47Å; L149-L183 HydrophobicContact CD1-CD1 3.66Å; L149-L183 HydrophobicContact CD1-CG 4.25Å; N180-L183 HydrophobicContact CB-CB 3.92Å; N180-L183 PolarHBondContact O-N 3.18Å; N180-L183 PolarHBondContact OD1-N 3.29Å; E181-L183 VanDerWaalsContact C-N 3.33Å; E181-L183 PolarHBondContact O-N 2.95Å; L183-I185 PolarHBondContact O-N 3.22Å; L183-H186 PolarHBondContact O-N 3.37Å; L183-Y187 PolarHBondContact O-N 2.5Å
184Q92.6Very high94.1Very high47 Ų4754.3 Ų54.322%0.2227%0.271CS..Hα-helixtrans-63.5-38.6172.6-68.4177.8-200112.6Q175 S178 N180 E181 Y187 K188Q175-Q184 WeakPolarHBondContact O-CG 3.25Å; Q175-Q184 PolarHBondContact O-NE2 2.86Å; S178-Q184 PolarHBondContact O-NE2 3.07Å; N180-Q184 WeakPolarHBondContact O-CG 3.1Å; N180-Q184 PolarHBondContact O-N 3.22Å; N180-Q184 VanDerWaalsContact O-N 3.11Å; E181-Q184 WeakPolarHBondContact O-CB 3.42Å; E181-Q184 PolarHBondContact O-N 3.19Å; Q184-Y187 WeakPolarHBondContact O-CB 3.47Å; Q184-Y187 PolarHBondContact O-N 2.76Å; Q184-K188 WeakPolarHBondContact O-CG 3.26Å; Q184-K188 PolarHBondContact O-N 3.24Å
185I92.4Very high94.2Very high27 Ų2754 Ų5414%0.13827%0.27CS..Hα-helixtrans-65.1-47.2174.3-66161.3000110E181 Q182 L183 Y187 K188 V189 L211 I216 V217E181-I185 VanDerWaalsContact O-CG1 3.31Å; E181-I185 WeakPolarHBondContact O-CG1 3.39Å; E181-I185 PolarHBondContact O-N 3.15Å; Q182-I185 PolarHBondContact O-N 3.31Å; L183-I185 PolarHBondContact O-N 3.22Å; I185-Y187 PolarHBondContact O-N 2.9Å; I185-K188 PolarHBondContact O-N 3.06Å; I185-V189 HydrophobicContact CG2-CG2 4.34Å; I185-V189 WeakPolarHBondContact O-CG2 3.44Å; I185-V189 PolarHBondContact O-N 3.5Å; I185-L211 HydrophobicContact CG2-CD2 4.42Å; I185-I216 HydrophobicContact CD1-CB 4.24Å; I185-I216 HydrophobicContact CD1-CD1 4.08Å; I185-I216 HydrophobicContact CD1-CG1 3.9Å; I185-I216 HydrophobicContact CD1-CG2 3.4Å; I185-I216 VanDerWaalsContact CD1-CG2 3.4Å; I185-I216 HydrophobicContact CG1-CG2 4.33Å; I185-V217 HydrophobicContact CD1-CG2 4.11Å; I185-V217 HydrophobicContact CG1-CG2 4.42Å; I185-V217 HydrophobicContact CG2-CG2 3.76Å
186H92.6Very high94.4Very high67 Ų6753 Ų5331%0.3127%0.265SS..Hα-helixtrans-57.5-37.8176.4-79-39.6000112.7L149 R153 Q182 L183 C190L149-H186 HydrophobicContact CD1-CB 4.17Å; R153-H186 VanDerWaalsContact NH2-CB 3.26Å; R153-H186 VanDerWaalsContact NH2-CG 3.33Å; R153-H186 PolarHBondContact NH2-ND1 3.38Å; Q182-H186 PolarHBondContact O-CD2 2.89Å; Q182-H186 PolarHBondContact O-N 2.99Å; L183-H186 PolarHBondContact O-N 3.37Å; H186-C190 VanDerWaalsContact O-CB 3.3Å; H186-C190 WeakPolarHBondContact O-CB 3.49Å; H186-C190 PolarHBondContact O-N 3.02Å
187Y95.4Very high94.6Very high18 Ų1848.3 Ų48.37%0.07124%0.239CC..Hα-helixtrans-60.3-51170162.8-96.6000111.8L149 I168 A171 S172 Q175 L183 Q184 I185 V189 C190 Y191L149-Y187 HydrophobicContact CD2-CD2 3.9Å; L149-Y187 HydrophobicContact CD2-CG 4.36Å; I168-Y187 HydrophobicContact CD1-CD2 3.65Å; I168-Y187 HydrophobicContact CD1-CE2 3.84Å; I168-Y187 HydrophobicContact CG1-CD2 4.34Å; I168-Y187 HydrophobicContact CG1-CE2 4.02Å; A171-Y187 HydrophobicContact CB-CD2 3.9Å; A171-Y187 HydrophobicContact CB-CE2 4.11Å; S172-Y187 WeakPolarHBondContact CA-OH 3.44Å; S172-Y187 WeakPolarHBondContact CB-OH 3.46Å; Q175-Y187 HydrophobicContact CB-CD1 3.85Å; Q175-Y187 HydrophobicContact CB-CD2 4.36Å; Q175-Y187 HydrophobicContact CB-CE1 4.2Å; Q175-Y187 HydrophobicContact CB-CG 3.96Å; Q175-Y187 HydrophobicContact CG-CD1 3.77Å; Q175-Y187 HydrophobicContact CG-CE1 3.61Å; Q175-Y187 HydrophobicContact CG-CE2 4.46Å; Q175-Y187 HydrophobicContact CG-CG 4.29Å; L183-Y187 PolarHBondContact O-N 2.5Å; Q184-Y187 WeakPolarHBondContact O-CB 3.47Å; Q184-Y187 PolarHBondContact O-N 2.76Å; I185-Y187 PolarHBondContact O-N 2.9Å; Y187-V189 VanDerWaalsContact C-N 3.34Å; Y187-V189 PolarHBondContact O-N 3.46Å; Y187-C190 PolarHBondContact O-N 3.05Å; Y187-Y191 WeakPolarHBondContact O-CB 3.38Å; Y187-Y191 PolarHBondContact O-N 3.29Å
188K93.8Very high94.6Very high67 Ų6746.4 Ų46.429%0.29123%0.226SC..Hα-helixtrans-61-42-178.7-72.9178.2-175.7-1780112.4Q184 I185 Y191 A192 L211Q184-K188 WeakPolarHBondContact O-CG 3.26Å; Q184-K188 PolarHBondContact O-N 3.24Å; I185-K188 PolarHBondContact O-N 3.06Å; K188-Y191 PolarHBondContact O-N 3.14Å; K188-A192 WeakPolarHBondContact O-CB 3.24Å; K188-A192 PolarHBondContact O-N 3.42Å; K188-L211 HydrophobicContact CB-CD1 4.25Å; K188-L211 HydrophobicContact CB-CD2 3.68Å; K188-L211 HydrophobicContact CB-CG 4.17Å; K188-L211 HydrophobicContact CD-CD2 4.39Å
189V94.9Very high94.5Very high55 Ų5552.7 Ų52.733%0.33325%0.249SC..Hα-helixtrans-61.9-48.2175.3173.50000110.4I185 Y187 Y191 A192 R193 L211I185-V189 HydrophobicContact CG2-CG2 4.34Å; I185-V189 WeakPolarHBondContact O-CG2 3.44Å; I185-V189 PolarHBondContact O-N 3.5Å; Y187-V189 VanDerWaalsContact C-N 3.34Å; Y187-V189 PolarHBondContact O-N 3.46Å; V189-Y191 VanDerWaalsContact C-N 3.34Å; V189-Y191 PolarHBondContact O-N 3.49Å; V189-A192 PolarHBondContact O-N 3.45Å; V189-R193 WeakPolarHBondContact O-CG 3.45Å; V189-R193 PolarHBondContact O-N 3.25Å; V189-L211 HydrophobicContact CB-CD1 4.47Å; V189-L211 HydrophobicContact CG2-CD1 3.87Å; V189-L211 HydrophobicContact CG2-CD2 4.16Å
190C96Very high94.6Very high2 Ų250.9 Ų50.91%0.01423%0.227CC..Hα-helixtrans-62.3-42.3179.1-171.80000111.7L149 I168 H186 Y187 R193 V194L149-C190 HydrophobicContact CD2-CB 4.27Å; I168-C190 HydrophobicContact CD1-CB 3.98Å; H186-C190 VanDerWaalsContact O-CB 3.3Å; H186-C190 WeakPolarHBondContact O-CB 3.49Å; H186-C190 PolarHBondContact O-N 3.02Å; Y187-C190 PolarHBondContact O-N 3.05Å; C190-R193 WeakPolarHBondContact O-CB 3.41Å; C190-R193 PolarHBondContact O-N 3.48Å; C190-V194 WeakPolarHBondContact O-CG2 3.37Å; C190-V194 PolarHBondContact O-N 3.17Å
191Y96.8Very high94.8Very high55 Ų5548.4 Ų48.422%0.21621%0.213CC..Hα-helixtrans-65.1-41.4178.4-168.5-133.4000112.5I168 Y187 K188 V189 R193 V194 L195I168-Y191 HydrophobicContact CB-CD2 4.37Å; I168-Y191 HydrophobicContact CG1-CD2 3.67Å; I168-Y191 HydrophobicContact CG1-CG 4.19Å; I168-Y191 HydrophobicContact CG2-CD2 3.7Å; I168-Y191 HydrophobicContact CG2-CE2 4.05Å; Y187-Y191 WeakPolarHBondContact O-CB 3.38Å; Y187-Y191 PolarHBondContact O-N 3.29Å; K188-Y191 PolarHBondContact O-N 3.14Å; V189-Y191 VanDerWaalsContact C-N 3.34Å; V189-Y191 PolarHBondContact O-N 3.49Å; Y191-R193 VanDerWaalsContact C-N 3.33Å; Y191-R193 PolarHBondContact O-N 2.74Å; Y191-V194 PolarHBondContact O-N 2.94Å; Y191-L195 HydrophobicContact CD1-CD1 4.31Å; Y191-L195 HydrophobicContact CE1-CD1 4.17Å; Y191-L195 WeakPolarHBondContact O-CG 3.28Å; Y191-L195 PolarHBondContact O-N 3.34Å
192A97.1Very high95Very high0 Ų043.8 Ų43.80%019%0.192CC..Hα-helixtrans-61.3-41.3173.400000112K188 V189 L195 D196 R207 Y208 L211K188-A192 WeakPolarHBondContact O-CB 3.24Å; K188-A192 PolarHBondContact O-N 3.42Å; V189-A192 PolarHBondContact O-N 3.45Å; A192-L195 PolarHBondContact O-N 2.95Å; A192-D196 PolarHBondContact O-N 3.49Å; A192-R207 HydrophobicContact CB-CB 3.81Å; A192-Y208 HydrophobicContact CB-CD1 3.67Å; A192-Y208 HydrophobicContact CB-CD2 4.05Å; A192-Y208 HydrophobicContact CB-CE1 3.48Å; A192-Y208 VanDerWaalsContact CB-CE1 3.48Å; A192-Y208 HydrophobicContact CB-CE2 3.89Å; A192-Y208 HydrophobicContact CB-CG 3.94Å; A192-L211 HydrophobicContact CB-CD1 4.43Å
193R97.1Very high95.3Very high64 Ų6441.6 Ų41.624%0.24218%0.182CC..Hα-helixtrans-61.3-46.2173.6-72.7-179.865.1-168.5-2.4112L156 E157 V189 C190 Y191 L195 D196 F197 Y208L156-R193 HydrophobicContact CD1-CB 3.77Å; E157-R193 IonicContact OE1-CZ 3.3Å; E157-R193 IonicContact OE1-NH1 3.96Å; E157-R193 PolarHBondContact OE1-NH1 3.07Å; E157-R193 IonicContact OE1-NH2 2.76Å; E157-R193 PolarHBondContact OE1-NH2 3.08Å; V189-R193 WeakPolarHBondContact O-CG 3.45Å; V189-R193 PolarHBondContact O-N 3.25Å; C190-R193 WeakPolarHBondContact O-CB 3.41Å; C190-R193 PolarHBondContact O-N 3.48Å; Y191-R193 VanDerWaalsContact C-N 3.33Å; Y191-R193 PolarHBondContact O-N 2.74Å; R193-L195 VanDerWaalsContact C-N 3.33Å; R193-L195 PolarHBondContact O-N 2.75Å; R193-D196 PolarHBondContact O-N 3.33Å; R193-F197 VanDerWaalsContact O-CD2 3.28Å; R193-F197 WeakPolarHBondContact O-CD2 3.39Å; R193-F197 PolarHBondContact O-N 2.92Å; R193-Y208 VanDerWaalsContact CA-OH 3.27Å; R193-Y208 WeakPolarHBondContact CA-OH 3.36Å; R193-Y208 VanDerWaalsContact CG-OH 3.26Å; R193-Y208 WeakPolarHBondContact CG-OH 3.35Å; R193-Y208 PolarHBondContact N-OH 2.95Å
194V97.4Very high95.6Very high0 Ų041 Ų410%018%0.179CC..Hα-helixtrans-58.1-46.6177171.40000111L156 A164 E165 I168 C190 Y191 D196 F197 R198L156-V194 HydrophobicContact CD1-CG2 3.89Å; L156-V194 HydrophobicContact CD2-CG2 4.17Å; L156-V194 HydrophobicContact CG-CG2 4.25Å; A164-V194 HydrophobicContact CB-CG2 3.91Å; E165-V194 HydrophobicContact CB-CG1 3.71Å; E165-V194 HydrophobicContact CG-CG1 4.2Å; I168-V194 HydrophobicContact CB-CG2 4.35Å; I168-V194 HydrophobicContact CG2-CB 4.34Å; I168-V194 HydrophobicContact CG2-CG1 4.13Å; I168-V194 HydrophobicContact CG2-CG2 4.11Å; C190-V194 WeakPolarHBondContact O-CG2 3.37Å; C190-V194 PolarHBondContact O-N 3.17Å; Y191-V194 PolarHBondContact O-N 2.94Å; V194-D196 VanDerWaalsContact C-N 3.33Å; V194-D196 PolarHBondContact O-N 2.96Å; V194-F197 PolarHBondContact O-N 3.24Å; V194-R198 HydrophobicContact CG1-CG 4.16Å; V194-R198 WeakPolarHBondContact O-CB 3.4Å; V194-R198 WeakPolarHBondContact O-CG 3.45Å; V194-R198 PolarHBondContact O-N 3.38Å
195L97.4Very high95.8Very high8 Ų838.8 Ų38.84%0.04217%0.168CC..Hα-helixtrans-60.3-42.3178.6-68.4169.9000112.1Y191 A192 R193 R198 R199 K200 E203 A204 R207Y191-L195 HydrophobicContact CD1-CD1 4.31Å; Y191-L195 HydrophobicContact CE1-CD1 4.17Å; Y191-L195 WeakPolarHBondContact O-CG 3.28Å; Y191-L195 PolarHBondContact O-N 3.34Å; A192-L195 PolarHBondContact O-N 2.95Å; R193-L195 VanDerWaalsContact C-N 3.33Å; R193-L195 PolarHBondContact O-N 2.75Å; L195-R198 CarbonylContact O-C 3.56Å; L195-R198 PolarHBondContact O-N 2.73Å; L195-R199 PolarHBondContact O-N 2.92Å; L195-K200 HydrophobicContact CB-CB 4.29Å; L195-K200 HydrophobicContact CD2-CB 4.06Å; L195-K200 HydrophobicContact CD2-CD 3.69Å; L195-K200 PolarHBondContact O-N 3.24Å; L195-E203 HydrophobicContact CD1-CB 4.07Å; L195-E203 HydrophobicContact CD2-CB 4.39Å; L195-A204 HydrophobicContact CB-CB 3.76Å; L195-R207 HydrophobicContact CD1-CG 4.04Å
196D96.9Very high96.1Very high1 Ų140.8 Ų40.81%0.00518%0.177CC..Hα-helixtrans-61.8-48.6176.5-179.226.1000111.7A192 R193 V194 R198 R199 F201 A204 Y208 M286 H288 Q289A192-D196 PolarHBondContact O-N 3.49Å; R193-D196 PolarHBondContact O-N 3.33Å; V194-D196 VanDerWaalsContact C-N 3.33Å; V194-D196 PolarHBondContact O-N 2.96Å; D196-R198 VanDerWaalsContact C-N 3.27Å; D196-R198 PolarHBondContact O-N 2.7Å; D196-R199 WeakPolarHBondContact O-CA 3.44Å; D196-R199 PolarHBondContact O-N 2.89Å; D196-F201 WeakPolarHBondContact OD1-CE1 3.36Å; D196-A204 HydrophobicContact CB-CB 4.03Å; D196-Y208 HydrophobicContact CB-CE2 4.22Å; D196-M286 VanDerWaalsContact OD2-CE 3.3Å; D196-M286 WeakPolarHBondContact OD2-CE 3.3Å; D196-H288 IonicContact OD1-NE2 2.74Å; D196-H288 IonicContact OD2-CE1 2.98Å; D196-H288 IonicContact OD2-NE2 2.57Å; D196-H288 PolarHBondContact OD2-NE2 3.44Å; D196-Q289 PolarHBondContact OD1-NE2 2.73Å; D196-Q289 PolarHBondContact OD2-NE2 3.25Å
197F95.3Very high96.3Very high33 Ų3342.2 Ų42.215%0.14518%0.18CC..Hα-helixtrans-63.7-31.9175.3-84.7-111.1000113.1L156 P161 R193 V194 R199 H288L156-F197 HydrophobicContact CD2-CB 3.94Å; L156-F197 HydrophobicContact CD2-CD1 4.04Å; L156-F197 HydrophobicContact CD2-CD2 4.03Å; L156-F197 HydrophobicContact CD2-CG 3.75Å; P161-F197 HydrophobicContact CB-CB 3.66Å; P161-F197 HydrophobicContact CG-CB 4.36Å; R193-F197 VanDerWaalsContact O-CD2 3.28Å; R193-F197 WeakPolarHBondContact O-CD2 3.39Å; R193-F197 PolarHBondContact O-N 2.92Å; V194-F197 PolarHBondContact O-N 3.24Å; F197-R199 PolarHBondContact O-N 3.01Å; F197-H288 HydrophobicContact CD1-CB 4.02Å; F197-H288 AromaticContact CD1-CG 3.99Å; F197-H288 AromaticContact CD2-CD2 3.73Å; F197-H288 AromaticContact CD2-CE1 3.77Å; F197-H288 AromaticContact CD2-NE2 3.53Å; F197-H288 HydrophobicContact CE1-CB 3.95Å; F197-H288 AromaticContact CE1-CG 3.89Å; F197-H288 AromaticContact CE1-ND1 3.99Å; F197-H288 AromaticContact CE2-CE1 3.35Å; F197-H288 WeakPolarHBondContact CE2-CE1 3.22Å; F197-H288 AromaticContact CE2-CG 3.98Å; F197-H288 AromaticContact CE2-ND1 3.64Å; F197-H288 AromaticContact CE2-NE2 3.64Å; F197-H288 AromaticContact CG-CD2 3.83Å; F197-H288 HydrophobicContact CZ-CB 4.4Å; F197-H288 AromaticContact CZ-CE1 3.76Å; F197-H288 AromaticContact CZ-CG 3.89Å; F197-H288 AromaticContact CZ-ND1 3.55Å
198R94.4Very high96.4Very high93 Ų9341.8 Ų41.835%0.35118%0.178SC..THydrogen-bonded Turntrans-77.72.3173.8-65.7-68.6-78154.6-7.9113.1P161 E165 V194 L195 D196 K200P161-R198 HydrophobicContact CB-CG 4.08Å; E165-R198 IonicContact OE2-CZ 2.77Å; E165-R198 VanDerWaalsContact OE2-CZ 3.3Å; E165-R198 IonicContact OE2-NE 2.7Å; E165-R198 PolarHBondContact OE2-NE 3.42Å; E165-R198 IonicContact OE2-NH2 3.31Å; E165-R198 PolarHBondContact OE2-NH2 3.38Å; V194-R198 HydrophobicContact CG1-CG 4.16Å; V194-R198 WeakPolarHBondContact O-CB 3.4Å; V194-R198 WeakPolarHBondContact O-CG 3.45Å; V194-R198 PolarHBondContact O-N 3.38Å; L195-R198 CarbonylContact O-C 3.56Å; L195-R198 PolarHBondContact O-N 2.73Å; D196-R198 VanDerWaalsContact C-N 3.27Å; D196-R198 PolarHBondContact O-N 2.7Å; R198-K200 HydrophobicContact CB-CD 4.41Å; R198-K200 HydrophobicContact CB-CG 4.33Å; R198-K200 PolarHBondContact O-N 3.04Å
199R93.6Very high96.6Very high136 Ų13639.3 Ų39.351%0.51317%0.168SC..THydrogen-bonded Turntrans62.220.3-179-50.6172.6-173.9174.81.2113.2L195 D196 F197 F201 A291 I299L195-R199 PolarHBondContact O-N 2.92Å; D196-R199 WeakPolarHBondContact O-CA 3.44Å; D196-R199 PolarHBondContact O-N 2.89Å; F197-R199 PolarHBondContact O-N 3.01Å; R199-F201 HydrophobicContact CB-CD2 4.39Å; R199-F201 HydrophobicContact CB-CE2 3.78Å; R199-F201 HydrophobicContact CB-CZ 3.98Å; R199-F201 HydrophobicContact CG-CE2 4.31Å; R199-F201 HydrophobicContact CG-CZ 4.11Å; R199-F201 WeakPolarHBondContact O-CD2 3.45Å; R199-F201 PolarHBondContact O-N 2.9Å; R199-A291 VanDerWaalsContact NH2-CB 3.3Å; R199-I299 HydrophobicContact CG-CD1 4.14Å
200K95.5Very high96.6Very high74 Ų7440.9 Ų40.932%0.32217%0.172SC..  trans-83.261.8170.6-66.7177.9179.31740108.5E165 L195 R198 I202 E203 A204E165-K200 IonicContact OE1-NZ 2.7Å; E165-K200 PolarHBondContact OE1-NZ 3.37Å; L195-K200 HydrophobicContact CB-CB 4.29Å; L195-K200 HydrophobicContact CD2-CB 4.06Å; L195-K200 HydrophobicContact CD2-CD 3.69Å; L195-K200 PolarHBondContact O-N 3.24Å; R198-K200 HydrophobicContact CB-CD 4.41Å; R198-K200 HydrophobicContact CB-CG 4.33Å; R198-K200 PolarHBondContact O-N 3.04Å; K200-I202 PolarHBondContact O-N 3.04Å; K200-E203 WeakPolarHBondContact CA-OE2 3.26Å; K200-E203 HydrophobicContact CB-CB 4.44Å; K200-E203 WeakPolarHBondContact CB-OE2 3.46Å; K200-E203 PolarHBondContact O-N 3.02Å; K200-A204 WeakPolarHBondContact O-CB 3.47Å; K200-A204 PolarHBondContact O-N 3.41Å
201F96.2Very high96.6Very high14 Ų1441.1 Ų41.16%0.06117%0.173CC..Hα-helixtrans-66-36.9-163.8-67.1-62000113.4D196 R199 A204 A205 C232 L235 A236 I299D196-F201 WeakPolarHBondContact OD1-CE1 3.36Å; R199-F201 HydrophobicContact CB-CD2 4.39Å; R199-F201 HydrophobicContact CB-CE2 3.78Å; R199-F201 HydrophobicContact CB-CZ 3.98Å; R199-F201 HydrophobicContact CG-CE2 4.31Å; R199-F201 HydrophobicContact CG-CZ 4.11Å; R199-F201 WeakPolarHBondContact O-CD2 3.45Å; R199-F201 PolarHBondContact O-N 2.9Å; F201-A204 PolarHBondContact O-N 3.29Å; F201-A205 VanDerWaalsContact O-CB 3.28Å; F201-A205 WeakPolarHBondContact O-CB 3.27Å; F201-A205 PolarHBondContact O-N 3.24Å; F201-C232 HydrophobicContact CB-CB 4.35Å; F201-C232 WeakPolarHBondContact CB-O 3.29Å; F201-C232 HydrophobicContact CD1-CB 4.46Å; F201-C232 WeakPolarHBondContact O-CB 3.3Å; F201-L235 HydrophobicContact CD1-CB 4.09Å; F201-L235 HydrophobicContact CD1-CD1 4.33Å; F201-L235 HydrophobicContact CD2-CB 4.08Å; F201-L235 HydrophobicContact CE1-CB 4.22Å; F201-L235 HydrophobicContact CE1-CD1 3.94Å; F201-L235 HydrophobicContact CE2-CB 4.22Å; F201-L235 HydrophobicContact CG-CB 4.03Å; F201-L235 HydrophobicContact CZ-CB 4.29Å; F201-L235 HydrophobicContact CZ-CD1 4.32Å; F201-A236 HydrophobicContact CB-CB 3.95Å; F201-I299 HydrophobicContact CE2-CD1 4.35Å; F201-I299 HydrophobicContact CE2-CG2 3.57Å; F201-I299 HydrophobicContact CZ-CD1 4.15Å; F201-I299 HydrophobicContact CZ-CG2 3.98Å
202I96.3Very high96.6Very high22 Ų2238.5 Ų38.511%0.11316%0.162CC..Hα-helixtrans-71.6-37.1-178.8-168.959.8000111.3K200 A205 Q206 A236 Q241 R242 M245K200-I202 PolarHBondContact O-N 3.04Å; I202-A205 PolarHBondContact O-N 3.29Å; I202-Q206 WeakPolarHBondContact O-CG 3.4Å; I202-Q206 PolarHBondContact O-N 3.47Å; I202-Q206 VanDerWaalsContact O-N 3.1Å; I202-A236 HydrophobicContact CB-CB 4.18Å; I202-Q241 HydrophobicContact CD1-CB 4.38Å; I202-Q241 HydrophobicContact CG1-CB 3.87Å; I202-R242 HydrophobicContact CD1-CB 4.46Å; I202-M245 HydrophobicContact CD1-CB 4.03Å
203E97.3Very high96.5Very high79 Ų7943.8 Ų43.837%0.36918%0.183SC..Hα-helixtrans-67.8-42.3173.8-5894145.300111L195 K200 A205 Q206 R207L195-E203 HydrophobicContact CD1-CB 4.07Å; L195-E203 HydrophobicContact CD2-CB 4.39Å; K200-E203 WeakPolarHBondContact CA-OE2 3.26Å; K200-E203 HydrophobicContact CB-CB 4.44Å; K200-E203 WeakPolarHBondContact CB-OE2 3.46Å; K200-E203 PolarHBondContact O-N 3.02Å; E203-A205 VanDerWaalsContact C-N 3.35Å; E203-A205 PolarHBondContact O-N 3.36Å; E203-Q206 PolarHBondContact O-N 3.45Å; E203-R207 WeakPolarHBondContact O-CG 3.45Å; E203-R207 PolarHBondContact O-N 3.36Å
