A0A087Y8M8_POEFO Loading...

ST13 Hsp70 interacting protein

One HIP oligomer binds the ATPase domains of at least two HSC70 molecules dependent on activation of the HSC70 ATPase by HSP40. Stabilizes the ADP state of HSC70 that has a high affinity for substrate protein. Through its own chaperone activity, it may contribute to the interaction of HSC70 with various target proteins.

AlphaFold DB , UniProt , Accession A0A087Y8M8, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 357 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
1M62.1Low88.6Confident206 Ų206113.4 Ų113.4100%1.01557%0.573SS**  0143.90-89.5-175-176.600108.8V6M1-V6 HydrophobicContact CB-CG2 3.91Å; M1-V6 HydrophobicContact SD-CG2 4.24Å
2D89.1Confident89Confident73 Ų73107.8 Ų107.839%0.3954%0.542SS..  trans-61.1126.9172.9178.3-10.6000110.5R4 K5 V6D2-R4 PolarHBondContact O-N 3.37Å; D2-R4 WeakPolarHBondContact OD1-CB 3.37Å; D2-R4 PolarHBondContact OD1-N 3.36Å; D2-K5 HydrophobicContact CB-CB 4.27Å; D2-K5 HydrophobicContact CB-CD 4.07Å; D2-K5 HydrophobicContact CB-CG 3.95Å; D2-K5 PolarHBondContact O-N 3.3Å; D2-V6 PolarHBondContact O-N 3.37Å
3P88.3Confident89.2Confident99 Ų99104.3 Ų104.364%0.64353%0.53SS*.Hα-helixtrans-55-30.3178.6-25.834.1000114.6V6 T7P3-V6 PolarHBondContact O-N 3.01Å; P3-T7 PolarHBondContact O-N 2.94Å; P3-T7 VanDerWaalsContact O-N 3.13Å; P3-T7 PolarHBondContact O-OG1 3.46Å
4R89.5Confident89.5Confident187 Ų187106 Ų10671%0.70654%0.535SS*.Hα-helixtrans-68.2-47.4178.1-65.7178.6177176.7-1.4111D2 V6 T7 E8D2-R4 PolarHBondContact O-N 3.37Å; D2-R4 WeakPolarHBondContact OD1-CB 3.37Å; D2-R4 PolarHBondContact OD1-N 3.36Å; R4-V6 VanDerWaalsContact C-N 3.26Å; R4-V6 PolarHBondContact O-N 3.12Å; R4-T7 WeakPolarHBondContact O-CA 3.31Å; R4-T7 WeakPolarHBondContact O-CB 3.28Å; R4-T7 PolarHBondContact O-N 3.34Å; R4-E8 PolarHBondContact O-N 3.05Å
5K89.3Confident89.5Confident136 Ų136104.5 Ų104.559%0.59153%0.527SS*.Hα-helixtrans-60.7-35.5176.3-62.8-172.8-179.8-172.40112.4D2 T7 L9D2-K5 HydrophobicContact CB-CB 4.27Å; D2-K5 HydrophobicContact CB-CD 4.07Å; D2-K5 HydrophobicContact CB-CG 3.95Å; D2-K5 PolarHBondContact O-N 3.3Å; K5-T7 VanDerWaalsContact C-N 3.33Å; K5-L9 WeakPolarHBondContact O-CB 3.28Å; K5-L9 PolarHBondContact O-N 3.38Å
6V92.3Very high89.4Confident48 Ų4899.3 Ų99.329%0.29150%0.502SS..Hα-helixtrans-66.9-36.3174.3176.50000111.4M1 D2 P3 R4 K10M1-V6 HydrophobicContact CB-CG2 3.91Å; M1-V6 HydrophobicContact SD-CG2 4.24Å; D2-V6 PolarHBondContact O-N 3.37Å; P3-V6 PolarHBondContact O-N 3.01Å; R4-V6 VanDerWaalsContact C-N 3.26Å; R4-V6 PolarHBondContact O-N 3.12Å; V6-K10 WeakPolarHBondContact O-CG 3.46Å; V6-K10 PolarHBondContact O-N 3.4Å
7T93.4Very high89.2Confident96 Ų96101.9 Ų101.959%0.58951%0.513SS*.Hα-helixtrans-70.7-43.5178.5-55.10000111.4P3 R4 K5 L9 K10 G11P3-T7 PolarHBondContact O-N 2.94Å; P3-T7 VanDerWaalsContact O-N 3.13Å; P3-T7 PolarHBondContact O-OG1 3.46Å; R4-T7 WeakPolarHBondContact O-CA 3.31Å; R4-T7 WeakPolarHBondContact O-CB 3.28Å; R4-T7 PolarHBondContact O-N 3.34Å; K5-T7 VanDerWaalsContact C-N 3.33Å; T7-L9 PolarHBondContact O-N 2.98Å; T7-K10 WeakPolarHBondContact O-CB 3.48Å; T7-K10 PolarHBondContact O-N 2.73Å; T7-G11 PolarHBondContact O-N 3.25Å
8E92.8Very high89.1Confident138 Ų138102.3 Ų102.365%0.64553%0.526SS*.Hα-helixtrans-60.1-44.8173.9-70.3165.6-174.100111.5R4 K10 G11 F12R4-E8 PolarHBondContact O-N 3.05Å; E8-K10 VanDerWaalsContact C-N 3.33Å; E8-K10 PolarHBondContact O-N 2.61Å; E8-G11 PolarHBondContact O-N 3.49Å; E8-F12 PolarHBondContact O-N 3.46Å
9L92.5Very high89Confident91 Ų91101.4 Ų101.448%0.47652%0.523SS..Hα-helixtrans-61-41.6176.5-177.963000111.9K5 T7 G11 F12 V13K5-L9 WeakPolarHBondContact O-CB 3.28Å; K5-L9 PolarHBondContact O-N 3.38Å; T7-L9 PolarHBondContact O-N 2.98Å; L9-G11 VanDerWaalsContact C-N 3.35Å; L9-G11 PolarHBondContact O-N 2.99Å; L9-F12 PolarHBondContact O-N 2.97Å; L9-V13 WeakPolarHBondContact O-CG2 3.28Å; L9-V13 PolarHBondContact O-N 3.21Å
10K92.4Very high88.8Confident138 Ų13899.1 Ų99.160%0.651%0.514SS*.Hα-helixtrans-61-43.4175.3-78.1176.2178.6-176.50111.9V6 T7 E8 F12 V13 Q14V6-K10 WeakPolarHBondContact O-CG 3.46Å; V6-K10 PolarHBondContact O-N 3.4Å; T7-K10 WeakPolarHBondContact O-CB 3.48Å; T7-K10 PolarHBondContact O-N 2.73Å; E8-K10 VanDerWaalsContact C-N 3.33Å; E8-K10 PolarHBondContact O-N 2.61Å; K10-F12 VanDerWaalsContact C-N 3.34Å; K10-V13 PolarHBondContact O-N 3.34Å; K10-Q14 PolarHBondContact O-N 3.29Å; K10-Q14 VanDerWaalsContact O-N 3.1Å
11G93.6Very high88.6Confident35 Ų3595.9 Ų95.936%0.36151%0.505SS..Hα-helixtrans-61.5-42.717600000112.2T7 E8 L9 V13 Q14 M15T7-G11 PolarHBondContact O-N 3.25Å; E8-G11 PolarHBondContact O-N 3.49Å; L9-G11 VanDerWaalsContact C-N 3.35Å; L9-G11 PolarHBondContact O-N 2.99Å; G11-V13 PolarHBondContact O-N 3.1Å; G11-Q14 PolarHBondContact O-N 3.13Å; G11-M15 PolarHBondContact O-N 3.43Å
12F93.1Very high89.8Confident46 Ų4687.3 Ų87.320%0.20246%0.463CS..Hα-helixtrans-63.5-39.5176.4-180-100.8000113.1E8 L9 K10 M15 C16 I22 M28 F31E8-F12 PolarHBondContact O-N 3.46Å; L9-F12 PolarHBondContact O-N 2.97Å; K10-F12 VanDerWaalsContact C-N 3.34Å; F12-M15 HydrophobicContact CD2-CE 3.42Å; F12-M15 VanDerWaalsContact CD2-CE 3.42Å; F12-M15 HydrophobicContact CE2-CE 3.7Å; F12-M15 HydrophobicContact CG-CE 4.46Å; F12-M15 WeakPolarHBondContact O-CB 3.36Å; F12-M15 PolarHBondContact O-N 2.89Å; F12-C16 VanDerWaalsContact CE1-SG 3.54Å; F12-C16 VanDerWaalsContact CZ-SG 3.58Å; F12-C16 PolarHBondContact O-N 3.47Å; F12-C16 PolarHBondContact O-SG 3.41Å; F12-C16 VanDerWaalsContact O-SG 3.37Å; F12-I22 HydrophobicContact CE2-CG2 4.31Å; F12-M28 HydrophobicContact CE2-CE 4.21Å; F12-M28 HydrophobicContact CE2-SD 4.21Å; F12-M28 HydrophobicContact CZ-SD 3.96Å; F12-F31 HydrophobicContact CE1-CD1 4.14Å; F12-F31 AromaticContact CE1-CE1 3.7Å; F12-F31 HydrophobicContact CE1-CE1 3.7Å; F12-F31 HydrophobicContact CE1-CZ 4.14Å; F12-F31 HydrophobicContact CZ-CD1 4.43Å; F12-F31 HydrophobicContact CZ-CE1 4.39Å
13V91.7Very high89.8Confident63 Ų6384.6 Ų84.638%0.38245%0.449SS..Hα-helixtrans-62.9-45.9176171.30000111L9 K10 G11 M15 C16 E17L9-V13 WeakPolarHBondContact O-CG2 3.28Å; L9-V13 PolarHBondContact O-N 3.21Å; K10-V13 PolarHBondContact O-N 3.34Å; G11-V13 PolarHBondContact O-N 3.1Å; V13-M15 PolarHBondContact O-N 2.72Å; V13-C16 WeakPolarHBondContact O-CB 3.39Å; V13-C16 PolarHBondContact O-N 3.41Å; V13-C16 VanDerWaalsContact O-N 3.1Å; V13-E17 WeakPolarHBondContact O-CG 3.19Å; V13-E17 PolarHBondContact O-N 2.89Å
14Q92.8Very high89.7Confident128 Ų12882.6 Ų82.660%0.59843%0.431SS*.Hα-helixtrans-59.9-36.3175.9-73.5179.1-25.500112.6K10 G11 E17 S18K10-Q14 PolarHBondContact O-N 3.29Å; K10-Q14 VanDerWaalsContact O-N 3.1Å; G11-Q14 PolarHBondContact O-N 3.13Å; Q14-E17 PolarHBondContact O-N 3.4Å; Q14-S18 WeakPolarHBondContact O-CB 3.03Å; Q14-S18 PolarHBondContact O-N 2.95Å; Q14-S18 PolarHBondContact O-OG 3.37Å
15M89.7Confident89.6Confident84 Ų8477.7 Ų77.741%0.41442%0.418SS..Hα-helixtrans-66.6-41.3175-174.5177.361.600111.8G11 F12 V13 E17 S18 N19 I22G11-M15 PolarHBondContact O-N 3.43Å; F12-M15 HydrophobicContact CD2-CE 3.42Å; F12-M15 VanDerWaalsContact CD2-CE 3.42Å; F12-M15 HydrophobicContact CE2-CE 3.7Å; F12-M15 HydrophobicContact CG-CE 4.46Å; F12-M15 WeakPolarHBondContact O-CB 3.36Å; F12-M15 PolarHBondContact O-N 2.89Å; V13-M15 PolarHBondContact O-N 2.72Å; M15-E17 VanDerWaalsContact C-N 3.33Å; M15-S18 PolarHBondContact O-N 3.33Å; M15-N19 PolarHBondContact O-N 3.26Å; M15-I22 HydrophobicContact CE-CD1 3.92Å; M15-I22 HydrophobicContact CE-CG2 4.42Å; M15-I22 HydrophobicContact CG-CD1 3.49Å; M15-I22 VanDerWaalsContact CG-CD1 3.49Å; M15-I22 HydrophobicContact SD-CD1 3.62Å
16C88.4Confident89.4Confident20 Ų2077.2 Ų77.214%0.13543%0.429CS..Hα-helixtrans-64.8-35.5174.1-69.20000112.7F12 V13 N19 P20F12-C16 VanDerWaalsContact CE1-SG 3.54Å; F12-C16 VanDerWaalsContact CZ-SG 3.58Å; F12-C16 PolarHBondContact O-N 3.47Å; F12-C16 PolarHBondContact O-SG 3.41Å; F12-C16 VanDerWaalsContact O-SG 3.37Å; V13-C16 WeakPolarHBondContact O-CB 3.39Å; V13-C16 PolarHBondContact O-N 3.41Å; V13-C16 VanDerWaalsContact O-N 3.1Å; C16-N19 CarbonylContact O-C 3.51Å; C16-P20 WeakPolarHBondContact O-CA 2.99Å
17E85.9Confident89.2Confident145 Ų14582.5 Ų82.568%0.67845%0.451SS*.Hα-helixtrans-65.7-40.3174.6-72.1176165.900111.7V13 Q14 M15V13-E17 WeakPolarHBondContact O-CG 3.19Å; V13-E17 PolarHBondContact O-N 2.89Å; Q14-E17 PolarHBondContact O-N 3.4Å; M15-E17 VanDerWaalsContact C-N 3.33Å
18S87.4Confident89Confident108 Ų10879.8 Ų79.876%0.75543%0.432SS*.Hα-helixtrans-76.8-34.2-179.2-55.50000112.5Q14 M15Q14-S18 WeakPolarHBondContact O-CB 3.03Å; Q14-S18 PolarHBondContact O-N 2.95Å; Q14-S18 PolarHBondContact O-OG 3.37Å; M15-S18 PolarHBondContact O-N 3.33Å
19N86.9Confident88.7Confident86 Ų8674.6 Ų74.646%0.4642%0.415SS..  trans-140.588.6178.9-176.88.3000111.6M15 C16 G21 I22M15-N19 PolarHBondContact O-N 3.26Å; C16-N19 CarbonylContact O-C 3.51Å; N19-G21 PolarHBondContact O-N 2.94Å; N19-G21 PolarHBondContact OD1-N 2.88Å; N19-G21 VanDerWaalsContact OD1-N 3.1Å; N19-I22 HydrophobicContact CB-CD1 4.37Å; N19-I22 PolarHBondContact O-N 3.05Å
20P84.7Confident88.8Confident54 Ų5477.6 Ų77.635%0.35142%0.424SS..G310 helixtrans-61.8-14.6177-24.734.9000114.2C16 I22 L23 P43C16-P20 WeakPolarHBondContact O-CA 2.99Å; P20-I22 PolarHBondContact O-N 2.68Å; P20-L23 PolarHBondContact O-N 2.98Å; P20-P43 HydrophobicContact CB-CG 4.33Å
21G85.5Confident88.7Confident32 Ų3272.9 Ų72.933%0.3340%0.404SS..G310 helixtrans-63-26.9176.800000113.7N19 L23 H24N19-G21 PolarHBondContact O-N 2.94Å; N19-G21 PolarHBondContact OD1-N 2.88Å; N19-G21 VanDerWaalsContact OD1-N 3.1Å; G21-L23 PolarHBondContact O-N 3.3Å; G21-H24 WeakPolarHBondContact O-CB 3.03Å; G21-H24 PolarHBondContact O-N 2.99Å
22I87.4Confident88.5Confident26 Ų2673.4 Ų73.413%0.13340%0.395CS..G310 helixtrans-59-34.5179-85.3166.1000112.3F12 M15 N19 P20 H24 L25 M28F12-I22 HydrophobicContact CE2-CG2 4.31Å; M15-I22 HydrophobicContact CE-CD1 3.92Å; M15-I22 HydrophobicContact CE-CG2 4.42Å; M15-I22 HydrophobicContact CG-CD1 3.49Å; M15-I22 VanDerWaalsContact CG-CD1 3.49Å; M15-I22 HydrophobicContact SD-CD1 3.62Å; N19-I22 HydrophobicContact CB-CD1 4.37Å; N19-I22 PolarHBondContact O-N 3.05Å; P20-I22 PolarHBondContact O-N 2.68Å; I22-H24 PolarHBondContact O-N 3.35Å; I22-H24 VanDerWaalsContact O-N 3.11Å; I22-L25 HydrophobicContact CB-CD1 4.47Å; I22-L25 HydrophobicContact CG1-CD1 4.23Å; I22-L25 HydrophobicContact CG2-CD1 4.48Å; I22-L25 WeakPolarHBondContact O-CB 3.37Å; I22-L25 WeakPolarHBondContact O-CG 3.4Å; I22-L25 PolarHBondContact O-N 2.68Å; I22-L25 VanDerWaalsContact O-N 3.11Å; I22-M28 HydrophobicContact CG2-CG 4.48Å; I22-M28 WeakPolarHBondContact O-CG 3.44Å
23L87.3Confident88.4Confident16 Ų1674.7 Ų74.78%0.08441%0.41CS..G310 helixtrans-61.6-24.6177.8-63.2176000111.5P20 G21 L25 F31 R32 L35 I42P20-L23 PolarHBondContact O-N 2.98Å; G21-L23 PolarHBondContact O-N 3.3Å; L23-L25 VanDerWaalsContact C-N 3.34Å; L23-F31 HydrophobicContact CD2-CD1 3.77Å; L23-F31 HydrophobicContact CD2-CE1 3.87Å; L23-R32 PolarHBondContact O-NE 3.43Å; L23-R32 VanDerWaalsContact O-NE 3.17Å; L23-R32 PolarHBondContact O-NH2 2.92Å; L23-L35 HydrophobicContact CD1-CD1 4.47Å; L23-L35 HydrophobicContact CD2-CD1 4.27Å; L23-I42 HydrophobicContact CB-CG2 4.43Å; L23-I42 HydrophobicContact CD1-CG2 3.96Å
24H87.8Confident88.5Confident58 Ų5877.9 Ų77.927%0.26942%0.415SS..G310 helixtrans-87.91.9-178.1-62.2-87.2000113.4G21 I22 R32 P43 P45G21-H24 WeakPolarHBondContact O-CB 3.03Å; G21-H24 PolarHBondContact O-N 2.99Å; I22-H24 PolarHBondContact O-N 3.35Å; I22-H24 VanDerWaalsContact O-N 3.11Å; H24-R32 PolarHBondContact CD2-NH2 2.95Å; H24-R32 VanDerWaalsContact CD2-NH2 3.33Å; H24-R32 PolarHBondContact CE1-NH1 3.28Å; H24-R32 PolarHBondContact CE1-NH2 3.26Å; H24-R32 VanDerWaalsContact ND1-CZ 3.34Å; H24-R32 PolarHBondContact ND1-NH1 3.44Å; H24-R32 PolarHBondContact ND1-NH2 3.45Å; H24-R32 PolarHBondContact NE2-NH2 2.87Å; H24-P43 PolarHBondContact CE1-O 3.06Å; H24-P43 VanDerWaalsContact CE1-O 3.24Å; H24-P43 PolarHBondContact NE2-O 3.45Å; H24-P45 HydrophobicContact CB-CB 4.37Å; H24-P45 WeakPolarHBondContact CE1-CD 3.45Å
25L87.1Confident88.4Confident84 Ų8473.2 Ų73.244%0.4439%0.394SS..SBendtrans-67.8143.5171.3-65.6171.5000110.6I22 L23 E27 M28I22-L25 HydrophobicContact CB-CD1 4.47Å; I22-L25 HydrophobicContact CG1-CD1 4.23Å; I22-L25 HydrophobicContact CG2-CD1 4.48Å; I22-L25 WeakPolarHBondContact O-CB 3.37Å; I22-L25 WeakPolarHBondContact O-CG 3.4Å; I22-L25 PolarHBondContact O-N 2.68Å; I22-L25 VanDerWaalsContact O-N 3.11Å; L23-L25 VanDerWaalsContact C-N 3.34Å; L25-E27 PolarHBondContact O-N 3.18Å; L25-M28 HydrophobicContact CB-CG 4.26Å; L25-M28 PolarHBondContact O-N 3.46Å
26P84Confident88.4Confident126 Ų12674.3 Ų74.382%0.81840%0.398SS*.G310 helixtrans-54.7-37.9178.8-26.834.7000113.7M28 G29P26-M28 PolarHBondContact O-N 2.99Å; P26-G29 PolarHBondContact O-N 3.43Å
27E88.6Confident88.6Confident159 Ų15977.9 Ų77.974%0.74342%0.424SS*.G310 helixtrans-64-25.4178.6-62.9173.1-171.700113L25 G29L25-E27 PolarHBondContact O-N 3.18Å; E27-G29 VanDerWaalsContact C-N 3.32Å; E27-G29 PolarHBondContact O-N 2.8Å
28M90.3Very high88.9Confident39 Ų3976.1 Ų76.119%0.19242%0.417CS..G310 helixtrans-91.710.3-178.5-61.9-63.4155.500113F12 I22 L25 P26 F30 F31 R32F12-M28 HydrophobicContact CE2-CE 4.21Å; F12-M28 HydrophobicContact CE2-SD 4.21Å; F12-M28 HydrophobicContact CZ-SD 3.96Å; I22-M28 HydrophobicContact CG2-CG 4.48Å; I22-M28 WeakPolarHBondContact O-CG 3.44Å; L25-M28 HydrophobicContact CB-CG 4.26Å; L25-M28 PolarHBondContact O-N 3.46Å; P26-M28 PolarHBondContact O-N 2.99Å; M28-F30 PolarHBondContact O-N 2.8Å; M28-F31 PolarHBondContact O-N 2.87Å; M28-R32 PolarHBondContact O-N 2.93Å
29G85.6Confident89Confident29 Ų2974.2 Ų74.230%0.29941%0.414SS..Hα-helixtrans-58.8-42.2-178.100000113.8P26 E27 F31 R32 S33P26-G29 PolarHBondContact O-N 3.43Å; E27-G29 VanDerWaalsContact C-N 3.32Å; E27-G29 PolarHBondContact O-N 2.8Å; G29-F31 VanDerWaalsContact C-N 3.35Å; G29-F31 PolarHBondContact O-N 3Å; G29-R32 PolarHBondContact O-N 3.46Å; G29-S33 PolarHBondContact O-N 2.99Å; G29-S33 VanDerWaalsContact O-N 3.08Å; G29-S33 PolarHBondContact O-OG 3.28Å; G29-S33 VanDerWaalsContact O-OG 3.11Å
30F93.7Very high89.1Confident153 Ų15372.2 Ų72.267%0.67141%0.41SS*.Hα-helixtrans-63.3-41.8178.179.4-84.8000111.7M28 S33 W34M28-F30 PolarHBondContact O-N 2.8Å; F30-S33 PolarHBondContact O-N 3.07Å; F30-W34 WeakPolarHBondContact O-CB 3.45Å; F30-W34 PolarHBondContact O-N 3.1Å
31F91.3Very high89.2Confident39 Ų3977.3 Ų77.317%0.17143%0.434CS..Hα-helixtrans-71.2-39.1-177-172.9-115.9000111.4F12 L23 M28 G29 W34 L35F12-F31 HydrophobicContact CE1-CD1 4.14Å; F12-F31 AromaticContact CE1-CE1 3.7Å; F12-F31 HydrophobicContact CE1-CE1 3.7Å; F12-F31 HydrophobicContact CE1-CZ 4.14Å; F12-F31 HydrophobicContact CZ-CD1 4.43Å; F12-F31 HydrophobicContact CZ-CE1 4.39Å; L23-F31 HydrophobicContact CD2-CD1 3.77Å; L23-F31 HydrophobicContact CD2-CE1 3.87Å; M28-F31 PolarHBondContact O-N 2.87Å; G29-F31 VanDerWaalsContact C-N 3.35Å; G29-F31 PolarHBondContact O-N 3Å; F31-W34 AromaticContact CD2-CE3 3.82Å; F31-W34 HydrophobicContact CD2-CE3 3.82Å; F31-W34 HydrophobicContact CD2-CZ3 4.2Å; F31-W34 AromaticContact CE2-CE3 3.6Å; F31-W34 HydrophobicContact CE2-CE3 3.6Å; F31-W34 AromaticContact CE2-CZ3 3.5Å; F31-W34 HydrophobicContact CE2-CZ3 3.5Å; F31-W34 VanDerWaalsContact CE2-CZ3 3.5Å; F31-W34 HydrophobicContact CZ-CE3 4.46Å; F31-W34 HydrophobicContact CZ-CZ3 4.17Å; F31-W34 PolarHBondContact O-N 3.06Å; F31-L35 HydrophobicContact CD1-CD1 3.89Å; F31-L35 HydrophobicContact CD1-CG 4.43Å; F31-L35 HydrophobicContact CE1-CD1 3.59Å; F31-L35 HydrophobicContact CE1-CG 4.16Å; F31-L35 HydrophobicContact CZ-CD1 4.12Å; F31-L35 HydrophobicContact CZ-CD2 4.29Å; F31-L35 HydrophobicContact CZ-CG 4.24Å; F31-L35 WeakPolarHBondContact O-CB 3.14Å; F31-L35 WeakPolarHBondContact O-CG 3.34Å; F31-L35 PolarHBondContact O-N 2.95Å
32R90.3Very high89.2Confident46 Ų4676.9 Ų76.917%0.17442%0.424CS..Hα-helixtrans-57.9-50.1170.6170.4-175-64.6-84-12.1112.2L23 H24 M28 G29 W34 L35 Q36 I42L23-R32 PolarHBondContact O-NE 3.43Å; L23-R32 VanDerWaalsContact O-NE 3.17Å; L23-R32 PolarHBondContact O-NH2 2.92Å; H24-R32 PolarHBondContact CD2-NH2 2.95Å; H24-R32 VanDerWaalsContact CD2-NH2 3.33Å; H24-R32 PolarHBondContact CE1-NH1 3.28Å; H24-R32 PolarHBondContact CE1-NH2 3.26Å; H24-R32 VanDerWaalsContact ND1-CZ 3.34Å; H24-R32 PolarHBondContact ND1-NH1 3.44Å; H24-R32 PolarHBondContact ND1-NH2 3.45Å; H24-R32 PolarHBondContact NE2-NH2 2.87Å; M28-R32 PolarHBondContact O-N 2.93Å; G29-R32 PolarHBondContact O-N 3.46Å; R32-W34 VanDerWaalsContact C-N 3.27Å; R32-W34 PolarHBondContact O-N 3.46Å; R32-L35 PolarHBondContact O-N 3.41Å; R32-Q36 WeakPolarHBondContact O-CG 3.35Å; R32-Q36 PolarHBondContact O-N 2.86Å; R32-I42 HydrophobicContact CB-CD1 4.35Å; R32-I42 HydrophobicContact CG-CD1 3.8Å
33S89.6Confident88.9Confident73 Ų7378.9 Ų78.951%0.5144%0.438SS..Hα-helixtrans-61.8-38.4179.8-63.20000111.6G29 F30 Q36 S37G29-S33 PolarHBondContact O-N 2.99Å; G29-S33 VanDerWaalsContact O-N 3.08Å; G29-S33 PolarHBondContact O-OG 3.28Å; G29-S33 VanDerWaalsContact O-OG 3.11Å; F30-S33 PolarHBondContact O-N 3.07Å; S33-Q36 PolarHBondContact O-N 3.44Å; S33-S37 PolarHBondContact O-N 2.92Å
34W93.9Very high88.4Confident130 Ų13083.5 Ų83.549%0.49247%0.469SS..Hα-helixtrans-66.6-42.2174.3177.676.7000113F30 F31 R32 Q36 S37 M38F30-W34 WeakPolarHBondContact O-CB 3.45Å; F30-W34 PolarHBondContact O-N 3.1Å; F31-W34 AromaticContact CD2-CE3 3.82Å; F31-W34 HydrophobicContact CD2-CE3 3.82Å; F31-W34 HydrophobicContact CD2-CZ3 4.2Å; F31-W34 AromaticContact CE2-CE3 3.6Å; F31-W34 HydrophobicContact CE2-CE3 3.6Å; F31-W34 AromaticContact CE2-CZ3 3.5Å; F31-W34 HydrophobicContact CE2-CZ3 3.5Å; F31-W34 VanDerWaalsContact CE2-CZ3 3.5Å; F31-W34 HydrophobicContact CZ-CE3 4.46Å; F31-W34 HydrophobicContact CZ-CZ3 4.17Å; F31-W34 PolarHBondContact O-N 3.06Å; R32-W34 VanDerWaalsContact C-N 3.27Å; R32-W34 PolarHBondContact O-N 3.46Å; W34-Q36 VanDerWaalsContact C-N 3.32Å; W34-Q36 PolarHBondContact O-N 3.4Å; W34-S37 PolarHBondContact O-N 3.27Å; W34-S37 PolarHBondContact O-OG 3.38Å; W34-M38 HydrophobicContact CD2-CE 3.85Å; W34-M38 HydrophobicContact CD2-SD 4.46Å; W34-M38 HydrophobicContact CE3-CE 3.65Å; W34-M38 HydrophobicContact CH2-CE 3.18Å; W34-M38 HydrophobicContact CH2-SD 3.92Å; W34-M38 HydrophobicContact CZ2-CE 3.36Å; W34-M38 HydrophobicContact CZ2-SD 3.49Å; W34-M38 WeakPolarHBondContact CZ2-SD 3.4Å; W34-M38 HydrophobicContact CZ3-CE 3.31Å; W34-M38 PolarHBondContact O-N 2.94Å
35L91.8Very high87.8Confident30 Ų3084.5 Ų84.516%0.15748%0.481CS..Hα-helixtrans-61.8-41174.4-76.1175.3000111.8L23 F31 R32 M38 G39 A40 I42L23-L35 HydrophobicContact CD1-CD1 4.47Å; L23-L35 HydrophobicContact CD2-CD1 4.27Å; F31-L35 HydrophobicContact CD1-CD1 3.89Å; F31-L35 HydrophobicContact CD1-CG 4.43Å; F31-L35 HydrophobicContact CE1-CD1 3.59Å; F31-L35 HydrophobicContact CE1-CG 4.16Å; F31-L35 HydrophobicContact CZ-CD1 4.12Å; F31-L35 HydrophobicContact CZ-CD2 4.29Å; F31-L35 HydrophobicContact CZ-CG 4.24Å; F31-L35 WeakPolarHBondContact O-CB 3.14Å; F31-L35 WeakPolarHBondContact O-CG 3.34Å; F31-L35 PolarHBondContact O-N 2.95Å; R32-L35 PolarHBondContact O-N 3.41Å; L35-M38 HydrophobicContact CD2-CE 4.05Å; L35-M38 PolarHBondContact O-N 2.95Å; L35-G39 PolarHBondContact O-N 3.16Å; L35-A40 HydrophobicContact CB-CB 4.1Å; L35-A40 HydrophobicContact CD2-CB 4.42Å; L35-A40 WeakPolarHBondContact O-CB 3.4Å; L35-A40 PolarHBondContact O-N 2.97Å; L35-I42 HydrophobicContact CB-CD1 4.06Å; L35-I42 HydrophobicContact CD1-CD1 4.3Å
36Q89.7Confident86.9Confident108 Ų10885 Ų8551%0.50550%0.497SS..Hα-helixtrans-66.7-36.3177-72.1175.5-34.600112.5R32 S33 W34 M38 G39 I42R32-Q36 WeakPolarHBondContact O-CG 3.35Å; R32-Q36 PolarHBondContact O-N 2.86Å; S33-Q36 PolarHBondContact O-N 3.44Å; W34-Q36 VanDerWaalsContact C-N 3.32Å; W34-Q36 PolarHBondContact O-N 3.4Å; Q36-M38 PolarHBondContact O-N 3.45Å; Q36-G39 PolarHBondContact O-N 3.18Å; Q36-I42 HydrophobicContact CG-CD1 4.01Å
37S91.8Very high85.3Confident95 Ų9588.8 Ų88.866%0.66450%0.501SS*.Hα-helixtrans-66.3-26.5176760000112.7S33 W34 G39S33-S37 PolarHBondContact O-N 2.92Å; W34-S37 PolarHBondContact O-N 3.27Å; W34-S37 PolarHBondContact O-OG 3.38Å; S37-G39 VanDerWaalsContact C-N 3.28Å
38M92.4Very high83.2Confident108 Ų10890 Ų9053%0.53250%0.504SS..THydrogen-bonded Turntrans-84.94.3171.7-63.3-165.2-58.600113.9W34 L35 Q36W34-M38 HydrophobicContact CD2-CE 3.85Å; W34-M38 HydrophobicContact CD2-SD 4.46Å; W34-M38 HydrophobicContact CE3-CE 3.65Å; W34-M38 HydrophobicContact CH2-CE 3.18Å; W34-M38 HydrophobicContact CH2-SD 3.92Å; W34-M38 HydrophobicContact CZ2-CE 3.36Å; W34-M38 HydrophobicContact CZ2-SD 3.49Å; W34-M38 WeakPolarHBondContact CZ2-SD 3.4Å; W34-M38 HydrophobicContact CZ3-CE 3.31Å; W34-M38 PolarHBondContact O-N 2.94Å; L35-M38 HydrophobicContact CD2-CE 4.05Å; L35-M38 PolarHBondContact O-N 2.95Å; Q36-M38 PolarHBondContact O-N 3.45Å
39G90.3Very high80.6Confident68 Ų6897.7 Ų97.770%0.70154%0.539SS*.THydrogen-bonded Turntrans77.917.7179.100000114.9L35 Q36 S37L35-G39 PolarHBondContact O-N 3.16Å; Q36-G39 PolarHBondContact O-N 3.18Å; S37-G39 VanDerWaalsContact C-N 3.28Å
40A88.4Confident78.1Confident44 Ų44102.8 Ų102.836%0.36456%0.559SS.*  trans-72.5135.817700000111.6L35L35-A40 HydrophobicContact CB-CB 4.1Å; L35-A40 HydrophobicContact CD2-CB 4.42Å; L35-A40 WeakPolarHBondContact O-CB 3.4Å; L35-A40 PolarHBondContact O-N 2.97Å
41N87.1Confident75.3Confident160 Ų160100.4 Ų100.486%0.85656%0.562SS**  trans-90.4110.2175.6-172.315.8000110.5
42I84Confident72.4Confident24 Ų24105 Ų10512%0.12360%0.597CS.*PPolyproline II helixtrans-94.7126.4-177.1-56.9172.6000109.3L23 R32 L35 Q36L23-I42 HydrophobicContact CB-CG2 4.43Å; L23-I42 HydrophobicContact CD1-CG2 3.96Å; R32-I42 HydrophobicContact CB-CD1 4.35Å; R32-I42 HydrophobicContact CG-CD1 3.8Å; L35-I42 HydrophobicContact CB-CD1 4.06Å; L35-I42 HydrophobicContact CD1-CD1 4.3Å; Q36-I42 HydrophobicContact CG-CD1 4.01Å
43P80.9Confident69.8Low67 Ų67111.9 Ų111.944%0.43563%0.631SS.*PPolyproline II helixtrans-55.3143177-24.532.9000112.3P20 H24P20-P43 HydrophobicContact CB-CG 4.33Å; H24-P43 PolarHBondContact CE1-O 3.06Å; H24-P43 VanDerWaalsContact CE1-O 3.24Å; H24-P43 PolarHBondContact NE2-O 3.45Å
44P77.2Confident67.1Low113 Ų113112.4 Ų112.473%0.73465%0.648SS**PPolyproline II helixtrans-62.5152.1177.225.8-32.8000111.3A46P44-A46 PolarHBondContact O-N 2.97Å
45P76.4Confident64.2Low80 Ų80109.9 Ų109.952%0.51966%0.663SS.*PPolyproline II helixtrans-61.9138.4-18025.7-30.3000109.8H24 K47H24-P45 HydrophobicContact CB-CB 4.37Å; H24-P45 WeakPolarHBondContact CE1-CD 3.45Å; P45-K47 PolarHBondContact O-N 2.77Å
46A66.9Low61.2Low95 Ų95114.8 Ų114.879%0.78570%0.698SS**PPolyproline II helixtrans-57.5124.8172.800000109P44 K48P44-A46 PolarHBondContact O-N 2.97Å; A46-K48 PolarHBondContact O-N 3.24Å; A46-K48 VanDerWaalsContact O-N 3.14Å
47K52.1Low59.1Low204 Ų204115.1 Ų115.189%0.88771%0.71SS**PPolyproline II helixtrans-58.1119.4-180-70.8-179.2178.51800109.2P45 Q49P45-K47 PolarHBondContact O-N 2.77Å; K47-Q49 PolarHBondContact O-N 2.88Å
48K43.7Very low56.4Low185 Ų185117.2 Ų117.280%0.80472%0.723SS**PPolyproline II helixtrans-58.6120.3162.9-73179.9176.3-179.50107.3A46 D50A46-K48 PolarHBondContact O-N 3.24Å; A46-K48 VanDerWaalsContact O-N 3.14Å; K48-D50 VanDerWaalsContact C-N 3.28Å; K48-D50 PolarHBondContact O-N 3.23Å
49Q35Very low53.6Low200 Ų200115.1 Ų115.194%0.93573%0.729SS**  trans-69.894.3163.9-80.9-174.1-26.400107.2K47K47-Q49 PolarHBondContact O-N 2.88Å
50D33.8Very low51.3Low136 Ų136118.4 Ų118.473%0.72774%0.738SS**  trans-73.7131.9165.1-84.2-34.8000109.9K48K48-D50 VanDerWaalsContact C-N 3.28Å; K48-D50 PolarHBondContact O-N 3.23Å
51S35Very low48.7Very low104 Ų104121.5 Ų121.573%0.72776%0.757SS**  trans63.2107.2154.267.50000118.6Q53S51-Q53 PolarHBondContact O-N 3.4Å
52C29.3Very low46.5Very low134 Ų134119.9 Ų119.991%0.90576%0.755SS**  trans-70.9108.815560.70000109.9
53Q36.1Very low44.3Very low191 Ų191124.6 Ų124.689%0.89379%0.79SS**  trans-125.6127.7154.9-83.1-169.6-5.900108.6S51S51-Q53 PolarHBondContact O-N 3.4Å
54G33.5Very low42.2Very low84 Ų84125.6 Ų125.687%0.86680%0.804SS**SBendtrans112.1115.616900000113.3
55G32.3Very low40.4Very low78 Ų78124.7 Ų124.780%0.80481%0.806SS**  trans-85.3153.7-16800000115.9
56C28.7Very low39Very low132 Ų132126.3 Ų126.389%0.89282%0.817SS**  trans-177.2163.1143.6-1040000109.7
57P45.2Very low38Very low115 Ų115127.3 Ų127.375%0.74782%0.815SS**  -96.6159.1-126.136.1-37000115.7
58C35.3Very low37.7Very low139 Ų139123.4 Ų123.494%0.93981%0.811SS**  trans-22.5121.2169.3-47.40000116.6
59G33.8Very low37.8Very low65 Ų65122.7 Ų122.767%0.6781%0.81SS**  trans-123.1144.115200000108.9
60P42.6Very low38.1Very low136 Ų136118.9 Ų118.988%0.88380%0.803SS**  trans-73.5147.9-168.529.9-33000112.7
61S34.2Very low38.6Very low110 Ų110121 Ų12177%0.76981%0.808SS**  trans-52.7141.3-178-163.70000114.3S63S61-S63 PolarHBondContact O-N 2.99Å; S61-S63 VanDerWaalsContact O-N 3.12Å
62P41.2Very low38.9Very low126 Ų126123.3 Ų123.382%0.81881%0.812SS**  trans-70.4106.2165.227.9-29.3000109.9A64P62-A64 PolarHBondContact O-N 3.5Å
63S37.6Very low39.4Very low122 Ų122122 Ų12285%0.85380%0.801SS**  trans-69.7116.8160.1-179.50000109S61S61-S63 PolarHBondContact O-N 2.99Å; S61-S63 VanDerWaalsContact O-N 3.12Å
64A35.6Very low39.7Very low89 Ų89119.4 Ų119.474%0.73680%0.798SS**  trans154.383.1140.500000109.5P62P62-A64 PolarHBondContact O-N 3.5Å
65A40.2Very low40.1Very low93 Ų93120.1 Ų120.177%0.76978%0.783SS**PPolyproline II helixtrans-69.7134.1155.800000108
66P47.1Very low40.5Very low115 Ų115121.3 Ų121.375%0.74778%0.779SS**PPolyproline II helixtrans-62.1146.5167.326.8-31000109.1
67P46.8Very low41.2Very low115 Ų115124.1 Ų124.175%0.74778%0.778SS**PPolyproline II helixtrans-60.3143.9-177.525.6-32.8000110E69P67-E69 PolarHBondContact O-N 3.37Å
68P43.9Very low41.1Very low122 Ų122122 Ų12279%0.79277%0.767SS**PPolyproline II helixtrans-59.4126.2176.424.6-31000108.5
69E47.1Very low41.8Very low170 Ų170124.8 Ų124.879%0.79477%0.766SS**PPolyproline II helixtrans-51.2139.7160.2-83.1-178.3151.800107.6P67 E71P67-E69 PolarHBondContact O-N 3.37Å; E69-E71 VanDerWaalsContact C-N 3.34Å; E69-E71 PolarHBondContact O-N 3.11Å
70P40.1Very low42.6Very low121 Ų121124.9 Ų124.979%0.78675%0.749SS**  trans-62.3103.3176.325.5-30.4000107.1L72P70-L72 PolarHBondContact O-N 3.08Å
71E45.1Very low43.3Very low180 Ų180121.9 Ų121.984%0.84173%0.731SS**  trans-50.3118.1162.5-71-171.5171.500105.5E69E69-E71 VanDerWaalsContact C-N 3.34Å; E69-E71 PolarHBondContact O-N 3.11Å
72L40.6Very low45Very low153 Ų153125.2 Ų125.280%0.80174%0.735SS**  trans-44.8134.2167.4-69.9166.3000106.3P70 V74P70-L72 PolarHBondContact O-N 3.08Å; L72-V74 PolarHBondContact O-N 3.41Å
73P40Very low46.8Very low105 Ų105121.6 Ų121.668%0.68271%0.708SS**  trans-54.2114.9175.323.6-30.7000105.7D75P73-D75 PolarHBondContact O-N 3.46Å
74V43.5Very low48.9Very low137 Ų137123.5 Ų123.583%0.8370%0.703SS**  trans-57.684.4151.7-89.80000103.4L72 S76L72-V74 PolarHBondContact O-N 3.41Å; V74-S76 PolarHBondContact O-N 3.02Å
75D41.1Very low51.3Low100 Ų100121 Ų12154%0.53568%0.677SS.*  trans-44114.4164.8-94.9-26.8000103.5P73 E77 K248P73-D75 PolarHBondContact O-N 3.46Å; D75-E77 PolarHBondContact O-N 3.21Å; D75-K248 IonicContact OD2-NZ 3.82Å
76S41Very low53.5Low103 Ų103120.6 Ų120.672%0.7266%0.662SS**  trans-39120.6-176.960.30000106.6V74 S78V74-S76 PolarHBondContact O-N 3.02Å; S76-S78 PolarHBondContact O-N 2.96Å
77E42.7Very low55.5Low190 Ų190119.9 Ų119.989%0.88865%0.652SS**  trans-52.197.1163.9-65.3-171.5141.700104.4D75 E79D75-E77 PolarHBondContact O-N 3.21Å; E77-E79 PolarHBondContact O-N 3.4Å
78S44.4Very low57.6Low72 Ų72121.2 Ų121.250%0.50365%0.648SS.*  trans-45.7131.4177.81630000104.6S76 E80S76-S78 PolarHBondContact O-N 2.96Å; S78-E80 WeakPolarHBondContact O-CA 3.29Å; S78-E80 WeakPolarHBondContact O-CB 3.26Å; S78-E80 WeakPolarHBondContact O-CG 3.46Å; S78-E80 PolarHBondContact O-N 3.37Å
79E49.1Very low59.7Low196 Ų196117.5 Ų117.592%0.91663%0.632SS**  trans-53.779.3172.7-61.2-178.4149.500108.6E77 S81E77-E79 PolarHBondContact O-N 3.4Å; E79-S81 PolarHBondContact O-N 3.12Å
80E50.4Low62.1Low67 Ų67111.8 Ų111.831%0.31361%0.608SS.*  trans-83.394-170.8-73.3-117.7136.400104.8S78 E82 Y241 K244S78-E80 WeakPolarHBondContact O-CA 3.29Å; S78-E80 WeakPolarHBondContact O-CB 3.26Å; S78-E80 WeakPolarHBondContact O-CG 3.46Å; S78-E80 PolarHBondContact O-N 3.37Å; E80-E82 PolarHBondContact O-N 2.96Å; E80-E82 VanDerWaalsContact O-N 3.11Å; E80-Y241 WeakPolarHBondContact OE2-CD2 3.23Å; E80-Y241 WeakPolarHBondContact OE2-CE2 3.38Å; E80-K244 IonicContact OE1-NZ 2.6Å; E80-K244 PolarHBondContact OE1-NZ 3.36Å; E80-K244 IonicContact OE2-NZ 3.83Å
81S58.4Low64.7Low73 Ų73108 Ų10851%0.5158%0.581SS.*  trans-7.2100.6170.857.80000113.5E79 I83E79-S81 PolarHBondContact O-N 3.12Å; S81-I83 PolarHBondContact O-N 3.02Å
82E69.8Low67.1Low181 Ų181107.7 Ų107.785%0.84658%0.58SS**  trans-51.1124.9168.1-173173.2-175.800108.2E80 E84E80-E82 PolarHBondContact O-N 2.96Å; E80-E82 VanDerWaalsContact O-N 3.11Å; E82-E84 PolarHBondContact O-N 2.77Å
83I79.4Confident69.7Low49 Ų49103.9 Ų103.925%0.25156%0.564SS.*  trans-69105178.7-55.3172.5000107.5S81 I85 K233 H237S81-I83 PolarHBondContact O-N 3.02Å; I83-I85 HydrophobicContact CB-CD1 4.33Å; I83-I85 HydrophobicContact CG2-CD1 3.56Å; I83-I85 HydrophobicContact CG2-CG1 3.71Å; I83-I85 PolarHBondContact O-N 3.3Å; I83-K233 HydrophobicContact CG2-CD 4.28Å; I83-K233 HydrophobicContact CG2-CG 4.3Å; I83-H237 HydrophobicContact CD1-CB 3.34Å; I83-H237 VanDerWaalsContact CD1-ND1 3.33Å; I83-H237 WeakPolarHBondContact CD1-ND1 3.29Å; I83-H237 HydrophobicContact CG1-CB 3.86Å; I83-H237 WeakPolarHBondContact CG1-CD2 3.44Å
84E80.2Confident72.3Confident163 Ų16399.8 Ų99.876%0.76254%0.537SS*.  trans-71.4102.7170-66179.6-174.700109.6E82 K233E82-E84 PolarHBondContact O-N 2.77Å; E84-K233 PolarHBondContact O-NZ 2.85Å
85I86.3Confident74.7Confident35 Ų3599.7 Ų99.718%0.17954%0.536CS..  trans-108.8131.4168.6-71.2146.3000108I83 N87 W201 K230 I234I83-I85 HydrophobicContact CB-CD1 4.33Å; I83-I85 HydrophobicContact CG2-CD1 3.56Å; I83-I85 HydrophobicContact CG2-CG1 3.71Å; I83-I85 PolarHBondContact O-N 3.3Å; I85-N87 PolarHBondContact O-N 3.49Å; I85-N87 PolarHBondContact O-OD1 2.99Å; I85-W201 HydrophobicContact CG2-CZ2 4.3Å; I85-K230 HydrophobicContact CG2-CB 4.46Å; I85-K230 HydrophobicContact CG2-CD 4.19Å; I85-K230 HydrophobicContact CG2-CG 4.35Å; I85-I234 HydrophobicContact CD1-CD1 3.73Å; I85-I234 HydrophobicContact CD1-CG1 3.38Å
86D87.1Confident77Confident86 Ų8698.9 Ų98.946%0.4653%0.532SS..  trans-62.4117.5168.816450000109.8E88 K230D86-E88 WeakPolarHBondContact OD1-CB 3.37Å; D86-E88 PolarHBondContact OD1-N 3.48Å; D86-E88 WeakPolarHBondContact OD2-CB 3.42Å; D86-K230 WeakPolarHBondContact O-CE 3.31Å; D86-K230 PolarHBondContact O-NZ 2.75Å; D86-K230 IonicContact OD2-NZ 3.45Å; D86-K230 PolarHBondContact OD2-NZ 3.4Å
87N89.1Confident79.3Confident99 Ų99101.3 Ų101.353%0.52954%0.537SS..  trans-9821.1-179.9-67.7-27.7000112.3I85 G89 V90I85-N87 PolarHBondContact O-N 3.49Å; I85-N87 PolarHBondContact O-OD1 2.99Å; N87-G89 PolarHBondContact O-N 3.47Å; N87-V90 HydrophobicContact CB-CB 4.27Å; N87-V90 HydrophobicContact CB-CG2 4.04Å; N87-V90 VanDerWaalsContact O-CB 3.31Å; N87-V90 WeakPolarHBondContact O-CB 3.49Å; N87-V90 WeakPolarHBondContact O-CG2 3.32Å; N87-V90 PolarHBondContact O-N 3.05Å
88E90.4Very high81.6Confident144 Ų144100.1 Ų100.167%0.67353%0.532SS*.THydrogen-bonded Turntrans-50.9131.3174.2-174.3173.5-16900111.3D86 V90 R196D86-E88 WeakPolarHBondContact OD1-CB 3.37Å; D86-E88 PolarHBondContact OD1-N 3.48Å; D86-E88 WeakPolarHBondContact OD2-CB 3.42Å; E88-V90 PolarHBondContact O-N 3.34Å; E88-R196 PolarHBondContact O-NH1 2.95Å; E88-R196 PolarHBondContact O-NH2 3.06Å
89G89.1Confident83.9Confident44 Ų4498.2 Ų98.245%0.45452%0.515SS..THydrogen-bonded Turntrans70.35.418000000115.6N87N87-G89 PolarHBondContact O-N 3.47Å
90V95.8Very high86Confident49 Ų4993.5 Ų93.530%0.29749%0.493SS..  trans-74.3133.6166.9179.60000108.6N87 E88 L197 W201N87-V90 HydrophobicContact CB-CB 4.27Å; N87-V90 HydrophobicContact CB-CG2 4.04Å; N87-V90 VanDerWaalsContact O-CB 3.31Å; N87-V90 WeakPolarHBondContact O-CB 3.49Å; N87-V90 WeakPolarHBondContact O-CG2 3.32Å; N87-V90 PolarHBondContact O-N 3.05Å; E88-V90 PolarHBondContact O-N 3.34Å; V90-L197 CarbonylContact C-O 3.03Å; V90-L197 VanDerWaalsContact CA-O 3.29Å; V90-L197 WeakPolarHBondContact CA-O 3.47Å; V90-W201 HydrophobicContact CG2-CH2 3.84Å; V90-W201 HydrophobicContact CG2-CZ2 3.52Å
91I95.8Very high88.1Confident41 Ų4192.8 Ų92.821%0.2149%0.49CS..  trans-116.2162.5-179.962170.9000110.3Q165 P167 L197I91-Q165 HydrophobicContact CD1-CB 3.79Å; I91-Q165 HydrophobicContact CD1-CG 4.42Å; I91-P167 HydrophobicContact CD1-CG 4.08Å; I91-P167 HydrophobicContact CG1-CG 4.46Å; I91-L197 HydrophobicContact CD1-CB 4.05Å; I91-L197 HydrophobicContact CD1-CD1 4.21Å; I91-L197 HydrophobicContact CD1-CD2 4.23Å; I91-L197 HydrophobicContact CD1-CG 4.4Å; I91-L197 HydrophobicContact CG1-CB 3.95Å; I91-L197 HydrophobicContact CG1-CD2 4.39Å; I91-L197 WeakPolarHBondContact CG1-O 3.47Å; I91-L197 PolarHBondContact N-O 3.24Å
92E94.8Very high89.5Confident174 Ų17490.4 Ų90.481%0.81348%0.477SS*.PPolyproline II helixtrans-65.6142.7172.5-67.5-175.1175.900111
93P95.8Very high90.4Very high74 Ų7488 Ų8848%0.48147%0.466SS..PPolyproline II helixtrans-63.5137.1176.124.5-31.8000111.1T95 N168 L198P93-T95 PolarHBondContact O-N 2.85Å; P93-N168 VanDerWaalsContact CB-ND2 3.3Å; P93-N168 WeakPolarHBondContact CB-ND2 3.43Å; P93-L198 HydrophobicContact CB-CD2 3.79Å
94D95.3Very high90.5Very high19 Ų1989.2 Ų89.210%0.10247%0.469CS..PPolyproline II helixtrans-65133.2169.853.8-60.5000110.6K166 P167 N168 A169D94-K166 HydrophobicContact CB-CB 4.22Å; D94-K166 HydrophobicContact CB-CG 4.35Å; D94-P167 WeakPolarHBondContact OD1-CD 3.37Å; D94-P167 VanDerWaalsContact OD1-N 3.12Å; D94-N168 PolarHBondContact O-ND2 3.04Å; D94-N168 WeakPolarHBondContact OD1-CA 3.21Å; D94-N168 WeakPolarHBondContact OD1-CB 3.37Å; D94-N168 PolarHBondContact OD1-N 2.95Å; D94-N168 PolarHBondContact OD1-ND2 3.17Å; D94-N168 WeakPolarHBondContact OD2-CB 3.37Å; D94-A169 PolarHBondContact OD2-N 3.46Å
95T93.1Very high90.6Very high134 Ų13487.8 Ų87.882%0.82247%0.467SS*.  trans-113.311.5-177.451.80000112.8P93P93-T95 PolarHBondContact O-N 2.85Å
96D88.8Confident90.4Very high83 Ų8392.8 Ų92.844%0.44449%0.494SS..PPolyproline II helixtrans-61.7157.7177.3-63.7-35.3000112.1K166D96-K166 VanDerWaalsContact OD2-CE 3.25Å; D96-K166 WeakPolarHBondContact OD2-CE 3.49Å; D96-K166 IonicContact OD2-NZ 2.76Å; D96-K166 PolarHBondContact OD2-NZ 3.44Å
97D88.7Confident90.5Very high155 Ų15590.5 Ų90.583%0.82948%0.481SS*.PPolyproline II helixtrans-53.5150.8172.8-70.5-34.3000111.7Q99D97-Q99 PolarHBondContact O-N 2.85Å
98Q91.4Very high90.5Very high165 Ų16593.7 Ų93.777%0.77149%0.493SS*.PPolyproline II helixtrans-60.6125.8179.5-65.8-173.93.300110.4
99Q92.9Very high90.6Very high31 Ų3187.9 Ų87.915%0.14547%0.467CS..PPolyproline II helixtrans-67.9155.4179.275.2-86.820.200111.5D97 M101 F161 A169 D173D97-Q99 PolarHBondContact O-N 2.85Å; Q99-M101 HydrophobicContact CG-SD 3.82Å; Q99-M101 WeakPolarHBondContact O-CG 3.42Å; Q99-M101 PolarHBondContact O-N 3.39Å; Q99-F161 HydrophobicContact CB-CZ 4.11Å; Q99-F161 HydrophobicContact CG-CE2 4.18Å; Q99-F161 HydrophobicContact CG-CZ 4.04Å; Q99-A169 PolarHBondContact NE2-O 3.35Å; Q99-D173 PolarHBondContact NE2-OD1 3.03Å
100E94.1Very high91Very high98 Ų9888.9 Ų88.946%0.45847%0.465SS..PPolyproline II helixtrans-69.8127.2-179.8-165.9168173.800111.8T141 K145 R157E100-T141 HydrophobicContact CB-CG2 4.09Å; E100-K145 WeakPolarHBondContact OE1-CD 3.37Å; E100-K145 WeakPolarHBondContact OE1-CE 3.41Å; E100-K145 IonicContact OE1-NZ 2.73Å; E100-K145 PolarHBondContact OE1-NZ 3.25Å; E100-K145 WeakPolarHBondContact OE2-CE 3.46Å; E100-K145 IonicContact OE2-NZ 2.61Å; E100-K145 PolarHBondContact OE2-NZ 3.44Å; E100-R157 PolarHBondContact O-NH1 3.35Å; E100-R157 PolarHBondContact O-NH2 3.34Å