204A98Very high96.3Very high0 Ų045 Ų450%019%0.19CC..Hα-helixtrans-59.2-46.2172.900000111.3L195 D196 K200 F201 Q206 R207 Y208 C232L195-A204 HydrophobicContact CB-CB 3.76Å; D196-A204 HydrophobicContact CB-CB 4.03Å; K200-A204 WeakPolarHBondContact O-CB 3.47Å; K200-A204 PolarHBondContact O-N 3.41Å; F201-A204 PolarHBondContact O-N 3.29Å; A204-Q206 VanDerWaalsContact C-N 3.33Å; A204-Q206 PolarHBondContact O-N 3.25Å; A204-R207 PolarHBondContact O-N 2.98Å; A204-R207 VanDerWaalsContact O-N 3.15Å; A204-Y208 HydrophobicContact CB-CD2 4.3Å; A204-Y208 HydrophobicContact CB-CE2 4.24Å; A204-Y208 WeakPolarHBondContact O-CD2 3.45Å; A204-Y208 PolarHBondContact O-N 3.02Å; A204-C232 HydrophobicContact CB-CB 4.43Å
205A98.2Very high96Very high0 Ų050.3 Ų50.30%023%0.227CC..Hα-helixtrans-58.7-42.7179.300000112.5F201 I202 E203 Y208 N209 C232 T233 M245F201-A205 VanDerWaalsContact O-CB 3.28Å; F201-A205 WeakPolarHBondContact O-CB 3.27Å; F201-A205 PolarHBondContact O-N 3.24Å; I202-A205 PolarHBondContact O-N 3.29Å; E203-A205 VanDerWaalsContact C-N 3.35Å; E203-A205 PolarHBondContact O-N 3.36Å; A205-Y208 PolarHBondContact O-N 3.02Å; A205-N209 VanDerWaalsContact O-CB 3.22Å; A205-N209 WeakPolarHBondContact O-CB 3.46Å; A205-N209 PolarHBondContact O-N 3.39Å; A205-C232 HydrophobicContact CB-CB 3.85Å; A205-T233 WeakPolarHBondContact CB-OG1 3.37Å; A205-M245 HydrophobicContact CB-CG 4.38Å
206Q97.6Very high95.7Very high68 Ų6854.2 Ų54.232%0.31825%0.247SC..Hα-helixtrans-59.6-47.3175.3-71.7169.13.600111.5I202 E203 A204 N209 E210 M245I202-Q206 WeakPolarHBondContact O-CG 3.4Å; I202-Q206 PolarHBondContact O-N 3.47Å; I202-Q206 VanDerWaalsContact O-N 3.1Å; E203-Q206 PolarHBondContact O-N 3.45Å; A204-Q206 VanDerWaalsContact C-N 3.33Å; A204-Q206 PolarHBondContact O-N 3.25Å; Q206-N209 PolarHBondContact O-N 3.3Å; Q206-E210 WeakPolarHBondContact O-CB 3.44Å; Q206-E210 VanDerWaalsContact O-CG 3.3Å; Q206-E210 WeakPolarHBondContact O-CG 3.37Å; Q206-E210 PolarHBondContact O-N 3.41Å; Q206-M245 HydrophobicContact CB-CE 4.17Å; Q206-M245 HydrophobicContact CG-CE 3.48Å; Q206-M245 VanDerWaalsContact CG-CE 3.48Å
207R96.7Very high95.4Very high98 Ų9854.9 Ų54.937%0.3725%0.251SS..Hα-helixtrans-66.7-41.8-179.7-62.8-56.2178.2-153-4.2112.8A192 L195 E203 A204 E210 L211A192-R207 HydrophobicContact CB-CB 3.81Å; L195-R207 HydrophobicContact CD1-CG 4.04Å; E203-R207 WeakPolarHBondContact O-CG 3.45Å; E203-R207 PolarHBondContact O-N 3.36Å; A204-R207 PolarHBondContact O-N 2.98Å; A204-R207 VanDerWaalsContact O-N 3.15Å; R207-E210 IonicContact CZ-OE2 2.69Å; R207-E210 IonicContact NH1-OE1 2.89Å; R207-E210 PolarHBondContact NH1-OE1 3.19Å; R207-E210 VanDerWaalsContact NH1-OE1 3.16Å; R207-E210 IonicContact NH1-OE2 3.44Å; R207-E210 PolarHBondContact NH1-OE2 3.02Å; R207-E210 PolarHBondContact O-N 3.45Å; R207-L211 WeakPolarHBondContact O-CB 3.4Å; R207-L211 WeakPolarHBondContact O-CG 3.38Å; R207-L211 PolarHBondContact O-N 2.82Å
208Y98.3Very high95.3Very high8 Ų859.3 Ų59.33%0.03127%0.272CS..Hα-helixtrans-64.8-39.7174.4-77.1-54.2000112.4A192 R193 D196 A204 A205 L211 S212 A225 H228A192-Y208 HydrophobicContact CB-CD1 3.67Å; A192-Y208 HydrophobicContact CB-CD2 4.05Å; A192-Y208 HydrophobicContact CB-CE1 3.48Å; A192-Y208 VanDerWaalsContact CB-CE1 3.48Å; A192-Y208 HydrophobicContact CB-CE2 3.89Å; A192-Y208 HydrophobicContact CB-CG 3.94Å; R193-Y208 VanDerWaalsContact CA-OH 3.27Å; R193-Y208 WeakPolarHBondContact CA-OH 3.36Å; R193-Y208 VanDerWaalsContact CG-OH 3.26Å; R193-Y208 WeakPolarHBondContact CG-OH 3.35Å; R193-Y208 PolarHBondContact N-OH 2.95Å; D196-Y208 HydrophobicContact CB-CE2 4.22Å; A204-Y208 HydrophobicContact CB-CD2 4.3Å; A204-Y208 HydrophobicContact CB-CE2 4.24Å; A204-Y208 WeakPolarHBondContact O-CD2 3.45Å; A204-Y208 PolarHBondContact O-N 3.02Å; A205-Y208 PolarHBondContact O-N 3.02Å; Y208-L211 HydrophobicContact CD1-CD1 4.38Å; Y208-L211 WeakPolarHBondContact O-CB 3.5Å; Y208-L211 PolarHBondContact O-N 3.04Å; Y208-S212 PolarHBondContact O-N 3.33Å; Y208-S212 VanDerWaalsContact O-N 3.09Å; Y208-A225 WeakPolarHBondContact CB-O 3.42Å; Y208-H228 HydrophobicContact CD1-CB 3.78Å; Y208-H228 HydrophobicContact CD2-CB 3.7Å; Y208-H228 HydrophobicContact CE1-CB 3.9Å; Y208-H228 HydrophobicContact CE2-CB 3.81Å; Y208-H228 HydrophobicContact CG-CB 3.69Å
209N98.1Very high95.2Very high15 Ų1561.8 Ų61.88%0.0829%0.288CS..Hα-helixtrans-65-45.8176.1178.4-108.8000111.4A205 Q206 L211 S212 Y213 A229 M245A205-N209 VanDerWaalsContact O-CB 3.22Å; A205-N209 WeakPolarHBondContact O-CB 3.46Å; A205-N209 PolarHBondContact O-N 3.39Å; Q206-N209 PolarHBondContact O-N 3.3Å; N209-L211 VanDerWaalsContact C-N 3.3Å; N209-L211 PolarHBondContact O-N 3.2Å; N209-S212 WeakPolarHBondContact O-CB 3.36Å; N209-S212 PolarHBondContact O-N 3.16Å; N209-S212 VanDerWaalsContact O-N 3.09Å; N209-S212 PolarHBondContact O-OG 3.26Å; N209-Y213 PolarHBondContact ND2-OH 3.42Å; N209-Y213 WeakPolarHBondContact O-CD2 3.47Å; N209-Y213 WeakPolarHBondContact O-CE2 3.47Å; N209-Y213 WeakPolarHBondContact OD1-CE2 3.46Å; N209-A229 HydrophobicContact CB-CB 4Å; N209-M245 HydrophobicContact CB-CE 4.49Å; N209-M245 HydrophobicContact CB-SD 4.26Å
210E95.6Very high95.2Very high88 Ų8858.7 Ų58.741%0.41129%0.287SS..Hα-helixtrans-56.6-41.9173.7-74.7171.4-177.300112.4Q206 R207 S212 Y213Q206-E210 WeakPolarHBondContact O-CB 3.44Å; Q206-E210 VanDerWaalsContact O-CG 3.3Å; Q206-E210 WeakPolarHBondContact O-CG 3.37Å; Q206-E210 PolarHBondContact O-N 3.41Å; R207-E210 IonicContact CZ-OE2 2.69Å; R207-E210 IonicContact NH1-OE1 2.89Å; R207-E210 PolarHBondContact NH1-OE1 3.19Å; R207-E210 VanDerWaalsContact NH1-OE1 3.16Å; R207-E210 IonicContact NH1-OE2 3.44Å; R207-E210 PolarHBondContact NH1-OE2 3.02Å; R207-E210 PolarHBondContact O-N 3.45Å; E210-S212 VanDerWaalsContact C-N 3.32Å; E210-S212 PolarHBondContact O-N 2.82Å; E210-Y213 PolarHBondContact O-N 2.89Å
211L95.3Very high95.1Very high7 Ų760.9 Ų60.94%0.03730%0.299CS..Hα-helixtrans-61.9-38175.9-81.7167.1000112.4I185 K188 V189 A192 R207 Y208 N209 Y213 K214 A225I185-L211 HydrophobicContact CG2-CD2 4.42Å; K188-L211 HydrophobicContact CB-CD1 4.25Å; K188-L211 HydrophobicContact CB-CD2 3.68Å; K188-L211 HydrophobicContact CB-CG 4.17Å; K188-L211 HydrophobicContact CD-CD2 4.39Å; V189-L211 HydrophobicContact CB-CD1 4.47Å; V189-L211 HydrophobicContact CG2-CD1 3.87Å; V189-L211 HydrophobicContact CG2-CD2 4.16Å; A192-L211 HydrophobicContact CB-CD1 4.43Å; R207-L211 WeakPolarHBondContact O-CB 3.4Å; R207-L211 WeakPolarHBondContact O-CG 3.38Å; R207-L211 PolarHBondContact O-N 2.82Å; Y208-L211 HydrophobicContact CD1-CD1 4.38Å; Y208-L211 WeakPolarHBondContact O-CB 3.5Å; Y208-L211 PolarHBondContact O-N 3.04Å; N209-L211 VanDerWaalsContact C-N 3.3Å; N209-L211 PolarHBondContact O-N 3.2Å; L211-Y213 PolarHBondContact O-N 2.94Å; L211-Y213 VanDerWaalsContact O-N 3.1Å; L211-K214 WeakPolarHBondContact O-CB 3.49Å; L211-K214 PolarHBondContact O-N 3.5Å; L211-K214 VanDerWaalsContact O-N 3.08Å; L211-A225 HydrophobicContact CB-CB 4.19Å
212S96.9Very high95.1Very high0 Ų063.4 Ų63.40%031%0.307CS..Hα-helixtrans-62.4-19.1-179.283.70000114.1Y208 N209 E210 R222 R254Y208-S212 PolarHBondContact O-N 3.33Å; Y208-S212 VanDerWaalsContact O-N 3.09Å; N209-S212 WeakPolarHBondContact O-CB 3.36Å; N209-S212 PolarHBondContact O-N 3.16Å; N209-S212 VanDerWaalsContact O-N 3.09Å; N209-S212 PolarHBondContact O-OG 3.26Å; E210-S212 VanDerWaalsContact C-N 3.32Å; E210-S212 PolarHBondContact O-N 2.82Å; S212-R222 WeakPolarHBondContact CB-O 3.37Å; S212-R222 PolarHBondContact O-NE 3.11Å; S212-R254 PolarHBondContact O-NH1 3.11Å; S212-R254 PolarHBondContact OG-NH2 3.26Å
213Y94.5Very high95.1Very high111 Ų11164.8 Ų64.844%0.43532%0.315SS..THydrogen-bonded Turntrans-94.1-5.2179-61.9-60.7000113.7N209 E210 L211 S215 D252N209-Y213 PolarHBondContact ND2-OH 3.42Å; N209-Y213 WeakPolarHBondContact O-CD2 3.47Å; N209-Y213 WeakPolarHBondContact O-CE2 3.47Å; N209-Y213 WeakPolarHBondContact OD1-CE2 3.46Å; E210-Y213 PolarHBondContact O-N 2.89Å; L211-Y213 PolarHBondContact O-N 2.94Å; L211-Y213 VanDerWaalsContact O-N 3.1Å; Y213-S215 PolarHBondContact O-N 3.26Å; Y213-D252 PolarHBondContact OH-OD2 3.46Å
214K92.6Very high95.1Very high90 Ų9064.7 Ų64.739%0.39131%0.314SS..  trans-77.8109.5-178.9-66.6-70.4176.9-178.70110.7L211 I216 V217 R222L211-K214 WeakPolarHBondContact O-CB 3.49Å; L211-K214 PolarHBondContact O-N 3.5Å; L211-K214 VanDerWaalsContact O-N 3.08Å; K214-I216 HydrophobicContact CB-CG2 4.22Å; K214-I216 PolarHBondContact O-N 3.46Å; K214-V217 HydrophobicContact CB-CB 4.49Å; K214-V217 HydrophobicContact CB-CG2 3.84Å; K214-V217 WeakPolarHBondContact O-CB 3.06Å; K214-V217 PolarHBondContact O-N 3.06Å; K214-R222 WeakPolarHBondContact O-CD 3.34Å
215S90.9Very high95.1Very high111 Ų11165.2 Ų65.278%0.77632%0.319SS*.THydrogen-bonded Turntrans-63.6-25-178.151.70000114.7Y213 V217Y213-S215 PolarHBondContact O-N 3.26Å; S215-V217 PolarHBondContact O-N 3.44Å
216I90.8Very high95.1Very high91 Ų9165.2 Ų65.247%0.46732%0.319SS..THydrogen-bonded Turntrans-68.3-21.1173.8-177.6162.2000112.8E181 I185 K214E181-I216 HydrophobicContact CB-CD1 3.93Å; E181-I216 WeakPolarHBondContact OE2-CD1 2.93Å; I185-I216 HydrophobicContact CD1-CB 4.24Å; I185-I216 HydrophobicContact CD1-CD1 4.08Å; I185-I216 HydrophobicContact CD1-CG1 3.9Å; I185-I216 HydrophobicContact CD1-CG2 3.4Å; I185-I216 VanDerWaalsContact CD1-CG2 3.4Å; I185-I216 HydrophobicContact CG1-CG2 4.33Å; K214-I216 HydrophobicContact CB-CG2 4.22Å; K214-I216 PolarHBondContact O-N 3.46Å
217V91.9Very high95.1Very high15 Ų1565.3 Ų65.39%0.09132%0.318CS..SBendtrans-83.6137.7174.8-1780000108.9I185 K214 S215 E221 R222I185-V217 HydrophobicContact CD1-CG2 4.11Å; I185-V217 HydrophobicContact CG1-CG2 4.42Å; I185-V217 HydrophobicContact CG2-CG2 3.76Å; K214-V217 HydrophobicContact CB-CB 4.49Å; K214-V217 HydrophobicContact CB-CG2 3.84Å; K214-V217 WeakPolarHBondContact O-CB 3.06Å; K214-V217 PolarHBondContact O-N 3.06Å; S215-V217 PolarHBondContact O-N 3.44Å; V217-E221 HydrophobicContact CG1-CB 3.55Å; V217-R222 HydrophobicContact CB-CG 3.82Å; V217-R222 HydrophobicContact CG1-CG 3.87Å; V217-R222 WeakPolarHBondContact O-CD 3.35Å
218H92.6Very high95.1Very high126 Ų12662.3 Ų62.358%0.58331%0.308SS*.  trans-60149.1-179.9-172.6-95.4000111.5S220 E221 R222H218-S220 VanDerWaalsContact C-N 3.32Å; H218-S220 PolarHBondContact ND1-N 3.11Å; H218-S220 PolarHBondContact ND1-OG 2.77Å; H218-S220 PolarHBondContact O-N 3.4Å; H218-E221 HydrophobicContact CB-CG 4.4Å; H218-E221 PolarHBondContact O-N 3.09Å; H218-E221 VanDerWaalsContact O-N 3.08Å; H218-R222 WeakPolarHBondContact O-CG 3.32Å; H218-R222 PolarHBondContact O-N 2.92Å
219E92.4Very high95.1Very high144 Ų14462 Ų6267%0.67331%0.307SS*.Hα-helixtrans-57.6-41.8-174-172.8176178.100113.1E221 R222 L223E219-E221 PolarHBondContact O-N 3.32Å; E219-R222 WeakPolarHBondContact O-CB 3.16Å; E219-R222 PolarHBondContact O-N 3.27Å; E219-L223 PolarHBondContact O-N 2.96Å
220S93.6Very high95.1Very high71 Ų7161.2 Ų61.250%0.49730%0.303SS..Hα-helixtrans-62.5-41176.260.80000112.7H218 L223 E224H218-S220 VanDerWaalsContact C-N 3.32Å; H218-S220 PolarHBondContact ND1-N 3.11Å; H218-S220 PolarHBondContact ND1-OG 2.77Å; H218-S220 PolarHBondContact O-N 3.4Å; S220-L223 PolarHBondContact O-N 3.04Å; S220-E224 PolarHBondContact O-N 3.11Å
221E93.9Very high95.2Very high121 Ų12157.3 Ų57.357%0.56529%0.285SS*.Hα-helixtrans-70.9-32.9178.1-66.3-173.1145.600111.6V217 H218 E219 L223 E224 A225V217-E221 HydrophobicContact CG1-CB 3.55Å; H218-E221 HydrophobicContact CB-CG 4.4Å; H218-E221 PolarHBondContact O-N 3.09Å; H218-E221 VanDerWaalsContact O-N 3.08Å; E219-E221 PolarHBondContact O-N 3.32Å; E221-L223 VanDerWaalsContact C-N 3.33Å; E221-E224 PolarHBondContact O-N 3.22Å; E221-A225 WeakPolarHBondContact O-CB 3.38Å; E221-A225 PolarHBondContact O-N 3.06Å
222R96.2Very high95.4Very high66 Ų6657 Ų5725%0.24928%0.283CS..Hα-helixtrans-64.6-38.9172.2-71.3167.859.2-154.9-3.9111.6S212 K214 V217 H218 E219 L226S212-R222 WeakPolarHBondContact CB-O 3.37Å; S212-R222 PolarHBondContact O-NE 3.11Å; K214-R222 WeakPolarHBondContact O-CD 3.34Å; V217-R222 HydrophobicContact CB-CG 3.82Å; V217-R222 HydrophobicContact CG1-CG 3.87Å; V217-R222 WeakPolarHBondContact O-CD 3.35Å; H218-R222 WeakPolarHBondContact O-CG 3.32Å; H218-R222 PolarHBondContact O-N 2.92Å; E219-R222 WeakPolarHBondContact O-CB 3.16Å; E219-R222 PolarHBondContact O-N 3.27Å; R222-L226 WeakPolarHBondContact O-CB 3.5Å; R222-L226 PolarHBondContact O-N 2.93Å
223L96.6Very high95.4Very high51 Ų5157 Ų5727%0.26728%0.283SS..Hα-helixtrans-69.6-39.5175.9-169.764.8000111.4E219 S220 E221 L226 K227 R254 L258E219-L223 PolarHBondContact O-N 2.96Å; S220-L223 PolarHBondContact O-N 3.04Å; E221-L223 VanDerWaalsContact C-N 3.33Å; L223-L226 HydrophobicContact CD1-CD2 4.44Å; L223-L226 WeakPolarHBondContact O-CB 3.17Å; L223-L226 PolarHBondContact O-N 2.99Å; L223-K227 PolarHBondContact O-N 3.02Å; L223-R254 HydrophobicContact CD1-CB 4.49Å; L223-L258 HydrophobicContact CD1-CD2 3.81Å; L223-L258 HydrophobicContact CD1-CG 4.47Å; L223-L258 HydrophobicContact CG-CD2 4Å
224E96.5Very high95.4Very high77 Ų7751.7 Ų51.736%0.3626%0.262SS..Hα-helixtrans-65.1-41.1174.1-167.262.3-150.500111.5S220 E221 L226 K227 H228S220-E224 PolarHBondContact O-N 3.11Å; E221-E224 PolarHBondContact O-N 3.22Å; E224-L226 VanDerWaalsContact C-N 3.33Å; E224-L226 PolarHBondContact O-N 2.68Å; E224-K227 WeakPolarHBondContact O-CB 3.48Å; E224-K227 PolarHBondContact O-N 2.84Å; E224-K227 IonicContact OE1-NZ 2.87Å; E224-K227 PolarHBondContact OE1-NZ 3.43Å; E224-K227 IonicContact OE2-NZ 2.96Å; E224-K227 PolarHBondContact OE2-NZ 3.37Å; E224-H228 PolarHBondContact O-CD2 2.88Å; E224-H228 PolarHBondContact O-N 3.36Å; E224-H228 IonicContact OE1-CE1 3.08Å; E224-H228 IonicContact OE1-NE2 3.07Å
225A97.3Very high95.5Very high11 Ų1147.5 Ų47.59%0.09124%0.244CC..Hα-helixtrans-60.1-42.7171.900000111.5Y208 L211 E221 K227 H228 A229Y208-A225 WeakPolarHBondContact CB-O 3.42Å; L211-A225 HydrophobicContact CB-CB 4.19Å; E221-A225 WeakPolarHBondContact O-CB 3.38Å; E221-A225 PolarHBondContact O-N 3.06Å; A225-K227 VanDerWaalsContact C-N 3.33Å; A225-K227 PolarHBondContact O-N 3.15Å; A225-H228 PolarHBondContact O-N 3.07Å; A225-A229 PolarHBondContact O-N 3.3Å
226L98.1Very high95.6Very high0 Ų042.4 Ų42.40%021%0.209CC..Hα-helixtrans-63-39.7176.1-172.463.1000112.1R222 L223 E224 A229 L230 L249 R254 L258R222-L226 WeakPolarHBondContact O-CB 3.5Å; R222-L226 PolarHBondContact O-N 2.93Å; L223-L226 HydrophobicContact CD1-CD2 4.44Å; L223-L226 WeakPolarHBondContact O-CB 3.17Å; L223-L226 PolarHBondContact O-N 2.99Å; E224-L226 VanDerWaalsContact C-N 3.33Å; E224-L226 PolarHBondContact O-N 2.68Å; L226-A229 WeakPolarHBondContact O-CB 3.34Å; L226-A229 PolarHBondContact O-N 2.9Å; L226-L230 PolarHBondContact O-N 3.38Å; L226-L249 HydrophobicContact CD1-CD2 3.6Å; L226-R254 HydrophobicContact CD2-CB 3.6Å; L226-L258 HydrophobicContact CG-CD1 4.31Å
227K97.9Very high95.4Very high70 Ų7042 Ų4230%0.30421%0.214SC..Hα-helixtrans-61.3-45173.2175.3-176.9158.6-147.10111.8L223 E224 A225 A229 L230 N231 L258L223-K227 PolarHBondContact O-N 3.02Å; E224-K227 WeakPolarHBondContact O-CB 3.48Å; E224-K227 PolarHBondContact O-N 2.84Å; E224-K227 IonicContact OE1-NZ 2.87Å; E224-K227 PolarHBondContact OE1-NZ 3.43Å; E224-K227 IonicContact OE2-NZ 2.96Å; E224-K227 PolarHBondContact OE2-NZ 3.37Å; A225-K227 VanDerWaalsContact C-N 3.33Å; A225-K227 PolarHBondContact O-N 3.15Å; K227-A229 VanDerWaalsContact C-N 3.33Å; K227-A229 PolarHBondContact O-N 3.37Å; K227-L230 PolarHBondContact O-N 3.14Å; K227-N231 PolarHBondContact O-N 3.5Å; K227-N231 PolarHBondContact O-OD1 3.43Å; K227-L258 HydrophobicContact CB-CD1 4.27Å; K227-L258 HydrophobicContact CB-CD2 4.02Å
228H97.9Very high95.1Very high36 Ų3641.7 Ų41.717%0.16721%0.213CC..Hα-helixtrans-62.1-40.2173.8-71.8-58.7000112.2Y208 E224 A225 L230 N231 C232Y208-H228 HydrophobicContact CD1-CB 3.78Å; Y208-H228 HydrophobicContact CD2-CB 3.7Å; Y208-H228 HydrophobicContact CE1-CB 3.9Å; Y208-H228 HydrophobicContact CE2-CB 3.81Å; Y208-H228 HydrophobicContact CG-CB 3.69Å; E224-H228 PolarHBondContact O-CD2 2.88Å; E224-H228 PolarHBondContact O-N 3.36Å; E224-H228 IonicContact OE1-CE1 3.08Å; E224-H228 IonicContact OE1-NE2 3.07Å; A225-H228 PolarHBondContact O-N 3.07Å; H228-L230 VanDerWaalsContact C-N 3.34Å; H228-L230 PolarHBondContact O-N 2.9Å; H228-N231 PolarHBondContact O-N 3.21Å; H228-C232 WeakPolarHBondContact O-CB 3.37Å; H228-C232 PolarHBondContact O-N 2.86Å; H228-C232 PolarHBondContact O-SG 3.45Å
229A98.4Very high94.7Very high0 Ų037.1 Ų37.10%020%0.2CC..Hα-helixtrans-60.3-44.7175.200000111.8N209 A225 L226 K227 T233 L249N209-A229 HydrophobicContact CB-CB 4Å; A225-A229 PolarHBondContact O-N 3.3Å; L226-A229 WeakPolarHBondContact O-CB 3.34Å; L226-A229 PolarHBondContact O-N 2.9Å; K227-A229 VanDerWaalsContact C-N 3.33Å; K227-A229 PolarHBondContact O-N 3.37Å; A229-T233 WeakPolarHBondContact O-CB 3.49Å; A229-T233 PolarHBondContact O-N 2.97Å; A229-T233 PolarHBondContact O-OG1 2.94Å; A229-L249 HydrophobicContact CB-CD2 4.43Å
230L98.2Very high94.4Very high0 Ų036.8 Ų36.80%020%0.199CC..Hα-helixtrans-62.6-49.5176.8175.755.9000111.7L226 K227 H228 C232 T233 I234 L249 L258 A260 L264L226-L230 PolarHBondContact O-N 3.38Å; K227-L230 PolarHBondContact O-N 3.14Å; H228-L230 VanDerWaalsContact C-N 3.34Å; H228-L230 PolarHBondContact O-N 2.9Å; L230-C232 PolarHBondContact O-N 3.35Å; L230-T233 PolarHBondContact O-N 3.25Å; L230-T233 VanDerWaalsContact O-N 3.14Å; L230-I234 HydrophobicContact CD1-CD1 3.71Å; L230-I234 HydrophobicContact CD1-CG1 4.06Å; L230-I234 HydrophobicContact CG-CD1 3.93Å; L230-I234 WeakPolarHBondContact O-CG1 3.37Å; L230-I234 PolarHBondContact O-N 2.77Å; L230-L249 HydrophobicContact CB-CD1 4.28Å; L230-L249 HydrophobicContact CD1-CD1 4.03Å; L230-L258 HydrophobicContact CD2-CB 4.41Å; L230-L258 HydrophobicContact CD2-CD1 3.87Å; L230-A260 HydrophobicContact CD2-CB 3.75Å; L230-A260 HydrophobicContact CG-CB 4.4Å; L230-L264 HydrophobicContact CD1-CB 3.83Å; L230-L264 HydrophobicContact CD1-CD1 3.81Å; L230-L264 HydrophobicContact CD1-CD2 4.07Å; L230-L264 HydrophobicContact CD1-CG 4.1Å