101M93.6Very high91Very high52 Ų5293.9 Ų93.926%0.25649%0.485SS..  trans-106.70.7-173-61.4-55.5-69.600114.1Q99 I144 Y154 R157 D173 R176Q99-M101 HydrophobicContact CG-SD 3.82Å; Q99-M101 WeakPolarHBondContact O-CG 3.42Å; Q99-M101 PolarHBondContact O-N 3.39Å; M101-I144 WeakPolarHBondContact O-CG2 3.4Å; M101-Y154 HydrophobicContact CE-CD1 3.84Å; M101-Y154 HydrophobicContact CE-CE1 3.72Å; M101-Y154 PolarHBondContact O-OH 3.5Å; M101-R157 PolarHBondContact SD-NH2 2.93Å; M101-D173 WeakPolarHBondContact CE-OD1 3.39Å; M101-D173 VanDerWaalsContact SD-OD1 3.36Å; M101-R176 HydrophobicContact CE-CB 3.71Å; M101-R176 HydrophobicContact CE-CG 3.93Å
102G88.5Confident91Very high22 Ų2298.2 Ų98.223%0.22750%0.504CS..  trans71.5158.9-172.100000113.1F104G102-F104 PolarHBondContact O-N 3.46Å
103E88.1Confident91.1Very high132 Ų13291.7 Ų91.762%0.61747%0.474SS*.  trans-87.386.9-179-67.1-175-159.800111.2D105 I107E103-D105 PolarHBondContact O-N 3.03Å; E103-I107 HydrophobicContact CB-CB 4.48Å; E103-I107 WeakPolarHBondContact O-CB 3.47Å; E103-I107 WeakPolarHBondContact O-CG2 3.43Å; E103-I107 PolarHBondContact O-N 3.21Å
104F80.7Confident91.1Very high73 Ų7392.4 Ų92.432%0.3247%0.472SS..THydrogen-bonded Turntrans-65-41.8-171.7-178.5-124.8000115.4G102 R149G102-F104 PolarHBondContact O-N 3.46Å; F104-R149 HydrophobicContact CD2-CG 3.83Å; F104-R149 HydrophobicContact CE2-CB 4.21Å; F104-R149 HydrophobicContact CE2-CG 3.66Å; F104-R149 PolarHBondContact O-NH2 2.94Å
105D82.7Confident91.3Very high134 Ų13495.9 Ų95.972%0.71749%0.491SS*.THydrogen-bonded Turntrans-86.4-28.7-168.8-63.7-36.8000113E103E103-D105 PolarHBondContact O-N 3.03Å
106N82.6Confident91.5Very high140 Ų14093 Ų9375%0.74947%0.468SS*.THydrogen-bonded Turntrans-107.2-12.7-168.2-63.4-26.9000114.2
107I88.9Confident91.9Very high37 Ų3789.2 Ų89.219%0.1945%0.448CS..  trans-87.4127.4-178.4-154.2169.6000111.3E103 V109 M113 K145 P148E103-I107 HydrophobicContact CB-CB 4.48Å; E103-I107 WeakPolarHBondContact O-CB 3.47Å; E103-I107 WeakPolarHBondContact O-CG2 3.43Å; E103-I107 PolarHBondContact O-N 3.21Å; I107-V109 HydrophobicContact CG2-CG2 3.93Å; I107-M113 HydrophobicContact CD1-CE 3.47Å; I107-M113 VanDerWaalsContact CD1-CE 3.47Å; I107-M113 HydrophobicContact CG1-CE 3.93Å; I107-K145 VanDerWaalsContact CD1-O 3.31Å; I107-K145 WeakPolarHBondContact CD1-O 3.48Å; I107-P148 HydrophobicContact CG2-CG 3.59Å
108E90.1Very high92.3Very high167 Ų16785 Ų8578%0.7843%0.426SS*.  trans-86.6111.8164.7-172.9172.5-169.300108.3T110E108-T110 PolarHBondContact O-N 3.5Å
109V92.8Very high92.7Very high22 Ų2282.8 Ų82.813%0.13342%0.415CS..  trans-84.2108-178.9-175.30000108.7I107 M113 M114 N147I107-V109 HydrophobicContact CG2-CG2 3.93Å; V109-M113 HydrophobicContact CG1-CB 4.29Å; V109-M114 HydrophobicContact CB-CE 4.22Å; V109-M114 HydrophobicContact CG1-CE 3.81Å; V109-M114 HydrophobicContact CG1-CG 3.55Å; V109-M114 HydrophobicContact CG1-SD 4.5Å; V109-M114 WeakPolarHBondContact O-CE 3.25Å; V109-N147 HydrophobicContact CG1-CB 4.09Å
110T96.1Very high92.9Very high65 Ų6584.1 Ų84.140%0.39942%0.421SS..  trans-80162.4175.567.10000111.5E108 E112 M113 M114E108-T110 PolarHBondContact O-N 3.5Å; T110-E112 VanDerWaalsContact C-N 3.29Å; T110-E112 PolarHBondContact O-N 3.32Å; T110-M113 HydrophobicContact CG2-SD 4.3Å; T110-M113 WeakPolarHBondContact O-CB 3.41Å; T110-M113 PolarHBondContact O-N 2.9Å; T110-M113 VanDerWaalsContact O-N 3.12Å; T110-M113 VanDerWaalsContact OG1-CG 3.28Å; T110-M113 WeakPolarHBondContact OG1-CG 3.44Å; T110-M113 PolarHBondContact OG1-N 2.98Å; T110-M114 WeakPolarHBondContact O-CG 3.47Å; T110-M114 PolarHBondContact O-N 2.95Å
111E95.7Very high93.1Very high153 Ų15381.9 Ų81.972%0.71541%0.41SS*.Hα-helixtrans-56.3-42.9176.2-171.8172.7-170.100111.8M113 M114 D115E111-M113 VanDerWaalsContact C-N 3.33Å; E111-M113 PolarHBondContact O-N 3.24Å; E111-M114 WeakPolarHBondContact O-CB 3.24Å; E111-M114 PolarHBondContact O-N 3.33Å; E111-D115 PolarHBondContact O-N 3.23Å
112E96.8Very high93.4Very high132 Ų13283.3 Ų83.362%0.61742%0.417SS*.Hα-helixtrans-60.2-41.3175.8-174.9177.4-177.900112.2T110 M114 D115 Q116T110-E112 VanDerWaalsContact C-N 3.29Å; T110-E112 PolarHBondContact O-N 3.32Å; E112-M114 VanDerWaalsContact C-N 3.31Å; E112-M114 PolarHBondContact O-N 3.18Å; E112-D115 PolarHBondContact O-N 2.65Å; E112-Q116 WeakPolarHBondContact O-CB 3.47Å; E112-Q116 VanDerWaalsContact O-CG 3.28Å; E112-Q116 WeakPolarHBondContact O-CG 3.27Å; E112-Q116 PolarHBondContact O-N 3.16Å; E112-Q116 PolarHBondContact OE1-NE2 2.85Å
113M96.4Very high93.8Very high38 Ų3886.5 Ų86.519%0.18743%0.426CS..Hα-helixtrans-66.4-33.6175.2-68.4169.875.900112.2I107 V109 T110 E111 A117 L146I107-M113 HydrophobicContact CD1-CE 3.47Å; I107-M113 VanDerWaalsContact CD1-CE 3.47Å; I107-M113 HydrophobicContact CG1-CE 3.93Å; V109-M113 HydrophobicContact CG1-CB 4.29Å; T110-M113 HydrophobicContact CG2-SD 4.3Å; T110-M113 WeakPolarHBondContact O-CB 3.41Å; T110-M113 PolarHBondContact O-N 2.9Å; T110-M113 VanDerWaalsContact O-N 3.12Å; T110-M113 VanDerWaalsContact OG1-CG 3.28Å; T110-M113 WeakPolarHBondContact OG1-CG 3.44Å; T110-M113 PolarHBondContact OG1-N 2.98Å; E111-M113 VanDerWaalsContact C-N 3.33Å; E111-M113 PolarHBondContact O-N 3.24Å; M113-A117 WeakPolarHBondContact O-CB 3.38Å; M113-A117 PolarHBondContact O-N 3.22Å; M113-L146 VanDerWaalsContact CE-O 3.28Å; M113-L146 WeakPolarHBondContact CE-O 3.45Å; M113-L146 HydrophobicContact CG-CD2 4.41Å
114M96.8Very high94.3Very high88 Ų8880.2 Ų80.243%0.43340%0.397SS..Hα-helixtrans-66.1-43174.9-60.9-172-159.100111.4V109 T110 E111 E112 A117 N118V109-M114 HydrophobicContact CB-CE 4.22Å; V109-M114 HydrophobicContact CG1-CE 3.81Å; V109-M114 HydrophobicContact CG1-CG 3.55Å; V109-M114 HydrophobicContact CG1-SD 4.5Å; V109-M114 WeakPolarHBondContact O-CE 3.25Å; T110-M114 WeakPolarHBondContact O-CG 3.47Å; T110-M114 PolarHBondContact O-N 2.95Å; E111-M114 WeakPolarHBondContact O-CB 3.24Å; E111-M114 PolarHBondContact O-N 3.33Å; E112-M114 VanDerWaalsContact C-N 3.31Å; E112-M114 PolarHBondContact O-N 3.18Å; M114-A117 PolarHBondContact O-N 2.95Å; M114-N118 WeakPolarHBondContact O-CB 3.34Å; M114-N118 PolarHBondContact O-N 3.07Å
115D97.7Very high95.1Very high93 Ų9380 Ų8050%0.49740%0.398SS..Hα-helixtrans-64.5-48.6177.6-73.1-21.2000111E111 E112 A117 N118 E119E111-D115 PolarHBondContact O-N 3.23Å; E112-D115 PolarHBondContact O-N 2.65Å; D115-A117 VanDerWaalsContact C-N 3.34Å; D115-A117 PolarHBondContact O-N 3.45Å; D115-N118 WeakPolarHBondContact O-CA 3.22Å; D115-N118 WeakPolarHBondContact O-CB 3.42Å; D115-N118 PolarHBondContact O-N 3.32Å; D115-E119 WeakPolarHBondContact O-CG 3.33Å; D115-E119 PolarHBondContact O-N 3.12Å
116Q97.9Very high95.9Very high72 Ų7277.9 Ų77.934%0.33639%0.387SS..Hα-helixtrans-59.5-43.1175.2-70.4174.54.600111.8E112 N118 E119 K120 L146E112-Q116 WeakPolarHBondContact O-CB 3.47Å; E112-Q116 VanDerWaalsContact O-CG 3.28Å; E112-Q116 WeakPolarHBondContact O-CG 3.27Å; E112-Q116 PolarHBondContact O-N 3.16Å; E112-Q116 PolarHBondContact OE1-NE2 2.85Å; Q116-N118 VanDerWaalsContact C-N 3.26Å; Q116-N118 PolarHBondContact O-N 3.39Å; Q116-E119 PolarHBondContact O-N 2.88Å; Q116-K120 WeakPolarHBondContact O-CB 3.47Å; Q116-K120 VanDerWaalsContact O-CG 3.26Å; Q116-K120 WeakPolarHBondContact O-CG 3.26Å; Q116-K120 PolarHBondContact O-N 3.47Å; Q116-L146 HydrophobicContact CB-CD1 3.79Å
117A97.8Very high96.6Very high4 Ų471.3 Ų71.33%0.03335%0.352CS..Hα-helixtrans-62-37.1175.800000111.6M113 M114 D115 K121 L146 N147M113-A117 WeakPolarHBondContact O-CB 3.38Å; M113-A117 PolarHBondContact O-N 3.22Å; M114-A117 PolarHBondContact O-N 2.95Å; D115-A117 VanDerWaalsContact C-N 3.34Å; D115-A117 PolarHBondContact O-N 3.45Å; A117-K121 WeakPolarHBondContact O-CB 3.41Å; A117-K121 PolarHBondContact O-N 3.21Å; A117-L146 HydrophobicContact CB-CB 3.81Å; A117-N147 HydrophobicContact CB-CB 3.73Å
118N97.7Very high97Very high68 Ų6870.7 Ų70.736%0.36435%0.349SS..Hα-helixtrans-70.7-39.5178.1-174.362.7000112.3M114 D115 Q116 K121 I122M114-N118 WeakPolarHBondContact O-CB 3.34Å; M114-N118 PolarHBondContact O-N 3.07Å; D115-N118 WeakPolarHBondContact O-CA 3.22Å; D115-N118 WeakPolarHBondContact O-CB 3.42Å; D115-N118 PolarHBondContact O-N 3.32Å; Q116-N118 VanDerWaalsContact C-N 3.26Å; Q116-N118 PolarHBondContact O-N 3.39Å; N118-K121 WeakPolarHBondContact O-CB 3.35Å; N118-K121 PolarHBondContact O-N 3.46Å; N118-K121 WeakPolarHBondContact OD1-CE 3.46Å; N118-K121 PolarHBondContact OD1-NZ 3.36Å; N118-I122 WeakPolarHBondContact O-CG1 3.38Å; N118-I122 PolarHBondContact O-N 3.21Å
119E98.3Very high97.2Very high118 Ų11866.1 Ų66.155%0.55135%0.347SS*.Hα-helixtrans-59.8-51.6171.7-71.6178.4173.500110.8D115 Q116 K121 I122 E123D115-E119 WeakPolarHBondContact O-CG 3.33Å; D115-E119 PolarHBondContact O-N 3.12Å; Q116-E119 PolarHBondContact O-N 2.88Å; E119-K121 VanDerWaalsContact C-N 3.27Å; E119-K121 PolarHBondContact O-N 3.47Å; E119-I122 WeakPolarHBondContact O-CA 3.46Å; E119-I122 WeakPolarHBondContact O-CB 3.4Å; E119-I122 PolarHBondContact O-N 3.23Å; E119-E123 PolarHBondContact O-N 3.29Å
120K98.5Very high97.4Very high59 Ų5972 Ų7226%0.25737%0.373SS..Hα-helixtrans-58.3-38176.8-68.4-67.5178.31710112.8Q116 E123 A124 L139 E142 A143 L146Q116-K120 WeakPolarHBondContact O-CB 3.47Å; Q116-K120 VanDerWaalsContact O-CG 3.26Å; Q116-K120 WeakPolarHBondContact O-CG 3.26Å; Q116-K120 PolarHBondContact O-N 3.47Å; K120-E123 IonicContact NZ-OE2 2.72Å; K120-E123 PolarHBondContact O-N 3.33Å; K120-A124 VanDerWaalsContact O-CB 3.27Å; K120-A124 WeakPolarHBondContact O-CB 3.5Å; K120-A124 PolarHBondContact O-N 3.25Å; K120-L139 HydrophobicContact CD-CD2 3.84Å; K120-E142 HydrophobicContact CD-CB 4.41Å; K120-E142 WeakPolarHBondContact CD-OE2 3.49Å; K120-E142 WeakPolarHBondContact CE-OE2 3.39Å; K120-E142 IonicContact NZ-OE2 3.75Å; K120-E142 PolarHBondContact NZ-OE2 3.47Å; K120-A143 HydrophobicContact CB-CB 3.84Å; K120-L146 HydrophobicContact CG-CD1 4.27Å
121K98.3Very high97.4Very high51 Ų5171.3 Ų71.322%0.22238%0.378CS..Hα-helixtrans-61.4-43.3173-177.7-165.978.3-167.60111.9A117 N118 E119 A124 I125 F140 L153A117-K121 WeakPolarHBondContact O-CB 3.41Å; A117-K121 PolarHBondContact O-N 3.21Å; N118-K121 WeakPolarHBondContact O-CB 3.35Å; N118-K121 PolarHBondContact O-N 3.46Å; N118-K121 WeakPolarHBondContact OD1-CE 3.46Å; N118-K121 PolarHBondContact OD1-NZ 3.36Å; E119-K121 VanDerWaalsContact C-N 3.27Å; E119-K121 PolarHBondContact O-N 3.47Å; K121-A124 PolarHBondContact O-N 3.35Å; K121-I125 HydrophobicContact CG-CD1 4.14Å; K121-I125 VanDerWaalsContact O-CG1 3.26Å; K121-I125 WeakPolarHBondContact O-CG1 3.5Å; K121-I125 PolarHBondContact O-N 2.94Å; K121-F140 HydrophobicContact CG-CE1 4.27Å; K121-L153 HydrophobicContact CB-CD2 3.69Å; K121-L153 HydrophobicContact CD-CD2 3.74Å; K121-L153 HydrophobicContact CG-CD2 3.57Å
122I98.4Very high97.5Very high82 Ų8267.4 Ų67.442%0.42136%0.362SS..Hα-helixtrans-66.5-45.8179-67.5164.1000109.9N118 E119 A124 I125 N126N118-I122 WeakPolarHBondContact O-CG1 3.38Å; N118-I122 PolarHBondContact O-N 3.21Å; E119-I122 WeakPolarHBondContact O-CA 3.46Å; E119-I122 WeakPolarHBondContact O-CB 3.4Å; E119-I122 PolarHBondContact O-N 3.23Å; I122-A124 VanDerWaalsContact C-N 3.31Å; I122-A124 PolarHBondContact O-N 2.69Å; I122-I125 PolarHBondContact O-N 2.95Å; I122-N126 VanDerWaalsContact O-CG 3.3Å; I122-N126 PolarHBondContact O-N 2.85Å; I122-N126 PolarHBondContact O-ND2 3.5Å
123E98.4Very high97.5Very high88 Ų8863.2 Ų63.241%0.41134%0.344SS..Hα-helixtrans-57.8-43.4174.6-67.2179.8178.500111.8E119 K120 I125 N126 A127 L139E119-E123 PolarHBondContact O-N 3.29Å; K120-E123 IonicContact NZ-OE2 2.72Å; K120-E123 PolarHBondContact O-N 3.33Å; E123-I125 VanDerWaalsContact C-N 3.35Å; E123-I125 PolarHBondContact O-N 3.4Å; E123-N126 PolarHBondContact O-N 3.4Å; E123-A127 WeakPolarHBondContact O-CB 3.39Å; E123-A127 PolarHBondContact O-N 3.24Å; E123-L139 HydrophobicContact CB-CD1 3.85Å; E123-L139 HydrophobicContact CB-CD2 4.29Å; E123-L139 WeakPolarHBondContact OE2-CD2 3.46Å
124A98.3Very high97.5Very high0 Ų065.8 Ų65.80%036%0.356CS..Hα-helixtrans-62.8-40.5177.800000112.3K120 K121 I122 N126 A127 L128 A136 L139 F140K120-A124 VanDerWaalsContact O-CB 3.27Å; K120-A124 WeakPolarHBondContact O-CB 3.5Å; K120-A124 PolarHBondContact O-N 3.25Å; K121-A124 PolarHBondContact O-N 3.35Å; I122-A124 VanDerWaalsContact C-N 3.31Å; I122-A124 PolarHBondContact O-N 2.69Å; A124-N126 VanDerWaalsContact C-N 3.35Å; A124-A127 PolarHBondContact O-N 3.17Å; A124-L128 WeakPolarHBondContact O-CB 3.44Å; A124-L128 PolarHBondContact O-N 3.11Å; A124-A136 WeakPolarHBondContact O-CB 3.45Å; A124-L139 HydrophobicContact CB-CB 3.6Å; A124-F140 HydrophobicContact CB-CD1 3.63Å; A124-F140 HydrophobicContact CB-CD2 3.81Å; A124-F140 HydrophobicContact CB-CE1 3.53Å; A124-F140 HydrophobicContact CB-CE2 3.71Å; A124-F140 HydrophobicContact CB-CG 3.74Å; A124-F140 HydrophobicContact CB-CZ 3.55Å
125I97.8Very high97.6Very high68 Ų6866.3 Ų66.335%0.34936%0.355SS..Hα-helixtrans-65.6-40.2176-70.3166.5000110.8K121 I122 E123 L128 G129 F140K121-I125 HydrophobicContact CG-CD1 4.14Å; K121-I125 VanDerWaalsContact O-CG1 3.26Å; K121-I125 WeakPolarHBondContact O-CG1 3.5Å; K121-I125 PolarHBondContact O-N 2.94Å; I122-I125 PolarHBondContact O-N 2.95Å; E123-I125 VanDerWaalsContact C-N 3.35Å; E123-I125 PolarHBondContact O-N 3.4Å; I125-L128 PolarHBondContact O-N 3.31Å; I125-G129 PolarHBondContact O-N 3.47Å; I125-F140 HydrophobicContact CG1-CE1 4.4Å; I125-F140 HydrophobicContact CG1-CZ 4.01Å
126N98.2Very high97.6Very high91 Ų9161.9 Ų61.949%0.48733%0.332SS..Hα-helixtrans-64.5-48176.7-67.2-19.8000111I122 E123 A124 L128 G129 E130I122-N126 VanDerWaalsContact O-CG 3.3Å; I122-N126 PolarHBondContact O-N 2.85Å; I122-N126 PolarHBondContact O-ND2 3.5Å; E123-N126 PolarHBondContact O-N 3.4Å; A124-N126 VanDerWaalsContact C-N 3.35Å; N126-L128 VanDerWaalsContact C-N 3.27Å; N126-L128 PolarHBondContact O-N 3.37Å; N126-G129 WeakPolarHBondContact O-CA 3.41Å; N126-G129 PolarHBondContact O-N 3.23Å; N126-E130 WeakPolarHBondContact O-CG 3.35Å; N126-E130 PolarHBondContact O-N 3.4Å
127A98Very high97.6Very high2 Ų259.4 Ų59.42%0.01732%0.321CS..Hα-helixtrans-58-40175.200000112E123 A124 G129 E130 G131 D132 K135 A136 L139E123-A127 WeakPolarHBondContact O-CB 3.39Å; E123-A127 PolarHBondContact O-N 3.24Å; A124-A127 PolarHBondContact O-N 3.17Å; A127-G129 VanDerWaalsContact C-N 3.32Å; A127-G129 PolarHBondContact O-N 3.32Å; A127-E130 PolarHBondContact O-N 2.96Å; A127-G131 PolarHBondContact O-N 3.49Å; A127-G131 VanDerWaalsContact O-N 3.07Å; A127-D132 PolarHBondContact O-N 3.22Å; A127-K135 HydrophobicContact CB-CB 4.32Å; A127-K135 HydrophobicContact CB-CD 4.1Å; A127-K135 HydrophobicContact CB-CG 4.1Å; A127-A136 HydrophobicContact CB-CB 4.13Å; A127-L139 HydrophobicContact CB-CD1 4.29Å
128L96.4Very high97.6Very high24 Ų2462.7 Ų62.713%0.12634%0.338CS..Hα-helixtrans-64.8-34.5174.5-178.159.4000112.8A124 I125 N126 G131 L133 A136 V160 K163A124-L128 WeakPolarHBondContact O-CB 3.44Å; A124-L128 PolarHBondContact O-N 3.11Å; I125-L128 PolarHBondContact O-N 3.31Å; N126-L128 VanDerWaalsContact C-N 3.27Å; N126-L128 PolarHBondContact O-N 3.37Å; L128-G131 PolarHBondContact O-N 2.67Å; L128-L133 HydrophobicContact CD1-CD2 3.58Å; L128-A136 HydrophobicContact CB-CB 4.01Å; L128-V160 HydrophobicContact CD1-CG2 4Å; L128-V160 HydrophobicContact CD2-CG2 4.14Å; L128-K163 HydrophobicContact CD1-CD 3.97Å
129G95.9Very high97.7Very high71 Ų7160.1 Ų60.173%0.73232%0.324SS*.Hα-helixtrans-70-32.9174.400000113.1I125 N126 A127 G131I125-G129 PolarHBondContact O-N 3.47Å; N126-G129 WeakPolarHBondContact O-CA 3.41Å; N126-G129 PolarHBondContact O-N 3.23Å; A127-G129 VanDerWaalsContact C-N 3.32Å; A127-G129 PolarHBondContact O-N 3.32Å; G129-G131 VanDerWaalsContact C-N 3.26Å
130E96.6Very high97.7Very high146 Ų14654.5 Ų54.568%0.68230%0.298SS*.Hα-helixtrans-76-13.7172.7-67.3171.8178.700112.7N126 A127N126-E130 WeakPolarHBondContact O-CG 3.35Å; N126-E130 PolarHBondContact O-N 3.4Å; A127-E130 PolarHBondContact O-N 2.96Å
131G95.2Very high97.7Very high49 Ų4952.6 Ų52.651%0.50529%0.291SS..THydrogen-bonded Turntrans89.43.8-179.500000114.5A127 L128 G129 L133A127-G131 PolarHBondContact O-N 3.49Å; A127-G131 VanDerWaalsContact O-N 3.07Å; L128-G131 PolarHBondContact O-N 2.67Å; G129-G131 VanDerWaalsContact C-N 3.26Å; G131-L133 PolarHBondContact O-N 3.38Å
132D97.6Very high97.7Very high72 Ų7254 Ų5439%0.38530%0.298SS..  trans-79.985.4175.3-169.1-16.7000110.4A127 K135 A136A127-D132 PolarHBondContact O-N 3.22Å; D132-K135 HydrophobicContact CB-CB 4.11Å; D132-K135 VanDerWaalsContact OD1-CB 3.28Å; D132-K135 WeakPolarHBondContact OD1-CB 3.46Å; D132-K135 PolarHBondContact OD1-N 3.4Å; D132-K135 VanDerWaalsContact OD2-CB 3.25Å; D132-K135 WeakPolarHBondContact OD2-CB 3.45Å; D132-K135 WeakPolarHBondContact OD2-CD 3.36Å; D132-A136 WeakPolarHBondContact O-CB 3.48Å; D132-A136 PolarHBondContact O-N 3.22Å
133L97.4Very high97.7Very high43 Ų4350.1 Ų50.123%0.22528%0.278CS..Hα-helixtrans-66.6-37.5-175.4-57.3-176.6000112.6L128 G131 A136 L137 V160 K163 M164L128-L133 HydrophobicContact CD1-CD2 3.58Å; G131-L133 PolarHBondContact O-N 3.38Å; L133-A136 PolarHBondContact O-N 2.87Å; L133-L137 WeakPolarHBondContact O-CB 3.43Å; L133-L137 PolarHBondContact O-N 3.45Å; L133-V160 HydrophobicContact CB-CG1 4.07Å; L133-V160 HydrophobicContact CD2-CG1 4.42Å; L133-V160 VanDerWaalsContact O-CG1 3.32Å; L133-V160 WeakPolarHBondContact O-CG1 3.48Å; L133-K163 HydrophobicContact CD1-CB 3.88Å; L133-K163 HydrophobicContact CD2-CB 4.22Å; L133-K163 HydrophobicContact CD2-CD 3.82Å; L133-M164 HydrophobicContact CB-CG 3.98Å; L133-M164 HydrophobicContact CB-SD 4.15Å; L133-M164 HydrophobicContact CD1-CG 3.79Å
134Q97.5Very high97.6Very high93 Ų9346 Ų4644%0.43526%0.259SS..Hα-helixtrans-69.7-47.2-178.2-173.459.75200110.4A136 L137 D138Q134-A136 VanDerWaalsContact C-N 3.3Å; Q134-A136 PolarHBondContact O-N 3.48Å; Q134-L137 WeakPolarHBondContact O-CB 3.04Å; Q134-L137 PolarHBondContact O-N 3.28Å; Q134-L137 VanDerWaalsContact O-N 3.12Å; Q134-D138 PolarHBondContact NE2-OD1 3.24Å; Q134-D138 VanDerWaalsContact O-CG 3.26Å; Q134-D138 PolarHBondContact O-N 3.09Å