231N97.4Very high94.3Very high5 Ų538.6 Ų38.63%0.02720%0.199CC..Hα-helixtrans-59.9-46.4-180-71.2-2000111.5K227 H228 T233 I234 L235 F281 L285K227-N231 PolarHBondContact O-N 3.5Å; K227-N231 PolarHBondContact O-OD1 3.43Å; H228-N231 PolarHBondContact O-N 3.21Å; N231-T233 VanDerWaalsContact C-N 3.33Å; N231-T233 PolarHBondContact O-N 3.31Å; N231-I234 PolarHBondContact O-N 3Å; N231-L235 WeakPolarHBondContact O-CB 3.38Å; N231-L235 VanDerWaalsContact O-CG 3.29Å; N231-L235 WeakPolarHBondContact O-CG 3.29Å; N231-L235 PolarHBondContact O-N 3.25Å; N231-F281 HydrophobicContact CB-CZ 4.38Å; N231-F281 WeakPolarHBondContact OD1-CE2 3.42Å; N231-L285 HydrophobicContact CB-CD2 4.16Å
232C97.7Very high94.3Very high0 Ų033.3 Ų33.30%017%0.174CC..Hα-helixtrans-62.8-39.5176.2-65.90000111.7F201 A204 A205 H228 L230 I234 L235 A236F201-C232 HydrophobicContact CB-CB 4.35Å; F201-C232 WeakPolarHBondContact CB-O 3.29Å; F201-C232 HydrophobicContact CD1-CB 4.46Å; F201-C232 WeakPolarHBondContact O-CB 3.3Å; A204-C232 HydrophobicContact CB-CB 4.43Å; A205-C232 HydrophobicContact CB-CB 3.85Å; H228-C232 WeakPolarHBondContact O-CB 3.37Å; H228-C232 PolarHBondContact O-N 2.86Å; H228-C232 PolarHBondContact O-SG 3.45Å; L230-C232 PolarHBondContact O-N 3.35Å; C232-I234 VanDerWaalsContact C-N 3.34Å; C232-I234 PolarHBondContact O-N 2.86Å; C232-L235 PolarHBondContact O-N 3.02Å; C232-A236 WeakPolarHBondContact O-CB 3.22Å; C232-A236 PolarHBondContact O-N 3.37Å
233T97.5Very high94.1Very high0 Ų033 Ų330%018%0.182CC..Hα-helixtrans-63.6-40.7177.3-57.30000112A205 A229 L230 N231 A236 R242 M245 L246 L249A205-T233 WeakPolarHBondContact CB-OG1 3.37Å; A229-T233 WeakPolarHBondContact O-CB 3.49Å; A229-T233 PolarHBondContact O-N 2.97Å; A229-T233 PolarHBondContact O-OG1 2.94Å; L230-T233 PolarHBondContact O-N 3.25Å; L230-T233 VanDerWaalsContact O-N 3.14Å; N231-T233 VanDerWaalsContact C-N 3.33Å; N231-T233 PolarHBondContact O-N 3.31Å; T233-A236 PolarHBondContact O-N 3.05Å; T233-R242 HydrophobicContact CG2-CG 4.23Å; T233-R242 PolarHBondContact O-NE 2.87Å; T233-M245 HydrophobicContact CG2-CB 3.88Å; T233-M245 HydrophobicContact CG2-CG 3.73Å; T233-M245 WeakPolarHBondContact OG1-CG 3.3Å; T233-L246 HydrophobicContact CG2-CD2 3.71Å; T233-L246 HydrophobicContact CG2-CG 3.76Å; T233-L249 HydrophobicContact CG2-CD1 4.15Å; T233-L249 WeakPolarHBondContact OG1-CD1 3.35Å
234I95.1Very high94.1Very high0 Ų037.8 Ų37.80%020%0.197CC..Hα-helixtrans-63.9-44.3176.9-71167.7000110.5L230 N231 C232 R242 I263 M267 F281 L300L230-I234 HydrophobicContact CD1-CD1 3.71Å; L230-I234 HydrophobicContact CD1-CG1 4.06Å; L230-I234 HydrophobicContact CG-CD1 3.93Å; L230-I234 WeakPolarHBondContact O-CG1 3.37Å; L230-I234 PolarHBondContact O-N 2.77Å; N231-I234 PolarHBondContact O-N 3Å; C232-I234 VanDerWaalsContact C-N 3.34Å; C232-I234 PolarHBondContact O-N 2.86Å; I234-R242 PolarHBondContact O-NH2 3.5Å; I234-I263 HydrophobicContact CD1-CB 4.21Å; I234-I263 HydrophobicContact CD1-CG2 3.72Å; I234-I263 HydrophobicContact CG1-CG2 4.21Å; I234-I263 HydrophobicContact CG2-CG2 4.3Å; I234-M267 HydrophobicContact CB-SD 4.25Å; I234-M267 HydrophobicContact CG1-SD 3.93Å; I234-M267 HydrophobicContact CG2-CE 3.75Å; I234-M267 HydrophobicContact CG2-SD 3.91Å; I234-F281 HydrophobicContact CB-CE1 4.12Å; I234-F281 HydrophobicContact CB-CZ 3.78Å; I234-F281 HydrophobicContact CD1-CD2 4.25Å; I234-F281 HydrophobicContact CD1-CE1 4.43Å; I234-F281 HydrophobicContact CD1-CE2 3.47Å; I234-F281 VanDerWaalsContact CD1-CE2 3.47Å; I234-F281 HydrophobicContact CD1-CZ 3.58Å; I234-F281 HydrophobicContact CG1-CZ 4.28Å; I234-F281 HydrophobicContact CG2-CD1 4.13Å; I234-F281 HydrophobicContact CG2-CE1 3.41Å; I234-F281 VanDerWaalsContact CG2-CE1 3.41Å; I234-F281 HydrophobicContact CG2-CE2 4.4Å; I234-F281 HydrophobicContact CG2-CZ 3.57Å; I234-L300 HydrophobicContact CG2-CD1 4.28Å
235L94.5Very high94.1Very high3 Ų335 Ų352%0.01618%0.184CC..Hα-helixtrans-72.7-22.3179.5-69.4170.2000114.4F201 N231 C232 L285 Q289 I299 L300F201-L235 HydrophobicContact CD1-CB 4.09Å; F201-L235 HydrophobicContact CD1-CD1 4.33Å; F201-L235 HydrophobicContact CD2-CB 4.08Å; F201-L235 HydrophobicContact CE1-CB 4.22Å; F201-L235 HydrophobicContact CE1-CD1 3.94Å; F201-L235 HydrophobicContact CE2-CB 4.22Å; F201-L235 HydrophobicContact CG-CB 4.03Å; F201-L235 HydrophobicContact CZ-CB 4.29Å; F201-L235 HydrophobicContact CZ-CD1 4.32Å; N231-L235 WeakPolarHBondContact O-CB 3.38Å; N231-L235 VanDerWaalsContact O-CG 3.29Å; N231-L235 WeakPolarHBondContact O-CG 3.29Å; N231-L235 PolarHBondContact O-N 3.25Å; C232-L235 PolarHBondContact O-N 3.02Å; L235-L285 HydrophobicContact CD1-CD1 4.33Å; L235-L285 HydrophobicContact CD1-CD2 4.02Å; L235-L285 HydrophobicContact CD2-CD1 3.86Å; L235-L285 HydrophobicContact CG-CD1 4.5Å; L235-Q289 HydrophobicContact CD1-CB 3.85Å; L235-Q289 HydrophobicContact CD1-CG 4.04Å; L235-I299 HydrophobicContact CD2-CG2 4.27Å; L235-L300 HydrophobicContact CD2-CB 3.8Å; L235-L300 HydrophobicContact CD2-CD1 3.91Å; L235-L300 HydrophobicContact CD2-CG 4.43Å
236A93.1Very high94.1Very high4 Ų434.7 Ų34.73%0.03318%0.181CC..SBendtrans-62.4148.2177.900000111.6F201 I202 C232 T233 R242F201-A236 HydrophobicContact CB-CB 3.95Å; I202-A236 HydrophobicContact CB-CB 4.18Å; C232-A236 WeakPolarHBondContact O-CB 3.22Å; C232-A236 PolarHBondContact O-N 3.37Å; T233-A236 PolarHBondContact O-N 3.05Å; A236-R242 HydrophobicContact CB-CG 4.39Å; A236-R242 VanDerWaalsContact O-CD 3.22Å; A236-R242 WeakPolarHBondContact O-CD 3.42Å; A236-R242 PolarHBondContact O-NE 2.95Å; A236-R242 VanDerWaalsContact O-NE 3.08Å
237S87.1Confident94.1Very high83 Ų8335.6 Ų35.658%0.5819%0.189SC*.PPolyproline II helixtrans-62.5147177.3-49.90000111.8G239 R242S237-G239 PolarHBondContact O-N 2.91Å; S237-R242 VanDerWaalsContact O-CD 3.29Å; S237-R242 WeakPolarHBondContact O-CD 3.39Å
238A84.8Confident94.1Very high7 Ų735 Ų356%0.05819%0.191CC..SBendtrans-61.2131.9-179.900000111E306 R347A238-E306 HydrophobicContact CB-CB 4.32Å; A238-R347 WeakPolarHBondContact O-CD 3.29Å; A238-R347 PolarHBondContact O-NH1 3.45Å
239G83.8Confident94.1Very high31 Ų3133.3 Ų33.332%0.3218%0.183SC..SBendtrans169.1175.6-17900000113.4S237 Q241 R242 S243S237-G239 PolarHBondContact O-N 2.91Å; G239-Q241 PolarHBondContact O-N 3.11Å; G239-R242 PolarHBondContact O-N 3.4Å; G239-S243 PolarHBondContact O-N 2.91Å; G239-S243 PolarHBondContact O-OG 3.45Å
240Q86.3Confident94.1Very high137 Ų13735.7 Ų35.764%0.6419%0.193SC*.Hα-helixtrans-60-41.6-172.2-170.8-177.364.100113.5S243 R244Q240-S243 PolarHBondContact O-N 2.84Å; Q240-R244 WeakPolarHBondContact O-CG 3.28Å; Q240-R244 PolarHBondContact O-N 3.44Å
241Q91.3Very high94.1Very high109 Ų10943.3 Ų43.351%0.50923%0.227SC..Hα-helixtrans-63.9-42.8179.4-66.2-174.9-3.900111.6I202 G239 R244 M245I202-Q241 HydrophobicContact CD1-CB 4.38Å; I202-Q241 HydrophobicContact CG1-CB 3.87Å; G239-Q241 PolarHBondContact O-N 3.11Å; Q241-R244 PolarHBondContact O-N 3.4Å; Q241-M245 PolarHBondContact O-N 3.41Å
242R93.9Very high94.1Very high9 Ų944 Ų443%0.03423%0.23CC..Hα-helixtrans-61.4-47175-176.8-174.9-176.6-113.811.6111.4I202 T233 I234 A236 S237 G239 R244 M245 L246 M267 H307I202-R242 HydrophobicContact CD1-CB 4.46Å; T233-R242 HydrophobicContact CG2-CG 4.23Å; T233-R242 PolarHBondContact O-NE 2.87Å; I234-R242 PolarHBondContact O-NH2 3.5Å; A236-R242 HydrophobicContact CB-CG 4.39Å; A236-R242 VanDerWaalsContact O-CD 3.22Å; A236-R242 WeakPolarHBondContact O-CD 3.42Å; A236-R242 PolarHBondContact O-NE 2.95Å; A236-R242 VanDerWaalsContact O-NE 3.08Å; S237-R242 VanDerWaalsContact O-CD 3.29Å; S237-R242 WeakPolarHBondContact O-CD 3.39Å; G239-R242 PolarHBondContact O-N 3.4Å; R242-R244 VanDerWaalsContact C-N 3.29Å; R242-R244 PolarHBondContact O-N 3.08Å; R242-M245 PolarHBondContact O-N 3.15Å; R242-M245 VanDerWaalsContact O-N 3.12Å; R242-L246 HydrophobicContact CG-CD1 4.2Å; R242-L246 HydrophobicContact CG-CG 4.42Å; R242-L246 WeakPolarHBondContact O-CG 3.17Å; R242-L246 PolarHBondContact O-N 3.45Å; R242-M267 PolarHBondContact NH2-SD 3.37Å; R242-H307 PolarHBondContact NH1-ND1 3.45Å
243S92.4Very high94.1Very high61 Ų6151.1 Ų51.143%0.42726%0.263SS..Hα-helixtrans-59.4-39.3177.9-58.90000112.6G239 Q240 A247G239-S243 PolarHBondContact O-N 2.91Å; G239-S243 PolarHBondContact O-OG 3.45Å; Q240-S243 PolarHBondContact O-N 2.84Å; S243-A247 PolarHBondContact O-N 3.39Å
244R95.9Very high94.1Very high151 Ų15153.6 Ų53.657%0.5727%0.273SS*.Hα-helixtrans-64.1-44.5174.2-70.6177.8-172.2172.55.3111.6Q240 Q241 R242 A247 T248Q240-R244 WeakPolarHBondContact O-CG 3.28Å; Q240-R244 PolarHBondContact O-N 3.44Å; Q241-R244 PolarHBondContact O-N 3.4Å; R242-R244 VanDerWaalsContact C-N 3.29Å; R242-R244 PolarHBondContact O-N 3.08Å; R244-A247 WeakPolarHBondContact O-CB 3.36Å; R244-A247 PolarHBondContact O-N 3.5Å; R244-T248 PolarHBondContact O-N 3.17Å; R244-T248 PolarHBondContact O-OG1 3.1Å
245M98Very high94.3Very high17 Ų1753.6 Ų53.68%0.08427%0.273CS..Hα-helixtrans-65.7-41.1178.4-172.856.970.600112.2I202 A205 Q206 N209 T233 Q241 R242 A247 T248 L249I202-M245 HydrophobicContact CD1-CB 4.03Å; A205-M245 HydrophobicContact CB-CG 4.38Å; Q206-M245 HydrophobicContact CB-CE 4.17Å; Q206-M245 HydrophobicContact CG-CE 3.48Å; Q206-M245 VanDerWaalsContact CG-CE 3.48Å; N209-M245 HydrophobicContact CB-CE 4.49Å; N209-M245 HydrophobicContact CB-SD 4.26Å; T233-M245 HydrophobicContact CG2-CB 3.88Å; T233-M245 HydrophobicContact CG2-CG 3.73Å; T233-M245 WeakPolarHBondContact OG1-CG 3.3Å; Q241-M245 PolarHBondContact O-N 3.41Å; R242-M245 PolarHBondContact O-N 3.15Å; R242-M245 VanDerWaalsContact O-N 3.12Å; M245-A247 VanDerWaalsContact C-N 3.28Å; M245-A247 PolarHBondContact O-N 2.9Å; M245-T248 WeakPolarHBondContact O-CB 3.36Å; M245-T248 PolarHBondContact O-N 3.2Å; M245-T248 VanDerWaalsContact O-N 3.17Å; M245-L249 HydrophobicContact CG-CD1 4.1Å; M245-L249 HydrophobicContact CG-CG 4.41Å; M245-L249 WeakPolarHBondContact O-CG 3.47Å; M245-L249 PolarHBondContact O-N 3.5Å; M245-L249 HydrophobicContact SD-CG 4.28Å
246L97.7Very high94.4Very high5 Ų558.9 Ų58.93%0.02630%0.297CS..Hα-helixtrans-56.7-43.3171.9-72.8170.4000111.2T233 R242 L249 F250 L264 M267 Y268T233-L246 HydrophobicContact CG2-CD2 3.71Å; T233-L246 HydrophobicContact CG2-CG 3.76Å; R242-L246 HydrophobicContact CG-CD1 4.2Å; R242-L246 HydrophobicContact CG-CG 4.42Å; R242-L246 WeakPolarHBondContact O-CG 3.17Å; R242-L246 PolarHBondContact O-N 3.45Å; L246-L249 PolarHBondContact O-N 3.01Å; L246-F250 VanDerWaalsContact O-CB 3.22Å; L246-F250 WeakPolarHBondContact O-CB 3.37Å; L246-F250 PolarHBondContact O-N 3.37Å; L246-L264 HydrophobicContact CD2-CD1 3.67Å; L246-M267 HydrophobicContact CD1-CB 4.21Å; L246-M267 HydrophobicContact CD2-CB 4.2Å; L246-Y268 HydrophobicContact CB-CD2 4.36Å
247A97.5Very high94.5Very high20 Ų2065.3 Ų65.317%0.16533%0.327CS..Hα-helixtrans-64-40.9176.400000112.7S243 R244 M245 K251 Y268S243-A247 PolarHBondContact O-N 3.39Å; R244-A247 WeakPolarHBondContact O-CB 3.36Å; R244-A247 PolarHBondContact O-N 3.5Å; M245-A247 VanDerWaalsContact C-N 3.28Å; M245-A247 PolarHBondContact O-N 2.9Å; A247-K251 VanDerWaalsContact O-CG 3.29Å; A247-K251 WeakPolarHBondContact O-CG 3.43Å; A247-K251 PolarHBondContact O-N 2.92Å; A247-Y268 VanDerWaalsContact CA-CE2 3.46Å; A247-Y268 HydrophobicContact CB-CD2 4.16Å; A247-Y268 HydrophobicContact CB-CE2 3.53Å
248T98.3Very high94.9Very high57 Ų5762.2 Ų62.235%0.3530%0.303SS..Hα-helixtrans-60.8-50.2175.2-62.20000110.8R244 M245 K251 D252R244-T248 PolarHBondContact O-N 3.17Å; R244-T248 PolarHBondContact O-OG1 3.1Å; M245-T248 WeakPolarHBondContact O-CB 3.36Å; M245-T248 PolarHBondContact O-N 3.2Å; M245-T248 VanDerWaalsContact O-N 3.17Å; T248-K251 PolarHBondContact O-N 3.25Å; T248-D252 PolarHBondContact O-N 3.38Å
249L98.4Very high95.4Very high0 Ų065.9 Ų65.90%033%0.334CS..Hα-helixtrans-66.8-38.6-178.9-66.8171.8000112.1L226 A229 L230 T233 M245 L246 K251 D252 C255 L264L226-L249 HydrophobicContact CD1-CD2 3.6Å; A229-L249 HydrophobicContact CB-CD2 4.43Å; L230-L249 HydrophobicContact CB-CD1 4.28Å; L230-L249 HydrophobicContact CD1-CD1 4.03Å; T233-L249 HydrophobicContact CG2-CD1 4.15Å; T233-L249 WeakPolarHBondContact OG1-CD1 3.35Å; M245-L249 HydrophobicContact CG-CD1 4.1Å; M245-L249 HydrophobicContact CG-CG 4.41Å; M245-L249 WeakPolarHBondContact O-CG 3.47Å; M245-L249 PolarHBondContact O-N 3.5Å; M245-L249 HydrophobicContact SD-CG 4.28Å; L246-L249 PolarHBondContact O-N 3.01Å; L249-K251 VanDerWaalsContact C-N 3.29Å; L249-K251 PolarHBondContact O-N 2.98Å; L249-D252 WeakPolarHBondContact O-CB 3.35Å; L249-D252 PolarHBondContact O-N 3.48Å; L249-D252 VanDerWaalsContact O-N 3.11Å; L249-C255 PolarHBondContact O-SG 2.9Å; L249-L264 HydrophobicContact CB-CD1 3.99Å; L249-L264 HydrophobicContact CB-CD2 3.97Å
250F98.1Very high95.9Very high51 Ų5164.7 Ų64.722%0.22432%0.321CS..Hα-helixtrans-64.9-33.1179.3-176.7-103.7000112.8L246 D252 Y261 L264 E265 Y268L246-F250 VanDerWaalsContact O-CB 3.22Å; L246-F250 WeakPolarHBondContact O-CB 3.37Å; L246-F250 PolarHBondContact O-N 3.37Å; F250-D252 VanDerWaalsContact C-N 3.3Å; F250-Y261 HydrophobicContact CD2-CE2 4.46Å; F250-Y261 WeakPolarHBondContact CE2-OH 3.41Å; F250-L264 HydrophobicContact CB-CG 4.49Å; F250-E265 HydrophobicContact CE2-CB 4.04Å; F250-E265 HydrophobicContact CE2-CG 3.92Å; F250-Y268 HydrophobicContact CB-CD1 3.94Å; F250-Y268 HydrophobicContact CB-CD2 4.27Å; F250-Y268 HydrophobicContact CB-CE1 4.38Å; F250-Y268 HydrophobicContact CB-CG 3.86Å; F250-Y268 AromaticContact CD1-CD1 3.25Å; F250-Y268 HydrophobicContact CD1-CD1 3.25Å; F250-Y268 AromaticContact CD1-CE1 3.19Å; F250-Y268 HydrophobicContact CD1-CE1 3.19Å; F250-Y268 HydrophobicContact CD1-CG 4.07Å; F250-Y268 AromaticContact CD1-CZ 3.99Å; F250-Y268 AromaticContact CD2-CD1 3.87Å; F250-Y268 HydrophobicContact CD2-CD1 3.87Å; F250-Y268 HydrophobicContact CD2-CG 4.3Å; F250-Y268 AromaticContact CE1-CD1 3.62Å; F250-Y268 HydrophobicContact CE1-CD1 3.62Å; F250-Y268 AromaticContact CE1-CE1 3.51Å; F250-Y268 HydrophobicContact CE1-CE1 3.51Å; F250-Y268 HydrophobicContact CE2-CD1 4.21Å; F250-Y268 AromaticContact CG-CD1 3.38Å; F250-Y268 HydrophobicContact CG-CD1 3.38Å; F250-Y268 AromaticContact CG-CE1 3.83Å; F250-Y268 HydrophobicContact CG-CE1 3.83Å; F250-Y268 AromaticContact CG-CG 3.8Å; F250-Y268 HydrophobicContact CG-CG 3.8Å; F250-Y268 HydrophobicContact CZ-CD1 4.08Å; F250-Y268 HydrophobicContact CZ-CE1 4.36Å
251K97.9Very high96.4Very high160 Ų16060.6 Ų60.670%0.69630%0.3SS*.Hα-helixtrans-78-13.9175-68.7171.6-175.3178.10113.4A247 T248 L249 E253A247-K251 VanDerWaalsContact O-CG 3.29Å; A247-K251 WeakPolarHBondContact O-CG 3.43Å; A247-K251 PolarHBondContact O-N 2.92Å; T248-K251 PolarHBondContact O-N 3.25Å; L249-K251 VanDerWaalsContact C-N 3.29Å; L249-K251 PolarHBondContact O-N 2.98Å; K251-E253 PolarHBondContact O-N 2.9Å
252D98Very high96.6Very high18 Ų1857 Ų5710%0.09629%0.293CS..  trans-85.4106.4178.5-164.2-40.1000109.5Y213 T248 L249 F250 R254 C255Y213-D252 PolarHBondContact OH-OD2 3.46Å; T248-D252 PolarHBondContact O-N 3.38Å; L249-D252 WeakPolarHBondContact O-CB 3.35Å; L249-D252 PolarHBondContact O-N 3.48Å; L249-D252 VanDerWaalsContact O-N 3.11Å; F250-D252 VanDerWaalsContact C-N 3.3Å; D252-R254 PolarHBondContact O-N 3.31Å; D252-R254 VanDerWaalsContact O-N 3.09Å; D252-R254 VanDerWaalsContact OD1-CB 3.29Å; D252-R254 WeakPolarHBondContact OD1-CB 3.3Å; D252-R254 WeakPolarHBondContact OD1-CG 3.49Å; D252-R254 IonicContact OD1-CZ 3.67Å; D252-R254 PolarHBondContact OD1-N 2.93Å; D252-R254 IonicContact OD1-NE 3.8Å; D252-R254 PolarHBondContact OD1-NE 2.87Å; D252-R254 IonicContact OD1-NH2 2.75Å; D252-R254 IonicContact OD2-CZ 3.61Å; D252-R254 IonicContact OD2-NE 2.73Å; D252-R254 PolarHBondContact OD2-NE 3.48Å; D252-R254 IonicContact OD2-NH2 3.49Å; D252-R254 PolarHBondContact OD2-NH2 3.39Å; D252-C255 VanDerWaalsContact O-CB 3.31Å; D252-C255 WeakPolarHBondContact O-CB 3.13Å; D252-C255 PolarHBondContact O-N 3.04Å
253E97.3Very high96.7Very high151 Ų15157.3 Ų57.371%0.70630%0.295SS*.G310 helixtrans-57.5-26.7-176.7-66.2-176.9169.100113.1K251 C255 Q256K251-E253 PolarHBondContact O-N 2.9Å; E253-C255 PolarHBondContact O-N 3.27Å; E253-Q256 VanDerWaalsContact O-CB 3.29Å; E253-Q256 WeakPolarHBondContact O-CB 3.5Å; E253-Q256 WeakPolarHBondContact O-CG 3.27Å; E253-Q256 PolarHBondContact O-N 3.25Å
254R97.7Very high96.9Very high51 Ų5154.4 Ų54.419%0.19228%0.275CS..G310 helixtrans-62-26.9177.2-57.2176.1-63.7161.82.9111.9S212 L223 L226 D252 Q256 Q257S212-R254 PolarHBondContact O-NH1 3.11Å; S212-R254 PolarHBondContact OG-NH2 3.26Å; L223-R254 HydrophobicContact CD1-CB 4.49Å; L226-R254 HydrophobicContact CD2-CB 3.6Å; D252-R254 PolarHBondContact O-N 3.31Å; D252-R254 VanDerWaalsContact O-N 3.09Å; D252-R254 VanDerWaalsContact OD1-CB 3.29Å; D252-R254 WeakPolarHBondContact OD1-CB 3.3Å; D252-R254 WeakPolarHBondContact OD1-CG 3.49Å; D252-R254 IonicContact OD1-CZ 3.67Å; D252-R254 PolarHBondContact OD1-N 2.93Å; D252-R254 IonicContact OD1-NE 3.8Å; D252-R254 PolarHBondContact OD1-NE 2.87Å; D252-R254 IonicContact OD1-NH2 2.75Å; D252-R254 IonicContact OD2-CZ 3.61Å; D252-R254 IonicContact OD2-NE 2.73Å; D252-R254 PolarHBondContact OD2-NE 3.48Å; D252-R254 IonicContact OD2-NH2 3.49Å; D252-R254 PolarHBondContact OD2-NH2 3.39Å; R254-Q256 PolarHBondContact O-N 2.95Å; R254-Q257 WeakPolarHBondContact O-CB 3.31Å; R254-Q257 PolarHBondContact O-N 3.46Å
255C97.8Very high96.9Very high0 Ų050.3 Ų50.30%026%0.262CS..G310 helixtrans-62.8-24.3176.3-67.80000112.5L249 D252 E253 Q257 L258 Y261 L264L249-C255 PolarHBondContact O-SG 2.9Å; D252-C255 VanDerWaalsContact O-CB 3.31Å; D252-C255 WeakPolarHBondContact O-CB 3.13Å; D252-C255 PolarHBondContact O-N 3.04Å; E253-C255 PolarHBondContact O-N 3.27Å; C255-Q257 PolarHBondContact O-N 3.19Å; C255-L258 WeakPolarHBondContact O-CB 3.22Å; C255-L258 PolarHBondContact O-N 2.91Å; C255-Y261 HydrophobicContact CB-CD2 3.96Å; C255-Y261 HydrophobicContact CB-CE2 4.33Å; C255-Y261 WeakPolarHBondContact O-CB 3.16Å; C255-Y261 WeakPolarHBondContact O-CD2 3.39Å; C255-L264 HydrophobicContact CB-CD2 3.85Å
256Q96.8Very high96.8Very high115 Ų11552 Ų5254%0.53727%0.269SS..G310 helixtrans-64.3-20.9178.3-61.6174.118.800112.8E253 R254 L258 Y261E253-Q256 VanDerWaalsContact O-CB 3.29Å; E253-Q256 WeakPolarHBondContact O-CB 3.5Å; E253-Q256 WeakPolarHBondContact O-CG 3.27Å; E253-Q256 PolarHBondContact O-N 3.25Å; R254-Q256 PolarHBondContact O-N 2.95Å; Q256-L258 VanDerWaalsContact C-N 3.31Å; Q256-Y261 HydrophobicContact CG-CD2 4.25Å; Q256-Y261 HydrophobicContact CG-CE1 4.17Å; Q256-Y261 HydrophobicContact CG-CE2 3.78Å
257Q95.5Very high96.7Very high138 Ų13851.9 Ų51.965%0.64527%0.268SS*.G310 helixtrans-80.3-13.9176-56.9178.53.300112.6R254 C255R254-Q257 WeakPolarHBondContact O-CB 3.31Å; R254-Q257 PolarHBondContact O-N 3.46Å; C255-Q257 PolarHBondContact O-N 3.19Å
258L95.9Very high96.5Very high18 Ų1854.6 Ų54.69%0.09428%0.275CS..SBendtrans-86.9136.5-176.3-56.6179.6000110.6L223 L226 K227 L230 C255 Q256 A260 Y261L223-L258 HydrophobicContact CD1-CD2 3.81Å; L223-L258 HydrophobicContact CD1-CG 4.47Å; L223-L258 HydrophobicContact CG-CD2 4Å; L226-L258 HydrophobicContact CG-CD1 4.31Å; K227-L258 HydrophobicContact CB-CD1 4.27Å; K227-L258 HydrophobicContact CB-CD2 4.02Å; L230-L258 HydrophobicContact CD2-CB 4.41Å; L230-L258 HydrophobicContact CD2-CD1 3.87Å; C255-L258 WeakPolarHBondContact O-CB 3.22Å; C255-L258 PolarHBondContact O-N 2.91Å; Q256-L258 VanDerWaalsContact C-N 3.31Å; L258-A260 PolarHBondContact O-N 3.02Å; L258-A260 VanDerWaalsContact O-N 3.08Å; L258-Y261 VanDerWaalsContact O-CB 3.29Å; L258-Y261 WeakPolarHBondContact O-CB 3.3Å; L258-Y261 PolarHBondContact O-N 3.38Å
259A94.9Very high96.3Very high84 Ų8455.3 Ų55.369%0.69428%0.276SS*.THydrogen-bonded Turntrans-57.4-28.4177.700000113.2Y261 M284A259-Y261 VanDerWaalsContact C-N 3.29Å; A259-Y261 PolarHBondContact O-N 2.93Å; A259-M284 HydrophobicContact CB-CE 3.66Å; A259-M284 HydrophobicContact CB-SD 3.92Å
260A95.1Very high96Very high7 Ų758 Ų586%0.05829%0.291CS..THydrogen-bonded Turntrans-81.23.317800000114.5L230 L258 G262 I263 L264 F281L230-A260 HydrophobicContact CD2-CB 3.75Å; L230-A260 HydrophobicContact CG-CB 4.4Å; L258-A260 PolarHBondContact O-N 3.02Å; L258-A260 VanDerWaalsContact O-N 3.08Å; A260-G262 VanDerWaalsContact C-N 3.29Å; A260-G262 PolarHBondContact O-N 2.98Å; A260-I263 PolarHBondContact O-N 2.96Å; A260-I263 VanDerWaalsContact O-N 3.08Å; A260-L264 PolarHBondContact O-N 3.5Å; A260-L264 VanDerWaalsContact O-N 3.07Å; A260-F281 HydrophobicContact CB-CD2 3.91Å; A260-F281 HydrophobicContact CB-CE2 3.81Å
261Y96.7Very high95.7Very high50 Ų5061.2 Ų61.220%0.19630%0.301CS..Hα-helixtrans-58.1-38.5-179.4-174.8-106.3000113F250 C255 Q256 L258 A259 I263 L264 E265F250-Y261 HydrophobicContact CD2-CE2 4.46Å; F250-Y261 WeakPolarHBondContact CE2-OH 3.41Å; C255-Y261 HydrophobicContact CB-CD2 3.96Å; C255-Y261 HydrophobicContact CB-CE2 4.33Å; C255-Y261 WeakPolarHBondContact O-CB 3.16Å; C255-Y261 WeakPolarHBondContact O-CD2 3.39Å; Q256-Y261 HydrophobicContact CG-CD2 4.25Å; Q256-Y261 HydrophobicContact CG-CE1 4.17Å; Q256-Y261 HydrophobicContact CG-CE2 3.78Å; L258-Y261 VanDerWaalsContact O-CB 3.29Å; L258-Y261 WeakPolarHBondContact O-CB 3.3Å; L258-Y261 PolarHBondContact O-N 3.38Å; A259-Y261 VanDerWaalsContact C-N 3.29Å; A259-Y261 PolarHBondContact O-N 2.93Å; Y261-I263 PolarHBondContact O-N 3.23Å; Y261-L264 HydrophobicContact CD2-CD2 4.04Å; Y261-L264 HydrophobicContact CE2-CD2 4.26Å; Y261-L264 WeakPolarHBondContact O-CB 3.47Å; Y261-L264 PolarHBondContact O-N 2.92Å; Y261-L264 VanDerWaalsContact O-N 3.12Å; Y261-E265 PolarHBondContact O-N 3.2Å
262G95.5Very high95.5Very high35 Ų3554.7 Ų54.736%0.36127%0.274SS..Hα-helixtrans-62.3-32.3177.600000113.2A260 K266A260-G262 VanDerWaalsContact C-N 3.29Å; A260-G262 PolarHBondContact O-N 2.98Å; G262-K266 WeakPolarHBondContact O-CG 3.34Å; G262-K266 PolarHBondContact O-N 3.12Å
263I95.6Very high95.2Very high14 Ų1454.1 Ų54.17%0.07227%0.27CS..Hα-helixtrans-73.2-44173-60.6-63.2000110.2I234 A260 Y261 E265 K266 M267 I273 Q277 F281I234-I263 HydrophobicContact CD1-CB 4.21Å; I234-I263 HydrophobicContact CD1-CG2 3.72Å; I234-I263 HydrophobicContact CG1-CG2 4.21Å; I234-I263 HydrophobicContact CG2-CG2 4.3Å; A260-I263 PolarHBondContact O-N 2.96Å; A260-I263 VanDerWaalsContact O-N 3.08Å; Y261-I263 PolarHBondContact O-N 3.23Å; I263-E265 PolarHBondContact O-N 3.46Å; I263-K266 PolarHBondContact O-N 3.13Å; I263-M267 HydrophobicContact CG2-CE 3.86Å; I263-M267 HydrophobicContact CG2-CG 4.14Å; I263-M267 HydrophobicContact CG2-SD 3.95Å; I263-M267 WeakPolarHBondContact O-CB 3.17Å; I263-M267 WeakPolarHBondContact O-CG 3.28Å; I263-M267 PolarHBondContact O-N 3.18Å; I263-I273 HydrophobicContact CD1-CG2 4.07Å; I263-Q277 HydrophobicContact CD1-CB 3.74Å; I263-F281 HydrophobicContact CG1-CB 4.29Å; I263-F281 HydrophobicContact CG1-CD2 4.42Å
264L96.8Very high94.9Very high0 Ų051.7 Ų51.70%026%0.255CS..Hα-helixtrans-54.4-51.8175.7175.957.9000111.7L230 L246 L249 F250 C255 A260 Y261 K266 M267 Y268L230-L264 HydrophobicContact CD1-CB 3.83Å; L230-L264 HydrophobicContact CD1-CD1 3.81Å; L230-L264 HydrophobicContact CD1-CD2 4.07Å; L230-L264 HydrophobicContact CD1-CG 4.1Å; L246-L264 HydrophobicContact CD2-CD1 3.67Å; L249-L264 HydrophobicContact CB-CD1 3.99Å; L249-L264 HydrophobicContact CB-CD2 3.97Å; F250-L264 HydrophobicContact CB-CG 4.49Å; C255-L264 HydrophobicContact CB-CD2 3.85Å; A260-L264 PolarHBondContact O-N 3.5Å; A260-L264 VanDerWaalsContact O-N 3.07Å; Y261-L264 HydrophobicContact CD2-CD2 4.04Å; Y261-L264 HydrophobicContact CE2-CD2 4.26Å; Y261-L264 WeakPolarHBondContact O-CB 3.47Å; Y261-L264 PolarHBondContact O-N 2.92Å; Y261-L264 VanDerWaalsContact O-N 3.12Å; L264-K266 PolarHBondContact O-N 3.32Å; L264-M267 PolarHBondContact O-N 3.34Å; L264-Y268 VanDerWaalsContact O-CB 3.29Å; L264-Y268 WeakPolarHBondContact O-CB 3.3Å; L264-Y268 PolarHBondContact O-N 3Å
265E96.6Very high94.4Very high65 Ų6549.9 Ų49.930%0.30425%0.252SS..Hα-helixtrans-57.6-50.1179.3179.7-169.4-140.100110.7F250 Y261 I263 M267 Y268 L269 R271F250-E265 HydrophobicContact CE2-CB 4.04Å; F250-E265 HydrophobicContact CE2-CG 3.92Å; Y261-E265 PolarHBondContact O-N 3.2Å; I263-E265 PolarHBondContact O-N 3.46Å; E265-M267 PolarHBondContact O-N 2.82Å; E265-Y268 PolarHBondContact O-N 2.93Å; E265-L269 HydrophobicContact CG-CD1 3.76Å; E265-L269 HydrophobicContact CG-CG 4.4Å; E265-L269 WeakPolarHBondContact O-CB 3.43Å; E265-L269 VanDerWaalsContact O-CG 3.31Å; E265-L269 WeakPolarHBondContact O-CG 3.38Å; E265-L269 PolarHBondContact O-N 3.02Å; E265-R271 IonicContact OE2-NH1 2.7Å
266K95.3Very high94Very high53 Ų5354.7 Ų54.723%0.2328%0.278CS..Hα-helixtrans-62.4-43.1180-74.5-173.8178.1-160.70112.1G262 I263 L264 L269 D270 R271 I273 Q277G262-K266 WeakPolarHBondContact O-CG 3.34Å; G262-K266 PolarHBondContact O-N 3.12Å; I263-K266 PolarHBondContact O-N 3.13Å; L264-K266 PolarHBondContact O-N 3.32Å; K266-L269 PolarHBondContact O-N 3.31Å; K266-D270 PolarHBondContact O-N 3.3Å; K266-R271 HydrophobicContact CB-CB 4.04Å; K266-R271 HydrophobicContact CG-CB 4.25Å; K266-R271 WeakPolarHBondContact O-CB 3.03Å; K266-R271 PolarHBondContact O-N 2.76Å; K266-I273 HydrophobicContact CB-CD1 3.35Å; K266-I273 HydrophobicContact CD-CD1 3.96Å; K266-I273 HydrophobicContact CG-CD1 4.3Å; K266-Q277 VanDerWaalsContact CE-NE2 3.32Å
267M94.2Very high93.6Very high2 Ų250.9 Ų50.91%0.0126%0.26CS..Hα-helixtrans-67-41.2178.7-73.1-168.2170.400112.2I234 R242 L246 I263 L264 E265 D270 I273 V304 H307I234-M267 HydrophobicContact CB-SD 4.25Å; I234-M267 HydrophobicContact CG1-SD 3.93Å; I234-M267 HydrophobicContact CG2-CE 3.75Å; I234-M267 HydrophobicContact CG2-SD 3.91Å; R242-M267 PolarHBondContact NH2-SD 3.37Å; L246-M267 HydrophobicContact CD1-CB 4.21Å; L246-M267 HydrophobicContact CD2-CB 4.2Å; I263-M267 HydrophobicContact CG2-CE 3.86Å; I263-M267 HydrophobicContact CG2-CG 4.14Å; I263-M267 HydrophobicContact CG2-SD 3.95Å; I263-M267 WeakPolarHBondContact O-CB 3.17Å; I263-M267 WeakPolarHBondContact O-CG 3.28Å; I263-M267 PolarHBondContact O-N 3.18Å; L264-M267 PolarHBondContact O-N 3.34Å; E265-M267 PolarHBondContact O-N 2.82Å; M267-D270 PolarHBondContact O-N 3.44Å; M267-I273 HydrophobicContact CE-CG1 4.08Å; M267-I273 HydrophobicContact CG-CD1 4.09Å; M267-I273 HydrophobicContact CG-CG1 4.23Å; M267-V304 HydrophobicContact CE-CG2 3.78Å; M267-H307 VanDerWaalsContact CA-CE1 3.49Å; M267-H307 WeakPolarHBondContact CA-CE1 3.4Å; M267-H307 PolarHBondContact O-CE1 3.14Å
268Y95.1Very high93.3Very high78 Ų7845.5 Ų45.531%0.30624%0.236SC..Hα-helixtrans-65.9-39.8177.4175.6-108.9000112.3L246 A247 F250 L264 E265 D270L246-Y268 HydrophobicContact CB-CD2 4.36Å; A247-Y268 VanDerWaalsContact CA-CE2 3.46Å; A247-Y268 HydrophobicContact CB-CD2 4.16Å; A247-Y268 HydrophobicContact CB-CE2 3.53Å; F250-Y268 HydrophobicContact CB-CD1 3.94Å; F250-Y268 HydrophobicContact CB-CD2 4.27Å; F250-Y268 HydrophobicContact CB-CE1 4.38Å; F250-Y268 HydrophobicContact CB-CG 3.86Å; F250-Y268 AromaticContact CD1-CD1 3.25Å; F250-Y268 HydrophobicContact CD1-CD1 3.25Å; F250-Y268 AromaticContact CD1-CE1 3.19Å; F250-Y268 HydrophobicContact CD1-CE1 3.19Å; F250-Y268 HydrophobicContact CD1-CG 4.07Å; F250-Y268 AromaticContact CD1-CZ 3.99Å; F250-Y268 AromaticContact CD2-CD1 3.87Å; F250-Y268 HydrophobicContact CD2-CD1 3.87Å; F250-Y268 HydrophobicContact CD2-CG 4.3Å; F250-Y268 AromaticContact CE1-CD1 3.62Å; F250-Y268 HydrophobicContact CE1-CD1 3.62Å; F250-Y268 AromaticContact CE1-CE1 3.51Å; F250-Y268 HydrophobicContact CE1-CE1 3.51Å; F250-Y268 HydrophobicContact CE2-CD1 4.21Å; F250-Y268 AromaticContact CG-CD1 3.38Å; F250-Y268 HydrophobicContact CG-CD1 3.38Å; F250-Y268 AromaticContact CG-CE1 3.83Å; F250-Y268 HydrophobicContact CG-CE1 3.83Å; F250-Y268 AromaticContact CG-CG 3.8Å; F250-Y268 HydrophobicContact CG-CG 3.8Å; F250-Y268 HydrophobicContact CZ-CD1 4.08Å; F250-Y268 HydrophobicContact CZ-CE1 4.36Å; L264-Y268 VanDerWaalsContact O-CB 3.29Å; L264-Y268 WeakPolarHBondContact O-CB 3.3Å; L264-Y268 PolarHBondContact O-N 3Å; E265-Y268 PolarHBondContact O-N 2.93Å; Y268-D270 PolarHBondContact O-N 3.44Å
269L93.6Very high93Very high71 Ų7151.5 Ų51.537%0.37226%0.263SS..THydrogen-bonded Turntrans-83.714.6177.4-61.8179.2000113.4E265 K266 R271E265-L269 HydrophobicContact CG-CD1 3.76Å; E265-L269 HydrophobicContact CG-CG 4.4Å; E265-L269 WeakPolarHBondContact O-CB 3.43Å; E265-L269 VanDerWaalsContact O-CG 3.31Å; E265-L269 WeakPolarHBondContact O-CG 3.38Å; E265-L269 PolarHBondContact O-N 3.02Å; K266-L269 PolarHBondContact O-N 3.31Å; L269-R271 HydrophobicContact CB-CG 4.14Å; L269-R271 PolarHBondContact O-N 3.26Å; L269-R271 VanDerWaalsContact O-N 3.14Å
270D91Very high92.8Very high58 Ų5853.7 Ų53.731%0.3126%0.259SS..THydrogen-bonded Turntrans54.631.8178.6-61.8-59.3000114.2K266 M267 Y268 S311 K314K266-D270 PolarHBondContact O-N 3.3Å; M267-D270 PolarHBondContact O-N 3.44Å; Y268-D270 PolarHBondContact O-N 3.44Å; D270-S311 WeakPolarHBondContact O-CB 3.35Å; D270-S311 PolarHBondContact O-OG 3.38Å; D270-K314 HydrophobicContact CB-CD 3.98Å; D270-K314 IonicContact OD1-NZ 3.39Å; D270-K314 PolarHBondContact OD1-NZ 3.47Å; D270-K314 IonicContact OD2-NZ 3.58Å; D270-K314 PolarHBondContact OD2-NZ 3.33Å
271R93.4Very high92.8Very high117 Ų11753.6 Ų53.644%0.44226%0.257SS..PPolyproline II helixtrans-84.6149176.6-59.8178.4178.9165.1-0.8110.8E265 K266 L269 H307E265-R271 IonicContact OE2-NH1 2.7Å; K266-R271 HydrophobicContact CB-CB 4.04Å; K266-R271 HydrophobicContact CG-CB 4.25Å; K266-R271 WeakPolarHBondContact O-CB 3.03Å; K266-R271 PolarHBondContact O-N 2.76Å; L269-R271 HydrophobicContact CB-CG 4.14Å; L269-R271 PolarHBondContact O-N 3.26Å; L269-R271 VanDerWaalsContact O-N 3.14Å; R271-H307 PolarHBondContact O-NE2 3.47Å; R271-H307 VanDerWaalsContact O-NE2 3.1Å
272I91.8Very high92.6Very high24 Ų2452.6 Ų52.612%0.12326%0.26CS..PPolyproline II helixtrans-68.7132.4173.8-62.9174000109.8N308 L315 L327I272-N308 HydrophobicContact CG2-CB 4.44Å; I272-L315 HydrophobicContact CD1-CD1 4.17Å; I272-L315 HydrophobicContact CG1-CD1 4.5Å; I272-L327 HydrophobicContact CD1-CD1 3.84Å; I272-L327 HydrophobicContact CD1-CD2 3.71Å; I272-L327 HydrophobicContact CD1-CG 3.88Å
273I93.6Very high92.5Very high5 Ų554.5 Ų54.53%0.02627%0.272CS..PPolyproline II helixtrans-94.3127.5175.1-50.1-59.2000109I263 K266 M267 Q277 V304 N308I263-I273 HydrophobicContact CD1-CG2 4.07Å; K266-I273 HydrophobicContact CB-CD1 3.35Å; K266-I273 HydrophobicContact CD-CD1 3.96Å; K266-I273 HydrophobicContact CG-CD1 4.3Å; M267-I273 HydrophobicContact CE-CG1 4.08Å; M267-I273 HydrophobicContact CG-CD1 4.09Å; M267-I273 HydrophobicContact CG-CG1 4.23Å; I273-Q277 HydrophobicContact CG2-CB 4.3Å; I273-V304 HydrophobicContact CB-CG1 3.91Å; I273-V304 HydrophobicContact CG2-CG1 4.24Å; I273-N308 PolarHBondContact N-OD1 2.9Å; I273-N308 PolarHBondContact O-ND2 2.92Å
274R89.4Confident92.3Very high100 Ų10057.7 Ų57.738%0.37729%0.287SS..PPolyproline II helixtrans-91.3156.9179.9-62.4-64.4-176-157.6-0.6111.7N276 Q277 L278 L327R274-N276 VanDerWaalsContact C-N 3.31Å; R274-N276 VanDerWaalsContact CB-OD1 3.28Å; R274-N276 WeakPolarHBondContact CB-OD1 3.46Å; R274-N276 PolarHBondContact O-N 3Å; R274-Q277 PolarHBondContact O-N 2.92Å; R274-Q277 VanDerWaalsContact O-N 3.14Å; R274-L278 PolarHBondContact O-N 2.7Å; R274-L327 PolarHBondContact NH1-O 3.24Å
275G88.2Confident92.1Very high14 Ų1458.1 Ų58.114%0.14429%0.29CS..Hα-helixtrans-57.3-36.2-175.400000114.9Q277 L278 Q279 E329G275-Q277 PolarHBondContact O-N 3.3Å; G275-L278 WeakPolarHBondContact O-CB 3.11Å; G275-L278 PolarHBondContact O-N 3.14Å; G275-Q279 WeakPolarHBondContact O-CG 3.34Å; G275-Q279 PolarHBondContact O-N 3.4Å; G275-E329 VanDerWaalsContact CA-OE2 3.27Å; G275-E329 WeakPolarHBondContact CA-OE2 3.13Å; G275-E329 PolarHBondContact N-OE2 2.86Å
276N88.9Confident91.9Very high100 Ų10057.7 Ų57.754%0.53529%0.289SS..Hα-helixtrans-61.6-42.9177.363.9-34.1000112.8R274 L278 Q279 E280R274-N276 VanDerWaalsContact C-N 3.31Å; R274-N276 VanDerWaalsContact CB-OD1 3.28Å; R274-N276 WeakPolarHBondContact CB-OD1 3.46Å; R274-N276 PolarHBondContact O-N 3Å; N276-L278 VanDerWaalsContact C-N 3.28Å; N276-L278 PolarHBondContact O-N 2.92Å; N276-Q279 PolarHBondContact O-N 2.91Å; N276-E280 PolarHBondContact O-N 2.94Å
277Q89.3Confident91.8Very high36 Ų3660.7 Ų60.717%0.16831%0.313CS..Hα-helixtrans-69.8-32.9178.1-44.9-170.9-85.800111.3I263 K266 I273 R274 G275 F281I263-Q277 HydrophobicContact CD1-CB 3.74Å; K266-Q277 VanDerWaalsContact CE-NE2 3.32Å; I273-Q277 HydrophobicContact CG2-CB 4.3Å; R274-Q277 PolarHBondContact O-N 2.92Å; R274-Q277 VanDerWaalsContact O-N 3.14Å; G275-Q277 PolarHBondContact O-N 3.3Å; Q277-F281 PolarHBondContact O-N 2.92Å; Q277-F281 VanDerWaalsContact O-N 3.08Å
278L88.9Confident91.6Very high24 Ų2462.1 Ų62.113%0.12632%0.32CS..Hα-helixtrans-64.8-41.5175.7-166.362.3000111.5R274 G275 N276 F281 A282 L300 V304R274-L278 PolarHBondContact O-N 2.7Å; G275-L278 WeakPolarHBondContact O-CB 3.11Å; G275-L278 PolarHBondContact O-N 3.14Å; N276-L278 VanDerWaalsContact C-N 3.28Å; N276-L278 PolarHBondContact O-N 2.92Å; L278-F281 PolarHBondContact O-N 3.42Å; L278-A282 VanDerWaalsContact O-CB 3.27Å; L278-A282 WeakPolarHBondContact O-CB 3.44Å; L278-A282 PolarHBondContact O-N 2.94Å; L278-L300 HydrophobicContact CD1-CD1 3.73Å; L278-L300 HydrophobicContact CD1-CD2 3.69Å; L278-L300 HydrophobicContact CD1-CG 3.54Å; L278-L300 HydrophobicContact CG-CD2 4.09Å; L278-L300 HydrophobicContact CG-CG 4.23Å; L278-V304 HydrophobicContact CD1-CB 3.98Å; L278-V304 HydrophobicContact CD1-CG1 4.16Å; L278-V304 HydrophobicContact CD1-CG2 3.38Å; L278-V304 HydrophobicContact CD2-CB 4.35Å; L278-V304 HydrophobicContact CD2-CG1 4.32Å
279Q89.3Confident91.5Very high144 Ų14458.4 Ų58.467%0.67331%0.305SS*.Hα-helixtrans-63.3-44.6177.5-72.2172.82.500112G275 N276 F281 A282 A283G275-Q279 WeakPolarHBondContact O-CG 3.34Å; G275-Q279 PolarHBondContact O-N 3.4Å; N276-Q279 PolarHBondContact O-N 2.91Å; Q279-F281 VanDerWaalsContact C-N 3.34Å; Q279-F281 PolarHBondContact O-N 3.48Å; Q279-A282 PolarHBondContact O-N 3.29Å; Q279-A283 PolarHBondContact O-N 3.15Å
280E91.2Very high91.4Very high131 Ų13159.3 Ų59.361%0.61231%0.306SS*.Hα-helixtrans-59.6-44.8174.9-72.3176.5-177.100111.5N276 A283N276-E280 PolarHBondContact O-N 2.94Å; E280-A283 WeakPolarHBondContact O-CB 3.41Å; E280-A283 PolarHBondContact O-N 3.26Å
281F93.6Very high91.2Very high4 Ų457.6 Ų57.62%0.01830%0.3CS..Hα-helixtrans-66.7-42.7177.2-178-104.1000112.3N231 I234 A260 I263 Q277 L278 Q279 A283 M284 L285 L300N231-F281 HydrophobicContact CB-CZ 4.38Å; N231-F281 WeakPolarHBondContact OD1-CE2 3.42Å; I234-F281 HydrophobicContact CB-CE1 4.12Å; I234-F281 HydrophobicContact CB-CZ 3.78Å; I234-F281 HydrophobicContact CD1-CD2 4.25Å; I234-F281 HydrophobicContact CD1-CE1 4.43Å; I234-F281 HydrophobicContact CD1-CE2 3.47Å; I234-F281 VanDerWaalsContact CD1-CE2 3.47Å; I234-F281 HydrophobicContact CD1-CZ 3.58Å; I234-F281 HydrophobicContact CG1-CZ 4.28Å; I234-F281 HydrophobicContact CG2-CD1 4.13Å; I234-F281 HydrophobicContact CG2-CE1 3.41Å; I234-F281 VanDerWaalsContact CG2-CE1 3.41Å; I234-F281 HydrophobicContact CG2-CE2 4.4Å; I234-F281 HydrophobicContact CG2-CZ 3.57Å; A260-F281 HydrophobicContact CB-CD2 3.91Å; A260-F281 HydrophobicContact CB-CE2 3.81Å; I263-F281 HydrophobicContact CG1-CB 4.29Å; I263-F281 HydrophobicContact CG1-CD2 4.42Å; Q277-F281 PolarHBondContact O-N 2.92Å; Q277-F281 VanDerWaalsContact O-N 3.08Å; L278-F281 PolarHBondContact O-N 3.42Å; Q279-F281 VanDerWaalsContact C-N 3.34Å; Q279-F281 PolarHBondContact O-N 3.48Å; F281-A283 PolarHBondContact O-N 2.92Å; F281-M284 WeakPolarHBondContact O-CB 3.38Å; F281-M284 PolarHBondContact O-N 3.47Å; F281-L285 HydrophobicContact CD1-CD1 4.44Å; F281-L285 HydrophobicContact CD1-CG 4.5Å; F281-L285 HydrophobicContact CE1-CD1 4.1Å; F281-L285 HydrophobicContact CE1-CD2 3.78Å; F281-L285 HydrophobicContact CE1-CG 4.15Å; F281-L285 HydrophobicContact CZ-CD2 3.8Å; F281-L300 HydrophobicContact CD1-CD1 3.67Å; F281-L300 HydrophobicContact CD1-CD2 3.83Å; F281-L300 HydrophobicContact CD1-CG 4.41Å; F281-L300 HydrophobicContact CE1-CD1 3.7Å; F281-L300 HydrophobicContact CE1-CD2 4.41Å