135K98Very high97.6Very high99 Ų9950.1 Ų50.143%0.4328%0.277SS..Hα-helixtrans-60.4-41175.5-175.3-179.2176.7-172.10111.9A127 D132 L137 D138 L139A127-K135 HydrophobicContact CB-CB 4.32Å; A127-K135 HydrophobicContact CB-CD 4.1Å; A127-K135 HydrophobicContact CB-CG 4.1Å; D132-K135 HydrophobicContact CB-CB 4.11Å; D132-K135 VanDerWaalsContact OD1-CB 3.28Å; D132-K135 WeakPolarHBondContact OD1-CB 3.46Å; D132-K135 PolarHBondContact OD1-N 3.4Å; D132-K135 VanDerWaalsContact OD2-CB 3.25Å; D132-K135 WeakPolarHBondContact OD2-CB 3.45Å; D132-K135 WeakPolarHBondContact OD2-CD 3.36Å; K135-L137 VanDerWaalsContact C-N 3.33Å; K135-L137 PolarHBondContact O-N 3.27Å; K135-D138 PolarHBondContact O-N 3.13Å; K135-L139 HydrophobicContact CG-CD1 3.9Å; K135-L139 HydrophobicContact CG-CG 4.49Å; K135-L139 WeakPolarHBondContact O-CB 3.48Å; K135-L139 WeakPolarHBondContact O-CD1 3.48Å; K135-L139 VanDerWaalsContact O-CG 3.25Å; K135-L139 WeakPolarHBondContact O-CG 3.44Å; K135-L139 PolarHBondContact O-N 2.98Å
136A98.3Very high97.5Very high0 Ų048.6 Ų48.60%027%0.269CS..Hα-helixtrans-61.1-42175.300000112.1A124 A127 L128 D132 L133 Q134 F140 V160A124-A136 WeakPolarHBondContact O-CB 3.45Å; A127-A136 HydrophobicContact CB-CB 4.13Å; L128-A136 HydrophobicContact CB-CB 4.01Å; D132-A136 WeakPolarHBondContact O-CB 3.48Å; D132-A136 PolarHBondContact O-N 3.22Å; L133-A136 PolarHBondContact O-N 2.87Å; Q134-A136 VanDerWaalsContact C-N 3.3Å; Q134-A136 PolarHBondContact O-N 3.48Å; A136-F140 HydrophobicContact CB-CE2 4.46Å; A136-F140 WeakPolarHBondContact O-CB 3.25Å; A136-F140 WeakPolarHBondContact O-CD2 3.5Å; A136-F140 WeakPolarHBondContact O-CG 3.28Å; A136-F140 PolarHBondContact O-N 3.03Å; A136-V160 HydrophobicContact CB-CG2 4.3Å
137L97.9Very high97.4Very high20 Ų2045 Ų4511%0.10525%0.25CC..Hα-helixtrans-63.1-45177.6-174.5157.6000111.8L133 Q134 K135 F140 T141 V160 F161 M164L133-L137 WeakPolarHBondContact O-CB 3.43Å; L133-L137 PolarHBondContact O-N 3.45Å; Q134-L137 WeakPolarHBondContact O-CB 3.04Å; Q134-L137 PolarHBondContact O-N 3.28Å; Q134-L137 VanDerWaalsContact O-N 3.12Å; K135-L137 VanDerWaalsContact C-N 3.33Å; K135-L137 PolarHBondContact O-N 3.27Å; L137-F140 PolarHBondContact O-N 2.97Å; L137-T141 WeakPolarHBondContact O-CB 3.34Å; L137-T141 PolarHBondContact O-N 3.39Å; L137-T141 PolarHBondContact O-OG1 3.35Å; L137-V160 HydrophobicContact CB-CG1 4.22Å; L137-F161 HydrophobicContact CD1-CD1 3.89Å; L137-F161 HydrophobicContact CD1-CE1 3.37Å; L137-F161 HydrophobicContact CD1-CZ 3.8Å; L137-F161 HydrophobicContact CG-CE1 4.29Å; L137-F161 HydrophobicContact CG-CZ 4.23Å; L137-M164 HydrophobicContact CD1-CE 4.46Å; L137-M164 HydrophobicContact CD1-SD 3.75Å
138D98Very high97.3Very high73 Ų7344.9 Ų44.939%0.3925%0.249SC..Hα-helixtrans-63.2-47.6179.2-62.3-19.7000110.4Q134 K135 F140 T141 E142Q134-D138 PolarHBondContact NE2-OD1 3.24Å; Q134-D138 VanDerWaalsContact O-CG 3.26Å; Q134-D138 PolarHBondContact O-N 3.09Å; K135-D138 PolarHBondContact O-N 3.13Å; D138-F140 PolarHBondContact O-N 2.75Å; D138-T141 WeakPolarHBondContact O-CA 3.36Å; D138-T141 WeakPolarHBondContact O-CB 3.5Å; D138-T141 PolarHBondContact O-N 2.85Å; D138-E142 PolarHBondContact O-N 3.3Å
139L98.6Very high97.2Very high14 Ų1449.7 Ų49.77%0.07327%0.266CS..Hα-helixtrans-64-39.8177.6-70.2167.3000112.9K120 E123 A124 A127 K135 T141 E142 A143K120-L139 HydrophobicContact CD-CD2 3.84Å; E123-L139 HydrophobicContact CB-CD1 3.85Å; E123-L139 HydrophobicContact CB-CD2 4.29Å; E123-L139 WeakPolarHBondContact OE2-CD2 3.46Å; A124-L139 HydrophobicContact CB-CB 3.6Å; A127-L139 HydrophobicContact CB-CD1 4.29Å; K135-L139 HydrophobicContact CG-CD1 3.9Å; K135-L139 HydrophobicContact CG-CG 4.49Å; K135-L139 WeakPolarHBondContact O-CB 3.48Å; K135-L139 WeakPolarHBondContact O-CD1 3.48Å; K135-L139 VanDerWaalsContact O-CG 3.25Å; K135-L139 WeakPolarHBondContact O-CG 3.44Å; K135-L139 PolarHBondContact O-N 2.98Å; L139-T141 VanDerWaalsContact C-N 3.28Å; L139-T141 PolarHBondContact O-N 3.29Å; L139-E142 PolarHBondContact O-N 3.23Å; L139-A143 WeakPolarHBondContact O-CB 3.46Å; L139-A143 PolarHBondContact O-N 3.01Å
140F98.6Very high97.2Very high0 Ų048.4 Ų48.40%024%0.243CC..Hα-helixtrans-64.8-35.1172.2-78.9-52.5000112K121 A124 I125 A136 L137 D138 A143 I144 K156 R157 V160K121-F140 HydrophobicContact CG-CE1 4.27Å; A124-F140 HydrophobicContact CB-CD1 3.63Å; A124-F140 HydrophobicContact CB-CD2 3.81Å; A124-F140 HydrophobicContact CB-CE1 3.53Å; A124-F140 HydrophobicContact CB-CE2 3.71Å; A124-F140 HydrophobicContact CB-CG 3.74Å; A124-F140 HydrophobicContact CB-CZ 3.55Å; I125-F140 HydrophobicContact CG1-CE1 4.4Å; I125-F140 HydrophobicContact CG1-CZ 4.01Å; A136-F140 HydrophobicContact CB-CE2 4.46Å; A136-F140 WeakPolarHBondContact O-CB 3.25Å; A136-F140 WeakPolarHBondContact O-CD2 3.5Å; A136-F140 WeakPolarHBondContact O-CG 3.28Å; A136-F140 PolarHBondContact O-N 3.03Å; L137-F140 PolarHBondContact O-N 2.97Å; D138-F140 PolarHBondContact O-N 2.75Å; F140-A143 PolarHBondContact O-N 3.24Å; F140-I144 WeakPolarHBondContact O-CB 3.25Å; F140-I144 WeakPolarHBondContact O-CD1 3.37Å; F140-I144 VanDerWaalsContact O-CG1 3.24Å; F140-I144 WeakPolarHBondContact O-CG1 3.41Å; F140-I144 PolarHBondContact O-N 2.62Å; F140-K156 HydrophobicContact CD1-CB 4.3Å; F140-K156 HydrophobicContact CE1-CB 3.61Å; F140-K156 HydrophobicContact CE1-CG 4.37Å; F140-K156 HydrophobicContact CE2-CB 4.04Å; F140-K156 HydrophobicContact CZ-CB 3.47Å; F140-K156 VanDerWaalsContact CZ-CB 3.47Å; F140-K156 HydrophobicContact CZ-CG 4.31Å; F140-R157 HydrophobicContact CB-CB 3.85Å; F140-R157 HydrophobicContact CB-CG 3.91Å; F140-R157 HydrophobicContact CD2-CB 4.27Å; F140-R157 HydrophobicContact CG-CB 4.15Å; F140-V160 HydrophobicContact CD2-CG2 4Å; F140-V160 HydrophobicContact CE2-CG2 3.83Å
141T98.3Very high97.3Very high19 Ų1942 Ų4212%0.11722%0.215CC..Hα-helixtrans-67.4-44.4176.9-59.90000110.8E100 L137 D138 L139 A143 I144 K145 R157E100-T141 HydrophobicContact CB-CG2 4.09Å; L137-T141 WeakPolarHBondContact O-CB 3.34Å; L137-T141 PolarHBondContact O-N 3.39Å; L137-T141 PolarHBondContact O-OG1 3.35Å; D138-T141 WeakPolarHBondContact O-CA 3.36Å; D138-T141 WeakPolarHBondContact O-CB 3.5Å; D138-T141 PolarHBondContact O-N 2.85Å; L139-T141 VanDerWaalsContact C-N 3.28Å; L139-T141 PolarHBondContact O-N 3.29Å; T141-A143 PolarHBondContact O-N 3.12Å; T141-I144 PolarHBondContact O-N 3.47Å; T141-K145 WeakPolarHBondContact O-CG 3.46Å; T141-K145 PolarHBondContact O-N 3.34Å; T141-R157 PolarHBondContact OG1-NH1 2.88Å
142E98Very high97.4Very high81 Ų8142.7 Ų42.738%0.37921%0.207SC..Hα-helixtrans-57-46.6171.5-70.4177.7-16700111.8K120 D138 L139 I144 K145 L146K120-E142 HydrophobicContact CD-CB 4.41Å; K120-E142 WeakPolarHBondContact CD-OE2 3.49Å; K120-E142 WeakPolarHBondContact CE-OE2 3.39Å; K120-E142 IonicContact NZ-OE2 3.75Å; K120-E142 PolarHBondContact NZ-OE2 3.47Å; D138-E142 PolarHBondContact O-N 3.3Å; L139-E142 PolarHBondContact O-N 3.23Å; E142-I144 VanDerWaalsContact C-N 3.29Å; E142-I144 PolarHBondContact O-N 3.09Å; E142-K145 PolarHBondContact O-N 3.07Å; E142-L146 WeakPolarHBondContact O-CG 3.42Å; E142-L146 PolarHBondContact O-N 3.39Å; E142-L146 VanDerWaalsContact O-N 3.1Å
143A98.1Very high97.4Very high0 Ų039.4 Ų39.40%019%0.189CC..Hα-helixtrans-59.8-38.7176.700000112.4K120 L139 F140 T141 L146 N147 L153K120-A143 HydrophobicContact CB-CB 3.84Å; L139-A143 WeakPolarHBondContact O-CB 3.46Å; L139-A143 PolarHBondContact O-N 3.01Å; F140-A143 PolarHBondContact O-N 3.24Å; T141-A143 PolarHBondContact O-N 3.12Å; A143-L146 PolarHBondContact O-N 2.97Å; A143-N147 PolarHBondContact O-N 2.97Å; A143-L153 HydrophobicContact CB-CD1 3.96Å; A143-L153 HydrophobicContact CB-CD2 4Å
144I97.8Very high97.4Very high0 Ų037.4 Ų37.40%018%0.179CC..Hα-helixtrans-69-38.2177.7-74.6163.9000111.5M101 F140 T141 E142 L146 N147 P148 L153 Y154 R157M101-I144 WeakPolarHBondContact O-CG2 3.4Å; F140-I144 WeakPolarHBondContact O-CB 3.25Å; F140-I144 WeakPolarHBondContact O-CD1 3.37Å; F140-I144 VanDerWaalsContact O-CG1 3.24Å; F140-I144 WeakPolarHBondContact O-CG1 3.41Å; F140-I144 PolarHBondContact O-N 2.62Å; T141-I144 PolarHBondContact O-N 3.47Å; E142-I144 VanDerWaalsContact C-N 3.29Å; E142-I144 PolarHBondContact O-N 3.09Å; I144-L146 VanDerWaalsContact C-N 3.29Å; I144-L146 PolarHBondContact O-N 3.37Å; I144-N147 CarbonylContact O-C 3.59Å; I144-N147 VanDerWaalsContact O-C 3.27Å; I144-N147 PolarHBondContact O-N 3.23Å; I144-P148 VanDerWaalsContact O-CA 3.29Å; I144-P148 WeakPolarHBondContact O-CA 3.33Å; I144-P148 WeakPolarHBondContact O-CB 3.32Å; I144-P148 WeakPolarHBondContact O-CD 3.47Å; I144-L153 HydrophobicContact CD1-CB 4.27Å; I144-L153 HydrophobicContact CG1-CB 3.68Å; I144-L153 HydrophobicContact CG1-CD1 4.19Å; I144-Y154 HydrophobicContact CD1-CD1 3.7Å; I144-Y154 HydrophobicContact CD1-CE1 3.86Å; I144-Y154 HydrophobicContact CD1-CG 4.22Å; I144-Y154 HydrophobicContact CG1-CD1 4.3Å; I144-Y154 HydrophobicContact CG1-CE1 4.12Å; I144-Y154 HydrophobicContact CG2-CE1 3.6Å; I144-R157 HydrophobicContact CD1-CB 4.49Å
145K96.7Very high97.5Very high87 Ų8733 Ų3338%0.37816%0.158SC..Hα-helixtrans-61.9-40.3174.5-66.6-177.9-159-139.30111.5E100 I107 T141 E142E100-K145 WeakPolarHBondContact OE1-CD 3.37Å; E100-K145 WeakPolarHBondContact OE1-CE 3.41Å; E100-K145 IonicContact OE1-NZ 2.73Å; E100-K145 PolarHBondContact OE1-NZ 3.25Å; E100-K145 WeakPolarHBondContact OE2-CE 3.46Å; E100-K145 IonicContact OE2-NZ 2.61Å; E100-K145 PolarHBondContact OE2-NZ 3.44Å; I107-K145 VanDerWaalsContact CD1-O 3.31Å; I107-K145 WeakPolarHBondContact CD1-O 3.48Å; T141-K145 WeakPolarHBondContact O-CG 3.46Å; T141-K145 PolarHBondContact O-N 3.34Å; E142-K145 PolarHBondContact O-N 3.07Å
146L96.6Very high97.5Very high36 Ų3631.6 Ų31.619%0.18815%0.152CC..Hα-helixtrans-71.2-40.7178.3-70.3166.1000112M113 Q116 A117 K120 E142 A143 I144M113-L146 VanDerWaalsContact CE-O 3.28Å; M113-L146 WeakPolarHBondContact CE-O 3.45Å; M113-L146 HydrophobicContact CG-CD2 4.41Å; Q116-L146 HydrophobicContact CB-CD1 3.79Å; A117-L146 HydrophobicContact CB-CB 3.81Å; K120-L146 HydrophobicContact CG-CD1 4.27Å; E142-L146 WeakPolarHBondContact O-CG 3.42Å; E142-L146 PolarHBondContact O-N 3.39Å; E142-L146 VanDerWaalsContact O-N 3.1Å; A143-L146 PolarHBondContact O-N 2.97Å; I144-L146 VanDerWaalsContact C-N 3.29Å; I144-L146 PolarHBondContact O-N 3.37Å
147N95.9Very high97.5Very high15 Ų1531.6 Ų31.68%0.0815%0.152CC..  trans-142.587.4178.6-167.6-14.2000112.9V109 A117 A143 I144 R149 V150V109-N147 HydrophobicContact CG1-CB 4.09Å; A117-N147 HydrophobicContact CB-CB 3.73Å; A143-N147 PolarHBondContact O-N 2.97Å; I144-N147 CarbonylContact O-C 3.59Å; I144-N147 VanDerWaalsContact O-C 3.27Å; I144-N147 PolarHBondContact O-N 3.23Å; N147-R149 PolarHBondContact O-N 3.01Å; N147-R149 VanDerWaalsContact O-N 3.13Å; N147-R149 PolarHBondContact OD1-N 3.14Å; N147-V150 HydrophobicContact CB-CG2 4.31Å; N147-V150 VanDerWaalsContact CG-CG2 3.47Å; N147-V150 VanDerWaalsContact ND2-CG2 3.31Å; N147-V150 WeakPolarHBondContact ND2-CG2 3.42Å
148P96.1Very high97.5Very high0 Ų030.7 Ų30.70%015%0.147CC..THydrogen-bonded Turntrans-78.76.9-177.431.5-35.7000113.6I107 I144 Y154 R176I107-P148 HydrophobicContact CG2-CG 3.59Å; I144-P148 VanDerWaalsContact O-CA 3.29Å; I144-P148 WeakPolarHBondContact O-CA 3.33Å; I144-P148 WeakPolarHBondContact O-CB 3.32Å; I144-P148 WeakPolarHBondContact O-CD 3.47Å; P148-Y154 WeakPolarHBondContact CA-OH 3.34Å; P148-Y154 WeakPolarHBondContact CB-OH 3.25Å; P148-Y154 WeakPolarHBondContact O-CE2 3.39Å; P148-Y154 PolarHBondContact O-OH 2.98Å; P148-Y154 VanDerWaalsContact O-OH 3.1Å; P148-R176 PolarHBondContact O-NH2 3.21Å; P148-R176 VanDerWaalsContact O-NH2 3.07Å
149R94.7Very high97.6Very high125 Ų12527.5 Ų27.547%0.47213%0.131SC..THydrogen-bonded Turntrans-1025.2-178-50-159.4169158.31.6113.1F104 N147 I180F104-R149 HydrophobicContact CD2-CG 3.83Å; F104-R149 HydrophobicContact CE2-CB 4.21Å; F104-R149 HydrophobicContact CE2-CG 3.66Å; F104-R149 PolarHBondContact O-NH2 2.94Å; N147-R149 PolarHBondContact O-N 3.01Å; N147-R149 VanDerWaalsContact O-N 3.13Å; N147-R149 PolarHBondContact OD1-N 3.14Å; R149-I180 VanDerWaalsContact O-CG2 3.22Å; R149-I180 WeakPolarHBondContact O-CG2 3.49Å
150V96.1Very high97.5Very high44 Ų4426.9 Ų26.927%0.26713%0.128SC..  trans-103.8104.8-176.4178.30000110.4N147 I152 L153N147-V150 HydrophobicContact CB-CG2 4.31Å; N147-V150 VanDerWaalsContact CG-CG2 3.47Å; N147-V150 VanDerWaalsContact ND2-CG2 3.31Å; N147-V150 WeakPolarHBondContact ND2-CG2 3.42Å; V150-I152 VanDerWaalsContact C-N 3.25Å; V150-I152 HydrophobicContact CG1-CG2 3.41Å; V150-I152 VanDerWaalsContact CG1-CG2 3.41Å; V150-I152 PolarHBondContact O-N 3.1Å; V150-L153 HydrophobicContact CB-CD1 3.92Å; V150-L153 HydrophobicContact CB-CG 3.95Å; V150-L153 HydrophobicContact CG1-CD1 4.28Å; V150-L153 HydrophobicContact CG1-CG 3.81Å; V150-L153 PolarHBondContact O-N 3.22Å; V150-L153 VanDerWaalsContact O-N 3.16Å
151A97.3Very high97.5Very high11 Ų1127.3 Ų27.39%0.09113%0.13CC..Hα-helixtrans-55.3-37.2-17700000113.7L153 Y154 A155 A177 I180 N181A151-L153 VanDerWaalsContact C-N 3.27Å; A151-L153 PolarHBondContact O-N 3.02Å; A151-Y154 PolarHBondContact O-N 3.23Å; A151-A155 PolarHBondContact O-N 3.1Å; A151-A155 VanDerWaalsContact O-N 3.07Å; A151-A177 HydrophobicContact CB-CB 4.46Å; A151-A177 WeakPolarHBondContact O-CB 3.41Å; A151-I180 HydrophobicContact CB-CB 3.96Å; A151-I180 HydrophobicContact CB-CG2 3.82Å; A151-N181 HydrophobicContact CB-CB 3.71Å
152I97.4Very high97.5Very high64 Ų6427.4 Ų27.433%0.32813%0.129SC..Hα-helixtrans-66.2-27.7-176.4-171.961.7000112.7V150 A155 K156V150-I152 VanDerWaalsContact C-N 3.25Å; V150-I152 HydrophobicContact CG1-CG2 3.41Å; V150-I152 VanDerWaalsContact CG1-CG2 3.41Å; V150-I152 PolarHBondContact O-N 3.1Å; I152-A155 HydrophobicContact CD1-CB 4.45Å; I152-A155 PolarHBondContact O-N 3.28Å; I152-K156 HydrophobicContact CD1-CG 4.05Å; I152-K156 HydrophobicContact CG1-CG 4.12Å; I152-K156 WeakPolarHBondContact O-CB 3.32Å; I152-K156 VanDerWaalsContact O-CG 3.25Å; I152-K156 WeakPolarHBondContact O-CG 3.35Å; I152-K156 PolarHBondContact O-N 3.28Å
153L98.1Very high97.5Very high4 Ų429.1 Ų29.12%0.02114%0.136CC..Hα-helixtrans-64.2-49.9177.1-61.6-179.8000110.7K121 A143 I144 V150 A151 A155 K156 R157K121-L153 HydrophobicContact CB-CD2 3.69Å; K121-L153 HydrophobicContact CD-CD2 3.74Å; K121-L153 HydrophobicContact CG-CD2 3.57Å; A143-L153 HydrophobicContact CB-CD1 3.96Å; A143-L153 HydrophobicContact CB-CD2 4Å; I144-L153 HydrophobicContact CD1-CB 4.27Å; I144-L153 HydrophobicContact CG1-CB 3.68Å; I144-L153 HydrophobicContact CG1-CD1 4.19Å; V150-L153 HydrophobicContact CB-CD1 3.92Å; V150-L153 HydrophobicContact CB-CG 3.95Å; V150-L153 HydrophobicContact CG1-CD1 4.28Å; V150-L153 HydrophobicContact CG1-CG 3.81Å; V150-L153 PolarHBondContact O-N 3.22Å; V150-L153 VanDerWaalsContact O-N 3.16Å; A151-L153 VanDerWaalsContact C-N 3.27Å; A151-L153 PolarHBondContact O-N 3.02Å; L153-A155 PolarHBondContact O-N 2.87Å; L153-K156 PolarHBondContact O-N 3.11Å; L153-R157 WeakPolarHBondContact O-CB 3.49Å; L153-R157 PolarHBondContact O-N 3Å
154Y98.6Very high97.5Very high0 Ų031.6 Ų31.60%015%0.148CC..Hα-helixtrans-62.7-43.1175.9-62.1-79.2000111.9M101 I144 P148 A151 K156 R157 A158 D173 R176 I180M101-Y154 HydrophobicContact CE-CD1 3.84Å; M101-Y154 HydrophobicContact CE-CE1 3.72Å; M101-Y154 PolarHBondContact O-OH 3.5Å; I144-Y154 HydrophobicContact CD1-CD1 3.7Å; I144-Y154 HydrophobicContact CD1-CE1 3.86Å; I144-Y154 HydrophobicContact CD1-CG 4.22Å; I144-Y154 HydrophobicContact CG1-CD1 4.3Å; I144-Y154 HydrophobicContact CG1-CE1 4.12Å; I144-Y154 HydrophobicContact CG2-CE1 3.6Å; P148-Y154 WeakPolarHBondContact CA-OH 3.34Å; P148-Y154 WeakPolarHBondContact CB-OH 3.25Å; P148-Y154 WeakPolarHBondContact O-CE2 3.39Å; P148-Y154 PolarHBondContact O-OH 2.98Å; P148-Y154 VanDerWaalsContact O-OH 3.1Å; A151-Y154 PolarHBondContact O-N 3.23Å; Y154-K156 VanDerWaalsContact C-N 3.32Å; Y154-K156 PolarHBondContact O-N 2.88Å; Y154-R157 PolarHBondContact O-N 3.03Å; Y154-A158 WeakPolarHBondContact O-CB 3.23Å; Y154-A158 PolarHBondContact O-N 3.32Å; Y154-D173 WeakPolarHBondContact CB-O 3.37Å; Y154-R176 HydrophobicContact CD1-CB 4.11Å; Y154-R176 HydrophobicContact CD1-CG 3.79Å; Y154-R176 HydrophobicContact CD2-CG 3.97Å; Y154-R176 HydrophobicContact CE1-CB 4.36Å; Y154-R176 HydrophobicContact CE1-CG 3.61Å; Y154-R176 HydrophobicContact CE2-CG 3.79Å; Y154-R176 HydrophobicContact CG-CB 4.26Å; Y154-R176 HydrophobicContact CG-CG 3.95Å; Y154-I180 HydrophobicContact CD2-CD1 3.8Å; Y154-I180 HydrophobicContact CE2-CD1 3.54Å
155A98.3Very high97.4Very high1 Ų137.6 Ų37.61%0.00818%0.176CC..Hα-helixtrans-61.9-39.3178.200000112.6A151 I152 L153 S159 A177 Q186 P187A151-A155 PolarHBondContact O-N 3.1Å; A151-A155 VanDerWaalsContact O-N 3.07Å; I152-A155 HydrophobicContact CD1-CB 4.45Å; I152-A155 PolarHBondContact O-N 3.28Å; L153-A155 PolarHBondContact O-N 2.87Å; A155-S159 PolarHBondContact O-N 2.95Å; A155-A177 HydrophobicContact CB-CB 4.36Å; A155-Q186 HydrophobicContact CB-CB 4.42Å; A155-P187 HydrophobicContact CB-CG 3.98Å
156K98.3Very high97.5Very high70 Ų7036.1 Ų36.130%0.30417%0.169SC..Hα-helixtrans-71.8-42.1177.2-70.2-68.2-176.3-177.40111.6F140 I152 L153 Y154 A158 S159 V160F140-K156 HydrophobicContact CD1-CB 4.3Å; F140-K156 HydrophobicContact CE1-CB 3.61Å; F140-K156 HydrophobicContact CE1-CG 4.37Å; F140-K156 HydrophobicContact CE2-CB 4.04Å; F140-K156 HydrophobicContact CZ-CB 3.47Å; F140-K156 VanDerWaalsContact CZ-CB 3.47Å; F140-K156 HydrophobicContact CZ-CG 4.31Å; I152-K156 HydrophobicContact CD1-CG 4.05Å; I152-K156 HydrophobicContact CG1-CG 4.12Å; I152-K156 WeakPolarHBondContact O-CB 3.32Å; I152-K156 VanDerWaalsContact O-CG 3.25Å; I152-K156 WeakPolarHBondContact O-CG 3.35Å; I152-K156 PolarHBondContact O-N 3.28Å; L153-K156 PolarHBondContact O-N 3.11Å; Y154-K156 VanDerWaalsContact C-N 3.32Å; Y154-K156 PolarHBondContact O-N 2.88Å; K156-A158 VanDerWaalsContact C-N 3.34Å; K156-A158 PolarHBondContact O-N 3.35Å; K156-S159 WeakPolarHBondContact O-CB 3.48Å; K156-S159 PolarHBondContact O-N 3.3Å; K156-S159 VanDerWaalsContact O-N 3.09Å; K156-S159 PolarHBondContact O-OG 3.06Å; K156-V160 PolarHBondContact O-N 3.42Å