282A93.1Very high90.9Very high30 Ų3056.7 Ų56.725%0.24831%0.308CS..Hα-helixtrans-58.2-36.6177.100000111.6L278 Q279 M284 L285 K290 L300L278-A282 VanDerWaalsContact O-CB 3.27Å; L278-A282 WeakPolarHBondContact O-CB 3.44Å; L278-A282 PolarHBondContact O-N 2.94Å; Q279-A282 PolarHBondContact O-N 3.29Å; A282-M284 PolarHBondContact O-N 3.26Å; A282-L285 PolarHBondContact O-N 2.9Å; A282-K290 WeakPolarHBondContact O-CE 3.41Å; A282-K290 PolarHBondContact O-NZ 3.02Å; A282-K290 VanDerWaalsContact O-NZ 3.11Å; A282-L300 HydrophobicContact CB-CD2 3.63Å
283A92.7Very high90.3Very high75 Ų7557.5 Ų57.562%0.6231%0.314SS*.Hα-helixtrans-60.8-29.2176.400000112.9Q279 E280 F281Q279-A283 PolarHBondContact O-N 3.15Å; E280-A283 WeakPolarHBondContact O-CB 3.41Å; E280-A283 PolarHBondContact O-N 3.26Å; F281-A283 PolarHBondContact O-N 2.92Å
284M91.8Very high89.6Confident80 Ų8063 Ų6339%0.39436%0.36SS..THydrogen-bonded Turntrans-82.1-10.8-179.5-55176.8-16900114A259 F281 A282A259-M284 HydrophobicContact CB-CE 3.66Å; A259-M284 HydrophobicContact CB-SD 3.92Å; F281-M284 WeakPolarHBondContact O-CB 3.38Å; F281-M284 PolarHBondContact O-N 3.47Å; A282-M284 PolarHBondContact O-N 3.26Å
285L94.2Very high88.9Confident10 Ų1062.7 Ų62.75%0.05237%0.366CS..SBendtrans-80.2151.8-177.2-64.7-177.7000112.7N231 L235 F281 A282 Q289 K290 L300N231-L285 HydrophobicContact CB-CD2 4.16Å; L235-L285 HydrophobicContact CD1-CD1 4.33Å; L235-L285 HydrophobicContact CD1-CD2 4.02Å; L235-L285 HydrophobicContact CD2-CD1 3.86Å; L235-L285 HydrophobicContact CG-CD1 4.5Å; F281-L285 HydrophobicContact CD1-CD1 4.44Å; F281-L285 HydrophobicContact CD1-CG 4.5Å; F281-L285 HydrophobicContact CE1-CD1 4.1Å; F281-L285 HydrophobicContact CE1-CD2 3.78Å; F281-L285 HydrophobicContact CE1-CG 4.15Å; F281-L285 HydrophobicContact CZ-CD2 3.8Å; A282-L285 PolarHBondContact O-N 2.9Å; L285-Q289 HydrophobicContact CB-CB 4.16Å; L285-Q289 HydrophobicContact CD1-CB 4.48Å; L285-K290 HydrophobicContact CB-CG 4.16Å; L285-K290 WeakPolarHBondContact O-CE 3.41Å; L285-K290 PolarHBondContact O-NZ 3.21Å; L285-L300 HydrophobicContact CD1-CB 4.33Å; L285-L300 HydrophobicContact CD1-CD2 3.88Å
286M92.3Very high88.5Confident56 Ų5664.8 Ų64.828%0.27639%0.387SS..  trans-72.6156.5172.9-66.3-179.8-75.700111.2D196 H288 Q289 K290D196-M286 VanDerWaalsContact OD2-CE 3.3Å; D196-M286 WeakPolarHBondContact OD2-CE 3.3Å; M286-H288 VanDerWaalsContact C-N 3.34Å; M286-H288 VanDerWaalsContact CB-CE1 3.5Å; M286-H288 WeakPolarHBondContact CB-CE1 3.39Å; M286-H288 WeakPolarHBondContact CB-ND1 3.13Å; M286-H288 WeakPolarHBondContact CE-CE1 3.46Å; M286-H288 PolarHBondContact O-N 3.22Å; M286-Q289 HydrophobicContact CB-CG 4.29Å; M286-Q289 HydrophobicContact CE-CG 4.46Å; M286-Q289 VanDerWaalsContact N-OE1 3.11Å; M286-Q289 WeakPolarHBondContact O-CB 3.4Å; M286-Q289 PolarHBondContact O-N 3.4Å; M286-K290 PolarHBondContact O-N 3.33Å
287P92.1Very high88.2Confident115 Ų11560.5 Ų60.575%0.74737%0.366SS*.G310 helixtrans-52.7-45.1-179.1-28.636.2000114.2Q289 K290P287-Q289 PolarHBondContact O-N 3.45Å; P287-K290 PolarHBondContact O-N 2.86Å
288H90.7Very high88.1Confident32 Ų3259.9 Ų59.915%0.14837%0.365CS..G310 helixtrans-64.4-26.5179.967.9-81000113.5D196 F197 M286 K290D196-H288 IonicContact OD1-NE2 2.74Å; D196-H288 IonicContact OD2-CE1 2.98Å; D196-H288 IonicContact OD2-NE2 2.57Å; D196-H288 PolarHBondContact OD2-NE2 3.44Å; F197-H288 HydrophobicContact CD1-CB 4.02Å; F197-H288 AromaticContact CD1-CG 3.99Å; F197-H288 AromaticContact CD2-CD2 3.73Å; F197-H288 AromaticContact CD2-CE1 3.77Å; F197-H288 AromaticContact CD2-NE2 3.53Å; F197-H288 HydrophobicContact CE1-CB 3.95Å; F197-H288 AromaticContact CE1-CG 3.89Å; F197-H288 AromaticContact CE1-ND1 3.99Å; F197-H288 AromaticContact CE2-CE1 3.35Å; F197-H288 WeakPolarHBondContact CE2-CE1 3.22Å; F197-H288 AromaticContact CE2-CG 3.98Å; F197-H288 AromaticContact CE2-ND1 3.64Å; F197-H288 AromaticContact CE2-NE2 3.64Å; F197-H288 AromaticContact CG-CD2 3.83Å; F197-H288 HydrophobicContact CZ-CB 4.4Å; F197-H288 AromaticContact CZ-CE1 3.76Å; F197-H288 AromaticContact CZ-CG 3.89Å; F197-H288 AromaticContact CZ-ND1 3.55Å; M286-H288 VanDerWaalsContact C-N 3.34Å; M286-H288 VanDerWaalsContact CB-CE1 3.5Å; M286-H288 WeakPolarHBondContact CB-CE1 3.39Å; M286-H288 WeakPolarHBondContact CB-ND1 3.13Å; M286-H288 WeakPolarHBondContact CE-CE1 3.46Å; M286-H288 PolarHBondContact O-N 3.22Å; H288-K290 VanDerWaalsContact C-N 3.29Å
289Q93.2Very high88.1Confident1 Ų159.7 Ų59.71%0.00536%0.364CS..G310 helixtrans-78.3-15.7178.1-62.3179.1-39.500112.6D196 L235 L285 M286 P287 A291D196-Q289 PolarHBondContact OD1-NE2 2.73Å; D196-Q289 PolarHBondContact OD2-NE2 3.25Å; L235-Q289 HydrophobicContact CD1-CB 3.85Å; L235-Q289 HydrophobicContact CD1-CG 4.04Å; L285-Q289 HydrophobicContact CB-CB 4.16Å; L285-Q289 HydrophobicContact CD1-CB 4.48Å; M286-Q289 HydrophobicContact CB-CG 4.29Å; M286-Q289 HydrophobicContact CE-CG 4.46Å; M286-Q289 VanDerWaalsContact N-OE1 3.11Å; M286-Q289 WeakPolarHBondContact O-CB 3.4Å; M286-Q289 PolarHBondContact O-N 3.4Å; P287-Q289 PolarHBondContact O-N 3.45Å; Q289-A291 VanDerWaalsContact C-N 3.31Å
290K91.8Very high88.1Confident90 Ų9053 Ų5339%0.39133%0.333SS..G310 helixtrans-9111.4177.9-62.1177.3-174-177.50113.2A282 L285 M286 P287 H288 T292A282-K290 WeakPolarHBondContact O-CE 3.41Å; A282-K290 PolarHBondContact O-NZ 3.02Å; A282-K290 VanDerWaalsContact O-NZ 3.11Å; L285-K290 HydrophobicContact CB-CG 4.16Å; L285-K290 WeakPolarHBondContact O-CE 3.41Å; L285-K290 PolarHBondContact O-NZ 3.21Å; M286-K290 PolarHBondContact O-N 3.33Å; P287-K290 PolarHBondContact O-N 2.86Å; H288-K290 VanDerWaalsContact C-N 3.29Å; K290-T292 PolarHBondContact O-N 3.03Å
291A86.3Confident87.9Confident22 Ų2249.4 Ų49.418%0.18232%0.318CS..PPolyproline II helixtrans-57141.4-177.600000111.6R199 Q289 S298 I299R199-A291 VanDerWaalsContact NH2-CB 3.3Å; Q289-A291 VanDerWaalsContact C-N 3.31Å; A291-S298 WeakPolarHBondContact O-CA 3.15Å; A291-I299 HydrophobicContact CB-CD1 3.86Å; A291-I299 WeakPolarHBondContact O-CG1 3.35Å; A291-I299 PolarHBondContact O-N 3.12Å
292T87.4Confident87.7Confident97 Ų9752.8 Ų52.860%0.59533%0.33SS*.BIsolated β-bridgetrans-92.8145.7178.649.90000111.2K290 S297K290-T292 PolarHBondContact O-N 3.03Å; T292-S297 CarbonylContact C-O 3.54Å; T292-S297 VanDerWaalsContact CA-O 3.26Å; T292-S297 WeakPolarHBondContact CA-O 3.45Å
293T79.6Confident87.4Confident41 Ų4151.6 Ų51.625%0.25232%0.321SS..PPolyproline II helixtrans-84.2168.4172.350.50000110.3D295 G296 S297T293-D295 VanDerWaalsContact CB-OD1 3.24Å; T293-D295 WeakPolarHBondContact CB-OD1 3.17Å; T293-D295 PolarHBondContact O-N 2.84Å; T293-D295 VanDerWaalsContact O-N 3.11Å; T293-D295 PolarHBondContact OG1-OD1 3.35Å; T293-G296 PolarHBondContact O-N 3.38Å; T293-S297 PolarHBondContact N-O 3.34Å; T293-S297 PolarHBondContact OG1-O 3.09Å; T293-S297 PolarHBondContact OG1-OG 3.48Å
294A78Confident87.4Confident121 Ų12148.3 Ų48.3100%129%0.293SS*.THydrogen-bonded Turntrans-60.5-22-177.100000114.1G296A294-G296 VanDerWaalsContact C-N 3.32Å
295D73.9Confident87.4Confident93 Ų9345.2 Ų45.250%0.49728%0.278SS..THydrogen-bonded Turntrans-89.49.3174.967-42.7000113.6T293 S297 K334T293-D295 VanDerWaalsContact CB-OD1 3.24Å; T293-D295 WeakPolarHBondContact CB-OD1 3.17Å; T293-D295 PolarHBondContact O-N 2.84Å; T293-D295 VanDerWaalsContact O-N 3.11Å; T293-D295 PolarHBondContact OG1-OD1 3.35Å; D295-S297 VanDerWaalsContact C-N 3.32Å; D295-S297 PolarHBondContact O-N 2.88Å; D295-S297 PolarHBondContact OD1-OG 3.09Å; D295-S297 PolarHBondContact OD2-OG 3.35Å; D295-S297 VanDerWaalsContact OD2-OG 3.07Å; D295-K334 WeakPolarHBondContact OD2-CE 3.46Å; D295-K334 IonicContact OD2-NZ 3.35Å; D295-K334 PolarHBondContact OD2-NZ 3.34Å
296G79.8Confident87.2Confident58 Ų5844.9 Ų44.960%0.59828%0.276SS*.SBendtrans83.1-7.317400000115.8T293 A294T293-G296 PolarHBondContact O-N 3.38Å; A294-G296 VanDerWaalsContact C-N 3.32Å
297S82.5Confident87.2Confident11 Ų1142.5 Ų42.58%0.07726%0.264CS..  trans-77.5154.4172.844.10000112.4T292 T293 D295 K334T292-S297 CarbonylContact C-O 3.54Å; T292-S297 VanDerWaalsContact CA-O 3.26Å; T292-S297 WeakPolarHBondContact CA-O 3.45Å; T293-S297 PolarHBondContact N-O 3.34Å; T293-S297 PolarHBondContact OG1-O 3.09Å; T293-S297 PolarHBondContact OG1-OG 3.48Å; D295-S297 VanDerWaalsContact C-N 3.32Å; D295-S297 PolarHBondContact O-N 2.88Å; D295-S297 PolarHBondContact OD1-OG 3.09Å; D295-S297 PolarHBondContact OD2-OG 3.35Å; D295-S297 VanDerWaalsContact OD2-OG 3.07Å; S297-K334 PolarHBondContact OG-NZ 3.05Å
298S88.5Confident87.3Confident22 Ų2237.3 Ų37.315%0.15423%0.23CC..BIsolated β-bridgetrans-76.8161.7170.271.10000111.9A291 L300 D301 R302A291-S298 WeakPolarHBondContact O-CA 3.15Å; S298-L300 PolarHBondContact O-N 3.1Å; S298-D301 WeakPolarHBondContact CB-OD2 3.3Å; S298-D301 PolarHBondContact N-OD2 2.92Å; S298-D301 PolarHBondContact O-N 3.27Å; S298-D301 PolarHBondContact OG-N 3.36Å; S298-D301 PolarHBondContact OG-OD1 3.36Å; S298-D301 PolarHBondContact OG-OD2 2.85Å; S298-R302 PolarHBondContact O-N 3.29Å; S298-R302 VanDerWaalsContact O-N 3.14Å
299I87.6Confident87.4Confident20 Ų2035.8 Ų35.810%0.10322%0.223CC..Hα-helixtrans-52.3-42.6169.4-69.4167.5000110.9R199 F201 L235 A291 R302 A303R199-I299 HydrophobicContact CG-CD1 4.14Å; F201-I299 HydrophobicContact CE2-CD1 4.35Å; F201-I299 HydrophobicContact CE2-CG2 3.57Å; F201-I299 HydrophobicContact CZ-CD1 4.15Å; F201-I299 HydrophobicContact CZ-CG2 3.98Å; L235-I299 HydrophobicContact CD2-CG2 4.27Å; A291-I299 HydrophobicContact CB-CD1 3.86Å; A291-I299 WeakPolarHBondContact O-CG1 3.35Å; A291-I299 PolarHBondContact O-N 3.12Å; I299-R302 PolarHBondContact O-N 3.34Å; I299-A303 PolarHBondContact O-N 3.08Å
300L89.6Confident87.2Confident3 Ų337.3 Ų37.32%0.01623%0.231CC..Hα-helixtrans-62.8-46.1179.4175.662.2000111.6I234 L235 L278 F281 A282 L285 S298 R302 A303 V304I234-L300 HydrophobicContact CG2-CD1 4.28Å; L235-L300 HydrophobicContact CD2-CB 3.8Å; L235-L300 HydrophobicContact CD2-CD1 3.91Å; L235-L300 HydrophobicContact CD2-CG 4.43Å; L278-L300 HydrophobicContact CD1-CD1 3.73Å; L278-L300 HydrophobicContact CD1-CD2 3.69Å; L278-L300 HydrophobicContact CD1-CG 3.54Å; L278-L300 HydrophobicContact CG-CD2 4.09Å; L278-L300 HydrophobicContact CG-CG 4.23Å; F281-L300 HydrophobicContact CD1-CD1 3.67Å; F281-L300 HydrophobicContact CD1-CD2 3.83Å; F281-L300 HydrophobicContact CD1-CG 4.41Å; F281-L300 HydrophobicContact CE1-CD1 3.7Å; F281-L300 HydrophobicContact CE1-CD2 4.41Å; A282-L300 HydrophobicContact CB-CD2 3.63Å; L285-L300 HydrophobicContact CD1-CB 4.33Å; L285-L300 HydrophobicContact CD1-CD2 3.88Å; S298-L300 PolarHBondContact O-N 3.1Å; L300-R302 VanDerWaalsContact C-N 3.28Å; L300-R302 PolarHBondContact O-N 3.5Å; L300-A303 PolarHBondContact O-N 3.43Å; L300-V304 HydrophobicContact CD1-CG2 3.98Å; L300-V304 WeakPolarHBondContact O-CG2 3.35Å; L300-V304 PolarHBondContact O-N 3.04Å
301D88.7Confident87.2Confident56 Ų5633 Ų3330%0.29921%0.212SC..Hα-helixtrans-58.1-45.6178.4-60.1-39.1000110.4S298 A303 V304 I305S298-D301 WeakPolarHBondContact CB-OD2 3.3Å; S298-D301 PolarHBondContact N-OD2 2.92Å; S298-D301 PolarHBondContact O-N 3.27Å; S298-D301 PolarHBondContact OG-N 3.36Å; S298-D301 PolarHBondContact OG-OD1 3.36Å; S298-D301 PolarHBondContact OG-OD2 2.85Å; D301-A303 PolarHBondContact O-N 3.27Å; D301-V304 PolarHBondContact O-N 3.4Å; D301-I305 WeakPolarHBondContact O-CB 3.23Å; D301-I305 WeakPolarHBondContact O-CD1 3.48Å; D301-I305 WeakPolarHBondContact O-CG1 3.34Å; D301-I305 PolarHBondContact O-N 3.02Å
302R87.6Confident87.5Confident76 Ų7632 Ų3229%0.28720%0.203SC..Hα-helixtrans-60.3-48.8177.2-174.6179.7174.51009.5111.5S298 I299 L300 V304 I305 E306 Q341S298-R302 PolarHBondContact O-N 3.29Å; S298-R302 VanDerWaalsContact O-N 3.14Å; I299-R302 PolarHBondContact O-N 3.34Å; L300-R302 VanDerWaalsContact C-N 3.28Å; L300-R302 PolarHBondContact O-N 3.5Å; R302-V304 VanDerWaalsContact C-N 3.28Å; R302-V304 PolarHBondContact O-N 3.39Å; R302-I305 PolarHBondContact O-N 3.35Å; R302-E306 IonicContact CZ-OE1 2.91Å; R302-E306 IonicContact NE-OE1 2.84Å; R302-E306 PolarHBondContact NE-OE1 2.97Å; R302-E306 VanDerWaalsContact NE-OE1 3.08Å; R302-E306 IonicContact NH2-OE1 3Å; R302-E306 PolarHBondContact NH2-OE1 3.17Å; R302-E306 WeakPolarHBondContact O-CG 3.39Å; R302-E306 PolarHBondContact O-N 3.46Å; R302-Q341 VanDerWaalsContact NH2-OE1 3.11Å
303A88.5Confident87.6Confident5 Ų528.5 Ų28.54%0.04118%0.183CC..Hα-helixtrans-60.7-38.4-179.500000112.2I299 L300 D301 H307I299-A303 PolarHBondContact O-N 3.08Å; L300-A303 PolarHBondContact O-N 3.43Å; D301-A303 PolarHBondContact O-N 3.27Å; A303-H307 WeakPolarHBondContact O-CB 3.41Å; A303-H307 PolarHBondContact O-N 3.23Å
304V91.6Very high88Confident6 Ų631.8 Ų31.84%0.03619%0.194CC..Hα-helixtrans-76.4-36.7179.6172.40000112.9M267 I273 L278 L300 D301 R302 H307 N308M267-V304 HydrophobicContact CE-CG2 3.78Å; I273-V304 HydrophobicContact CB-CG1 3.91Å; I273-V304 HydrophobicContact CG2-CG1 4.24Å; L278-V304 HydrophobicContact CD1-CB 3.98Å; L278-V304 HydrophobicContact CD1-CG1 4.16Å; L278-V304 HydrophobicContact CD1-CG2 3.38Å; L278-V304 HydrophobicContact CD2-CB 4.35Å; L278-V304 HydrophobicContact CD2-CG1 4.32Å; L300-V304 HydrophobicContact CD1-CG2 3.98Å; L300-V304 WeakPolarHBondContact O-CG2 3.35Å; L300-V304 PolarHBondContact O-N 3.04Å; D301-V304 PolarHBondContact O-N 3.4Å; R302-V304 VanDerWaalsContact C-N 3.28Å; R302-V304 PolarHBondContact O-N 3.39Å; V304-H307 PolarHBondContact O-N 3.24Å; V304-N308 VanDerWaalsContact O-CB 3.28Å; V304-N308 WeakPolarHBondContact O-CB 3.27Å; V304-N308 VanDerWaalsContact O-CG 3.24Å; V304-N308 PolarHBondContact O-N 3.34Å
305I91.5Very high88.5Confident14 Ų1431.4 Ų31.47%0.07218%0.175CC..Hα-helixtrans-61.9-47.5172.7-66.3159.5000110.1D301 R302 H307 N308 L309 L328 I330 I338D301-I305 WeakPolarHBondContact O-CB 3.23Å; D301-I305 WeakPolarHBondContact O-CD1 3.48Å; D301-I305 WeakPolarHBondContact O-CG1 3.34Å; D301-I305 PolarHBondContact O-N 3.02Å; R302-I305 PolarHBondContact O-N 3.35Å; I305-H307 VanDerWaalsContact C-N 3.34Å; I305-H307 PolarHBondContact O-N 2.97Å; I305-N308 PolarHBondContact O-N 3.34Å; I305-L309 VanDerWaalsContact O-CB 3.3Å; I305-L309 WeakPolarHBondContact O-CB 3.19Å; I305-L309 PolarHBondContact O-N 2.86Å; I305-L328 HydrophobicContact CG2-CD1 4.47Å; I305-I330 HydrophobicContact CD1-CD1 4.47Å; I305-I330 HydrophobicContact CD1-CG2 3.75Å; I305-I330 HydrophobicContact CG1-CD1 4.45Å; I305-I330 HydrophobicContact CG1-CG2 4.04Å; I305-I330 HydrophobicContact CG2-CD1 3.71Å; I305-I338 HydrophobicContact CB-CD1 4.37Å; I305-I338 HydrophobicContact CD1-CD1 4.33Å; I305-I338 HydrophobicContact CG2-CD1 3.56Å; I305-I338 HydrophobicContact CG2-CG2 4.21Å
306E90.9Very high89.3Confident4 Ų431.5 Ų31.52%0.01917%0.169CC..Hα-helixtrans-60.6-43177.3-70.1-176.6-179.900111.7A238 R302 L309 L310 I338 M342 R347A238-E306 HydrophobicContact CB-CB 4.32Å; R302-E306 IonicContact CZ-OE1 2.91Å; R302-E306 IonicContact NE-OE1 2.84Å; R302-E306 PolarHBondContact NE-OE1 2.97Å; R302-E306 VanDerWaalsContact NE-OE1 3.08Å; R302-E306 IonicContact NH2-OE1 3Å; R302-E306 PolarHBondContact NH2-OE1 3.17Å; R302-E306 WeakPolarHBondContact O-CG 3.39Å; R302-E306 PolarHBondContact O-N 3.46Å; E306-L309 PolarHBondContact O-N 2.82Å; E306-L310 PolarHBondContact O-N 2.83Å; E306-L310 VanDerWaalsContact O-N 3.13Å; E306-I338 HydrophobicContact CG-CG2 4.12Å; E306-M342 HydrophobicContact CB-CE 4.21Å; E306-M342 HydrophobicContact CB-SD 3.83Å; E306-M342 HydrophobicContact CG-CG 4.47Å; E306-M342 HydrophobicContact CG-SD 3.92Å; E306-M342 WeakPolarHBondContact O-CE 3.34Å; E306-R347 IonicContact OE1-NH1 3.74Å; E306-R347 IonicContact OE1-NH2 2.72Å; E306-R347 PolarHBondContact OE1-NH2 3.47Å; E306-R347 IonicContact OE2-CZ 2.67Å; E306-R347 IonicContact OE2-NH1 3.74Å; E306-R347 PolarHBondContact OE2-NH1 3.2Å; E306-R347 IonicContact OE2-NH2 3.47Å; E306-R347 PolarHBondContact OE2-NH2 3.17Å
307H91.8Very high89.8Confident6 Ų634 Ų343%0.02817%0.168CC..Hα-helixtrans-60.5-52175174.381000112R242 M267 R271 A303 V304 I305 L309 L310 S311R242-H307 PolarHBondContact NH1-ND1 3.45Å; M267-H307 VanDerWaalsContact CA-CE1 3.49Å; M267-H307 WeakPolarHBondContact CA-CE1 3.4Å; M267-H307 PolarHBondContact O-CE1 3.14Å; R271-H307 PolarHBondContact O-NE2 3.47Å; R271-H307 VanDerWaalsContact O-NE2 3.1Å; A303-H307 WeakPolarHBondContact O-CB 3.41Å; A303-H307 PolarHBondContact O-N 3.23Å; V304-H307 PolarHBondContact O-N 3.24Å; I305-H307 VanDerWaalsContact C-N 3.34Å; I305-H307 PolarHBondContact O-N 2.97Å; H307-L309 VanDerWaalsContact C-N 3.25Å; H307-L309 PolarHBondContact O-N 3.08Å; H307-L310 PolarHBondContact O-N 3.42Å; H307-S311 PolarHBondContact NE2-OG 2.87Å; H307-S311 PolarHBondContact O-N 3.44Å; H307-S311 PolarHBondContact O-OG 3.36Å
308N93.4Very high90.4Very high5 Ų537.4 Ų37.43%0.02719%0.186CC..Hα-helixtrans-64-33.1-177.2-75.5-10.4000111.9I272 I273 V304 I305 S311 A312 L328I272-N308 HydrophobicContact CG2-CB 4.44Å; I273-N308 PolarHBondContact N-OD1 2.9Å; I273-N308 PolarHBondContact O-ND2 2.92Å; V304-N308 VanDerWaalsContact O-CB 3.28Å; V304-N308 WeakPolarHBondContact O-CB 3.27Å; V304-N308 VanDerWaalsContact O-CG 3.24Å; V304-N308 PolarHBondContact O-N 3.34Å; I305-N308 PolarHBondContact O-N 3.34Å; N308-S311 WeakPolarHBondContact O-CB 3.4Å; N308-S311 PolarHBondContact O-N 2.79Å; N308-A312 WeakPolarHBondContact O-CB 3.5Å; N308-A312 PolarHBondContact O-N 3.1Å; N308-L328 HydrophobicContact CB-CD2 3.23Å
309L92.7Very high90.8Very high0 Ų036.8 Ų36.80%018%0.181CC..Hα-helixtrans-66.9-43.5175.3-172.261.4000111.7I305 E306 H307 S311 A312 S313 L324 L328 I338 A339 M342 M348 F361I305-L309 VanDerWaalsContact O-CB 3.3Å; I305-L309 WeakPolarHBondContact O-CB 3.19Å; I305-L309 PolarHBondContact O-N 2.86Å; E306-L309 PolarHBondContact O-N 2.82Å; H307-L309 VanDerWaalsContact C-N 3.25Å; H307-L309 PolarHBondContact O-N 3.08Å; L309-S311 VanDerWaalsContact C-N 3.3Å; L309-S311 PolarHBondContact O-N 2.97Å; L309-A312 PolarHBondContact O-N 3.1Å; L309-S313 PolarHBondContact O-N 2.93Å; L309-L324 HydrophobicContact CD1-CD1 3.87Å; L309-L324 HydrophobicContact CD1-CD2 3.6Å; L309-L324 HydrophobicContact CD1-CG 4.19Å; L309-L328 HydrophobicContact CD1-CD1 4.2Å; L309-I338 HydrophobicContact CD2-CG2 4.13Å; L309-A339 VanDerWaalsContact CD2-CA 3.48Å; L309-A339 HydrophobicContact CD2-CB 3.83Å; L309-M342 HydrophobicContact CB-SD 4.22Å; L309-M342 HydrophobicContact CD2-SD 3.66Å; L309-M342 HydrophobicContact CG-SD 4.31Å; L309-M348 HydrophobicContact CD2-CE 4.04Å; L309-M348 HydrophobicContact CD2-SD 4.18Å; L309-M348 HydrophobicContact CG-CE 4.21Å; L309-M348 HydrophobicContact CG-SD 3.79Å; L309-F361 HydrophobicContact CD1-CZ 4.44Å
310L90.3Very high91.3Very high33 Ų3337.7 Ų37.717%0.17319%0.187CC..Hα-helixtrans-65.5-33.6173-170.966.4000112.4E306 H307 S313 M342 M348E306-L310 PolarHBondContact O-N 2.83Å; E306-L310 VanDerWaalsContact O-N 3.13Å; H307-L310 PolarHBondContact O-N 3.42Å; L310-S313 PolarHBondContact O-OG 3.37Å; L310-M342 HydrophobicContact CB-CE 4.24Å; L310-M348 HydrophobicContact CD1-CB 4.39Å; L310-M348 HydrophobicContact CD1-CG 4.44Å
311S90.8Very high91.7Very high0 Ų037.8 Ų37.80%019%0.188CC..Hα-helixtrans-65-45.8170.8-76.80000111.5D270 H307 N308 L309 S313 K314 L315D270-S311 WeakPolarHBondContact O-CB 3.35Å; D270-S311 PolarHBondContact O-OG 3.38Å; H307-S311 PolarHBondContact NE2-OG 2.87Å; H307-S311 PolarHBondContact O-N 3.44Å; H307-S311 PolarHBondContact O-OG 3.36Å; N308-S311 WeakPolarHBondContact O-CB 3.4Å; N308-S311 PolarHBondContact O-N 2.79Å; L309-S311 VanDerWaalsContact C-N 3.3Å; L309-S311 PolarHBondContact O-N 2.97Å; S311-S313 VanDerWaalsContact C-N 3.27Å; S311-S313 PolarHBondContact O-N 2.92Å; S311-K314 WeakPolarHBondContact O-CB 3.43Å; S311-K314 PolarHBondContact O-N 3.44Å; S311-K314 VanDerWaalsContact O-N 3.1Å; S311-L315 WeakPolarHBondContact O-CG 3.41Å; S311-L315 PolarHBondContact O-N 2.72Å
312A92.4Very high92Very high0 Ų040.8 Ų40.80%020%0.2CC..Hα-helixtrans-60.6-38177.400000111.4N308 L309 K314 L315 Y316 L324 L327N308-A312 WeakPolarHBondContact O-CB 3.5Å; N308-A312 PolarHBondContact O-N 3.1Å; L309-A312 PolarHBondContact O-N 3.1Å; A312-K314 PolarHBondContact O-N 3.13Å; A312-K314 VanDerWaalsContact O-N 3.1Å; A312-L315 PolarHBondContact O-N 3.35Å; A312-Y316 HydrophobicContact CB-CD2 4.19Å; A312-Y316 WeakPolarHBondContact O-CD2 3.49Å; A312-Y316 PolarHBondContact O-N 3.1Å; A312-L324 HydrophobicContact CB-CD1 4.2Å; A312-L327 HydrophobicContact CB-CD2 4.35Å
313S91.1Very high92.5Very high25 Ų2542.8 Ų42.818%0.17521%0.212CC..Hα-helixtrans-63.2-18.3177.386.30000114.3L309 L310 S311 F361L309-S313 PolarHBondContact O-N 2.93Å; L310-S313 PolarHBondContact O-OG 3.37Å; S311-S313 VanDerWaalsContact C-N 3.27Å; S311-S313 PolarHBondContact O-N 2.92Å; S313-F361 VanDerWaalsContact CA-CG 3.49Å
314K87.4Confident92.8Very high109 Ų10942.6 Ų42.647%0.47421%0.21SC..Hα-helixtrans-91.2-16.9175.5-65.4172.1-178.7178.80112.8D270 S311 A312D270-K314 HydrophobicContact CB-CD 3.98Å; D270-K314 IonicContact OD1-NZ 3.39Å; D270-K314 PolarHBondContact OD1-NZ 3.47Å; D270-K314 IonicContact OD2-NZ 3.58Å; D270-K314 PolarHBondContact OD2-NZ 3.33Å; S311-K314 WeakPolarHBondContact O-CB 3.43Å; S311-K314 PolarHBondContact O-N 3.44Å; S311-K314 VanDerWaalsContact O-N 3.1Å; A312-K314 PolarHBondContact O-N 3.13Å; A312-K314 VanDerWaalsContact O-N 3.1Å
315L88Confident92.9Very high113 Ų11342.3 Ų42.359%0.59221%0.209SC*.Hα-helixtrans-101.6-33.8-175.2-65.1174.3000112.4I272 S311 A312I272-L315 HydrophobicContact CD1-CD1 4.17Å; I272-L315 HydrophobicContact CG1-CD1 4.5Å; S311-L315 WeakPolarHBondContact O-CG 3.41Å; S311-L315 PolarHBondContact O-N 2.72Å; A312-L315 PolarHBondContact O-N 3.35Å
316Y91.4Very high93Very high95 Ų9545.3 Ų45.337%0.37324%0.236SC..  trans-114.1145.6-176-60.5-85.3000110.6A312 I319 L327 F361A312-Y316 HydrophobicContact CB-CD2 4.19Å; A312-Y316 WeakPolarHBondContact O-CD2 3.49Å; A312-Y316 PolarHBondContact O-N 3.1Å; Y316-I319 HydrophobicContact CD2-CD1 4.44Å; Y316-I319 HydrophobicContact CE1-CD1 4.47Å; Y316-I319 HydrophobicContact CE2-CD1 4.41Å; Y316-L327 HydrophobicContact CE2-CD2 3.81Å; Y316-F361 WeakPolarHBondContact O-CD2 3.3Å
317N90.4Very high93.1Very high111 Ų11146.4 Ų46.459%0.59424%0.242SC*.SBendtrans-78.2-38.4167.3-65.4-33.5000110.6F361 T363N317-F361 PolarHBondContact O-N 3.2Å; N317-T363 HydrophobicContact CB-CG2 4.03Å
318N94.2Very high93.1Very high83 Ų8346.6 Ų46.644%0.44424%0.243SC..EExtended strand (participates in β ladder)trans-155.316017552.264.9000109.2I358 V359N318-I358 HydrophobicContact CB-CG2 3.87Å; N318-V359 WeakPolarHBondContact CA-O 3.47Å; N318-V359 WeakPolarHBondContact CB-O 3.36Å
319I97.2Very high93Very high9 Ų952 Ų525%0.04627%0.268CS..EExtended strand (participates in β ladder)trans-156.7145.4178.6-169.5168.7000109.9Y316 E323 L324 L327 V359 F361Y316-I319 HydrophobicContact CD2-CD1 4.44Å; Y316-I319 HydrophobicContact CE1-CD1 4.47Å; Y316-I319 HydrophobicContact CE2-CD1 4.41Å; I319-E323 HydrophobicContact CD1-CB 4.09Å; I319-E323 HydrophobicContact CG1-CB 3.89Å; I319-L324 HydrophobicContact CD1-CB 4.16Å; I319-L324 HydrophobicContact CD1-CD1 4.44Å; I319-L324 HydrophobicContact CG1-CB 4.27Å; I319-L324 HydrophobicContact CG2-CB 4Å; I319-L324 HydrophobicContact CG2-CD1 4.16Å; I319-L324 HydrophobicContact CG2-CD2 4.19Å; I319-L324 HydrophobicContact CG2-CG 4.34Å; I319-L327 HydrophobicContact CD1-CD2 4.38Å; I319-V359 HydrophobicContact CG2-CG1 3.58Å; I319-V359 PolarHBondContact N-O 2.97Å; I319-V359 VanDerWaalsContact N-O 3.12Å; I319-V359 PolarHBondContact O-N 2.72Å; I319-F361 HydrophobicContact CG2-CE2 3.64Å; I319-F361 HydrophobicContact CG2-CZ 4.03Å
320T97.8Very high93Very high38 Ų3853.2 Ų53.223%0.23327%0.274CS..EExtended strand (participates in β ladder)trans-70.4152.3173.460.70000110.9E322 E323 L324 I358T320-E322 VanDerWaalsContact C-N 3.25Å; T320-E322 PolarHBondContact O-N 2.98Å; T320-E323 PolarHBondContact O-N 3.31Å; T320-E323 WeakPolarHBondContact OG1-CB 3.22Å; T320-E323 VanDerWaalsContact OG1-CG 3.23Å; T320-E323 WeakPolarHBondContact OG1-CG 3.48Å; T320-E323 PolarHBondContact OG1-N 3.02Å; T320-E323 PolarHBondContact OG1-OE2 2.89Å; T320-L324 WeakPolarHBondContact O-CB 3.47Å; T320-L324 PolarHBondContact O-N 3.29Å; T320-I358 HydrophobicContact CG2-CG1 4.08Å
321F97.3Very high93.1Very high6 Ų655.6 Ų55.63%0.02629%0.292CS..Hα-helixtrans-67.4-26.2176.8-71.4-58.2000113.2L324 G325 P332 A335 E336 A339 I352 G357 V359F321-L324 HydrophobicContact CD1-CD2 4.11Å; F321-L324 HydrophobicContact CE1-CD2 4.33Å; F321-G325 PolarHBondContact O-N 3.23Å; F321-P332 HydrophobicContact CB-CB 4.17Å; F321-P332 WeakPolarHBondContact O-CB 3.03Å; F321-A335 HydrophobicContact CD1-CB 4.45Å; F321-E336 HydrophobicContact CD1-CB 3.84Å; F321-E336 HydrophobicContact CD2-CB 4.05Å; F321-E336 HydrophobicContact CD2-CG 4.19Å; F321-E336 VanDerWaalsContact CE1-CA 3.41Å; F321-E336 HydrophobicContact CE1-CB 3.76Å; F321-E336 HydrophobicContact CE1-CG 4.16Å; F321-E336 HydrophobicContact CE2-CB 3.95Å; F321-E336 HydrophobicContact CE2-CG 3.69Å; F321-E336 HydrophobicContact CG-CB 4.01Å; F321-E336 HydrophobicContact CZ-CB 3.82Å; F321-E336 HydrophobicContact CZ-CG 3.68Å; F321-A339 HydrophobicContact CE1-CB 4.35Å; F321-I352 HydrophobicContact CE2-CG2 3.72Å; F321-I352 HydrophobicContact CZ-CB 4.46Å; F321-I352 HydrophobicContact CZ-CD1 4.11Å; F321-I352 HydrophobicContact CZ-CG1 4.07Å; F321-I352 HydrophobicContact CZ-CG2 3.67Å; F321-G357 VanDerWaalsContact CD2-C 3.46Å; F321-G357 WeakPolarHBondContact CD2-O 3.36Å; F321-G357 PolarHBondContact N-O 3.11Å; F321-V359 HydrophobicContact CE1-CB 3.95Å; F321-V359 HydrophobicContact CE1-CG1 4.17Å; F321-V359 HydrophobicContact CZ-CB 3.97Å
322E96.8Very high93.4Very high119 Ų11958.1 Ų58.156%0.55631%0.308SS*.Hα-helixtrans-62.8-52.3172.5-68.474.2-163.200111.5T320 G325 A326T320-E322 VanDerWaalsContact C-N 3.25Å; T320-E322 PolarHBondContact O-N 2.98Å; E322-G325 PolarHBondContact O-N 3.47Å; E322-A326 PolarHBondContact O-N 2.98Å
323E96.3Very high93.5Very high118 Ų11861.5 Ų61.555%0.55134%0.336SS*.Hα-helixtrans-70.3-38.3-180-69.1171.3141.600111.7I319 T320 A326 L327I319-E323 HydrophobicContact CD1-CB 4.09Å; I319-E323 HydrophobicContact CG1-CB 3.89Å; T320-E323 PolarHBondContact O-N 3.31Å; T320-E323 WeakPolarHBondContact OG1-CB 3.22Å; T320-E323 VanDerWaalsContact OG1-CG 3.23Å; T320-E323 WeakPolarHBondContact OG1-CG 3.48Å; T320-E323 PolarHBondContact OG1-N 3.02Å; T320-E323 PolarHBondContact OG1-OE2 2.89Å; E323-A326 PolarHBondContact O-N 3.23Å; E323-L327 VanDerWaalsContact O-CB 3.3Å; E323-L327 WeakPolarHBondContact O-CB 3.45Å; E323-L327 PolarHBondContact O-N 2.67Å
324L95.4Very high93.5Very high0 Ų062.7 Ų62.70%034%0.338CS..Hα-helixtrans-63.6-44175.4-177.660.5000111.1L309 A312 I319 T320 F321 A326 L327 L328 A335 V359L309-L324 HydrophobicContact CD1-CD1 3.87Å; L309-L324 HydrophobicContact CD1-CD2 3.6Å; L309-L324 HydrophobicContact CD1-CG 4.19Å; A312-L324 HydrophobicContact CB-CD1 4.2Å; I319-L324 HydrophobicContact CD1-CB 4.16Å; I319-L324 HydrophobicContact CD1-CD1 4.44Å; I319-L324 HydrophobicContact CG1-CB 4.27Å; I319-L324 HydrophobicContact CG2-CB 4Å; I319-L324 HydrophobicContact CG2-CD1 4.16Å; I319-L324 HydrophobicContact CG2-CD2 4.19Å; I319-L324 HydrophobicContact CG2-CG 4.34Å; T320-L324 WeakPolarHBondContact O-CB 3.47Å; T320-L324 PolarHBondContact O-N 3.29Å; F321-L324 HydrophobicContact CD1-CD2 4.11Å; F321-L324 HydrophobicContact CE1-CD2 4.33Å; L324-A326 PolarHBondContact O-N 3.47Å; L324-L327 PolarHBondContact O-N 3.05Å; L324-L328 HydrophobicContact CD1-CD1 3.73Å; L324-L328 HydrophobicContact CD1-CG 3.97Å; L324-L328 HydrophobicContact CG-CD1 3.85Å; L324-L328 HydrophobicContact CG-CG 4.37Å; L324-L328 VanDerWaalsContact O-CB 3.3Å; L324-L328 WeakPolarHBondContact O-CB 3.38Å; L324-L328 WeakPolarHBondContact O-CG 3.39Å; L324-L328 PolarHBondContact O-N 3.38Å; L324-A335 HydrophobicContact CD2-CB 4.25Å; L324-A335 HydrophobicContact CG-CB 4.26Å; L324-V359 HydrophobicContact CD2-CG1 3.9Å
325G94.3Very high93.9Very high1 Ų157.6 Ų57.61%0.0132%0.316CS..Hα-helixtrans-58.6-46.917400000111.9F321 E322 L327 L328 E329 I330F321-G325 PolarHBondContact O-N 3.23Å; E322-G325 PolarHBondContact O-N 3.47Å; G325-L327 PolarHBondContact O-N 3.08Å; G325-L328 CarbonylContact O-C 3.5Å; G325-L328 PolarHBondContact O-N 2.81Å; G325-E329 WeakPolarHBondContact O-CA 3.41Å; G325-E329 PolarHBondContact O-N 3.32Å; G325-I330 CarbonylContact C-O 3.52Å; G325-I330 WeakPolarHBondContact CA-O 3.43Å; G325-I330 PolarHBondContact O-N 3.28Å; G325-I330 VanDerWaalsContact O-O 3.07Å
326A94.2Very high94.2Very high77 Ų7754.9 Ų54.964%0.63630%0.301SS*.Hα-helixtrans-61.7-41.5176.100000112.7E322 E323 L324 L328 E329E322-A326 PolarHBondContact O-N 2.98Å; E323-A326 PolarHBondContact O-N 3.23Å; L324-A326 PolarHBondContact O-N 3.47Å; A326-L328 VanDerWaalsContact C-N 3.32Å; A326-L328 PolarHBondContact O-N 3.42Å; A326-E329 PolarHBondContact O-N 2.91Å
327L92.4Very high94.4Very high26 Ų2656.9 Ų56.914%0.13631%0.311CS..Hα-helixtrans-64.5-36.9178.4-178.967.1000112.5I272 R274 A312 Y316 I319 E323 L324 G325I272-L327 HydrophobicContact CD1-CD1 3.84Å; I272-L327 HydrophobicContact CD1-CD2 3.71Å; I272-L327 HydrophobicContact CD1-CG 3.88Å; R274-L327 PolarHBondContact NH1-O 3.24Å; A312-L327 HydrophobicContact CB-CD2 4.35Å; Y316-L327 HydrophobicContact CE2-CD2 3.81Å; I319-L327 HydrophobicContact CD1-CD2 4.38Å; E323-L327 VanDerWaalsContact O-CB 3.3Å; E323-L327 WeakPolarHBondContact O-CB 3.45Å; E323-L327 PolarHBondContact O-N 2.67Å; L324-L327 PolarHBondContact O-N 3.05Å; G325-L327 PolarHBondContact O-N 3.08Å
328L91.1Very high94.4Very high10 Ų1052 Ų525%0.05229%0.285CS..Hα-helixtrans-91.3-4.2-178.2-63.4-177.2000113.6I305 N308 L309 L324 G325 A326 I330I305-L328 HydrophobicContact CG2-CD1 4.47Å; N308-L328 HydrophobicContact CB-CD2 3.23Å; L309-L328 HydrophobicContact CD1-CD1 4.2Å; L324-L328 HydrophobicContact CD1-CD1 3.73Å; L324-L328 HydrophobicContact CD1-CG 3.97Å; L324-L328 HydrophobicContact CG-CD1 3.85Å; L324-L328 HydrophobicContact CG-CG 4.37Å; L324-L328 VanDerWaalsContact O-CB 3.3Å; L324-L328 WeakPolarHBondContact O-CB 3.38Å; L324-L328 WeakPolarHBondContact O-CG 3.39Å; L324-L328 PolarHBondContact O-N 3.38Å; G325-L328 CarbonylContact O-C 3.5Å; G325-L328 PolarHBondContact O-N 2.81Å; A326-L328 VanDerWaalsContact C-N 3.32Å; A326-L328 PolarHBondContact O-N 3.42Å; L328-I330 VanDerWaalsContact C-N 3.33Å; L328-I330 HydrophobicContact CB-CD1 4.1Å; L328-I330 HydrophobicContact CB-CG1 3.79Å; L328-I330 HydrophobicContact CD1-CD1 4.06Å; L328-I330 PolarHBondContact O-N 3.17Å
329E91.3Very high94.4Very high120 Ų12048.1 Ų48.156%0.56126%0.264SS*.THydrogen-bonded Turntrans59.238.5-175.6-58.6169.4-16600112.9G275 G325 A326G275-E329 VanDerWaalsContact CA-OE2 3.27Å; G275-E329 WeakPolarHBondContact CA-OE2 3.13Å; G275-E329 PolarHBondContact N-OE2 2.86Å; G325-E329 WeakPolarHBondContact O-CA 3.41Å; G325-E329 PolarHBondContact O-N 3.32Å; A326-E329 PolarHBondContact O-N 2.91Å
330I92.1Very high94.4Very high25 Ų2550.2 Ų50.213%0.12828%0.279CS..SBendtrans-135.2160.7179.262174.6000113I305 G325 L328 K334 A335I305-I330 HydrophobicContact CD1-CD1 4.47Å; I305-I330 HydrophobicContact CD1-CG2 3.75Å; I305-I330 HydrophobicContact CG1-CD1 4.45Å; I305-I330 HydrophobicContact CG1-CG2 4.04Å; I305-I330 HydrophobicContact CG2-CD1 3.71Å; G325-I330 CarbonylContact C-O 3.52Å; G325-I330 WeakPolarHBondContact CA-O 3.43Å; G325-I330 PolarHBondContact O-N 3.28Å; G325-I330 VanDerWaalsContact O-O 3.07Å; L328-I330 VanDerWaalsContact C-N 3.33Å; L328-I330 HydrophobicContact CB-CD1 4.1Å; L328-I330 HydrophobicContact CB-CG1 3.79Å; L328-I330 HydrophobicContact CD1-CD1 4.06Å; L328-I330 PolarHBondContact O-N 3.17Å; I330-K334 HydrophobicContact CD1-CG 4.46Å; I330-A335 HydrophobicContact CD1-CB 3.87Å; I330-A335 HydrophobicContact CG1-CB 4.25Å
331P94.2Very high94.1Very high83 Ų8351.2 Ų51.254%0.53928%0.281SS..  trans-60.8142.5174.3-24.234.8000112.8A333 K334 A335P331-A333 VanDerWaalsContact C-N 3.34Å; P331-A333 PolarHBondContact O-N 2.86Å; P331-K334 HydrophobicContact CB-CB 4.41Å; P331-K334 WeakPolarHBondContact O-CA 3.45Å; P331-K334 WeakPolarHBondContact O-CB 3.48Å; P331-K334 PolarHBondContact O-N 3.28Å; P331-A335 PolarHBondContact O-N 3.36Å; P331-A335 VanDerWaalsContact O-N 3.11Å
332P95.4Very high93.8Very high52 Ų5250.9 Ų50.934%0.33828%0.28SS..Hα-helixtrans-53.4-45.3-179.2-3037000113.9F321 K334 A335 E336F321-P332 HydrophobicContact CB-CB 4.17Å; F321-P332 WeakPolarHBondContact O-CB 3.03Å; P332-K334 PolarHBondContact O-N 2.92Å; P332-A335 WeakPolarHBondContact O-CA 3.42Å; P332-A335 WeakPolarHBondContact O-CB 3.37Å; P332-A335 PolarHBondContact O-N 3Å; P332-E336 PolarHBondContact O-N 2.72Å
333A94.4Very high93.6Very high72 Ų7247.3 Ų47.360%0.59526%0.264SS*.Hα-helixtrans-61.2-30.1177.200000113.3P331 K337P331-A333 VanDerWaalsContact C-N 3.34Å; P331-A333 PolarHBondContact O-N 2.86Å; A333-K337 WeakPolarHBondContact O-CB 3.28Å; A333-K337 PolarHBondContact O-N 2.68Å
334K92.3Very high93.5Very high50 Ų5047.1 Ų47.122%0.21727%0.272CS..Hα-helixtrans-74.2-39.2174.7-170.8169.8-174.3164.70110.6D295 S297 I330 P331 P332 K337 I338D295-K334 WeakPolarHBondContact OD2-CE 3.46Å; D295-K334 IonicContact OD2-NZ 3.35Å; D295-K334 PolarHBondContact OD2-NZ 3.34Å; S297-K334 PolarHBondContact OG-NZ 3.05Å; I330-K334 HydrophobicContact CD1-CG 4.46Å; P331-K334 HydrophobicContact CB-CB 4.41Å; P331-K334 WeakPolarHBondContact O-CA 3.45Å; P331-K334 WeakPolarHBondContact O-CB 3.48Å; P331-K334 PolarHBondContact O-N 3.28Å; P332-K334 PolarHBondContact O-N 2.92Å; K334-K337 PolarHBondContact O-N 2.86Å; K334-I338 HydrophobicContact CG-CD1 3.9Å; K334-I338 WeakPolarHBondContact O-CG1 3.48Å; K334-I338 PolarHBondContact O-N 3.28Å
335A94.7Very high93.2Very high1 Ų152.2 Ų52.21%0.00830%0.295CS..Hα-helixtrans-61.2-46.8175.100000111.6F321 L324 I330 P331 P332 K337 I338 A339F321-A335 HydrophobicContact CD1-CB 4.45Å; L324-A335 HydrophobicContact CD2-CB 4.25Å; L324-A335 HydrophobicContact CG-CB 4.26Å; I330-A335 HydrophobicContact CD1-CB 3.87Å; I330-A335 HydrophobicContact CG1-CB 4.25Å; P331-A335 PolarHBondContact O-N 3.36Å; P331-A335 VanDerWaalsContact O-N 3.11Å; P332-A335 WeakPolarHBondContact O-CA 3.42Å; P332-A335 WeakPolarHBondContact O-CB 3.37Å; P332-A335 PolarHBondContact O-N 3Å; A335-K337 PolarHBondContact O-N 2.92Å; A335-I338 PolarHBondContact O-N 2.85Å; A335-A339 VanDerWaalsContact O-CB 3.32Å; A335-A339 WeakPolarHBondContact O-CB 3.34Å; A335-A339 PolarHBondContact O-N 3.33Å