157R98.6Very high97.6Very high0 Ų034.4 Ų34.40%016%0.16CC..Hα-helixtrans-62.4-39.9174.4-164.9173.967.6173.50.4112.1E100 M101 F140 T141 I144 L153 Y154 S159 V160 F161 D173E100-R157 PolarHBondContact O-NH1 3.35Å; E100-R157 PolarHBondContact O-NH2 3.34Å; M101-R157 PolarHBondContact SD-NH2 2.93Å; F140-R157 HydrophobicContact CB-CB 3.85Å; F140-R157 HydrophobicContact CB-CG 3.91Å; F140-R157 HydrophobicContact CD2-CB 4.27Å; F140-R157 HydrophobicContact CG-CB 4.15Å; T141-R157 PolarHBondContact OG1-NH1 2.88Å; I144-R157 HydrophobicContact CD1-CB 4.49Å; L153-R157 WeakPolarHBondContact O-CB 3.49Å; L153-R157 PolarHBondContact O-N 3Å; Y154-R157 PolarHBondContact O-N 3.03Å; R157-S159 VanDerWaalsContact C-N 3.27Å; R157-S159 PolarHBondContact O-N 3.2Å; R157-V160 WeakPolarHBondContact O-CA 3.44Å; R157-V160 WeakPolarHBondContact O-CB 3.37Å; R157-V160 PolarHBondContact O-N 3.05Å; R157-F161 HydrophobicContact CG-CD2 4.18Å; R157-F161 HydrophobicContact CG-CE2 3.79Å; R157-F161 WeakPolarHBondContact O-CD2 3.24Å; R157-F161 PolarHBondContact O-N 3.26Å; R157-D173 WeakPolarHBondContact CB-OD2 3.3Å; R157-D173 WeakPolarHBondContact CG-OD2 3.49Å; R157-D173 IonicContact CZ-OD1 3.29Å; R157-D173 IonicContact CZ-OD2 2.89Å; R157-D173 IonicContact NE-OD1 2.7Å; R157-D173 IonicContact NE-OD2 3.12Å; R157-D173 PolarHBondContact NE-OD2 2.72Å; R157-D173 IonicContact NH2-OD1 3.87Å; R157-D173 PolarHBondContact NH2-OD1 3.22Å; R157-D173 IonicContact NH2-OD2 3.19Å; R157-D173 PolarHBondContact NH2-OD2 2.87Å
158A98.6Very high97.7Very high0 Ų035.7 Ų35.70%017%0.167CC..Hα-helixtrans-56.6-39.8171.100000112.5Y154 K156 V160 F161 I162 A170 D173 C174 W190Y154-A158 WeakPolarHBondContact O-CB 3.23Å; Y154-A158 PolarHBondContact O-N 3.32Å; K156-A158 VanDerWaalsContact C-N 3.34Å; K156-A158 PolarHBondContact O-N 3.35Å; A158-V160 VanDerWaalsContact C-N 3.28Å; A158-V160 PolarHBondContact O-N 3.1Å; A158-F161 PolarHBondContact O-N 3.06Å; A158-I162 WeakPolarHBondContact O-CG1 3.37Å; A158-I162 PolarHBondContact O-N 3.46Å; A158-A170 HydrophobicContact CB-CB 4.25Å; A158-D173 HydrophobicContact CB-CB 3.85Å; A158-C174 WeakPolarHBondContact CB-SG 3.19Å; A158-W190 HydrophobicContact CB-CB 4.3Å
159S98.3Very high97.8Very high7 Ų735.9 Ų35.95%0.04917%0.169CC..Hα-helixtrans-64-32.8176.182.70000112.9A155 K156 R157 K163 W190A155-S159 PolarHBondContact O-N 2.95Å; K156-S159 WeakPolarHBondContact O-CB 3.48Å; K156-S159 PolarHBondContact O-N 3.3Å; K156-S159 VanDerWaalsContact O-N 3.09Å; K156-S159 PolarHBondContact O-OG 3.06Å; R157-S159 VanDerWaalsContact C-N 3.27Å; R157-S159 PolarHBondContact O-N 3.2Å; S159-K163 WeakPolarHBondContact O-CG 3.41Å; S159-K163 PolarHBondContact O-N 2.95Å; S159-W190 VanDerWaalsContact CB-CE2 3.42Å
160V98.4Very high98Very high0 Ų029.9 Ų29.90%015%0.146CC..Hα-helixtrans-68.6-47.2172.9-175.20000110.1L128 L133 A136 L137 F140 K156 R157 A158 I162 K163 M164L128-V160 HydrophobicContact CD1-CG2 4Å; L128-V160 HydrophobicContact CD2-CG2 4.14Å; L133-V160 HydrophobicContact CB-CG1 4.07Å; L133-V160 HydrophobicContact CD2-CG1 4.42Å; L133-V160 VanDerWaalsContact O-CG1 3.32Å; L133-V160 WeakPolarHBondContact O-CG1 3.48Å; A136-V160 HydrophobicContact CB-CG2 4.3Å; L137-V160 HydrophobicContact CB-CG1 4.22Å; F140-V160 HydrophobicContact CD2-CG2 4Å; F140-V160 HydrophobicContact CE2-CG2 3.83Å; K156-V160 PolarHBondContact O-N 3.42Å; R157-V160 WeakPolarHBondContact O-CA 3.44Å; R157-V160 WeakPolarHBondContact O-CB 3.37Å; R157-V160 PolarHBondContact O-N 3.05Å; A158-V160 VanDerWaalsContact C-N 3.28Å; A158-V160 PolarHBondContact O-N 3.1Å; V160-I162 VanDerWaalsContact C-N 3.28Å; V160-I162 PolarHBondContact O-N 2.96Å; V160-K163 WeakPolarHBondContact O-CB 3.46Å; V160-K163 PolarHBondContact O-N 2.88Å; V160-M164 HydrophobicContact CG1-CG 4.47Å; V160-M164 HydrophobicContact CG1-SD 4.03Å; V160-M164 WeakPolarHBondContact O-CG 3.41Å; V160-M164 PolarHBondContact O-N 2.97Å
161F98.4Very high98.1Very high9 Ų928.8 Ų28.84%0.03914%0.139CC..Hα-helixtrans-57.2-39.1175.7-77.1-56.8000112.9Q99 L137 R157 A158 M164 Q165 K166 A169 A170 D173Q99-F161 HydrophobicContact CB-CZ 4.11Å; Q99-F161 HydrophobicContact CG-CE2 4.18Å; Q99-F161 HydrophobicContact CG-CZ 4.04Å; L137-F161 HydrophobicContact CD1-CD1 3.89Å; L137-F161 HydrophobicContact CD1-CE1 3.37Å; L137-F161 HydrophobicContact CD1-CZ 3.8Å; L137-F161 HydrophobicContact CG-CE1 4.29Å; L137-F161 HydrophobicContact CG-CZ 4.23Å; R157-F161 HydrophobicContact CG-CD2 4.18Å; R157-F161 HydrophobicContact CG-CE2 3.79Å; R157-F161 WeakPolarHBondContact O-CD2 3.24Å; R157-F161 PolarHBondContact O-N 3.26Å; A158-F161 PolarHBondContact O-N 3.06Å; F161-M164 CarbonylContact O-C 3.57Å; F161-M164 PolarHBondContact O-N 3.5Å; F161-Q165 PolarHBondContact O-N 3.01Å; F161-Q165 VanDerWaalsContact O-N 3.12Å; F161-K166 HydrophobicContact CB-CB 4.32Å; F161-K166 HydrophobicContact CD1-CB 3.96Å; F161-K166 HydrophobicContact CD1-CD 4.16Å; F161-K166 HydrophobicContact CE1-CD 4.45Å; F161-K166 PolarHBondContact O-N 3.5Å; F161-A169 HydrophobicContact CB-CB 4.43Å; F161-A169 HydrophobicContact CD1-CB 3.63Å; F161-A169 HydrophobicContact CD2-CB 4Å; F161-A169 HydrophobicContact CE1-CB 3.71Å; F161-A169 HydrophobicContact CE2-CB 4.09Å; F161-A169 HydrophobicContact CG-CB 3.79Å; F161-A169 HydrophobicContact CZ-CB 3.96Å; F161-A170 HydrophobicContact CB-CB 3.82Å; F161-D173 WeakPolarHBondContact CE2-OD2 3.2Å
162I98.2Very high98.1Very high22 Ų2232 Ų3211%0.11315%0.148CC..Hα-helixtrans-60.9-45.4173.2-68.9-63.1000111.7A158 V160 M164 Q165 A170 W190 K193 A194 L197A158-I162 WeakPolarHBondContact O-CG1 3.37Å; A158-I162 PolarHBondContact O-N 3.46Å; V160-I162 VanDerWaalsContact C-N 3.28Å; V160-I162 PolarHBondContact O-N 2.96Å; I162-M164 PolarHBondContact O-N 3.13Å; I162-Q165 PolarHBondContact O-N 3.3Å; I162-A170 HydrophobicContact CD1-CB 3.81Å; I162-A170 HydrophobicContact CG1-CB 3.94Å; I162-W190 HydrophobicContact CB-CE3 4.4Å; I162-W190 HydrophobicContact CG1-CE3 4.19Å; I162-W190 HydrophobicContact CG2-CE3 4.42Å; I162-W190 HydrophobicContact CG2-CZ3 4.45Å; I162-K193 HydrophobicContact CD1-CB 4.24Å; I162-K193 HydrophobicContact CG2-CB 4.49Å; I162-A194 HydrophobicContact CD1-CB 3.71Å; I162-L197 HydrophobicContact CD1-CD1 4.16Å
163K97.1Very high98.2Very high117 Ų11729 Ų2951%0.50913%0.133SC..Hα-helixtrans-63.1-29.8176.4-70.5-177.8179.8-172.60112.5L128 L133 S159 V160 Q165L128-K163 HydrophobicContact CD1-CD 3.97Å; L133-K163 HydrophobicContact CD1-CB 3.88Å; L133-K163 HydrophobicContact CD2-CB 4.22Å; L133-K163 HydrophobicContact CD2-CD 3.82Å; S159-K163 WeakPolarHBondContact O-CG 3.41Å; S159-K163 PolarHBondContact O-N 2.95Å; V160-K163 WeakPolarHBondContact O-CB 3.46Å; V160-K163 PolarHBondContact O-N 2.88Å; K163-Q165 VanDerWaalsContact C-N 3.29Å
164M97.3Very high98.2Very high51 Ų5128.8 Ų28.825%0.25113%0.132SC..THydrogen-bonded Turntrans-85.54.5175.4-62.7178.578.300113.7L133 L137 V160 F161 I162 K166L133-M164 HydrophobicContact CB-CG 3.98Å; L133-M164 HydrophobicContact CB-SD 4.15Å; L133-M164 HydrophobicContact CD1-CG 3.79Å; L137-M164 HydrophobicContact CD1-CE 4.46Å; L137-M164 HydrophobicContact CD1-SD 3.75Å; V160-M164 HydrophobicContact CG1-CG 4.47Å; V160-M164 HydrophobicContact CG1-SD 4.03Å; V160-M164 WeakPolarHBondContact O-CG 3.41Å; V160-M164 PolarHBondContact O-N 2.97Å; F161-M164 CarbonylContact O-C 3.57Å; F161-M164 PolarHBondContact O-N 3.5Å; I162-M164 PolarHBondContact O-N 3.13Å; M164-K166 VanDerWaalsContact C-N 3.31Å; M164-K166 HydrophobicContact CB-CG 4.3Å; M164-K166 PolarHBondContact O-N 3.18Å
165Q97.1Very high98.2Very high126 Ų12632.2 Ų32.259%0.58915%0.15SC*.THydrogen-bonded Turntrans57.838.1-176.6-61.3-175.7-27.800113.8I91 F161 I162 K163 P167I91-Q165 HydrophobicContact CD1-CB 3.79Å; I91-Q165 HydrophobicContact CD1-CG 4.42Å; F161-Q165 PolarHBondContact O-N 3.01Å; F161-Q165 VanDerWaalsContact O-N 3.12Å; I162-Q165 PolarHBondContact O-N 3.3Å; K163-Q165 VanDerWaalsContact C-N 3.29Å; Q165-P167 WeakPolarHBondContact O-CD 3.17Å
166K98.1Very high98.2Very high57 Ų5734.1 Ų34.125%0.24816%0.157CC..  trans-111.872.5175.4-60.3-166.9179.3-163.10111.9D94 D96 F161 M164 A169 A170D94-K166 HydrophobicContact CB-CB 4.22Å; D94-K166 HydrophobicContact CB-CG 4.35Å; D96-K166 VanDerWaalsContact OD2-CE 3.25Å; D96-K166 WeakPolarHBondContact OD2-CE 3.49Å; D96-K166 IonicContact OD2-NZ 2.76Å; D96-K166 PolarHBondContact OD2-NZ 3.44Å; F161-K166 HydrophobicContact CB-CB 4.32Å; F161-K166 HydrophobicContact CD1-CB 3.96Å; F161-K166 HydrophobicContact CD1-CD 4.16Å; F161-K166 HydrophobicContact CE1-CD 4.45Å; F161-K166 PolarHBondContact O-N 3.5Å; M164-K166 VanDerWaalsContact C-N 3.31Å; M164-K166 HydrophobicContact CB-CG 4.3Å; M164-K166 PolarHBondContact O-N 3.18Å; K166-A169 HydrophobicContact CB-CB 4.19Å; K166-A170 PolarHBondContact O-N 3.42Å; K166-A170 VanDerWaalsContact O-N 3.13Å
167P98.3Very high98.2Very high0 Ų030.8 Ų30.80%014%0.143CC..Hα-helixtrans-67-36.3-170.826.7-36.4000114.8I91 D94 Q165 A170 I171 A194 L197 L198I91-P167 HydrophobicContact CD1-CG 4.08Å; I91-P167 HydrophobicContact CG1-CG 4.46Å; D94-P167 WeakPolarHBondContact OD1-CD 3.37Å; D94-P167 VanDerWaalsContact OD1-N 3.12Å; Q165-P167 WeakPolarHBondContact O-CD 3.17Å; P167-A170 WeakPolarHBondContact O-CB 3.24Å; P167-A170 PolarHBondContact O-N 3.01Å; P167-I171 VanDerWaalsContact O-CG1 3.28Å; P167-I171 WeakPolarHBondContact O-CG1 3.45Å; P167-I171 PolarHBondContact O-N 2.86Å; P167-A194 HydrophobicContact CB-CB 3.88Å; P167-A194 WeakPolarHBondContact O-CB 3.37Å; P167-L197 HydrophobicContact CB-CB 4.21Å; P167-L197 HydrophobicContact CG-CB 4.45Å; P167-L198 HydrophobicContact CB-CD1 4.02Å; P167-L198 HydrophobicContact CB-CD2 4.22Å; P167-L198 HydrophobicContact CB-CG 3.8Å; P167-L198 HydrophobicContact CG-CD1 4.23Å; P167-L198 HydrophobicContact CG-CD2 3.55Å; P167-L198 HydrophobicContact CG-CG 3.7Å
168N98.3Very high98.2Very high41 Ų4131.9 Ų31.922%0.21915%0.148CC..Hα-helixtrans-65.8-44.4177.7-65.3-42.8000111.2P93 D94 A170 I171 R172 L198P93-N168 VanDerWaalsContact CB-ND2 3.3Å; P93-N168 WeakPolarHBondContact CB-ND2 3.43Å; D94-N168 PolarHBondContact O-ND2 3.04Å; D94-N168 WeakPolarHBondContact OD1-CA 3.21Å; D94-N168 WeakPolarHBondContact OD1-CB 3.37Å; D94-N168 PolarHBondContact OD1-N 2.95Å; D94-N168 PolarHBondContact OD1-ND2 3.17Å; D94-N168 WeakPolarHBondContact OD2-CB 3.37Å; N168-A170 VanDerWaalsContact C-N 3.32Å; N168-A170 PolarHBondContact O-N 2.69Å; N168-I171 PolarHBondContact O-N 3.39Å; N168-R172 WeakPolarHBondContact O-CG 3.5Å; N168-R172 PolarHBondContact O-N 2.94Å; N168-R172 VanDerWaalsContact O-N 3.09Å; N168-L198 WeakPolarHBondContact OD1-CD1 3.49Å
169A98.1Very high98.1Very high4 Ų435.5 Ų35.53%0.03317%0.174CC..Hα-helixtrans-56.7-46.3171.600000111.5D94 Q99 F161 K166 I171 R172 D173D94-A169 PolarHBondContact OD2-N 3.46Å; Q99-A169 PolarHBondContact NE2-O 3.35Å; F161-A169 HydrophobicContact CB-CB 4.43Å; F161-A169 HydrophobicContact CD1-CB 3.63Å; F161-A169 HydrophobicContact CD2-CB 4Å; F161-A169 HydrophobicContact CE1-CB 3.71Å; F161-A169 HydrophobicContact CE2-CB 4.09Å; F161-A169 HydrophobicContact CG-CB 3.79Å; F161-A169 HydrophobicContact CZ-CB 3.96Å; K166-A169 HydrophobicContact CB-CB 4.19Å; A169-I171 VanDerWaalsContact C-N 3.35Å; A169-I171 PolarHBondContact O-N 2.93Å; A169-R172 PolarHBondContact O-N 3.3Å; A169-D173 PolarHBondContact O-N 3.19Å
170A98.6Very high98.1Very high0 Ų037.5 Ų37.50%018%0.183CC..Hα-helixtrans-60-40.6175.900000112.9A158 F161 I162 K166 P167 N168 D173 C174 A194A158-A170 HydrophobicContact CB-CB 4.25Å; F161-A170 HydrophobicContact CB-CB 3.82Å; I162-A170 HydrophobicContact CD1-CB 3.81Å; I162-A170 HydrophobicContact CG1-CB 3.94Å; K166-A170 PolarHBondContact O-N 3.42Å; K166-A170 VanDerWaalsContact O-N 3.13Å; P167-A170 WeakPolarHBondContact O-CB 3.24Å; P167-A170 PolarHBondContact O-N 3.01Å; N168-A170 VanDerWaalsContact C-N 3.32Å; N168-A170 PolarHBondContact O-N 2.69Å; A170-D173 PolarHBondContact O-N 3.05Å; A170-C174 WeakPolarHBondContact O-CB 3.44Å; A170-C174 PolarHBondContact O-N 3.17Å; A170-C174 PolarHBondContact O-SG 3.49Å; A170-A194 HydrophobicContact CB-CB 4.3Å
171I98.6Very high98Very high21 Ų2140.6 Ų40.611%0.10820%0.2CC..Hα-helixtrans-61.8-43.7177.8-73.1161.6000111.2P167 N168 A169 D173 C174 N175 R191 A194 L198P167-I171 VanDerWaalsContact O-CG1 3.28Å; P167-I171 WeakPolarHBondContact O-CG1 3.45Å; P167-I171 PolarHBondContact O-N 2.86Å; N168-I171 PolarHBondContact O-N 3.39Å; A169-I171 VanDerWaalsContact C-N 3.35Å; A169-I171 PolarHBondContact O-N 2.93Å; I171-D173 PolarHBondContact O-N 3.33Å; I171-C174 PolarHBondContact O-N 3.18Å; I171-N175 WeakPolarHBondContact O-CB 3.14Å; I171-N175 PolarHBondContact O-N 2.88Å; I171-N175 PolarHBondContact O-ND2 3.49Å; I171-R191 HydrophobicContact CG1-CG 4.07Å; I171-R191 HydrophobicContact CG2-CG 4.46Å; I171-A194 HydrophobicContact CD1-CB 3.92Å; I171-A194 HydrophobicContact CG1-CB 3.53Å; I171-L198 HydrophobicContact CD1-CD1 3.57Å
172R98.1Very high98Very high78 Ų7843.3 Ų43.329%0.29422%0.218SC..Hα-helixtrans-60.1-46.3178-66.5178.7-159.2114.44111.3N168 A169 N175 R176N168-R172 WeakPolarHBondContact O-CG 3.5Å; N168-R172 PolarHBondContact O-N 2.94Å; N168-R172 VanDerWaalsContact O-N 3.09Å; A169-R172 PolarHBondContact O-N 3.3Å; R172-N175 PolarHBondContact O-N 3.12Å; R172-R176 WeakPolarHBondContact O-CB 3.48Å; R172-R176 PolarHBondContact O-N 2.84Å
173D98.6Very high97.9Very high0 Ų048.4 Ų48.40%025%0.245CC..Hα-helixtrans-63.7-42.6176.1-82.810.2000112.1Q99 M101 Y154 R157 A158 F161 A169 A170 I171 R176 A177Q99-D173 PolarHBondContact NE2-OD1 3.03Å; M101-D173 WeakPolarHBondContact CE-OD1 3.39Å; M101-D173 VanDerWaalsContact SD-OD1 3.36Å; Y154-D173 WeakPolarHBondContact CB-O 3.37Å; R157-D173 WeakPolarHBondContact CB-OD2 3.3Å; R157-D173 WeakPolarHBondContact CG-OD2 3.49Å; R157-D173 IonicContact CZ-OD1 3.29Å; R157-D173 IonicContact CZ-OD2 2.89Å; R157-D173 IonicContact NE-OD1 2.7Å; R157-D173 IonicContact NE-OD2 3.12Å; R157-D173 PolarHBondContact NE-OD2 2.72Å; R157-D173 IonicContact NH2-OD1 3.87Å; R157-D173 PolarHBondContact NH2-OD1 3.22Å; R157-D173 IonicContact NH2-OD2 3.19Å; R157-D173 PolarHBondContact NH2-OD2 2.87Å; A158-D173 HydrophobicContact CB-CB 3.85Å; F161-D173 WeakPolarHBondContact CE2-OD2 3.2Å; A169-D173 PolarHBondContact O-N 3.19Å; A170-D173 PolarHBondContact O-N 3.05Å; I171-D173 PolarHBondContact O-N 3.33Å; D173-R176 WeakPolarHBondContact O-CB 3.47Å; D173-R176 PolarHBondContact O-N 3.05Å; D173-A177 WeakPolarHBondContact O-CB 3.46Å; D173-A177 PolarHBondContact O-N 2.97Å
174C98.8Very high97.9Very high0 Ų044.1 Ų44.10%023%0.231CC..Hα-helixtrans-64.8-43.3177.8-67.30000112.1A158 A170 I171 R176 A177 I178 P187 R191A158-C174 WeakPolarHBondContact CB-SG 3.19Å; A170-C174 WeakPolarHBondContact O-CB 3.44Å; A170-C174 PolarHBondContact O-N 3.17Å; A170-C174 PolarHBondContact O-SG 3.49Å; I171-C174 PolarHBondContact O-N 3.18Å; C174-R176 PolarHBondContact O-N 3.17Å; C174-A177 PolarHBondContact O-N 3.37Å; C174-I178 WeakPolarHBondContact O-CB 3.45Å; C174-I178 WeakPolarHBondContact O-CD1 3.3Å; C174-I178 VanDerWaalsContact O-CG1 3.24Å; C174-I178 WeakPolarHBondContact O-CG1 3.4Å; C174-I178 PolarHBondContact O-N 3.03Å; C174-P187 HydrophobicContact CB-CB 4.44Å; C174-P187 PolarHBondContact SG-O 3.21Å; C174-P187 VanDerWaalsContact SG-O 3.35Å; C174-R191 HydrophobicContact CB-CB 3.65Å; C174-R191 HydrophobicContact CB-CG 4.01Å; C174-R191 PolarHBondContact SG-N 3.44Å
175N98.6Very high98Very high72 Ų7242.2 Ų42.239%0.38522%0.223SC..Hα-helixtrans-57.3-42.2174.9-73.7-18.9000110.8I171 R172 I178 S179 R191I171-N175 WeakPolarHBondContact O-CB 3.14Å; I171-N175 PolarHBondContact O-N 2.88Å; I171-N175 PolarHBondContact O-ND2 3.49Å; R172-N175 PolarHBondContact O-N 3.12Å; N175-I178 PolarHBondContact O-N 2.91Å; N175-S179 WeakPolarHBondContact O-CB 3.47Å; N175-S179 PolarHBondContact O-N 3.33Å; N175-R191 VanDerWaalsContact OD1-CD 3.23Å; N175-R191 WeakPolarHBondContact OD1-CD 3.28Å; N175-R191 PolarHBondContact OD1-NH1 2.7Å
176R97.7Very high98Very high42 Ų4238.6 Ų38.616%0.15821%0.206CC..Hα-helixtrans-64.8-47.7176.7-173.163.8-176.7126.518.1112M101 P148 Y154 R172 D173 C174 I178 S179 I180M101-R176 HydrophobicContact CE-CB 3.71Å; M101-R176 HydrophobicContact CE-CG 3.93Å; P148-R176 PolarHBondContact O-NH2 3.21Å; P148-R176 VanDerWaalsContact O-NH2 3.07Å; Y154-R176 HydrophobicContact CD1-CB 4.11Å; Y154-R176 HydrophobicContact CD1-CG 3.79Å; Y154-R176 HydrophobicContact CD2-CG 3.97Å; Y154-R176 HydrophobicContact CE1-CB 4.36Å; Y154-R176 HydrophobicContact CE1-CG 3.61Å; Y154-R176 HydrophobicContact CE2-CG 3.79Å; Y154-R176 HydrophobicContact CG-CB 4.26Å; Y154-R176 HydrophobicContact CG-CG 3.95Å; R172-R176 WeakPolarHBondContact O-CB 3.48Å; R172-R176 PolarHBondContact O-N 2.84Å; D173-R176 WeakPolarHBondContact O-CB 3.47Å; D173-R176 PolarHBondContact O-N 3.05Å; C174-R176 PolarHBondContact O-N 3.17Å; R176-I178 VanDerWaalsContact C-N 3.32Å; R176-I178 PolarHBondContact O-N 2.78Å; R176-S179 PolarHBondContact NH1-OG 3.44Å; R176-S179 PolarHBondContact O-N 3.32Å; R176-S179 VanDerWaalsContact O-N 3.16Å; R176-S179 PolarHBondContact O-OG 2.81Å; R176-I180 HydrophobicContact CG-CD1 4.31Å; R176-I180 WeakPolarHBondContact O-CG1 3.44Å; R176-I180 PolarHBondContact O-N 2.72Å
177A98.4Very high98.1Very high0 Ų035.9 Ų35.90%019%0.194CC..Hα-helixtrans-58.3-43.1176.700000112.2A151 A155 D173 C174 I180 N181 P187A151-A177 HydrophobicContact CB-CB 4.46Å; A151-A177 WeakPolarHBondContact O-CB 3.41Å; A155-A177 HydrophobicContact CB-CB 4.36Å; D173-A177 WeakPolarHBondContact O-CB 3.46Å; D173-A177 PolarHBondContact O-N 2.97Å; C174-A177 PolarHBondContact O-N 3.37Å; A177-I180 PolarHBondContact O-N 3.03Å; A177-N181 PolarHBondContact O-N 3.41Å; A177-P187 HydrophobicContact CB-CB 3.88Å; A177-P187 HydrophobicContact CB-CG 3.48Å; A177-P187 VanDerWaalsContact CB-CG 3.48Å
178I98.4Very high98.1Very high23 Ų2337.3 Ų37.312%0.11820%0.2CC..Hα-helixtrans-64.9-38.8177-68.6163.7000111.1C174 N175 R176 I180 N181 P182 P187 Y188 R191C174-I178 WeakPolarHBondContact O-CB 3.45Å; C174-I178 WeakPolarHBondContact O-CD1 3.3Å; C174-I178 VanDerWaalsContact O-CG1 3.24Å; C174-I178 WeakPolarHBondContact O-CG1 3.4Å; C174-I178 PolarHBondContact O-N 3.03Å; N175-I178 PolarHBondContact O-N 2.91Å; R176-I178 VanDerWaalsContact C-N 3.32Å; R176-I178 PolarHBondContact O-N 2.78Å; I178-I180 PolarHBondContact O-N 3.26Å; I178-N181 CarbonylContact O-C 3.27Å; I178-P182 WeakPolarHBondContact O-CA 3.36Å; I178-P182 VanDerWaalsContact O-N 3.15Å; I178-P187 HydrophobicContact CD1-CB 4.02Å; I178-P187 HydrophobicContact CG1-CB 3.52Å; I178-P187 HydrophobicContact CG1-CG 4.39Å; I178-Y188 HydrophobicContact CD1-CD1 3.78Å; I178-Y188 HydrophobicContact CD1-CE1 3.68Å; I178-Y188 HydrophobicContact CD1-CE2 4.46Å; I178-Y188 HydrophobicContact CD1-CG 4.23Å; I178-Y188 HydrophobicContact CG1-CD1 4.48Å; I178-Y188 HydrophobicContact CG1-CE1 4.13Å; I178-Y188 HydrophobicContact CG1-CE2 4.15Å; I178-Y188 HydrophobicContact CG2-CE1 4.31Å; I178-R191 VanDerWaalsContact CD1-CZ 3.4Å; I178-R191 VanDerWaalsContact CD1-NH1 3.29Å
179S97.8Very high98.1Very high76 Ų7636 Ų3653%0.53119%0.192SC..Hα-helixtrans-63.7-29.3176.775.50000113.1N175 R176N175-S179 WeakPolarHBondContact O-CB 3.47Å; N175-S179 PolarHBondContact O-N 3.33Å; R176-S179 PolarHBondContact NH1-OG 3.44Å; R176-S179 PolarHBondContact O-N 3.32Å; R176-S179 VanDerWaalsContact O-N 3.16Å; R176-S179 PolarHBondContact O-OG 2.81Å
180I96.9Very high98.1Very high48 Ų4837.5 Ų37.525%0.24620%0.197CC..Hα-helixtrans-85.8-46.1178.7-62.9165.5000110.6R149 A151 Y154 R176 A177 I178R149-I180 VanDerWaalsContact O-CG2 3.22Å; R149-I180 WeakPolarHBondContact O-CG2 3.49Å; A151-I180 HydrophobicContact CB-CB 3.96Å; A151-I180 HydrophobicContact CB-CG2 3.82Å; Y154-I180 HydrophobicContact CD2-CD1 3.8Å; Y154-I180 HydrophobicContact CE2-CD1 3.54Å; R176-I180 HydrophobicContact CG-CD1 4.31Å; R176-I180 WeakPolarHBondContact O-CG1 3.44Å; R176-I180 PolarHBondContact O-N 2.72Å; A177-I180 PolarHBondContact O-N 3.03Å; I178-I180 PolarHBondContact O-N 3.26Å
181N97.4Very high98.1Very high66 Ų6639.5 Ų39.535%0.35320%0.204SC..  trans-138.995.1179.6-176.2-0.9000110.5A151 A177 I178 D183 S184A151-N181 HydrophobicContact CB-CB 3.71Å; A177-N181 PolarHBondContact O-N 3.41Å; I178-N181 CarbonylContact O-C 3.27Å; N181-D183 PolarHBondContact O-N 2.87Å; N181-D183 PolarHBondContact OD1-N 3.1Å; N181-D183 VanDerWaalsContact OD1-N 3.12Å; N181-S184 PolarHBondContact O-N 3.02Å
182P97.8Very high98.1Very high65 Ų6538.5 Ų38.542%0.42220%0.199SC..THydrogen-bonded Turntrans-73.8-13.2-178.729.7-35.5000113.8I178 Y188I178-P182 WeakPolarHBondContact O-CA 3.36Å; I178-P182 VanDerWaalsContact O-N 3.15Å; P182-Y188 VanDerWaalsContact O-CE2 3.24Å; P182-Y188 WeakPolarHBondContact O-CE2 3.48Å; P182-Y188 PolarHBondContact O-OH 3.29Å
183D97.2Very high98.1Very high129 Ų12936.3 Ų36.369%0.6919%0.192SC*.THydrogen-bonded Turntrans-91.2-2.1-178.8-61.9-33.5000112.5N181N181-D183 PolarHBondContact O-N 2.87Å; N181-D183 PolarHBondContact OD1-N 3.1Å; N181-D183 VanDerWaalsContact OD1-N 3.12Å
184S97.2Very high98.1Very high28 Ų2836.3 Ų36.320%0.19619%0.192CC..  trans-80125.1175-169.20000111N181 P187 Y188N181-S184 PolarHBondContact O-N 3.02Å; S184-P187 WeakPolarHBondContact O-CD 3.46Å; S184-P187 WeakPolarHBondContact OG-CD 3.47Å; S184-Y188 WeakPolarHBondContact O-CD2 3.46Å; S184-Y188 WeakPolarHBondContact O-CE2 3.47Å
185A98Very high98.1Very high11 Ų1137.3 Ų37.39%0.09120%0.197CC..Hα-helixtrans-70.4-32.2177.500000113.7Y188 K189 L214 D215A185-Y188 PolarHBondContact O-N 3.31Å; A185-K189 PolarHBondContact O-N 3.36Å; A185-L214 HydrophobicContact CB-CB 3.77Å; A185-D215 HydrophobicContact CB-CB 3.54Å
186Q98.1Very high98.1Very high49 Ų4935 Ų3523%0.22918%0.183CC..Hα-helixtrans-59.5-47.3-171.7-69.6-68.9-51.900113.6A155 Y188 K189 W190A155-Q186 HydrophobicContact CB-CB 4.42Å; Q186-Y188 VanDerWaalsContact C-N 3.33Å; Q186-Y188 PolarHBondContact O-N 2.9Å; Q186-K189 WeakPolarHBondContact O-CB 3.49Å; Q186-K189 PolarHBondContact O-N 3.44Å; Q186-W190 PolarHBondContact O-N 3.05Å
187P98.6Very high98.1Very high0 Ų034.7 Ų34.70%018%0.184CC..Hα-helixtrans-56-41.8175-28.336.2000114.2A155 C174 A177 I178 S184 W190 R191A155-P187 HydrophobicContact CB-CG 3.98Å; C174-P187 HydrophobicContact CB-CB 4.44Å; C174-P187 PolarHBondContact SG-O 3.21Å; C174-P187 VanDerWaalsContact SG-O 3.35Å; A177-P187 HydrophobicContact CB-CB 3.88Å; A177-P187 HydrophobicContact CB-CG 3.48Å; A177-P187 VanDerWaalsContact CB-CG 3.48Å; I178-P187 HydrophobicContact CD1-CB 4.02Å; I178-P187 HydrophobicContact CG1-CB 3.52Å; I178-P187 HydrophobicContact CG1-CG 4.39Å; S184-P187 WeakPolarHBondContact O-CD 3.46Å; S184-P187 WeakPolarHBondContact OG-CD 3.47Å; P187-W190 PolarHBondContact O-N 3.23Å; P187-R191 VanDerWaalsContact O-CB 3.3Å; P187-R191 WeakPolarHBondContact O-CB 3.43Å; P187-R191 PolarHBondContact O-N 3.14Å
188Y98.8Very high98.1Very high30 Ų3035.5 Ų35.512%0.11819%0.188CC..Hα-helixtrans-66.7-39.6177-61.2-82.8000111.3I178 P182 S184 A185 Q186 W190 R191 G192 T210 L214I178-Y188 HydrophobicContact CD1-CD1 3.78Å; I178-Y188 HydrophobicContact CD1-CE1 3.68Å; I178-Y188 HydrophobicContact CD1-CE2 4.46Å; I178-Y188 HydrophobicContact CD1-CG 4.23Å; I178-Y188 HydrophobicContact CG1-CD1 4.48Å; I178-Y188 HydrophobicContact CG1-CE1 4.13Å; I178-Y188 HydrophobicContact CG1-CE2 4.15Å; I178-Y188 HydrophobicContact CG2-CE1 4.31Å; P182-Y188 VanDerWaalsContact O-CE2 3.24Å; P182-Y188 WeakPolarHBondContact O-CE2 3.48Å; P182-Y188 PolarHBondContact O-OH 3.29Å; S184-Y188 WeakPolarHBondContact O-CD2 3.46Å; S184-Y188 WeakPolarHBondContact O-CE2 3.47Å; A185-Y188 PolarHBondContact O-N 3.31Å; Q186-Y188 VanDerWaalsContact C-N 3.33Å; Q186-Y188 PolarHBondContact O-N 2.9Å; Y188-W190 PolarHBondContact O-N 3.13Å; Y188-R191 PolarHBondContact O-N 3.09Å; Y188-G192 PolarHBondContact O-N 2.91Å; Y188-T210 HydrophobicContact CD1-CG2 3.82Å; Y188-T210 HydrophobicContact CD2-CG2 4.16Å; Y188-T210 HydrophobicContact CE1-CG2 3.88Å; Y188-T210 HydrophobicContact CE2-CG2 4.22Å; Y188-T210 HydrophobicContact CG-CG2 3.97Å; Y188-L214 HydrophobicContact CD2-CD1 3.68Å; Y188-L214 HydrophobicContact CE2-CD1 3.57Å
189K98.6Very high98Very high14 Ų1435.2 Ų35.26%0.06119%0.19CC..Hα-helixtrans-57.3-49.3174.6-179.8168.787.2166.80111.5A185 Q186 K193 A211 D217 A220A185-K189 PolarHBondContact O-N 3.36Å; Q186-K189 WeakPolarHBondContact O-CB 3.49Å; Q186-K189 PolarHBondContact O-N 3.44Å; K189-K193 WeakPolarHBondContact O-CG 3.48Å; K189-K193 PolarHBondContact O-N 3.46Å; K189-A211 HydrophobicContact CB-CB 4.08Å; K189-D217 HydrophobicContact CD-CB 4.4Å; K189-D217 WeakPolarHBondContact CD-OD1 3.19Å; K189-D217 IonicContact NZ-OD1 3.6Å; K189-D217 PolarHBondContact NZ-OD1 3.21Å; K189-D217 IonicContact NZ-OD2 3.71Å; K189-D217 PolarHBondContact NZ-OD2 3.11Å; K189-A220 HydrophobicContact CD-CB 3.94Å; K189-A220 HydrophobicContact CG-CB 4.07Å
190W98.6Very high97.9Very high36 Ų3635.6 Ų35.614%0.13618%0.184CC..Hα-helixtrans-71.7-36.8-177.8-62120.9000112.6A158 S159 I162 Q186 P187 Y188 K193 A194A158-W190 HydrophobicContact CB-CB 4.3Å; S159-W190 VanDerWaalsContact CB-CE2 3.42Å; I162-W190 HydrophobicContact CB-CE3 4.4Å; I162-W190 HydrophobicContact CG1-CE3 4.19Å; I162-W190 HydrophobicContact CG2-CE3 4.42Å; I162-W190 HydrophobicContact CG2-CZ3 4.45Å; Q186-W190 PolarHBondContact O-N 3.05Å; P187-W190 PolarHBondContact O-N 3.23Å; Y188-W190 PolarHBondContact O-N 3.13Å; W190-K193 HydrophobicContact CE3-CD 3.65Å; W190-K193 HydrophobicContact CZ3-CD 3.59Å; W190-K193 PolarHBondContact O-N 3.46Å; W190-A194 PolarHBondContact O-N 3.48Å
191R98.8Very high98Very high41 Ų4133.7 Ų33.716%0.15517%0.173CC..Hα-helixtrans-66.3-40.1174.2-158.4171.564.7-173.1-3.7111.9I171 C174 N175 I178 P187 Y188 K193 A194 H195 D207I171-R191 HydrophobicContact CG1-CG 4.07Å; I171-R191 HydrophobicContact CG2-CG 4.46Å; C174-R191 HydrophobicContact CB-CB 3.65Å; C174-R191 HydrophobicContact CB-CG 4.01Å; C174-R191 PolarHBondContact SG-N 3.44Å; N175-R191 VanDerWaalsContact OD1-CD 3.23Å; N175-R191 WeakPolarHBondContact OD1-CD 3.28Å; N175-R191 PolarHBondContact OD1-NH1 2.7Å; I178-R191 VanDerWaalsContact CD1-CZ 3.4Å; I178-R191 VanDerWaalsContact CD1-NH1 3.29Å; P187-R191 VanDerWaalsContact O-CB 3.3Å; P187-R191 WeakPolarHBondContact O-CB 3.43Å; P187-R191 PolarHBondContact O-N 3.14Å; Y188-R191 PolarHBondContact O-N 3.09Å; R191-K193 PolarHBondContact O-N 3.06Å; R191-A194 WeakPolarHBondContact O-CB 3.45Å; R191-A194 PolarHBondContact O-N 2.83Å; R191-A194 VanDerWaalsContact O-N 3.17Å; R191-H195 PolarHBondContact O-CD2 3.3Å; R191-H195 PolarHBondContact O-N 3.42Å; R191-D207 WeakPolarHBondContact CB-OD2 3.34Å; R191-D207 WeakPolarHBondContact CG-OD2 3.48Å; R191-D207 IonicContact CZ-OD1 2.89Å; R191-D207 IonicContact CZ-OD2 4Å; R191-D207 IonicContact NE-OD1 2.77Å; R191-D207 IonicContact NE-OD2 3.59Å; R191-D207 PolarHBondContact NE-OD2 3.5Å; R191-D207 IonicContact NH2-OD1 2.64Å; R191-D207 PolarHBondContact NH2-OD1 3.5Å; R191-D207 IonicContact NH2-OD2 2.64Å; R191-D207 PolarHBondContact NH2-OD2 2.85Å
192G98.4Very high98Very high0 Ų033 Ų330%017%0.168CC..Hα-helixtrans-61.4-42.5172.800000112.7Y188 H195 R196Y188-G192 PolarHBondContact O-N 2.91Å; G192-H195 PolarHBondContact O-N 2.93Å; G192-R196 WeakPolarHBondContact O-CB 3.44Å; G192-R196 PolarHBondContact O-N 3.2Å
193K98.5Very high98Very high33 Ų3333.5 Ų33.514%0.14317%0.167CC..Hα-helixtrans-61.3-41.3171.1-77.7-179-178.3-167.20112.4I162 K189 W190 R191 R196 L197 D219 L223I162-K193 HydrophobicContact CD1-CB 4.24Å; I162-K193 HydrophobicContact CG2-CB 4.49Å; K189-K193 WeakPolarHBondContact O-CG 3.48Å; K189-K193 PolarHBondContact O-N 3.46Å; W190-K193 HydrophobicContact CE3-CD 3.65Å; W190-K193 HydrophobicContact CZ3-CD 3.59Å; W190-K193 PolarHBondContact O-N 3.46Å; R191-K193 PolarHBondContact O-N 3.06Å; K193-R196 WeakPolarHBondContact O-CB 3.46Å; K193-R196 PolarHBondContact O-N 2.95Å; K193-L197 WeakPolarHBondContact O-CG 3.46Å; K193-L197 PolarHBondContact O-N 3.47Å; K193-L197 VanDerWaalsContact O-N 3.09Å; K193-D219 IonicContact NZ-OD2 3.49Å; K193-L223 HydrophobicContact CD-CD1 3.97Å; K193-L223 HydrophobicContact CG-CD1 3.43Å; K193-L223 VanDerWaalsContact CG-CD1 3.43Å
194A98.6Very high98Very high0 Ų027.4 Ų27.40%013%0.134CC..Hα-helixtrans-63.8-46.4176.200000112I162 P167 A170 I171 W190 R191 R196 L197 L198I162-A194 HydrophobicContact CD1-CB 3.71Å; P167-A194 HydrophobicContact CB-CB 3.88Å; P167-A194 WeakPolarHBondContact O-CB 3.37Å; A170-A194 HydrophobicContact CB-CB 4.3Å; I171-A194 HydrophobicContact CD1-CB 3.92Å; I171-A194 HydrophobicContact CG1-CB 3.53Å; W190-A194 PolarHBondContact O-N 3.48Å; R191-A194 WeakPolarHBondContact O-CB 3.45Å; R191-A194 PolarHBondContact O-N 2.83Å; R191-A194 VanDerWaalsContact O-N 3.17Å; A194-R196 VanDerWaalsContact C-N 3.3Å; A194-R196 PolarHBondContact O-N 3.4Å; A194-L197 WeakPolarHBondContact O-CB 3.43Å; A194-L197 PolarHBondContact O-N 3.32Å; A194-L197 VanDerWaalsContact O-N 3.14Å; A194-L198 PolarHBondContact O-N 3.48Å
195H98.6Very high98.1Very high21 Ų2126.3 Ų26.310%0.09713%0.127CC..Hα-helixtrans-62.6-37.6176.8-77.1-51.1000112.2R191 G192 L197 L198 G199 H200 D203 A204 D207R191-H195 PolarHBondContact O-CD2 3.3Å; R191-H195 PolarHBondContact O-N 3.42Å; G192-H195 PolarHBondContact O-N 2.93Å; H195-L197 VanDerWaalsContact C-N 3.34Å; H195-L197 PolarHBondContact O-N 3.07Å; H195-L198 CarbonylContact O-C 3.37Å; H195-L198 PolarHBondContact O-N 3.37Å; H195-G199 PolarHBondContact O-N 3.42Å; H195-H200 HydrophobicContact CB-CB 3.93Å; H195-H200 AromaticContact CE1-ND1 3.94Å; H195-H200 AromaticContact ND1-CG 3.86Å; H195-H200 AromaticContact ND1-ND1 3.36Å; H195-H200 PolarHBondContact ND1-ND1 3.38Å; H195-H200 PolarHBondContact O-N 3.02Å; H195-D203 HydrophobicContact CB-CB 4.26Å; H195-A204 HydrophobicContact CB-CB 3.74Å; H195-D207 IonicContact CD2-OD2 3.54Å; H195-D207 PolarHBondContact CD2-OD2 3.47Å; H195-D207 IonicContact NE2-OD2 3.87Å
196R97.8Very high98.1Very high24 Ų2432.5 Ų32.59%0.09115%0.152CC..Hα-helixtrans-58.6-44.4171.7166.660.7-175.491.6-7.5112.2E88 G192 K193 A194 L198 G199 W201 A204 E226 V227E88-R196 PolarHBondContact O-NH1 2.95Å; E88-R196 PolarHBondContact O-NH2 3.06Å; G192-R196 WeakPolarHBondContact O-CB 3.44Å; G192-R196 PolarHBondContact O-N 3.2Å; K193-R196 WeakPolarHBondContact O-CB 3.46Å; K193-R196 PolarHBondContact O-N 2.95Å; A194-R196 VanDerWaalsContact C-N 3.3Å; A194-R196 PolarHBondContact O-N 3.4Å; R196-L198 VanDerWaalsContact C-N 3.28Å; R196-L198 PolarHBondContact O-N 3.45Å; R196-G199 PolarHBondContact O-N 3.16Å; R196-W201 VanDerWaalsContact NH1-CH2 3.32Å; R196-A204 HydrophobicContact CB-CB 4.31Å; R196-E226 IonicContact CZ-OE1 2.72Å; R196-E226 IonicContact NE-OE1 3.03Å; R196-E226 PolarHBondContact NE-OE1 3.42Å; R196-E226 IonicContact NE-OE2 3.46Å; R196-E226 IonicContact NH2-OE1 2.71Å; R196-E226 PolarHBondContact NH2-OE1 2.91Å; R196-V227 HydrophobicContact CB-CG1 4.28Å; R196-V227 HydrophobicContact CG-CG1 4.3Å
197L98Very high98.1Very high34 Ų3430.4 Ų30.418%0.17814%0.142CC..Hα-helixtrans-65.2-31.9177.5-75.4174.7000112.2V90 I91 I162 P167 K193 A194 H195V90-L197 CarbonylContact C-O 3.03Å; V90-L197 VanDerWaalsContact CA-O 3.29Å; V90-L197 WeakPolarHBondContact CA-O 3.47Å; I91-L197 HydrophobicContact CD1-CB 4.05Å; I91-L197 HydrophobicContact CD1-CD1 4.21Å; I91-L197 HydrophobicContact CD1-CD2 4.23Å; I91-L197 HydrophobicContact CD1-CG 4.4Å; I91-L197 HydrophobicContact CG1-CB 3.95Å; I91-L197 HydrophobicContact CG1-CD2 4.39Å; I91-L197 WeakPolarHBondContact CG1-O 3.47Å; I91-L197 PolarHBondContact N-O 3.24Å; I162-L197 HydrophobicContact CD1-CD1 4.16Å; P167-L197 HydrophobicContact CB-CB 4.21Å; P167-L197 HydrophobicContact CG-CB 4.45Å; K193-L197 WeakPolarHBondContact O-CG 3.46Å; K193-L197 PolarHBondContact O-N 3.47Å; K193-L197 VanDerWaalsContact O-N 3.09Å; A194-L197 WeakPolarHBondContact O-CB 3.43Å; A194-L197 PolarHBondContact O-N 3.32Å; A194-L197 VanDerWaalsContact O-N 3.14Å; H195-L197 VanDerWaalsContact C-N 3.34Å; H195-L197 PolarHBondContact O-N 3.07Å
198L97.7Very high98.1Very high18 Ų1830.4 Ų30.49%0.09414%0.142CC..THydrogen-bonded Turntrans-85.9-3.1176.9-68171.9000114.1P93 P167 N168 I171 A194 H195 R196 H200P93-L198 HydrophobicContact CB-CD2 3.79Å; P167-L198 HydrophobicContact CB-CD1 4.02Å; P167-L198 HydrophobicContact CB-CD2 4.22Å; P167-L198 HydrophobicContact CB-CG 3.8Å; P167-L198 HydrophobicContact CG-CD1 4.23Å; P167-L198 HydrophobicContact CG-CD2 3.55Å; P167-L198 HydrophobicContact CG-CG 3.7Å; N168-L198 WeakPolarHBondContact OD1-CD1 3.49Å; I171-L198 HydrophobicContact CD1-CD1 3.57Å; A194-L198 PolarHBondContact O-N 3.48Å; H195-L198 CarbonylContact O-C 3.37Å; H195-L198 PolarHBondContact O-N 3.37Å; R196-L198 VanDerWaalsContact C-N 3.28Å; R196-L198 PolarHBondContact O-N 3.45Å; L198-H200 PolarHBondContact O-CD2 2.95Å; L198-H200 PolarHBondContact O-N 3.46Å
199G96.2Very high98.1Very high16 Ų1630.9 Ų30.917%0.16515%0.153CC..THydrogen-bonded Turntrans69.518.2-172.900000113.8H195 R196 W201H195-G199 PolarHBondContact O-N 3.42Å; R196-G199 PolarHBondContact O-N 3.16Å; G199-W201 PolarHBondContact O-N 3.01Å; G199-W201 PolarHBondContact O-NE1 3.48Å; G199-W201 VanDerWaalsContact O-NE1 3.11Å
200H97.3Very high98.1Very high84 Ų8432.2 Ų32.239%0.38916%0.162SC..  trans-81.169.1172.9-62.8-178.2000109.5H195 L198 E202 D203 A204H195-H200 HydrophobicContact CB-CB 3.93Å; H195-H200 AromaticContact CE1-ND1 3.94Å; H195-H200 AromaticContact ND1-CG 3.86Å; H195-H200 AromaticContact ND1-ND1 3.36Å; H195-H200 PolarHBondContact ND1-ND1 3.38Å; H195-H200 PolarHBondContact O-N 3.02Å; L198-H200 PolarHBondContact O-CD2 2.95Å; L198-H200 PolarHBondContact O-N 3.46Å; H200-E202 PolarHBondContact O-N 2.95Å; H200-D203 HydrophobicContact CB-CB 4.35Å; H200-D203 PolarHBondContact O-N 3.25Å; H200-A204 WeakPolarHBondContact O-CB 3.36Å; H200-A204 PolarHBondContact O-N 2.93Å
201W97.4Very high98.1Very high8 Ų830.6 Ų30.63%0.0316%0.156CC..Hα-helixtrans-61-40.3-166.9-51.7103.9000114.1I85 V90 R196 G199 A204 A205 V227 K230 A231 I234I85-W201 HydrophobicContact CG2-CZ2 4.3Å; V90-W201 HydrophobicContact CG2-CH2 3.84Å; V90-W201 HydrophobicContact CG2-CZ2 3.52Å; R196-W201 VanDerWaalsContact NH1-CH2 3.32Å; G199-W201 PolarHBondContact O-N 3.01Å; G199-W201 PolarHBondContact O-NE1 3.48Å; G199-W201 VanDerWaalsContact O-NE1 3.11Å; W201-A204 PolarHBondContact O-N 3.39Å; W201-A205 WeakPolarHBondContact O-CB 3.2Å; W201-A205 PolarHBondContact O-N 3.47Å; W201-V227 HydrophobicContact CE3-CB 4.32Å; W201-V227 HydrophobicContact CE3-CG1 3.99Å; W201-V227 HydrophobicContact CZ3-CG1 4.23Å; W201-K230 HydrophobicContact CB-CB 4.12Å; W201-K230 HydrophobicContact CD2-CB 3.9Å; W201-K230 HydrophobicContact CD2-CD 3.82Å; W201-K230 HydrophobicContact CD2-CG 4.48Å; W201-K230 HydrophobicContact CE3-CB 4.07Å; W201-K230 HydrophobicContact CE3-CD 3.58Å; W201-K230 HydrophobicContact CE3-CG 4.41Å; W201-K230 HydrophobicContact CG-CB 3.9Å; W201-K230 HydrophobicContact CH2-CD 3.63Å; W201-K230 HydrophobicContact CZ2-CD 3.88Å; W201-K230 HydrophobicContact CZ3-CD 3.44Å; W201-K230 VanDerWaalsContact CZ3-CD 3.44Å; W201-A231 HydrophobicContact CB-CB 4.38Å; W201-I234 HydrophobicContact CB-CD1 3.86Å; W201-I234 VanDerWaalsContact CD1-CD1 3.49Å; W201-I234 HydrophobicContact CG-CD1 4.01Å
202E97.2Very high98Very high52 Ų5229.9 Ų29.924%0.24316%0.157CC..Hα-helixtrans-62.7-48.3178-71.5178.1-101.500111.7H200 A205 K206 A231 I234 M235 R238H200-E202 PolarHBondContact O-N 2.95Å; E202-A205 PolarHBondContact O-N 3.03Å; E202-K206 WeakPolarHBondContact O-CB 3.33Å; E202-K206 PolarHBondContact O-N 3.02Å; E202-A231 HydrophobicContact CG-CB 4.41Å; E202-I234 HydrophobicContact CG-CB 4.48Å; E202-I234 HydrophobicContact CG-CG2 4.34Å; E202-I234 WeakPolarHBondContact OE1-CG2 3.35Å; E202-M235 HydrophobicContact CG-CG 4.07Å; E202-M235 WeakPolarHBondContact OE2-CG 3.18Å; E202-R238 IonicContact OE1-CZ 3.5Å; E202-R238 VanDerWaalsContact OE1-CZ 3.29Å; E202-R238 IonicContact OE1-NH1 2.7Å; E202-R238 PolarHBondContact OE1-NH1 3.49Å; E202-R238 IonicContact OE1-NH2 3.49Å; E202-R238 PolarHBondContact OE1-NH2 3.47Å; E202-R238 IonicContact OE2-CZ 2.72Å; E202-R238 IonicContact OE2-NH1 3.52Å; E202-R238 PolarHBondContact OE2-NH1 3.13Å; E202-R238 IonicContact OE2-NH2 3.52Å