336E95.7Very high92.9Very high57 Ų5754.9 Ų54.927%0.26632%0.323SS..Hα-helixtrans-57.3-49.9175.3-178.8-176.3175.300111.9F321 P332 I338 A339 S340 Q354F321-E336 HydrophobicContact CD1-CB 3.84Å; F321-E336 HydrophobicContact CD2-CB 4.05Å; F321-E336 HydrophobicContact CD2-CG 4.19Å; F321-E336 VanDerWaalsContact CE1-CA 3.41Å; F321-E336 HydrophobicContact CE1-CB 3.76Å; F321-E336 HydrophobicContact CE1-CG 4.16Å; F321-E336 HydrophobicContact CE2-CB 3.95Å; F321-E336 HydrophobicContact CE2-CG 3.69Å; F321-E336 HydrophobicContact CG-CB 4.01Å; F321-E336 HydrophobicContact CZ-CB 3.82Å; F321-E336 HydrophobicContact CZ-CG 3.68Å; P332-E336 PolarHBondContact O-N 2.72Å; E336-I338 VanDerWaalsContact C-N 3.34Å; E336-I338 PolarHBondContact O-N 3.31Å; E336-A339 PolarHBondContact O-N 3.18Å; E336-S340 WeakPolarHBondContact O-CB 3.4Å; E336-S340 PolarHBondContact O-N 2.97Å; E336-Q354 PolarHBondContact OE1-NE2 3.39Å
337K94.3Very high92.5Very high137 Ų13754 Ų5460%0.59630%0.303SS*.Hα-helixtrans-59.6-43.1-179.6-175.1176.6-179.71780112.4A333 K334 A335 Q341A333-K337 WeakPolarHBondContact O-CB 3.28Å; A333-K337 PolarHBondContact O-N 2.68Å; K334-K337 PolarHBondContact O-N 2.86Å; A335-K337 PolarHBondContact O-N 2.92Å; K337-Q341 WeakPolarHBondContact O-CG 3.31Å; K337-Q341 PolarHBondContact O-N 2.86Å; K337-Q341 VanDerWaalsContact O-N 3.14Å
338I91.8Very high92.3Very high9 Ų953 Ų535%0.04630%0.297CS..Hα-helixtrans-72.2-40.5-180-64.9169.8000110.6I305 E306 L309 K334 A335 E336 S340 Q341 M342I305-I338 HydrophobicContact CB-CD1 4.37Å; I305-I338 HydrophobicContact CD1-CD1 4.33Å; I305-I338 HydrophobicContact CG2-CD1 3.56Å; I305-I338 HydrophobicContact CG2-CG2 4.21Å; E306-I338 HydrophobicContact CG-CG2 4.12Å; L309-I338 HydrophobicContact CD2-CG2 4.13Å; K334-I338 HydrophobicContact CG-CD1 3.9Å; K334-I338 WeakPolarHBondContact O-CG1 3.48Å; K334-I338 PolarHBondContact O-N 3.28Å; A335-I338 PolarHBondContact O-N 2.85Å; E336-I338 VanDerWaalsContact C-N 3.34Å; E336-I338 PolarHBondContact O-N 3.31Å; I338-S340 VanDerWaalsContact C-N 3.34Å; I338-S340 PolarHBondContact O-N 3.07Å; I338-Q341 PolarHBondContact O-N 3.4Å; I338-M342 HydrophobicContact CG2-CG 4.39Å; I338-M342 HydrophobicContact CG2-SD 4.2Å; I338-M342 WeakPolarHBondContact O-CG 3.34Å; I338-M342 PolarHBondContact O-N 3.46Å
339A94.5Very high92.3Very high0 Ų056.9 Ų56.90%032%0.318CS..Hα-helixtrans-57.2-47.6173.700000111.7L309 F321 A335 E336 Q341 M342 I343 M348 I352L309-A339 VanDerWaalsContact CD2-CA 3.48Å; L309-A339 HydrophobicContact CD2-CB 3.83Å; F321-A339 HydrophobicContact CE1-CB 4.35Å; A335-A339 VanDerWaalsContact O-CB 3.32Å; A335-A339 WeakPolarHBondContact O-CB 3.34Å; A335-A339 PolarHBondContact O-N 3.33Å; E336-A339 PolarHBondContact O-N 3.18Å; A339-Q341 VanDerWaalsContact C-N 3.34Å; A339-Q341 PolarHBondContact O-N 2.95Å; A339-M342 PolarHBondContact O-N 3.26Å; A339-I343 WeakPolarHBondContact O-CG1 3.39Å; A339-I343 PolarHBondContact O-N 3.12Å; A339-M348 HydrophobicContact CB-CE 4.01Å; A339-I352 HydrophobicContact CB-CD1 4.17Å
340S95.3Very high92.4Very high53 Ų5352.2 Ų52.237%0.37130%0.303SS..Hα-helixtrans-58.3-44.5177.2179.50000112E336 I338 I343 T344E336-S340 WeakPolarHBondContact O-CB 3.4Å; E336-S340 PolarHBondContact O-N 2.97Å; I338-S340 VanDerWaalsContact C-N 3.34Å; I338-S340 PolarHBondContact O-N 3.07Å; S340-I343 PolarHBondContact O-N 3.3Å; S340-T344 WeakPolarHBondContact O-CB 3.29Å; S340-T344 PolarHBondContact O-N 3.08Å; S340-T344 PolarHBondContact O-OG1 3.29Å
341Q92.5Very high92.5Very high59 Ų5957.1 Ų57.128%0.27632%0.323SS..Hα-helixtrans-61.5-48.4175.5-74.2179.8-3.700112R302 K337 I338 A339 I343 T344 E345R302-Q341 VanDerWaalsContact NH2-OE1 3.11Å; K337-Q341 WeakPolarHBondContact O-CG 3.31Å; K337-Q341 PolarHBondContact O-N 2.86Å; K337-Q341 VanDerWaalsContact O-N 3.14Å; I338-Q341 PolarHBondContact O-N 3.4Å; A339-Q341 VanDerWaalsContact C-N 3.34Å; A339-Q341 PolarHBondContact O-N 2.95Å; Q341-I343 VanDerWaalsContact C-N 3.31Å; Q341-I343 PolarHBondContact O-N 3.08Å; Q341-T344 PolarHBondContact O-N 3.24Å; Q341-E345 WeakPolarHBondContact O-CB 3.36Å; Q341-E345 VanDerWaalsContact O-CG 3.3Å; Q341-E345 WeakPolarHBondContact O-CG 3.34Å; Q341-E345 PolarHBondContact O-N 3.3Å
342M91Very high92.6Very high0 Ų055.4 Ų55.40%031%0.309CS..Hα-helixtrans-64-35.2-178.6-71.2-174.469.700112.9E306 L309 L310 I338 A339 G346 R347 M348E306-M342 HydrophobicContact CB-CE 4.21Å; E306-M342 HydrophobicContact CB-SD 3.83Å; E306-M342 HydrophobicContact CG-CG 4.47Å; E306-M342 HydrophobicContact CG-SD 3.92Å; E306-M342 WeakPolarHBondContact O-CE 3.34Å; L309-M342 HydrophobicContact CB-SD 4.22Å; L309-M342 HydrophobicContact CD2-SD 3.66Å; L309-M342 HydrophobicContact CG-SD 4.31Å; L310-M342 HydrophobicContact CB-CE 4.24Å; I338-M342 HydrophobicContact CG2-CG 4.39Å; I338-M342 HydrophobicContact CG2-SD 4.2Å; I338-M342 WeakPolarHBondContact O-CG 3.34Å; I338-M342 PolarHBondContact O-N 3.46Å; A339-M342 PolarHBondContact O-N 3.26Å; M342-G346 PolarHBondContact O-N 3.01Å; M342-R347 PolarHBondContact O-N 3.14Å; M342-M348 HydrophobicContact CB-CB 3.89Å; M342-M348 HydrophobicContact CB-CE 4.26Å; M342-M348 HydrophobicContact CE-CB 4.29Å; M342-M348 PolarHBondContact O-N 3.47Å; M342-M348 VanDerWaalsContact O-N 3.11Å
343I92.9Very high92.7Very high43 Ų4355.3 Ų55.322%0.22131%0.306CS..Hα-helixtrans-68.1-48.4173.4-67.5164.5000110.6A339 S340 Q341 E345 G346 M348 G350 I352 V359A339-I343 WeakPolarHBondContact O-CG1 3.39Å; A339-I343 PolarHBondContact O-N 3.12Å; S340-I343 PolarHBondContact O-N 3.3Å; Q341-I343 VanDerWaalsContact C-N 3.31Å; Q341-I343 PolarHBondContact O-N 3.08Å; I343-E345 VanDerWaalsContact C-N 3.28Å; I343-E345 PolarHBondContact O-N 3.49Å; I343-G346 PolarHBondContact O-N 2.79Å; I343-M348 WeakPolarHBondContact CA-O 3.39Å; I343-M348 HydrophobicContact CD1-CE 3.88Å; I343-M348 HydrophobicContact CG1-CE 3.61Å; I343-G350 WeakPolarHBondContact CG2-O 3.31Å; I343-I352 HydrophobicContact CD1-CD1 4.29Å; I343-I352 HydrophobicContact CD1-CG1 4.02Å; I343-V359 HydrophobicContact CD1-CG2 4.48Å
344T93.8Very high92.7Very high115 Ų11559.2 Ų59.271%0.70631%0.312SS*.Hα-helixtrans-60.8-38-179.1-56.70000112.2S340 Q341 G346S340-T344 WeakPolarHBondContact O-CB 3.29Å; S340-T344 PolarHBondContact O-N 3.08Å; S340-T344 PolarHBondContact O-OG1 3.29Å; Q341-T344 PolarHBondContact O-N 3.24Å; T344-G346 PolarHBondContact O-N 3.37Å
345E89.7Confident92.8Very high107 Ų10764.3 Ų64.350%0.534%0.34SS..THydrogen-bonded Turntrans-80-1.6178.4-67.7169.3-173.600113.3Q341 I343 R347Q341-E345 WeakPolarHBondContact O-CB 3.36Å; Q341-E345 VanDerWaalsContact O-CG 3.3Å; Q341-E345 WeakPolarHBondContact O-CG 3.34Å; Q341-E345 PolarHBondContact O-N 3.3Å; I343-E345 VanDerWaalsContact C-N 3.28Å; I343-E345 PolarHBondContact O-N 3.49Å; E345-R347 VanDerWaalsContact C-N 3.25Å; E345-R347 HydrophobicContact CB-CG 4.11Å; E345-R347 PolarHBondContact O-N 2.91Å; E345-R347 IonicContact OE2-CZ 2.72Å; E345-R347 IonicContact OE2-NE 2.72Å; E345-R347 PolarHBondContact OE2-NE 2.84Å; E345-R347 IonicContact OE2-NH2 3.81Å; E345-R347 PolarHBondContact OE2-NH2 3.32Å
346G87.9Confident92.8Very high57 Ų5769.5 Ų69.559%0.58837%0.368SS*.THydrogen-bonded Turntrans68.421.4-179.200000114.1M342 I343 T344M342-G346 PolarHBondContact O-N 3.01Å; I343-G346 PolarHBondContact O-N 2.79Å; T344-G346 PolarHBondContact O-N 3.37Å
347R85.4Confident92.8Very high58 Ų5867.6 Ų67.622%0.21936%0.363CS..SBendtrans-91.4-18.2179-61.1-170.6-64.8125.8-9.6112.8A238 E306 M342 E345A238-R347 WeakPolarHBondContact O-CD 3.29Å; A238-R347 PolarHBondContact O-NH1 3.45Å; E306-R347 IonicContact OE1-NH1 3.74Å; E306-R347 IonicContact OE1-NH2 2.72Å; E306-R347 PolarHBondContact OE1-NH2 3.47Å; E306-R347 IonicContact OE2-CZ 2.67Å; E306-R347 IonicContact OE2-NH1 3.74Å; E306-R347 PolarHBondContact OE2-NH1 3.2Å; E306-R347 IonicContact OE2-NH2 3.47Å; E306-R347 PolarHBondContact OE2-NH2 3.17Å; M342-R347 PolarHBondContact O-N 3.14Å; E345-R347 VanDerWaalsContact C-N 3.25Å; E345-R347 HydrophobicContact CB-CG 4.11Å; E345-R347 PolarHBondContact O-N 2.91Å; E345-R347 IonicContact OE2-CZ 2.72Å; E345-R347 IonicContact OE2-NE 2.72Å; E345-R347 PolarHBondContact OE2-NE 2.84Å; E345-R347 IonicContact OE2-NH2 3.81Å; E345-R347 PolarHBondContact OE2-NH2 3.32Å
348M89Confident93Very high4 Ų462.8 Ų62.82%0.0234%0.343CS..SBendtrans-139.2135.8175.4-178.6177.171.800109.3L309 L310 A339 M342 I343 F361L309-M348 HydrophobicContact CD2-CE 4.04Å; L309-M348 HydrophobicContact CD2-SD 4.18Å; L309-M348 HydrophobicContact CG-CE 4.21Å; L309-M348 HydrophobicContact CG-SD 3.79Å; L310-M348 HydrophobicContact CD1-CB 4.39Å; L310-M348 HydrophobicContact CD1-CG 4.44Å; A339-M348 HydrophobicContact CB-CE 4.01Å; M342-M348 HydrophobicContact CB-CB 3.89Å; M342-M348 HydrophobicContact CB-CE 4.26Å; M342-M348 HydrophobicContact CE-CB 4.29Å; M342-M348 PolarHBondContact O-N 3.47Å; M342-M348 VanDerWaalsContact O-N 3.11Å; I343-M348 WeakPolarHBondContact CA-O 3.39Å; I343-M348 HydrophobicContact CD1-CE 3.88Å; I343-M348 HydrophobicContact CG1-CE 3.61Å; M348-F361 HydrophobicContact CE-CE1 4.23Å; M348-F361 HydrophobicContact SD-CD1 4.18Å; M348-F361 HydrophobicContact SD-CE1 3.78Å
349N89.9Confident93.2Very high92 Ų9262.3 Ų62.349%0.49234%0.341SS..  trans-93.7135.4177.7-60.2-17.6000110.5E362N349-E362 HydrophobicContact CB-CB 3.62Å; N349-E362 HydrophobicContact CB-CG 4.33Å; N349-E362 WeakPolarHBondContact CB-OE2 3.45Å; N349-E362 VanDerWaalsContact CG-OE2 3.3Å; N349-E362 PolarHBondContact ND2-OE2 3.44Å; N349-E362 PolarHBondContact O-N 3.09Å
350G92.6Very high93.3Very high23 Ų2364.6 Ų64.624%0.23735%0.352CS..EExtended strand (participates in β ladder)trans155.4-178.1-179.600000112.1I343 H360I343-G350 WeakPolarHBondContact CG2-O 3.31Å; G350-H360 CarbonylContact C-O 3.58Å; G350-H360 WeakPolarHBondContact CA-O 3.29Å
351F95.2Very high93.2Very high127 Ų12762.3 Ų62.356%0.55734%0.335SS*.EExtended strand (participates in β ladder)trans-141.4160.1172.964.2-89.2000110.4H360F351-H360 HydrophobicContact CD1-CB 4.02Å; F351-H360 HydrophobicContact CD2-CB 4.16Å; F351-H360 HydrophobicContact CE1-CB 3.61Å; F351-H360 HydrophobicContact CE2-CB 3.77Å; F351-H360 AromaticContact CE2-CD2 3.5Å; F351-H360 AromaticContact CE2-CG 3.68Å; F351-H360 HydrophobicContact CG-CB 4.28Å; F351-H360 HydrophobicContact CZ-CB 3.48Å; F351-H360 VanDerWaalsContact CZ-CB 3.48Å; F351-H360 AromaticContact CZ-CD2 3.9Å; F351-H360 AromaticContact CZ-CG 3.58Å; F351-H360 PolarHBondContact N-O 3.03Å; F351-H360 PolarHBondContact O-N 3.23Å
352I97.1Very high92.6Very high47 Ų4765.7 Ų65.724%0.24135%0.351CS..EExtended strand (participates in β ladder)trans-110.6126.3-178.2-64.6174.4000108.7F321 A339 I343 V359F321-I352 HydrophobicContact CE2-CG2 3.72Å; F321-I352 HydrophobicContact CZ-CB 4.46Å; F321-I352 HydrophobicContact CZ-CD1 4.11Å; F321-I352 HydrophobicContact CZ-CG1 4.07Å; F321-I352 HydrophobicContact CZ-CG2 3.67Å; A339-I352 HydrophobicContact CB-CD1 4.17Å; I343-I352 HydrophobicContact CD1-CD1 4.29Å; I343-I352 HydrophobicContact CD1-CG1 4.02Å; I352-V359 HydrophobicContact CG1-CB 4.48Å; I352-V359 HydrophobicContact CG1-CG2 4.19Å
353D96.4Very high91.5Very high50 Ų5069.8 Ų69.827%0.26738%0.376SS..EExtended strand (participates in β ladder)trans-92.4107.5163.7-166.7-38.4000108.7I355 D356 G357 I358D353-I355 PolarHBondContact OD1-N 3.23Å; D353-D356 PolarHBondContact OD1-N 3.39Å; D353-D356 VanDerWaalsContact OD1-N 3.15Å; D353-G357 WeakPolarHBondContact O-CA 3.47Å; D353-G357 PolarHBondContact O-N 3.18Å; D353-I358 PolarHBondContact N-O 3.21Å; D353-I358 PolarHBondContact O-N 3.19Å
354Q94.8Very high90.3Very high154 Ų15476.1 Ų76.172%0.7240%0.397SS*.THydrogen-bonded Turntrans-79.1-22-177.6-167.4173.238.200112.9E336E336-Q354 PolarHBondContact OE1-NE2 3.39Å
355I95Very high89.5Confident158 Ų15877.1 Ų77.181%0.8139%0.394SS*.THydrogen-bonded Turntrans-73.4-47.4-179.7-61.2175.8000108.9D353D353-I355 PolarHBondContact OD1-N 3.23Å
356D94.3Very high89.1Confident110 Ų11077.3 Ų77.359%0.58840%0.404SS*.THydrogen-bonded Turntrans-88.2-11.2-178.7-69.3-14.7000112.7D353 I358D353-D356 PolarHBondContact OD1-N 3.39Å; D353-D356 VanDerWaalsContact OD1-N 3.15Å; D356-I358 HydrophobicContact CB-CD1 4.01Å; D356-I358 HydrophobicContact CB-CG1 4.19Å
357G96.1Very high89.1Confident17 Ų1780.5 Ų80.518%0.17541%0.407CS..THydrogen-bonded Turntrans70.134.9179.300000113.1F321 D353F321-G357 VanDerWaalsContact CD2-C 3.46Å; F321-G357 WeakPolarHBondContact CD2-O 3.36Å; F321-G357 PolarHBondContact N-O 3.11Å; D353-G357 WeakPolarHBondContact O-CA 3.47Å; D353-G357 PolarHBondContact O-N 3.18Å
358I96.9Very high89.3Confident35 Ų3580 Ų8018%0.17941%0.412CS..EExtended strand (participates in β ladder)trans-119.2134.7-173.2-61.4174.8000110N318 T320 D353 D356N318-I358 HydrophobicContact CB-CG2 3.87Å; T320-I358 HydrophobicContact CG2-CG1 4.08Å; D353-I358 PolarHBondContact N-O 3.21Å; D353-I358 PolarHBondContact O-N 3.19Å; D356-I358 HydrophobicContact CB-CD1 4.01Å; D356-I358 HydrophobicContact CB-CG1 4.19Å
359V96.9Very high89.1Confident0 Ų081.5 Ų81.50%042%0.421CS..EExtended strand (participates in β ladder)trans-94.2126.3164.5620000109.6N318 I319 F321 L324 I343 I352 F361N318-V359 WeakPolarHBondContact CA-O 3.47Å; N318-V359 WeakPolarHBondContact CB-O 3.36Å; I319-V359 HydrophobicContact CG2-CG1 3.58Å; I319-V359 PolarHBondContact N-O 2.97Å; I319-V359 VanDerWaalsContact N-O 3.12Å; I319-V359 PolarHBondContact O-N 2.72Å; F321-V359 HydrophobicContact CE1-CB 3.95Å; F321-V359 HydrophobicContact CE1-CG1 4.17Å; F321-V359 HydrophobicContact CZ-CB 3.97Å; L324-V359 HydrophobicContact CD2-CG1 3.9Å; I343-V359 HydrophobicContact CD1-CG2 4.48Å; I352-V359 HydrophobicContact CG1-CB 4.48Å; I352-V359 HydrophobicContact CG1-CG2 4.19Å; V359-F361 HydrophobicContact CG1-CE1 4.04Å; V359-F361 HydrophobicContact CG1-CE2 4.09Å; V359-F361 HydrophobicContact CG1-CZ 3.64Å; V359-F361 HydrophobicContact CG2-CD1 4.21Å; V359-F361 HydrophobicContact CG2-CE1 3.89Å; V359-F361 HydrophobicContact CG2-CZ 4.35Å
360H95.6Very high89.2Confident47 Ų4784.9 Ų84.922%0.21843%0.427CS..EExtended strand (participates in β ladder)trans-98.7114.7173-66.5-92.7000108.5G350 F351G350-H360 CarbonylContact C-O 3.58Å; G350-H360 WeakPolarHBondContact CA-O 3.29Å; F351-H360 HydrophobicContact CD1-CB 4.02Å; F351-H360 HydrophobicContact CD2-CB 4.16Å; F351-H360 HydrophobicContact CE1-CB 3.61Å; F351-H360 HydrophobicContact CE2-CB 3.77Å; F351-H360 AromaticContact CE2-CD2 3.5Å; F351-H360 AromaticContact CE2-CG 3.68Å; F351-H360 HydrophobicContact CG-CB 4.28Å; F351-H360 HydrophobicContact CZ-CB 3.48Å; F351-H360 VanDerWaalsContact CZ-CB 3.48Å; F351-H360 AromaticContact CZ-CD2 3.9Å; F351-H360 AromaticContact CZ-CG 3.58Å; F351-H360 PolarHBondContact N-O 3.03Å; F351-H360 PolarHBondContact O-N 3.23Å
361F93.4Very high89.1Confident6 Ų687.4 Ų87.43%0.02644%0.435CS..EExtended strand (participates in β ladder)trans-80.4150.1173.3-57.6-62.9000109.3L309 S313 Y316 N317 I319 M348 V359 T363L309-F361 HydrophobicContact CD1-CZ 4.44Å; S313-F361 VanDerWaalsContact CA-CG 3.49Å; Y316-F361 WeakPolarHBondContact O-CD2 3.3Å; N317-F361 PolarHBondContact O-N 3.2Å; I319-F361 HydrophobicContact CG2-CE2 3.64Å; I319-F361 HydrophobicContact CG2-CZ 4.03Å; M348-F361 HydrophobicContact CE-CE1 4.23Å; M348-F361 HydrophobicContact SD-CD1 4.18Å; M348-F361 HydrophobicContact SD-CE1 3.78Å; V359-F361 HydrophobicContact CG1-CE1 4.04Å; V359-F361 HydrophobicContact CG1-CE2 4.09Å; V359-F361 HydrophobicContact CG1-CZ 3.64Å; V359-F361 HydrophobicContact CG2-CD1 4.21Å; V359-F361 HydrophobicContact CG2-CE1 3.89Å; V359-F361 HydrophobicContact CG2-CZ 4.35Å; F361-T363 PolarHBondContact O-N 3.2Å
362E81.6Confident88.9Confident130 Ų13086.9 Ų86.961%0.60743%0.433SS*.  trans-60.8107.7-179.8-172.9177.4-136.100110.6N349 R364N349-E362 HydrophobicContact CB-CB 3.62Å; N349-E362 HydrophobicContact CB-CG 4.33Å; N349-E362 WeakPolarHBondContact CB-OE2 3.45Å; N349-E362 VanDerWaalsContact CG-OE2 3.3Å; N349-E362 PolarHBondContact ND2-OE2 3.44Å; N349-E362 PolarHBondContact O-N 3.09Å; E362-R364 PolarHBondContact O-N 3.33Å
363T66.4Low88.7Confident85 Ų8590.2 Ų90.252%0.52145%0.447SS..PPolyproline II helixtrans-68.3129.3170.541.90000108.8N317 F361 E365N317-T363 HydrophobicContact CB-CG2 4.03Å; F361-T363 PolarHBondContact O-N 3.2Å; T363-E365 PolarHBondContact O-N 2.87Å
364R69.4Low88.6Confident176 Ų17691.2 Ų91.266%0.66445%0.452SS*.PPolyproline II helixtrans-52.5128.4173-60.3176.1-178.5176.12.6108.8E362 T369E362-R364 PolarHBondContact O-N 3.33Å; R364-T369 WeakPolarHBondContact CB-OG1 3.47Å; R364-T369 PolarHBondContact O-OG1 3.39Å
365E75.1Confident88.6Confident136 Ų13690.2 Ų90.264%0.63645%0.447SS*.PPolyproline II helixtrans-49.9136.5179.2-67.9-176.7164.400110.7T363 L367 P368 T369T363-E365 PolarHBondContact O-N 2.87Å; E365-L367 VanDerWaalsContact C-N 3.32Å; E365-L367 PolarHBondContact O-N 2.97Å; E365-P368 HydrophobicContact CB-CB 4.49Å; E365-P368 HydrophobicContact CB-CG 3.78Å; E365-P368 WeakPolarHBondContact O-CD 3.29Å; E365-P368 WeakPolarHBondContact OE2-CG 3.49Å; E365-T369 VanDerWaalsContact O-CB 3.3Å; E365-T369 WeakPolarHBondContact O-CB 3.38Å; E365-T369 PolarHBondContact O-N 3.19Å; E365-T369 PolarHBondContact O-OG1 3.08Å
366P82.1Confident88.6Confident111 Ų11185 Ų8572%0.72142%0.424SS*.Hα-helixtrans-61.2-39-17018.7-29.5000112.7T369 W370P366-T369 PolarHBondContact O-N 3.29Å; P366-W370 WeakPolarHBondContact O-CB 3.4Å; P366-W370 PolarHBondContact O-N 3Å
367L88.8Confident88.7Confident124 Ų12484.9 Ų84.965%0.64942%0.423SS*.Hα-helixtrans-69.3-54.9179.9-68.2174.3000112.4E365 T369 W370 D371E365-L367 VanDerWaalsContact C-N 3.32Å; E365-L367 PolarHBondContact O-N 2.97Å; L367-T369 PolarHBondContact O-N 2.74Å; L367-W370 WeakPolarHBondContact O-CB 3.36Å; L367-W370 PolarHBondContact O-N 3.26Å; L367-W370 VanDerWaalsContact O-N 3.08Å; L367-D371 PolarHBondContact O-N 3.48Å
368P88Confident88.8Confident49 Ų4987.3 Ų87.332%0.31844%0.437SS..Hα-helixtrans-57-31.8172-2935.6000114.4E365 K372E365-P368 HydrophobicContact CB-CB 4.49Å; E365-P368 HydrophobicContact CB-CG 3.78Å; E365-P368 WeakPolarHBondContact O-CD 3.29Å; E365-P368 WeakPolarHBondContact OE2-CG 3.49Å; P368-K372 WeakPolarHBondContact O-CB 3.49Å; P368-K372 WeakPolarHBondContact O-CG 3.46Å; P368-K372 PolarHBondContact O-N 2.95Å