203D98.1Very high98Very high76 Ų7638.9 Ų38.941%0.40620%0.197SC..Hα-helixtrans-66.9-40.6179-65.8-41000111.2H195 H200 A205 K206 D207H195-D203 HydrophobicContact CB-CB 4.26Å; H200-D203 HydrophobicContact CB-CB 4.35Å; H200-D203 PolarHBondContact O-N 3.25Å; D203-A205 PolarHBondContact O-N 3.33Å; D203-K206 PolarHBondContact O-N 2.6Å; D203-D207 WeakPolarHBondContact O-CB 3.19Å; D203-D207 PolarHBondContact O-N 3.32Å
204A98.3Very high97.9Very high0 Ų040.9 Ų40.90%021%0.208CC..Hα-helixtrans-57.9-49175.200000111.7H195 R196 H200 W201 K206 D207 L208 V227H195-A204 HydrophobicContact CB-CB 3.74Å; R196-A204 HydrophobicContact CB-CB 4.31Å; H200-A204 WeakPolarHBondContact O-CB 3.36Å; H200-A204 PolarHBondContact O-N 2.93Å; W201-A204 PolarHBondContact O-N 3.39Å; A204-K206 VanDerWaalsContact C-N 3.35Å; A204-K206 PolarHBondContact O-N 2.96Å; A204-D207 PolarHBondContact O-N 3.05Å; A204-L208 WeakPolarHBondContact O-CB 3.36Å; A204-L208 WeakPolarHBondContact O-CD1 3.39Å; A204-L208 WeakPolarHBondContact O-CG 3.37Å; A204-L208 PolarHBondContact O-N 2.99Å; A204-V227 HydrophobicContact CB-CB 4.38Å; A204-V227 HydrophobicContact CB-CG1 4.17Å; A204-V227 HydrophobicContact CB-CG2 4.34Å
205A98.3Very high97.8Very high5 Ų545.6 Ų45.64%0.04123%0.234CC..Hα-helixtrans-61.9-43.6179.300000111.6W201 E202 D203 A209 L224 V227 A231W201-A205 WeakPolarHBondContact O-CB 3.2Å; W201-A205 PolarHBondContact O-N 3.47Å; E202-A205 PolarHBondContact O-N 3.03Å; D203-A205 PolarHBondContact O-N 3.33Å; A205-A209 WeakPolarHBondContact O-CB 3.48Å; A205-A209 PolarHBondContact O-N 3.02Å; A205-L224 HydrophobicContact CB-CD1 4.28Å; A205-L224 WeakPolarHBondContact O-CD1 3.4Å; A205-V227 HydrophobicContact CB-CG2 3.81Å; A205-A231 HydrophobicContact CB-CB 3.84Å
206K98.4Very high97.7Very high141 Ų14150.7 Ų50.761%0.61325%0.253SS*.Hα-helixtrans-61.4-46.7178.5-177.9-177176.7-174.70112.2E202 D203 A204 T210E202-K206 WeakPolarHBondContact O-CB 3.33Å; E202-K206 PolarHBondContact O-N 3.02Å; D203-K206 PolarHBondContact O-N 2.6Å; A204-K206 VanDerWaalsContact C-N 3.35Å; A204-K206 PolarHBondContact O-N 2.96Å; K206-T210 WeakPolarHBondContact O-CB 3.46Å; K206-T210 PolarHBondContact O-N 3.3Å; K206-T210 PolarHBondContact O-OG1 3.06Å
207D98.6Very high97.6Very high5 Ų551.4 Ų51.43%0.02726%0.258CS..Hα-helixtrans-70-44.4-178.4-81.9-17.3000112.2R191 H195 D203 A204 A209 T210 A211R191-D207 WeakPolarHBondContact CB-OD2 3.34Å; R191-D207 WeakPolarHBondContact CG-OD2 3.48Å; R191-D207 IonicContact CZ-OD1 2.89Å; R191-D207 IonicContact CZ-OD2 4Å; R191-D207 IonicContact NE-OD1 2.77Å; R191-D207 IonicContact NE-OD2 3.59Å; R191-D207 PolarHBondContact NE-OD2 3.5Å; R191-D207 IonicContact NH2-OD1 2.64Å; R191-D207 PolarHBondContact NH2-OD1 3.5Å; R191-D207 IonicContact NH2-OD2 2.64Å; R191-D207 PolarHBondContact NH2-OD2 2.85Å; H195-D207 IonicContact CD2-OD2 3.54Å; H195-D207 PolarHBondContact CD2-OD2 3.47Å; H195-D207 IonicContact NE2-OD2 3.87Å; D203-D207 WeakPolarHBondContact O-CB 3.19Å; D203-D207 PolarHBondContact O-N 3.32Å; A204-D207 PolarHBondContact O-N 3.05Å; D207-A209 VanDerWaalsContact C-N 3.34Å; D207-A209 PolarHBondContact O-N 3.24Å; D207-T210 WeakPolarHBondContact O-CB 3.25Å; D207-T210 PolarHBondContact O-N 3.37Å; D207-T210 VanDerWaalsContact O-N 3.16Å; D207-A211 WeakPolarHBondContact O-CB 3.45Å; D207-A211 PolarHBondContact O-N 3.2Å
208L98.5Very high97.5Very high0 Ų055.6 Ų55.60%028%0.277CS..Hα-helixtrans-64.1-39.5177.2-67.1167.6000111.6A204 T210 A211 C212 A220 L223 L224 V227A204-L208 WeakPolarHBondContact O-CB 3.36Å; A204-L208 WeakPolarHBondContact O-CD1 3.39Å; A204-L208 WeakPolarHBondContact O-CG 3.37Å; A204-L208 PolarHBondContact O-N 2.99Å; L208-T210 VanDerWaalsContact C-N 3.33Å; L208-T210 PolarHBondContact O-N 3.11Å; L208-A211 WeakPolarHBondContact O-CB 3.42Å; L208-A211 PolarHBondContact O-N 3.02Å; L208-C212 PolarHBondContact O-N 2.7Å; L208-C212 PolarHBondContact O-SG 2.89Å; L208-C212 VanDerWaalsContact O-SG 3.38Å; L208-A220 HydrophobicContact CD2-CB 4.17Å; L208-L223 HydrophobicContact CD1-CB 3.68Å; L208-L223 HydrophobicContact CD2-CB 4.29Å; L208-L223 HydrophobicContact CD2-CD1 4.49Å; L208-L224 HydrophobicContact CB-CB 4.01Å; L208-L224 HydrophobicContact CB-CD1 4.13Å; L208-V227 HydrophobicContact CD1-CG2 3.84Å
209A98.3Very high97.4Very high41 Ų4159 Ų5934%0.33930%0.296SS..Hα-helixtrans-62.6-40.3172.900000112.1A205 D207 K213 L224A205-A209 WeakPolarHBondContact O-CB 3.48Å; A205-A209 PolarHBondContact O-N 3.02Å; D207-A209 VanDerWaalsContact C-N 3.34Å; D207-A209 PolarHBondContact O-N 3.24Å; A209-K213 WeakPolarHBondContact O-CB 3.29Å; A209-K213 PolarHBondContact O-N 2.83Å; A209-L224 HydrophobicContact CB-CD1 4.18Å; A209-L224 HydrophobicContact CB-CD2 4.05Å
210T98.3Very high97.4Very high42 Ų4258.3 Ų58.326%0.25829%0.288SS..Hα-helixtrans-65.5-43.3175.8-56.20000111Y188 K206 D207 L208 K213 L214Y188-T210 HydrophobicContact CD1-CG2 3.82Å; Y188-T210 HydrophobicContact CD2-CG2 4.16Å; Y188-T210 HydrophobicContact CE1-CG2 3.88Å; Y188-T210 HydrophobicContact CE2-CG2 4.22Å; Y188-T210 HydrophobicContact CG-CG2 3.97Å; K206-T210 WeakPolarHBondContact O-CB 3.46Å; K206-T210 PolarHBondContact O-N 3.3Å; K206-T210 PolarHBondContact O-OG1 3.06Å; D207-T210 WeakPolarHBondContact O-CB 3.25Å; D207-T210 PolarHBondContact O-N 3.37Å; D207-T210 VanDerWaalsContact O-N 3.16Å; L208-T210 VanDerWaalsContact C-N 3.33Å; L208-T210 PolarHBondContact O-N 3.11Å; T210-K213 PolarHBondContact O-N 2.97Å; T210-L214 HydrophobicContact CG2-CD1 4.13Å; T210-L214 WeakPolarHBondContact O-CG 3.37Å; T210-L214 PolarHBondContact O-N 3.26Å
211A98.3Very high97.4Very high2 Ų255 Ų552%0.01727%0.274CS..Hα-helixtrans-56.9-54.8175.400000110.9K189 D207 L208 K213 L214 D215K189-A211 HydrophobicContact CB-CB 4.08Å; D207-A211 WeakPolarHBondContact O-CB 3.45Å; D207-A211 PolarHBondContact O-N 3.2Å; L208-A211 WeakPolarHBondContact O-CB 3.42Å; L208-A211 PolarHBondContact O-N 3.02Å; A211-K213 PolarHBondContact O-N 3.38Å; A211-L214 PolarHBondContact O-N 3.34Å; A211-L214 VanDerWaalsContact O-N 3.1Å; A211-D215 CarbonylContact C-O 3.53Å; A211-D215 CarbonylContact O-C 3.38Å; A211-D215 PolarHBondContact O-N 2.98Å
212C97.8Very high97.4Very high26 Ų2657.3 Ų57.318%0.17630%0.295CS..Hα-helixtrans-61.8-28.3179.3-67.90000113.8L208 S221L208-C212 PolarHBondContact O-N 2.7Å; L208-C212 PolarHBondContact O-SG 2.89Å; L208-C212 VanDerWaalsContact O-SG 3.38Å; C212-S221 PolarHBondContact SG-N 3.19Å
213K97.9Very high97.4Very high189 Ų18956.6 Ų56.682%0.82229%0.293SS*.Hα-helixtrans-72.8-38.8175.2-178.2-177.7176.3-173.60112.1A209 T210 A211A209-K213 WeakPolarHBondContact O-CB 3.29Å; A209-K213 PolarHBondContact O-N 2.83Å; T210-K213 PolarHBondContact O-N 2.97Å; A211-K213 PolarHBondContact O-N 3.38Å
214L97.3Very high97.4Very high74 Ų7454.5 Ų54.539%0.38728%0.282SS..Hα-helixtrans-75.6-47.1179.1-72.1172.3000111.3A185 Y188 T210 A211A185-L214 HydrophobicContact CB-CB 3.77Å; Y188-L214 HydrophobicContact CD2-CD1 3.68Å; Y188-L214 HydrophobicContact CE2-CD1 3.57Å; T210-L214 HydrophobicContact CG2-CD1 4.13Å; T210-L214 WeakPolarHBondContact O-CG 3.37Å; T210-L214 PolarHBondContact O-N 3.26Å; A211-L214 PolarHBondContact O-N 3.34Å; A211-L214 VanDerWaalsContact O-N 3.1Å
215D96.4Very high97.3Very high100 Ų10061.6 Ų61.654%0.53531%0.312SS..SBendtrans-151.6120.8177.4-171.215.1000109.4A185 A211 D217A185-D215 HydrophobicContact CB-CB 3.54Å; A211-D215 CarbonylContact C-O 3.53Å; A211-D215 CarbonylContact O-C 3.38Å; A211-D215 PolarHBondContact O-N 2.98Å; D215-D217 PolarHBondContact O-N 2.76Å
216Y95.9Very high97.2Very high127 Ų12765 Ų6550%0.49833%0.327SS..  trans-71.2123.7-176.6177.7-92.4000110.4E218Y216-E218 HydrophobicContact CE1-CG 4.07Å; Y216-E218 WeakPolarHBondContact CE1-OE1 3.31Å; Y216-E218 PolarHBondContact OH-OE1 3.43Å; Y216-E218 PolarHBondContact OH-OE2 3.35Å
217D95Very high97.1Very high39 Ų3958.2 Ų58.221%0.20930%0.298CS..  trans-131.2126.4179.4179.4-92.2000108.1K189 D215 D219 A220 S221K189-D217 HydrophobicContact CD-CB 4.4Å; K189-D217 WeakPolarHBondContact CD-OD1 3.19Å; K189-D217 IonicContact NZ-OD1 3.6Å; K189-D217 PolarHBondContact NZ-OD1 3.21Å; K189-D217 IonicContact NZ-OD2 3.71Å; K189-D217 PolarHBondContact NZ-OD2 3.11Å; D215-D217 PolarHBondContact O-N 2.76Å; D217-D219 VanDerWaalsContact C-N 3.31Å; D217-D219 PolarHBondContact O-N 2.88Å; D217-D219 WeakPolarHBondContact OD1-CB 3.45Å; D217-D219 PolarHBondContact OD1-N 2.96Å; D217-A220 HydrophobicContact CB-CB 4.04Å; D217-A220 PolarHBondContact O-N 3.42Å; D217-A220 PolarHBondContact OD1-N 3.03Å; D217-S221 WeakPolarHBondContact O-CB 3.41Å; D217-S221 PolarHBondContact O-N 3.43Å
218E96.4Very high97Very high122 Ų12261 Ų6157%0.5731%0.311SS*.Hα-helixtrans-59.4-40.7-176.8-76.6-67.2159.500111.9Y216 S221 A222Y216-E218 HydrophobicContact CE1-CG 4.07Å; Y216-E218 WeakPolarHBondContact CE1-OE1 3.31Å; Y216-E218 PolarHBondContact OH-OE1 3.43Å; Y216-E218 PolarHBondContact OH-OE2 3.35Å; E218-S221 PolarHBondContact O-N 3.48Å; E218-A222 WeakPolarHBondContact O-CB 3.38Å; E218-A222 PolarHBondContact O-N 3.23Å
219D95.3Very high96.9Very high91 Ų9164.7 Ų64.749%0.48734%0.335SS..Hα-helixtrans-64.3-44.9178.3-61.4-14.2000111.2K193 D217 S221 A222 L223K193-D219 IonicContact NZ-OD2 3.49Å; D217-D219 VanDerWaalsContact C-N 3.31Å; D217-D219 PolarHBondContact O-N 2.88Å; D217-D219 WeakPolarHBondContact OD1-CB 3.45Å; D217-D219 PolarHBondContact OD1-N 2.96Å; D219-S221 VanDerWaalsContact C-N 3.33Å; D219-A222 PolarHBondContact O-N 3.48Å; D219-L223 WeakPolarHBondContact O-CG 3.41Å; D219-L223 PolarHBondContact O-N 3.16Å
220A96.4Very high96.8Very high0 Ų064.1 Ų64.10%033%0.325CS..Hα-helixtrans-63.5-41.2178.300000111.5K189 L208 D217 L223 L224K189-A220 HydrophobicContact CD-CB 3.94Å; K189-A220 HydrophobicContact CG-CB 4.07Å; L208-A220 HydrophobicContact CD2-CB 4.17Å; D217-A220 HydrophobicContact CB-CB 4.04Å; D217-A220 PolarHBondContact O-N 3.42Å; D217-A220 PolarHBondContact OD1-N 3.03Å; A220-L223 PolarHBondContact O-N 3.12Å; A220-L224 WeakPolarHBondContact O-CB 3.44Å; A220-L224 PolarHBondContact O-N 3.17Å
221S97.6Very high96.6Very high15 Ų1562.2 Ų62.211%0.10531%0.313CS..Hα-helixtrans-64.1-43.1177.1177.60000112C212 D217 E218 D219 L224 K225C212-S221 PolarHBondContact SG-N 3.19Å; D217-S221 WeakPolarHBondContact O-CB 3.41Å; D217-S221 PolarHBondContact O-N 3.43Å; E218-S221 PolarHBondContact O-N 3.48Å; D219-S221 VanDerWaalsContact C-N 3.33Å; S221-L224 PolarHBondContact O-N 3.02Å; S221-K225 WeakPolarHBondContact O-CG 3.17Å; S221-K225 PolarHBondContact O-N 3.32Å; S221-K225 VanDerWaalsContact O-N 3.12Å
222A97.6Very high96.4Very high57 Ų5765 Ų6547%0.47133%0.327SS..Hα-helixtrans-62.5-48176.400000111.5E218 D219 L224 K225 E226E218-A222 WeakPolarHBondContact O-CB 3.38Å; E218-A222 PolarHBondContact O-N 3.23Å; D219-A222 PolarHBondContact O-N 3.48Å; A222-L224 VanDerWaalsContact C-N 3.32Å; A222-L224 PolarHBondContact O-N 3.22Å; A222-K225 PolarHBondContact O-N 3.49Å; A222-E226 PolarHBondContact O-N 3.15Å
223L96.7Very high96.3Very high36 Ų3668.6 Ų68.619%0.18834%0.34CS..Hα-helixtrans-63.4-37.9176.1-73.3170.7000112.3K193 L208 D219 A220 K225 E226 V227K193-L223 HydrophobicContact CD-CD1 3.97Å; K193-L223 HydrophobicContact CG-CD1 3.43Å; K193-L223 VanDerWaalsContact CG-CD1 3.43Å; L208-L223 HydrophobicContact CD1-CB 3.68Å; L208-L223 HydrophobicContact CD2-CB 4.29Å; L208-L223 HydrophobicContact CD2-CD1 4.49Å; D219-L223 WeakPolarHBondContact O-CG 3.41Å; D219-L223 PolarHBondContact O-N 3.16Å; A220-L223 PolarHBondContact O-N 3.12Å; L223-K225 VanDerWaalsContact C-N 3.31Å; L223-K225 PolarHBondContact O-N 3.44Å; L223-E226 WeakPolarHBondContact O-CB 3.41Å; L223-E226 PolarHBondContact O-N 2.87Å; L223-E226 VanDerWaalsContact O-N 3.11Å; L223-V227 WeakPolarHBondContact O-CG2 3.41Å; L223-V227 PolarHBondContact O-N 3.35Å
224L97.9Very high96Very high33 Ų3360.9 Ų60.917%0.17331%0.308CS..Hα-helixtrans-58.6-45.3176.6179.357.9000111A205 L208 A209 A220 S221 A222 E226 V227 Q228A205-L224 HydrophobicContact CB-CD1 4.28Å; A205-L224 WeakPolarHBondContact O-CD1 3.4Å; L208-L224 HydrophobicContact CB-CB 4.01Å; L208-L224 HydrophobicContact CB-CD1 4.13Å; A209-L224 HydrophobicContact CB-CD1 4.18Å; A209-L224 HydrophobicContact CB-CD2 4.05Å; A220-L224 WeakPolarHBondContact O-CB 3.44Å; A220-L224 PolarHBondContact O-N 3.17Å; S221-L224 PolarHBondContact O-N 3.02Å; A222-L224 VanDerWaalsContact C-N 3.32Å; A222-L224 PolarHBondContact O-N 3.22Å; L224-E226 PolarHBondContact O-N 2.77Å; L224-V227 HydrophobicContact CD1-CG2 4.35Å; L224-V227 PolarHBondContact O-N 2.92Å; L224-Q228 WeakPolarHBondContact O-CB 3.37Å; L224-Q228 PolarHBondContact O-N 3.35Å
225K97.3Very high95.7Very high148 Ų14860 Ų6064%0.64330%0.302SS*.Hα-helixtrans-60.2-32.2177.2-70.4170.1-175.9169.70112.5S221 A222 L223 P229S221-K225 WeakPolarHBondContact O-CG 3.17Å; S221-K225 PolarHBondContact O-N 3.32Å; S221-K225 VanDerWaalsContact O-N 3.12Å; A222-K225 PolarHBondContact O-N 3.49Å; L223-K225 VanDerWaalsContact C-N 3.31Å; L223-K225 PolarHBondContact O-N 3.44Å; K225-P229 WeakPolarHBondContact O-CD 3.3Å
226E95.2Very high95.5Very high76 Ų7661.3 Ų61.336%0.35531%0.305SS..Hα-helixtrans-74.4-46.7177.1-167-158.5138.500112.4R196 A222 L223 L224 P229R196-E226 IonicContact CZ-OE1 2.72Å; R196-E226 IonicContact NE-OE1 3.03Å; R196-E226 PolarHBondContact NE-OE1 3.42Å; R196-E226 IonicContact NE-OE2 3.46Å; R196-E226 IonicContact NH2-OE1 2.71Å; R196-E226 PolarHBondContact NH2-OE1 2.91Å; A222-E226 PolarHBondContact O-N 3.15Å; L223-E226 WeakPolarHBondContact O-CB 3.41Å; L223-E226 PolarHBondContact O-N 2.87Å; L223-E226 VanDerWaalsContact O-N 3.11Å; L224-E226 PolarHBondContact O-N 2.77Å; E226-P229 WeakPolarHBondContact O-CD 3.15Å; E226-P229 WeakPolarHBondContact O-CG 3.34Å
227V96.8Very high95.3Very high0 Ų057.6 Ų57.60%029%0.292CS..Hα-helixtrans-80.3-28.9-175.2-59.80000113.9R196 W201 A204 A205 L208 L223 L224 K230 A231R196-V227 HydrophobicContact CB-CG1 4.28Å; R196-V227 HydrophobicContact CG-CG1 4.3Å; W201-V227 HydrophobicContact CE3-CB 4.32Å; W201-V227 HydrophobicContact CE3-CG1 3.99Å; W201-V227 HydrophobicContact CZ3-CG1 4.23Å; A204-V227 HydrophobicContact CB-CB 4.38Å; A204-V227 HydrophobicContact CB-CG1 4.17Å; A204-V227 HydrophobicContact CB-CG2 4.34Å; A205-V227 HydrophobicContact CB-CG2 3.81Å; L208-V227 HydrophobicContact CD1-CG2 3.84Å; L223-V227 WeakPolarHBondContact O-CG2 3.41Å; L223-V227 PolarHBondContact O-N 3.35Å; L224-V227 HydrophobicContact CD1-CG2 4.35Å; L224-V227 PolarHBondContact O-N 2.92Å; V227-K230 PolarHBondContact O-N 3.22Å; V227-K230 VanDerWaalsContact O-N 3.16Å; V227-A231 PolarHBondContact O-N 3.49Å
228Q96.6Very high95Very high64 Ų6461.3 Ų61.330%0.29930%0.303SS..Hα-helixtrans-56.4-47.7-175.4-168.967.459.800114L224 K230 A231 N232L224-Q228 WeakPolarHBondContact O-CB 3.37Å; L224-Q228 PolarHBondContact O-N 3.35Å; Q228-K230 VanDerWaalsContact C-N 3.32Å; Q228-K230 PolarHBondContact O-N 3.47Å; Q228-A231 PolarHBondContact O-N 2.88Å; Q228-N232 PolarHBondContact NE2-OD1 3.12Å; Q228-N232 WeakPolarHBondContact O-CB 3.34Å; Q228-N232 PolarHBondContact O-N 2.91Å; Q228-N232 PolarHBondContact O-OD1 2.98Å
229P95.9Very high94.8Very high77 Ų7763.1 Ų63.150%0.531%0.305SS..Hα-helixtrans-63.9-37.3177.724.1-34.2000112.4K225 E226 N232 K233K225-P229 WeakPolarHBondContact O-CD 3.3Å; E226-P229 WeakPolarHBondContact O-CD 3.15Å; E226-P229 WeakPolarHBondContact O-CG 3.34Å; P229-N232 PolarHBondContact O-N 3.32Å; P229-K233 PolarHBondContact O-N 3.46Å
230K95.3Very high94.7Very high29 Ų2963.7 Ų63.713%0.12630%0.303CS..Hα-helixtrans-64.2-46.4176.5-62.9-176.9179.1-168.90110.7I85 D86 W201 V227 Q228 N232 K233 I234I85-K230 HydrophobicContact CG2-CB 4.46Å; I85-K230 HydrophobicContact CG2-CD 4.19Å; I85-K230 HydrophobicContact CG2-CG 4.35Å; D86-K230 WeakPolarHBondContact O-CE 3.31Å; D86-K230 PolarHBondContact O-NZ 2.75Å; D86-K230 IonicContact OD2-NZ 3.45Å; D86-K230 PolarHBondContact OD2-NZ 3.4Å; W201-K230 HydrophobicContact CB-CB 4.12Å; W201-K230 HydrophobicContact CD2-CB 3.9Å; W201-K230 HydrophobicContact CD2-CD 3.82Å; W201-K230 HydrophobicContact CD2-CG 4.48Å; W201-K230 HydrophobicContact CE3-CB 4.07Å; W201-K230 HydrophobicContact CE3-CD 3.58Å; W201-K230 HydrophobicContact CE3-CG 4.41Å; W201-K230 HydrophobicContact CG-CB 3.9Å; W201-K230 HydrophobicContact CH2-CD 3.63Å; W201-K230 HydrophobicContact CZ2-CD 3.88Å; W201-K230 HydrophobicContact CZ3-CD 3.44Å; W201-K230 VanDerWaalsContact CZ3-CD 3.44Å; V227-K230 PolarHBondContact O-N 3.22Å; V227-K230 VanDerWaalsContact O-N 3.16Å; Q228-K230 VanDerWaalsContact C-N 3.32Å; Q228-K230 PolarHBondContact O-N 3.47Å; K230-N232 PolarHBondContact O-N 2.64Å; K230-K233 PolarHBondContact O-N 3.21Å; K230-I234 WeakPolarHBondContact O-CG1 3.43Å; K230-I234 PolarHBondContact O-N 3.06Å
231A95.3Very high94.2Very high1 Ų169.5 Ų69.51%0.00833%0.326CS..Hα-helixtrans-59.4-45174.700000112.5W201 E202 A205 V227 Q228 K233 I234 M235W201-A231 HydrophobicContact CB-CB 4.38Å; E202-A231 HydrophobicContact CG-CB 4.41Å; A205-A231 HydrophobicContact CB-CB 3.84Å; V227-A231 PolarHBondContact O-N 3.49Å; Q228-A231 PolarHBondContact O-N 2.88Å; A231-K233 PolarHBondContact O-N 3.25Å; A231-I234 PolarHBondContact O-N 3.01Å; A231-M235 HydrophobicContact CB-CE 4.47Å; A231-M235 WeakPolarHBondContact O-CG 3.34Å; A231-M235 PolarHBondContact O-N 3.48Å
232N94.8Very high93.9Very high60 Ų6073.3 Ų73.332%0.32134%0.342SS..Hα-helixtrans-61.8-43.4179-69.8-7.2000111.8Q228 P229 K230 I234 M235 E236Q228-N232 PolarHBondContact NE2-OD1 3.12Å; Q228-N232 WeakPolarHBondContact O-CB 3.34Å; Q228-N232 PolarHBondContact O-N 2.91Å; Q228-N232 PolarHBondContact O-OD1 2.98Å; P229-N232 PolarHBondContact O-N 3.32Å; K230-N232 PolarHBondContact O-N 2.64Å; N232-I234 VanDerWaalsContact C-N 3.31Å; N232-I234 PolarHBondContact O-N 2.89Å; N232-M235 PolarHBondContact O-N 3.46Å; N232-M235 VanDerWaalsContact OD1-CE 3.25Å; N232-M235 WeakPolarHBondContact OD1-CE 3.5Å; N232-E236 WeakPolarHBondContact O-CB 3.43Å; N232-E236 VanDerWaalsContact O-CG 3.3Å; N232-E236 WeakPolarHBondContact O-CG 3.35Å; N232-E236 PolarHBondContact O-N 3.03Å