369T85.8Confident88.7Confident35 Ų3591.8 Ų91.822%0.21546%0.455CS..Hα-helixtrans-67.6-43.9175.8-58.30000111.1R364 E365 P366 L367 K372 Q373R364-T369 WeakPolarHBondContact CB-OG1 3.47Å; R364-T369 PolarHBondContact O-OG1 3.39Å; E365-T369 VanDerWaalsContact O-CB 3.3Å; E365-T369 WeakPolarHBondContact O-CB 3.38Å; E365-T369 PolarHBondContact O-N 3.19Å; E365-T369 PolarHBondContact O-OG1 3.08Å; P366-T369 PolarHBondContact O-N 3.29Å; L367-T369 PolarHBondContact O-N 2.74Å; T369-K372 PolarHBondContact O-N 3.03Å; T369-Q373 WeakPolarHBondContact O-CG 3.37Å; T369-Q373 PolarHBondContact O-N 3.03Å
370W90.9Very high88.7Confident163 Ų16397.5 Ų97.562%0.61748%0.482SS*.Hα-helixtrans-59-46175-179.961.9000111.6P366 L367 K372 Q373 I374P366-W370 WeakPolarHBondContact O-CB 3.4Å; P366-W370 PolarHBondContact O-N 3Å; L367-W370 WeakPolarHBondContact O-CB 3.36Å; L367-W370 PolarHBondContact O-N 3.26Å; L367-W370 VanDerWaalsContact O-N 3.08Å; W370-K372 VanDerWaalsContact C-N 3.34Å; W370-K372 PolarHBondContact O-N 3.06Å; W370-Q373 WeakPolarHBondContact O-CB 3.36Å; W370-Q373 PolarHBondContact O-N 3.09Å; W370-Q373 VanDerWaalsContact O-N 3.09Å; W370-I374 HydrophobicContact CD2-CD1 4Å; W370-I374 HydrophobicContact CE3-CD1 4.32Å; W370-I374 HydrophobicContact CH2-CD1 4.13Å; W370-I374 HydrophobicContact CZ2-CD1 3.76Å; W370-I374 HydrophobicContact CZ3-CD1 4.38Å; W370-I374 PolarHBondContact O-N 3.38Å
371D92.1Very high88.8Confident76 Ų7699.3 Ų99.341%0.40650%0.496SS..Hα-helixtrans-59.5-43175.7-68.5-30.2000112.2L367 Q373 I374 Q375L367-D371 PolarHBondContact O-N 3.48Å; D371-Q373 VanDerWaalsContact C-N 3.3Å; D371-Q373 PolarHBondContact O-N 2.96Å; D371-I374 PolarHBondContact O-N 3.41Å; D371-Q375 WeakPolarHBondContact O-CG 3.29Å; D371-Q375 PolarHBondContact O-N 3.34Å
372K89.8Confident88.9Confident116 Ų116103.4 Ų103.450%0.50452%0.518SS..Hα-helixtrans-62.4-35.3175.4-78.7177.5179.7174.70112.7P368 T369 W370 Q375 S376P368-K372 WeakPolarHBondContact O-CB 3.49Å; P368-K372 WeakPolarHBondContact O-CG 3.46Å; P368-K372 PolarHBondContact O-N 2.95Å; T369-K372 PolarHBondContact O-N 3.03Å; W370-K372 VanDerWaalsContact C-N 3.34Å; W370-K372 PolarHBondContact O-N 3.06Å; K372-Q375 PolarHBondContact O-N 3.26Å; K372-S376 WeakPolarHBondContact O-CB 3.38Å; K372-S376 PolarHBondContact O-N 3.49Å
373Q92.8Very high89.6Confident116 Ų11699.8 Ų99.854%0.54250%0.503SS..Hα-helixtrans-68-41.9176.3-68.5-62.1-21.800111.5T369 W370 D371 S376 L377T369-Q373 WeakPolarHBondContact O-CG 3.37Å; T369-Q373 PolarHBondContact O-N 3.03Å; W370-Q373 WeakPolarHBondContact O-CB 3.36Å; W370-Q373 PolarHBondContact O-N 3.09Å; W370-Q373 VanDerWaalsContact O-N 3.09Å; D371-Q373 VanDerWaalsContact C-N 3.3Å; D371-Q373 PolarHBondContact O-N 2.96Å; Q373-S376 PolarHBondContact O-N 3.29Å; Q373-L377 WeakPolarHBondContact O-CB 3.49Å; Q373-L377 PolarHBondContact O-N 3.48Å
374I95.2Very high91Very high72 Ų72100.8 Ų100.837%0.36951%0.505SS..Hα-helixtrans-60.8-46.9174.1-64170.9000110.2W370 D371 S376 L377 C378W370-I374 HydrophobicContact CD2-CD1 4Å; W370-I374 HydrophobicContact CE3-CD1 4.32Å; W370-I374 HydrophobicContact CH2-CD1 4.13Å; W370-I374 HydrophobicContact CZ2-CD1 3.76Å; W370-I374 HydrophobicContact CZ3-CD1 4.38Å; W370-I374 PolarHBondContact O-N 3.38Å; D371-I374 PolarHBondContact O-N 3.41Å; I374-S376 PolarHBondContact O-N 2.9Å; I374-L377 WeakPolarHBondContact O-CB 3.46Å; I374-L377 PolarHBondContact O-N 3.37Å; I374-C378 PolarHBondContact O-N 3.31Å; I374-C378 PolarHBondContact O-SG 2.98Å; I374-C378 VanDerWaalsContact O-SG 3.37Å
375Q94.8Very high92.2Very high132 Ų13296.1 Ų96.162%0.61749%0.493SS*.Hα-helixtrans-59.1-45.3176.4-71.4174.628.400112D371 K372 L377 C378 F379D371-Q375 WeakPolarHBondContact O-CG 3.29Å; D371-Q375 PolarHBondContact O-N 3.34Å; K372-Q375 PolarHBondContact O-N 3.26Å; Q375-L377 VanDerWaalsContact C-N 3.35Å; Q375-L377 PolarHBondContact O-N 3.44Å; Q375-C378 PolarHBondContact O-N 3.34Å; Q375-F379 WeakPolarHBondContact O-CB 3.39Å; Q375-F379 PolarHBondContact O-N 2.89Å
376S94.5Very high93.2Very high48 Ų4895.8 Ų95.834%0.33649%0.491SS..Hα-helixtrans-61.2-42.1177.2179.50000112K372 Q373 I374 F379 Q380K372-S376 WeakPolarHBondContact O-CB 3.38Å; K372-S376 PolarHBondContact O-N 3.49Å; Q373-S376 PolarHBondContact O-N 3.29Å; I374-S376 PolarHBondContact O-N 2.9Å; S376-F379 PolarHBondContact O-N 3.37Å; S376-Q380 WeakPolarHBondContact O-CG 3.42Å; S376-Q380 PolarHBondContact O-N 2.9Å
377L97.1Very high93.9Very high108 Ų10897.3 Ų97.357%0.56549%0.486SS*.Hα-helixtrans-60.4-50.3175.8177.265.6000110.9Q373 I374 Q375 F379 Q380 V381Q373-L377 WeakPolarHBondContact O-CB 3.49Å; Q373-L377 PolarHBondContact O-N 3.48Å; I374-L377 WeakPolarHBondContact O-CB 3.46Å; I374-L377 PolarHBondContact O-N 3.37Å; Q375-L377 VanDerWaalsContact C-N 3.35Å; Q375-L377 PolarHBondContact O-N 3.44Å; L377-F379 VanDerWaalsContact C-N 3.29Å; L377-F379 PolarHBondContact O-N 2.95Å; L377-Q380 PolarHBondContact O-N 3.31Å; L377-Q380 VanDerWaalsContact O-N 3.17Å; L377-V381 WeakPolarHBondContact O-CG2 3.29Å; L377-V381 PolarHBondContact O-N 3.17Å
378C96.9Very high94.2Very high68 Ų6894.1 Ų94.146%0.45947%0.469SS..Hα-helixtrans-60.6-39.4177.6-67.40000112I374 Q375 V381 N382I374-C378 PolarHBondContact O-N 3.31Å; I374-C378 PolarHBondContact O-SG 2.98Å; I374-C378 VanDerWaalsContact O-SG 3.37Å; Q375-C378 PolarHBondContact O-N 3.34Å; C378-V381 PolarHBondContact O-N 3.25Å; C378-N382 PolarHBondContact O-N 3.38Å
379F96.1Very high94.5Very high129 Ų12997.9 Ų97.957%0.56648%0.477SS*.Hα-helixtrans-63.6-40.9176-170.9-105.5000112Q375 S376 L377 N382 N383Q375-F379 WeakPolarHBondContact O-CB 3.39Å; Q375-F379 PolarHBondContact O-N 2.89Å; S376-F379 PolarHBondContact O-N 3.37Å; L377-F379 VanDerWaalsContact C-N 3.29Å; L377-F379 PolarHBondContact O-N 2.95Å; F379-N382 PolarHBondContact O-N 2.99Å; F379-N383 WeakPolarHBondContact CD1-ND2 3.01Å; F379-N383 WeakPolarHBondContact CE1-ND2 3.22Å; F379-N383 VanDerWaalsContact O-CG 3.23Å; F379-N383 PolarHBondContact O-N 3.19Å; F379-N383 PolarHBondContact O-ND2 3.29Å
380Q96.3Very high95Very high120 Ų120104.3 Ų104.356%0.56151%0.505SS*.Hα-helixtrans-64.8-40175-72.4176.62300112.4S376 L377 N383 L384S376-Q380 WeakPolarHBondContact O-CG 3.42Å; S376-Q380 PolarHBondContact O-N 2.9Å; L377-Q380 PolarHBondContact O-N 3.31Å; L377-Q380 VanDerWaalsContact O-N 3.17Å; Q380-N383 PolarHBondContact O-N 2.91Å; Q380-L384 WeakPolarHBondContact O-CB 3.35Å; Q380-L384 PolarHBondContact O-N 3.41Å
381V97.1Very high95.2Very high85 Ų85100.9 Ų100.952%0.51551%0.511SS..Hα-helixtrans-60.1-46.8174.7172.10000110.7L377 C378 L384 L385L377-V381 WeakPolarHBondContact O-CG2 3.29Å; L377-V381 PolarHBondContact O-N 3.17Å; C378-V381 PolarHBondContact O-N 3.25Å; V381-L384 PolarHBondContact O-N 3.35Å; V381-L385 WeakPolarHBondContact O-CB 3.33Å; V381-L385 PolarHBondContact O-N 2.99Å
382N95.9Very high95.4Very high92 Ų9299.2 Ų99.249%0.49251%0.508SS..Hα-helixtrans-60.2-49177.3-71.6-19.3000111.8C378 F379 L384 L385 E386C378-N382 PolarHBondContact O-N 3.38Å; F379-N382 PolarHBondContact O-N 2.99Å; N382-L384 VanDerWaalsContact C-N 3.29Å; N382-L384 PolarHBondContact O-N 3.31Å; N382-L385 PolarHBondContact O-N 3.01Å; N382-E386 PolarHBondContact O-N 2.95Å
383N95.6Very high95.7Very high54 Ų5497.6 Ų97.629%0.28951%0.509SS..Hα-helixtrans-61-38.4178.4-69.5-24.3000112.4F379 Q380 K387F379-N383 WeakPolarHBondContact CD1-ND2 3.01Å; F379-N383 WeakPolarHBondContact CE1-ND2 3.22Å; F379-N383 VanDerWaalsContact O-CG 3.23Å; F379-N383 PolarHBondContact O-N 3.19Å; F379-N383 PolarHBondContact O-ND2 3.29Å; Q380-N383 PolarHBondContact O-N 2.91Å; N383-K387 WeakPolarHBondContact O-CG 3.32Å; N383-K387 PolarHBondContact O-N 2.91Å
384L96.4Very high95.8Very high106 Ų10699.6 Ų99.656%0.55552%0.518SS*.Hα-helixtrans-66.4-43.6177.2-176.863.6000110.8Q380 V381 N382 K387 I388Q380-L384 WeakPolarHBondContact O-CB 3.35Å; Q380-L384 PolarHBondContact O-N 3.41Å; V381-L384 PolarHBondContact O-N 3.35Å; N382-L384 VanDerWaalsContact C-N 3.29Å; N382-L384 PolarHBondContact O-N 3.31Å; L384-K387 PolarHBondContact O-N 3.07Å; L384-I388 HydrophobicContact CD1-CD1 4.35Å; L384-I388 HydrophobicContact CG-CD1 3.97Å; L384-I388 VanDerWaalsContact O-CG1 3.29Å; L384-I388 WeakPolarHBondContact O-CG1 3.47Å; L384-I388 PolarHBondContact O-N 2.95Å
385L95.2Very high95.8Very high79 Ų79103.7 Ų103.741%0.41453%0.529SS..Hα-helixtrans-62.7-42.6178.1-171.768.2000111.8V381 N382 I388 R389V381-L385 WeakPolarHBondContact O-CB 3.33Å; V381-L385 PolarHBondContact O-N 2.99Å; N382-L385 PolarHBondContact O-N 3.01Å; L385-I388 PolarHBondContact O-N 3.44Å; L385-R389 WeakPolarHBondContact O-CB 3.36Å; L385-R389 WeakPolarHBondContact O-CG 3.49Å; L385-R389 PolarHBondContact O-N 2.94Å
386E95.5Very high95.6Very high129 Ų12998.2 Ų98.260%0.60351%0.507SS*.Hα-helixtrans-60.3-46.5174.2-75.4-178.3174.300111.8N382 I388 R389 Q390N382-E386 PolarHBondContact O-N 2.95Å; E386-I388 VanDerWaalsContact C-N 3.35Å; E386-I388 PolarHBondContact O-N 2.94Å; E386-R389 PolarHBondContact O-N 2.91Å; E386-Q390 WeakPolarHBondContact O-CB 3.41Å; E386-Q390 PolarHBondContact O-N 3.28Å
387K96.3Very high95.5Very high142 Ų14298.3 Ų98.362%0.61751%0.51SS*.Hα-helixtrans-61.1-41.6176.7-75.9178.2177.8-176.10112.5N383 L384 Q390 A391N383-K387 WeakPolarHBondContact O-CG 3.32Å; N383-K387 PolarHBondContact O-N 2.91Å; L384-K387 PolarHBondContact O-N 3.07Å; K387-Q390 PolarHBondContact O-N 3.37Å; K387-A391 VanDerWaalsContact O-CB 3.31Å; K387-A391 WeakPolarHBondContact O-CB 3.47Å; K387-A391 PolarHBondContact O-N 3.37Å
388I95.6Very high95.3Very high57 Ų5799 Ų9929%0.29251%0.511SS..Hα-helixtrans-63.9-47176.5-70.2167.4000110.4L384 L385 E386 Q390 A391 A392 W395L384-I388 HydrophobicContact CD1-CD1 4.35Å; L384-I388 HydrophobicContact CG-CD1 3.97Å; L384-I388 VanDerWaalsContact O-CG1 3.29Å; L384-I388 WeakPolarHBondContact O-CG1 3.47Å; L384-I388 PolarHBondContact O-N 2.95Å; L385-I388 PolarHBondContact O-N 3.44Å; E386-I388 VanDerWaalsContact C-N 3.35Å; E386-I388 PolarHBondContact O-N 2.94Å; I388-Q390 VanDerWaalsContact C-N 3.28Å; I388-Q390 PolarHBondContact O-N 3.41Å; I388-A391 PolarHBondContact O-N 2.81Å; I388-A392 CarbonylContact O-C 3.49Å; I388-A392 PolarHBondContact O-N 3.27Å; I388-W395 HydrophobicContact CG2-CE3 3.83Å; I388-W395 HydrophobicContact CG2-CZ3 3.69Å
389R94.6Very high95Very high129 Ų12997.8 Ų97.849%0.48751%0.506SS..Hα-helixtrans-61-37.2177.6-75.7177174.3-176.5-1.6112.4L385 E386 P393 A396L385-R389 WeakPolarHBondContact O-CB 3.36Å; L385-R389 WeakPolarHBondContact O-CG 3.49Å; L385-R389 PolarHBondContact O-N 2.94Å; E386-R389 PolarHBondContact O-N 2.91Å; R389-P393 WeakPolarHBondContact O-CA 3.31Å; R389-P393 WeakPolarHBondContact O-CB 3.43Å; R389-A396 HydrophobicContact CG-CB 3.98Å
390Q95.6Very high94.7Very high170 Ų17096.4 Ų96.479%0.79450%0.502SS*.Hα-helixtrans-71.2-40.3177.4-169.4178.81500112.3E386 K387 I388E386-Q390 WeakPolarHBondContact O-CB 3.41Å; E386-Q390 PolarHBondContact O-N 3.28Å; K387-Q390 PolarHBondContact O-N 3.37Å; I388-Q390 VanDerWaalsContact C-N 3.28Å; I388-Q390 PolarHBondContact O-N 3.41Å
391A97Very high94.4Very high90 Ų9096.9 Ų96.974%0.74450%0.504SS*.Hα-helixtrans-82.5-33.9-176.600000113.8K387 I388K387-A391 VanDerWaalsContact O-CB 3.31Å; K387-A391 WeakPolarHBondContact O-CB 3.47Å; K387-A391 PolarHBondContact O-N 3.37Å; I388-A391 PolarHBondContact O-N 2.81Å
392A96Very high94.1Very high41 Ų4195.2 Ų95.234%0.33950%0.499SS..  trans-143.770.7-174.800000111.6I388 E394 W395 A396I388-A392 CarbonylContact O-C 3.49Å; I388-A392 PolarHBondContact O-N 3.27Å; A392-E394 PolarHBondContact O-N 3.5Å; A392-W395 HydrophobicContact CB-CB 4.2Å; A392-W395 PolarHBondContact O-N 3.35Å; A392-A396 PolarHBondContact O-N 3.15Å; A392-A396 VanDerWaalsContact O-N 3.15Å
393P94.8Very high93.6Very high82 Ų8297 Ų9753%0.53251%0.505SS..Hα-helixtrans-64.6-37.3-174.224.1-33.5000113.4R389 A396 A397R389-P393 WeakPolarHBondContact O-CA 3.31Å; R389-P393 WeakPolarHBondContact O-CB 3.43Å; P393-A396 PolarHBondContact O-N 3.45Å; P393-A397 PolarHBondContact O-N 3.44Å
394E94.6Very high93Very high158 Ų158101.2 Ų101.274%0.73852%0.524SS*.Hα-helixtrans-66-43.5-179.7-65.1179.3179.100112A392 A396 A397 Q398A392-E394 PolarHBondContact O-N 3.5Å; E394-A396 VanDerWaalsContact C-N 3.34Å; E394-A396 PolarHBondContact O-N 3.42Å; E394-A397 PolarHBondContact O-N 3.13Å; E394-Q398 WeakPolarHBondContact O-CG 3.5Å; E394-Q398 PolarHBondContact O-N 3.49Å
395W95.3Very high92.3Very high158 Ų158101.8 Ų101.860%0.59853%0.533SS*.Hα-helixtrans-63.1-42.3175.2-179.686.2000111.4I388 A392 A397 Q398 A399I388-W395 HydrophobicContact CG2-CE3 3.83Å; I388-W395 HydrophobicContact CG2-CZ3 3.69Å; A392-W395 HydrophobicContact CB-CB 4.2Å; A392-W395 PolarHBondContact O-N 3.35Å; W395-A397 VanDerWaalsContact C-N 3.32Å; W395-A397 PolarHBondContact O-N 3.09Å; W395-Q398 PolarHBondContact O-N 3.15Å; W395-A399 WeakPolarHBondContact O-CB 3.37Å; W395-A399 PolarHBondContact O-N 2.99Å
396A92.1Very high90.8Very high17 Ų17107.6 Ų107.614%0.1456%0.558CS.*Hα-helixtrans-63.3-37.6178.300000112.2R389 A392 P393 E394 M400R389-A396 HydrophobicContact CG-CB 3.98Å; A392-A396 PolarHBondContact O-N 3.15Å; A392-A396 VanDerWaalsContact O-N 3.15Å; P393-A396 PolarHBondContact O-N 3.45Å; E394-A396 VanDerWaalsContact C-N 3.34Å; E394-A396 PolarHBondContact O-N 3.42Å; A396-M400 WeakPolarHBondContact O-CB 3.42Å; A396-M400 PolarHBondContact O-N 3.43Å; A396-M400 VanDerWaalsContact O-N 3.09Å
397A91.6Very high90.6Very high50 Ų50106.6 Ų106.641%0.41356%0.555SS.*Hα-helixtrans-66.3-46.9175.400000111.8P393 E394 W395 A399 M400 E401P393-A397 PolarHBondContact O-N 3.44Å; E394-A397 PolarHBondContact O-N 3.13Å; W395-A397 VanDerWaalsContact C-N 3.32Å; W395-A397 PolarHBondContact O-N 3.09Å; A397-A399 PolarHBondContact O-N 3.37Å; A397-M400 WeakPolarHBondContact O-CB 3.38Å; A397-M400 PolarHBondContact O-N 3.33Å; A397-M400 VanDerWaalsContact O-N 3.13Å; A397-E401 PolarHBondContact O-N 3.45Å
398Q92.6Very high90.3Very high124 Ų124104.7 Ų104.758%0.57955%0.552SS**Hα-helixtrans-60.3-43176.9-71.2174.20.800112.4E394 W395 M400 E401 A402E394-Q398 WeakPolarHBondContact O-CG 3.5Å; E394-Q398 PolarHBondContact O-N 3.49Å; W395-Q398 PolarHBondContact O-N 3.15Å; Q398-M400 VanDerWaalsContact C-N 3.29Å; Q398-M400 PolarHBondContact O-N 3Å; Q398-E401 PolarHBondContact O-N 3.43Å; Q398-A402 PolarHBondContact O-N 2.95Å
399A90.6Very high90Very high42 Ų42107.3 Ų107.335%0.34757%0.567SS.*Hα-helixtrans-64.7-34.6176.400000112.2W395 A397 A402 Q403W395-A399 WeakPolarHBondContact O-CB 3.37Å; W395-A399 PolarHBondContact O-N 2.99Å; A397-A399 PolarHBondContact O-N 3.37Å; A399-A402 PolarHBondContact O-N 3.36Å; A399-Q403 PolarHBondContact O-N 3.06Å; A399-Q403 VanDerWaalsContact O-N 3.15Å
400M90.6Very high89.7Confident100 Ų100106.1 Ų106.149%0.49357%0.571SS.*Hα-helixtrans-71.5-38.1177.2-166.1168.5170.700111.9A396 A397 Q398 Q403 M404A396-M400 WeakPolarHBondContact O-CB 3.42Å; A396-M400 PolarHBondContact O-N 3.43Å; A396-M400 VanDerWaalsContact O-N 3.09Å; A397-M400 WeakPolarHBondContact O-CB 3.38Å; A397-M400 PolarHBondContact O-N 3.33Å; A397-M400 VanDerWaalsContact O-N 3.13Å; Q398-M400 VanDerWaalsContact C-N 3.29Å; Q398-M400 PolarHBondContact O-N 3Å; M400-Q403 PolarHBondContact O-N 3.05Å; M400-M404 HydrophobicContact CE-CE 3.93Å; M400-M404 HydrophobicContact CG-CE 4.36Å; M400-M404 WeakPolarHBondContact O-CG 3.38Å; M400-M404 PolarHBondContact O-N 2.96Å; M400-M404 VanDerWaalsContact O-N 3.16Å
401E90.1Very high89.4Confident130 Ų130102.1 Ų102.161%0.60756%0.557SS**Hα-helixtrans-64.4-40.4172-72.7177.3178.900112.1A397 Q398 Q403 M404 T405A397-E401 PolarHBondContact O-N 3.45Å; Q398-E401 PolarHBondContact O-N 3.43Å; E401-Q403 VanDerWaalsContact C-N 3.27Å; E401-Q403 PolarHBondContact O-N 3.48Å; E401-M404 PolarHBondContact O-N 3.19Å; E401-M404 VanDerWaalsContact O-N 3.14Å; E401-T405 PolarHBondContact O-N 3.14Å; E401-T405 PolarHBondContact O-OG1 3.16Å
402A89.6Confident88.9Confident50 Ų50102.9 Ų102.941%0.41355%0.545SS..Hα-helixtrans-60.7-35.7174.100000112.6Q398 A399 T405 Q406Q398-A402 PolarHBondContact O-N 2.95Å; A399-A402 PolarHBondContact O-N 3.36Å; A402-T405 WeakPolarHBondContact CA-OG1 3.49Å; A402-T405 PolarHBondContact O-N 3.38Å; A402-T405 PolarHBondContact O-OG1 3.31Å; A402-T405 VanDerWaalsContact O-OG1 3.05Å; A402-Q406 PolarHBondContact O-N 2.95Å
403Q87.1Confident88.4Confident128 Ų128107.3 Ų107.360%0.59856%0.56SS**Hα-helixtrans-72.2-29.8175.1-166.867.636.300113A399 M400 E401 T405A399-Q403 PolarHBondContact O-N 3.06Å; A399-Q403 VanDerWaalsContact O-N 3.15Å; M400-Q403 PolarHBondContact O-N 3.05Å; E401-Q403 VanDerWaalsContact C-N 3.27Å; E401-Q403 PolarHBondContact O-N 3.48Å; Q403-T405 VanDerWaalsContact C-N 3.3Å
404M81.1Confident87.9Confident143 Ų143109.2 Ų109.270%0.70456%0.562SS**Hα-helixtrans-77.8-15.5176.2-68.2-163-164.900113.4M400 E401M400-M404 HydrophobicContact CE-CE 3.93Å; M400-M404 HydrophobicContact CG-CE 4.36Å; M400-M404 WeakPolarHBondContact O-CG 3.38Å; M400-M404 PolarHBondContact O-N 2.96Å; M400-M404 VanDerWaalsContact O-N 3.16Å; E401-M404 PolarHBondContact O-N 3.19Å; E401-M404 VanDerWaalsContact O-N 3.14Å
405T83.3Confident87.3Confident119 Ų119105.2 Ų105.273%0.7355%0.547SS*.  trans-100.2-6.2-178.545.60000113.4E401 A402 Q403E401-T405 PolarHBondContact O-N 3.14Å; E401-T405 PolarHBondContact O-OG1 3.16Å; A402-T405 WeakPolarHBondContact CA-OG1 3.49Å; A402-T405 PolarHBondContact O-N 3.38Å; A402-T405 PolarHBondContact O-OG1 3.31Å; A402-T405 VanDerWaalsContact O-OG1 3.05Å; Q403-T405 VanDerWaalsContact C-N 3.3Å
406Q63.8Low86.6Confident201 Ų201100.4 Ų100.494%0.93954%0.542SS*.  trans-90.40164.8-73.3-176.63.300110.3A402A402-Q406 PolarHBondContact O-N 2.95Å

Retrieved 406 of 406 residues in 497.5 ms (Link to these results)

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