233K94.2Very high93.6Very high102 Ų10277.7 Ų77.744%0.44335%0.346SS..Hα-helixtrans-59-42.1177.3-169.1177.9-177-177.70111.9I83 E84 P229 K230 A231 H237I83-K233 HydrophobicContact CG2-CD 4.28Å; I83-K233 HydrophobicContact CG2-CG 4.3Å; E84-K233 PolarHBondContact O-NZ 2.85Å; P229-K233 PolarHBondContact O-N 3.46Å; K230-K233 PolarHBondContact O-N 3.21Å; A231-K233 PolarHBondContact O-N 3.25Å; K233-H237 WeakPolarHBondContact O-CB 3.37Å; K233-H237 PolarHBondContact O-N 3.29Å
234I92.1Very high93.4Very high27 Ų2779.9 Ų79.914%0.13835%0.354CS..Hα-helixtrans-64.9-48.2176.6-63.2166.3000111I85 W201 E202 K230 A231 N232 E236 H237 R238I85-I234 HydrophobicContact CD1-CD1 3.73Å; I85-I234 HydrophobicContact CD1-CG1 3.38Å; W201-I234 HydrophobicContact CB-CD1 3.86Å; W201-I234 VanDerWaalsContact CD1-CD1 3.49Å; W201-I234 HydrophobicContact CG-CD1 4.01Å; E202-I234 HydrophobicContact CG-CB 4.48Å; E202-I234 HydrophobicContact CG-CG2 4.34Å; E202-I234 WeakPolarHBondContact OE1-CG2 3.35Å; K230-I234 WeakPolarHBondContact O-CG1 3.43Å; K230-I234 PolarHBondContact O-N 3.06Å; A231-I234 PolarHBondContact O-N 3.01Å; N232-I234 VanDerWaalsContact C-N 3.31Å; N232-I234 PolarHBondContact O-N 2.89Å; I234-E236 VanDerWaalsContact C-N 3.35Å; I234-E236 PolarHBondContact O-N 2.92Å; I234-H237 PolarHBondContact O-N 3.23Å; I234-R238 WeakPolarHBondContact O-CB 3.31Å; I234-R238 PolarHBondContact O-N 2.75Å
235M91.2Very high93.1Very high56 Ų5685.5 Ų85.528%0.27637%0.373SS..Hα-helixtrans-61.8-42.7179.8-73.3-172.1-71.200111.9E202 A231 N232 R238 R239E202-M235 HydrophobicContact CG-CG 4.07Å; E202-M235 WeakPolarHBondContact OE2-CG 3.18Å; A231-M235 HydrophobicContact CB-CE 4.47Å; A231-M235 WeakPolarHBondContact O-CG 3.34Å; A231-M235 PolarHBondContact O-N 3.48Å; N232-M235 PolarHBondContact O-N 3.46Å; N232-M235 VanDerWaalsContact OD1-CE 3.25Å; N232-M235 WeakPolarHBondContact OD1-CE 3.5Å; M235-R238 PolarHBondContact O-N 2.71Å; M235-R239 WeakPolarHBondContact O-CB 3.48Å; M235-R239 VanDerWaalsContact O-CG 3.25Å; M235-R239 WeakPolarHBondContact O-CG 3.49Å; M235-R239 PolarHBondContact O-N 2.87Å
236E92.3Very high92.9Very high128 Ų12883.9 Ų83.960%0.59837%0.368SS*.Hα-helixtrans-64.8-42.9177.7-75.2175.6-174.100112N232 I234 R239 K240N232-E236 WeakPolarHBondContact O-CB 3.43Å; N232-E236 VanDerWaalsContact O-CG 3.3Å; N232-E236 WeakPolarHBondContact O-CG 3.35Å; N232-E236 PolarHBondContact O-N 3.03Å; I234-E236 VanDerWaalsContact C-N 3.35Å; I234-E236 PolarHBondContact O-N 2.92Å; E236-R239 PolarHBondContact O-N 3.4Å; E236-K240 WeakPolarHBondContact O-CB 3.45Å; E236-K240 PolarHBondContact O-N 3.23Å
237H90.9Very high92.8Very high49 Ų4986.4 Ų86.423%0.22738%0.38CS..Hα-helixtrans-62-48174.7-177.8-86.3000111.5I83 K233 I234 R239 K240 Y241I83-H237 HydrophobicContact CD1-CB 3.34Å; I83-H237 VanDerWaalsContact CD1-ND1 3.33Å; I83-H237 WeakPolarHBondContact CD1-ND1 3.29Å; I83-H237 HydrophobicContact CG1-CB 3.86Å; I83-H237 WeakPolarHBondContact CG1-CD2 3.44Å; K233-H237 WeakPolarHBondContact O-CB 3.37Å; K233-H237 PolarHBondContact O-N 3.29Å; I234-H237 PolarHBondContact O-N 3.23Å; H237-R239 VanDerWaalsContact C-N 3.33Å; H237-R239 PolarHBondContact O-N 3.43Å; H237-K240 WeakPolarHBondContact O-CB 3.45Å; H237-K240 PolarHBondContact O-N 3.42Å; H237-K240 VanDerWaalsContact O-N 3.12Å; H237-Y241 WeakPolarHBondContact O-CB 3.49Å; H237-Y241 PolarHBondContact O-N 3.44Å
238R90.4Very high92.7Very high117 Ų11791.1 Ų91.144%0.44240%0.4SS..Hα-helixtrans-57.2-46.5177.2-173.3-177-66.4143.27.7111.2E202 I234 M235 K240 Y241 E242E202-R238 IonicContact OE1-CZ 3.5Å; E202-R238 VanDerWaalsContact OE1-CZ 3.29Å; E202-R238 IonicContact OE1-NH1 2.7Å; E202-R238 PolarHBondContact OE1-NH1 3.49Å; E202-R238 IonicContact OE1-NH2 3.49Å; E202-R238 PolarHBondContact OE1-NH2 3.47Å; E202-R238 IonicContact OE2-CZ 2.72Å; E202-R238 IonicContact OE2-NH1 3.52Å; E202-R238 PolarHBondContact OE2-NH1 3.13Å; E202-R238 IonicContact OE2-NH2 3.52Å; I234-R238 WeakPolarHBondContact O-CB 3.31Å; I234-R238 PolarHBondContact O-N 2.75Å; M235-R238 PolarHBondContact O-N 2.71Å; R238-K240 VanDerWaalsContact C-N 3.34Å; R238-K240 PolarHBondContact O-N 3.31Å; R238-Y241 WeakPolarHBondContact O-CB 3.34Å; R238-Y241 PolarHBondContact O-N 2.91Å; R238-E242 HydrophobicContact CG-CG 4.48Å; R238-E242 WeakPolarHBondContact CG-OE1 3.45Å; R238-E242 WeakPolarHBondContact O-CB 3.46Å; R238-E242 WeakPolarHBondContact O-CG 3.34Å; R238-E242 PolarHBondContact O-N 2.99Å
239R91.5Very high92.6Very high159 Ų15992.7 Ų92.760%0.641%0.407SS*.Hα-helixtrans-63.3-36.1176.1-73.4173.1-177.9-177.72.5113.1M235 E236 H237 R243M235-R239 WeakPolarHBondContact O-CB 3.48Å; M235-R239 VanDerWaalsContact O-CG 3.25Å; M235-R239 WeakPolarHBondContact O-CG 3.49Å; M235-R239 PolarHBondContact O-N 2.87Å; E236-R239 PolarHBondContact O-N 3.4Å; H237-R239 VanDerWaalsContact C-N 3.33Å; H237-R239 PolarHBondContact O-N 3.43Å; R239-R243 WeakPolarHBondContact O-CB 3.25Å; R239-R243 VanDerWaalsContact O-CG 3.31Å; R239-R243 WeakPolarHBondContact O-CG 3.41Å; R239-R243 PolarHBondContact O-N 3.45Å; R239-R243 VanDerWaalsContact O-N 3.13Å; R239-R243 PolarHBondContact O-NE 2.94Å
240K91.9Very high92.6Very high104 Ų10493.6 Ų93.645%0.45241%0.407SS..Hα-helixtrans-67-43.5175-176.1-174.8177.5-1720110.6E236 H237 R238 R243 K244E236-K240 WeakPolarHBondContact O-CB 3.45Å; E236-K240 PolarHBondContact O-N 3.23Å; H237-K240 WeakPolarHBondContact O-CB 3.45Å; H237-K240 PolarHBondContact O-N 3.42Å; H237-K240 VanDerWaalsContact O-N 3.12Å; R238-K240 VanDerWaalsContact C-N 3.34Å; R238-K240 PolarHBondContact O-N 3.31Å; K240-R243 PolarHBondContact O-N 3.22Å; K240-K244 WeakPolarHBondContact O-CG 3.42Å; K240-K244 PolarHBondContact O-N 3.38Å
241Y87Confident92.7Very high122 Ų12298.2 Ų98.248%0.47843%0.427SS..Hα-helixtrans-63-48.8178-169.7-88.8000111.6E80 H237 R238 R243 K244 R245E80-Y241 WeakPolarHBondContact OE2-CD2 3.23Å; E80-Y241 WeakPolarHBondContact OE2-CE2 3.38Å; H237-Y241 WeakPolarHBondContact O-CB 3.49Å; H237-Y241 PolarHBondContact O-N 3.44Å; R238-Y241 WeakPolarHBondContact O-CB 3.34Å; R238-Y241 PolarHBondContact O-N 2.91Å; Y241-R243 PolarHBondContact O-N 2.89Å; Y241-K244 PolarHBondContact O-N 3.25Å; Y241-R245 WeakPolarHBondContact O-CB 3.4Å; Y241-R245 PolarHBondContact O-N 3.47Å
242E90.3Very high92.7Very high94 Ų94101.6 Ų101.644%0.43944%0.443SS..Hα-helixtrans-58-47176.9-74.5170-178.600111.6R238 K244 R245 E246R238-E242 HydrophobicContact CG-CG 4.48Å; R238-E242 WeakPolarHBondContact CG-OE1 3.45Å; R238-E242 WeakPolarHBondContact O-CB 3.46Å; R238-E242 WeakPolarHBondContact O-CG 3.34Å; R238-E242 PolarHBondContact O-N 2.99Å; E242-K244 PolarHBondContact O-N 3.33Å; E242-R245 PolarHBondContact O-N 3.37Å; E242-E246 WeakPolarHBondContact O-CG 3.25Å; E242-E246 PolarHBondContact O-N 3.39Å
243R92.9Very high92.8Very high150 Ų150105.4 Ų105.457%0.56646%0.457SS*.Hα-helixtrans-59.1-47.7176.1-77.8-173.6-65.1163.6-1.3112.9R239 K240 Y241 R245 E246 E247R239-R243 WeakPolarHBondContact O-CB 3.25Å; R239-R243 VanDerWaalsContact O-CG 3.31Å; R239-R243 WeakPolarHBondContact O-CG 3.41Å; R239-R243 PolarHBondContact O-N 3.45Å; R239-R243 VanDerWaalsContact O-N 3.13Å; R239-R243 PolarHBondContact O-NE 2.94Å; K240-R243 PolarHBondContact O-N 3.22Å; Y241-R243 PolarHBondContact O-N 2.89Å; R243-R245 VanDerWaalsContact C-N 3.28Å; R243-R245 PolarHBondContact O-N 2.89Å; R243-E246 PolarHBondContact O-N 2.91Å; R243-E247 WeakPolarHBondContact O-CB 3.3Å; R243-E247 VanDerWaalsContact O-CG 3.29Å; R243-E247 WeakPolarHBondContact O-CG 3.39Å; R243-E247 PolarHBondContact O-N 3.47Å
244K91.6Very high92.8Very high82 Ų82106.6 Ų106.636%0.35746%0.464SS..Hα-helixtrans-59.4-41.8177.7-79.6177.5163.9-171.30111.8E80 K240 Y241 E242 E247 K248E80-K244 IonicContact OE1-NZ 2.6Å; E80-K244 PolarHBondContact OE1-NZ 3.36Å; E80-K244 IonicContact OE2-NZ 3.83Å; K240-K244 WeakPolarHBondContact O-CG 3.42Å; K240-K244 PolarHBondContact O-N 3.38Å; Y241-K244 PolarHBondContact O-N 3.25Å; E242-K244 PolarHBondContact O-N 3.33Å; K244-E247 PolarHBondContact O-N 3.29Å; K244-K248 WeakPolarHBondContact O-CB 3.44Å; K244-K248 PolarHBondContact O-N 3.44Å
245R91Very high93Very high151 Ų151110.5 Ų110.557%0.5748%0.481SS*.Hα-helixtrans-63.8-47.4177.9-178.6-175.8164.5-179.83.1111.1Y241 E242 R243 E247 K248 E249Y241-R245 WeakPolarHBondContact O-CB 3.4Å; Y241-R245 PolarHBondContact O-N 3.47Å; E242-R245 PolarHBondContact O-N 3.37Å; R243-R245 VanDerWaalsContact C-N 3.28Å; R243-R245 PolarHBondContact O-N 2.89Å; R245-E247 VanDerWaalsContact C-N 3.35Å; R245-E247 PolarHBondContact O-N 2.64Å; R245-K248 PolarHBondContact O-N 2.85Å; R245-E249 IonicContact CZ-OE1 3.93Å; R245-E249 IonicContact NE-OE1 2.83Å; R245-E249 PolarHBondContact NE-OE1 3.27Å; R245-E249 IonicContact NH2-OE1 2.67Å; R245-E249 PolarHBondContact NH2-OE1 3.34Å; R245-E249 WeakPolarHBondContact O-CG 3.42Å; R245-E249 PolarHBondContact O-N 2.9Å
246E93.6Very high93.2Very high114 Ų114116.3 Ų116.353%0.53350%0.5SS..Hα-helixtrans-61.6-42.1176.6-72.2176.3175.700111.8E242 R243 K248 E249 I250E242-E246 WeakPolarHBondContact O-CG 3.25Å; E242-E246 PolarHBondContact O-N 3.39Å; R243-E246 PolarHBondContact O-N 2.91Å; E246-K248 VanDerWaalsContact C-N 3.34Å; E246-K248 PolarHBondContact O-N 3.16Å; E246-E249 PolarHBondContact O-N 2.91Å; E246-I250 WeakPolarHBondContact O-CB 3.21Å; E246-I250 VanDerWaalsContact O-CG1 3.23Å; E246-I250 WeakPolarHBondContact O-CG1 3.45Å; E246-I250 PolarHBondContact O-N 3.3Å
247E93.9Very high93.4Very high128 Ų128115.2 Ų115.260%0.59850%0.497SS*.Hα-helixtrans-60.2-42.8174.4-75.5172.5-172.100111.7R243 K244 R245 I250 K251R243-E247 WeakPolarHBondContact O-CB 3.3Å; R243-E247 VanDerWaalsContact O-CG 3.29Å; R243-E247 WeakPolarHBondContact O-CG 3.39Å; R243-E247 PolarHBondContact O-N 3.47Å; K244-E247 PolarHBondContact O-N 3.29Å; R245-E247 VanDerWaalsContact C-N 3.35Å; R245-E247 PolarHBondContact O-N 2.64Å; E247-I250 PolarHBondContact O-N 3.27Å; E247-K251 VanDerWaalsContact O-CB 3.32Å; E247-K251 WeakPolarHBondContact O-CB 3.23Å; E247-K251 PolarHBondContact O-N 3.39Å
248K94.1Very high93.6Very high99 Ų99119 Ų11943%0.4351%0.513SS..Hα-helixtrans-62.5-47.8175-171.8177-180176.20111.2D75 K244 R245 E246 I250 K251 E252D75-K248 IonicContact OD2-NZ 3.82Å; K244-K248 WeakPolarHBondContact O-CB 3.44Å; K244-K248 PolarHBondContact O-N 3.44Å; R245-K248 PolarHBondContact O-N 2.85Å; E246-K248 VanDerWaalsContact C-N 3.34Å; E246-K248 PolarHBondContact O-N 3.16Å; K248-I250 VanDerWaalsContact C-N 3.35Å; K248-I250 PolarHBondContact O-N 3.36Å; K248-K251 PolarHBondContact O-N 2.89Å; K248-E252 WeakPolarHBondContact CE-OE1 3.41Å; K248-E252 WeakPolarHBondContact O-CG 3.42Å; K248-E252 PolarHBondContact O-N 3.44Å
249E95.3Very high93.9Very high97 Ų97120.5 Ų120.545%0.45352%0.523SS..Hα-helixtrans-61.4-40.5178-72.2178.4-169.200112.1R245 E246 K253R245-E249 IonicContact CZ-OE1 3.93Å; R245-E249 IonicContact NE-OE1 2.83Å; R245-E249 PolarHBondContact NE-OE1 3.27Å; R245-E249 IonicContact NH2-OE1 2.67Å; R245-E249 PolarHBondContact NH2-OE1 3.34Å; R245-E249 WeakPolarHBondContact O-CG 3.42Å; R245-E249 PolarHBondContact O-N 2.9Å; E246-E249 PolarHBondContact O-N 2.91Å; E249-K253 VanDerWaalsContact O-CB 3.31Å; E249-K253 WeakPolarHBondContact O-CB 3.44Å; E249-K253 PolarHBondContact O-N 3.31Å
250I95.8Very high94.1Very high96 Ų96115.6 Ų115.649%0.49252%0.516SS..Hα-helixtrans-65.4-45.7175.4-70.4166.1000110.7E246 E247 K248 K253 Q254E246-I250 WeakPolarHBondContact O-CB 3.21Å; E246-I250 VanDerWaalsContact O-CG1 3.23Å; E246-I250 WeakPolarHBondContact O-CG1 3.45Å; E246-I250 PolarHBondContact O-N 3.3Å; E247-I250 PolarHBondContact O-N 3.27Å; K248-I250 VanDerWaalsContact C-N 3.35Å; K248-I250 PolarHBondContact O-N 3.36Å; I250-K253 PolarHBondContact O-N 3.26Å; I250-Q254 HydrophobicContact CG2-CG 4.38Å; I250-Q254 WeakPolarHBondContact O-CG 3.31Å; I250-Q254 PolarHBondContact O-N 3.46Å
251K95.9Very high94.2Very high126 Ų126120.2 Ų120.255%0.54853%0.531SS..Hα-helixtrans-61.6-47.7179.5-174.7-176.4174.8-167.70111.2E247 K248 K253 Q254 E255E247-K251 VanDerWaalsContact O-CB 3.32Å; E247-K251 WeakPolarHBondContact O-CB 3.23Å; E247-K251 PolarHBondContact O-N 3.39Å; K248-K251 PolarHBondContact O-N 2.89Å; K251-K253 VanDerWaalsContact C-N 3.31Å; K251-K253 PolarHBondContact O-N 3.17Å; K251-Q254 WeakPolarHBondContact O-CB 3.18Å; K251-Q254 PolarHBondContact O-N 3.32Å; K251-E255 VanDerWaalsContact CE-OE1 3.23Å; K251-E255 WeakPolarHBondContact CE-OE1 3.15Å; K251-E255 WeakPolarHBondContact O-CG 3.38Å; K251-E255 PolarHBondContact O-N 2.94Å
252E96.3Very high94.7Very high73 Ų73119.8 Ų119.834%0.34153%0.533SS..Hα-helixtrans-59.9-41.3175.9-73.4178.7-162.900111.9K248 E255 R256K248-E252 WeakPolarHBondContact CE-OE1 3.41Å; K248-E252 WeakPolarHBondContact O-CG 3.42Å; K248-E252 PolarHBondContact O-N 3.44Å; E252-E255 PolarHBondContact O-N 3.3Å; E252-R256 VanDerWaalsContact O-CG 3.32Å; E252-R256 WeakPolarHBondContact O-CG 3.48Å; E252-R256 PolarHBondContact O-N 2.99Å
253K96Very high94.9Very high140 Ų140121.7 Ų121.761%0.60954%0.542SS*.Hα-helixtrans-64-42.3175.8-173.8176.7-179.5179.20111.9E249 I250 K251 R256 I257E249-K253 VanDerWaalsContact O-CB 3.31Å; E249-K253 WeakPolarHBondContact O-CB 3.44Å; E249-K253 PolarHBondContact O-N 3.31Å; I250-K253 PolarHBondContact O-N 3.26Å; K251-K253 VanDerWaalsContact C-N 3.31Å; K251-K253 PolarHBondContact O-N 3.17Å; K253-R256 PolarHBondContact O-N 3.29Å; K253-I257 HydrophobicContact CG-CD1 4.09Å; K253-I257 VanDerWaalsContact O-CG1 3.29Å; K253-I257 WeakPolarHBondContact O-CG1 3.5Å; K253-I257 PolarHBondContact O-N 3.33Å
254Q94.3Very high94.9Very high127 Ų127120.2 Ų120.259%0.59354%0.541SS*.Hα-helixtrans-62.7-42.5176.1-74.5177.7-2.200111.6I250 K251 I257 K258I250-Q254 HydrophobicContact CG2-CG 4.38Å; I250-Q254 WeakPolarHBondContact O-CG 3.31Å; I250-Q254 PolarHBondContact O-N 3.46Å; K251-Q254 WeakPolarHBondContact O-CB 3.18Å; K251-Q254 PolarHBondContact O-N 3.32Å; Q254-I257 PolarHBondContact O-N 3.18Å; Q254-K258 WeakPolarHBondContact O-CB 3.29Å; Q254-K258 PolarHBondContact O-N 3.23Å
255E96.4Very high95.1Very high108 Ų108118.2 Ų118.251%0.50554%0.54SS..Hα-helixtrans-64.8-41.6176.8-72.8176.9-175.200112.1K251 E252 K258 K259K251-E255 VanDerWaalsContact CE-OE1 3.23Å; K251-E255 WeakPolarHBondContact CE-OE1 3.15Å; K251-E255 WeakPolarHBondContact O-CG 3.38Å; K251-E255 PolarHBondContact O-N 2.94Å; E252-E255 PolarHBondContact O-N 3.3Å; E255-K258 PolarHBondContact O-N 3.5Å; E255-K259 WeakPolarHBondContact O-CB 3.48Å; E255-K259 PolarHBondContact O-N 3.05Å
256R96.5Very high95.3Very high179 Ų179118.8 Ų118.868%0.67554%0.542SS*.Hα-helixtrans-61.1-45.3173.9-72.5179.2-165.2-155.76.9112.2E252 K253 K259 A260E252-R256 VanDerWaalsContact O-CG 3.32Å; E252-R256 WeakPolarHBondContact O-CG 3.48Å; E252-R256 PolarHBondContact O-N 2.99Å; K253-R256 PolarHBondContact O-N 3.29Å; R256-K259 PolarHBondContact O-N 2.96Å; R256-A260 WeakPolarHBondContact O-CB 3.41Å; R256-A260 PolarHBondContact O-N 3.21Å
257I95.4Very high95.2Very high104 Ų104115.9 Ų115.953%0.53354%0.538SS..Hα-helixtrans-63.4-43.6177.3-68.9166.6000110.5K253 Q254 A260 R261K253-I257 HydrophobicContact CG-CD1 4.09Å; K253-I257 VanDerWaalsContact O-CG1 3.29Å; K253-I257 WeakPolarHBondContact O-CG1 3.5Å; K253-I257 PolarHBondContact O-N 3.33Å; Q254-I257 PolarHBondContact O-N 3.18Å; I257-A260 PolarHBondContact O-N 2.79Å; I257-R261 WeakPolarHBondContact O-CB 3.47Å; I257-R261 PolarHBondContact O-N 2.81Å
258K96.3Very high95.1Very high130 Ų130114.3 Ų114.357%0.56553%0.53SS*.Hα-helixtrans-60.6-48.3177.3-177.6-179.9172-174.50111.3Q254 E255 A260 R261 E262Q254-K258 WeakPolarHBondContact O-CB 3.29Å; Q254-K258 PolarHBondContact O-N 3.23Å; E255-K258 PolarHBondContact O-N 3.5Å; K258-A260 PolarHBondContact O-N 3.02Å; K258-R261 PolarHBondContact O-N 2.71Å; K258-E262 WeakPolarHBondContact CE-OE1 3.4Å; K258-E262 WeakPolarHBondContact O-CG 3.5Å; K258-E262 PolarHBondContact O-N 3Å
259K96.8Very high95Very high148 Ų148117.5 Ų117.564%0.64354%0.54SS*.Hα-helixtrans-61.3-44.7178.3-172.2177.2178.4-178.50112.1E255 R256 R261 E262 E263E255-K259 WeakPolarHBondContact O-CB 3.48Å; E255-K259 PolarHBondContact O-N 3.05Å; R256-K259 PolarHBondContact O-N 2.96Å; K259-R261 VanDerWaalsContact C-N 3.32Å; K259-R261 PolarHBondContact O-N 3.07Å; K259-E262 PolarHBondContact O-N 3.19Å; K259-E263 WeakPolarHBondContact O-CB 3.39Å; K259-E263 PolarHBondContact O-N 2.9Å
260A95.1Very high94.8Very high55 Ų55116.9 Ų116.946%0.45554%0.539SS..Hα-helixtrans-61.6-39.6176.100000112.1R256 I257 K258 H264R256-A260 WeakPolarHBondContact O-CB 3.41Å; R256-A260 PolarHBondContact O-N 3.21Å; I257-A260 PolarHBondContact O-N 2.79Å; K258-A260 PolarHBondContact O-N 3.02Å; A260-H264 VanDerWaalsContact O-CB 3.31Å; A260-H264 WeakPolarHBondContact O-CB 3.17Å; A260-H264 PolarHBondContact O-N 2.97Å
261R94.5Very high94.3Very high202 Ų202118.9 Ų118.976%0.76255%0.547SS*.Hα-helixtrans-66.3-41.9175.8-173.3178.6-178.8179.80.8112.2I257 K258 K259 A265I257-R261 WeakPolarHBondContact O-CB 3.47Å; I257-R261 PolarHBondContact O-N 2.81Å; K258-R261 PolarHBondContact O-N 2.71Å; K259-R261 VanDerWaalsContact C-N 3.32Å; K259-R261 PolarHBondContact O-N 3.07Å; R261-A265 WeakPolarHBondContact O-CB 3.34Å; R261-A265 PolarHBondContact O-N 3.35Å
262E95.9Very high93.9Very high113 Ų113118.3 Ų118.353%0.52855%0.546SS..Hα-helixtrans-65.5-41.8176.8-74.3175-17400111.9K258 K259 A265 R266K258-E262 WeakPolarHBondContact CE-OE1 3.4Å; K258-E262 WeakPolarHBondContact O-CG 3.5Å; K258-E262 PolarHBondContact O-N 3Å; K259-E262 PolarHBondContact O-N 3.19Å; E262-A265 PolarHBondContact O-N 3.43Å; E262-R266 WeakPolarHBondContact O-CB 3.07Å; E262-R266 PolarHBondContact O-N 2.85Å
263E94.6Very high93.4Very high134 Ų134117.7 Ų117.763%0.62655%0.554SS**Hα-helixtrans-63.8-46.4175.5-175173.3-174.200111.6K259 A265 R266 A267K259-E263 WeakPolarHBondContact O-CB 3.39Å; K259-E263 PolarHBondContact O-N 2.9Å; E263-A265 PolarHBondContact O-N 3.27Å; E263-R266 WeakPolarHBondContact O-CB 3.32Å; E263-R266 PolarHBondContact O-N 2.95Å; E263-A267 WeakPolarHBondContact O-CB 3.47Å; E263-A267 PolarHBondContact O-N 3.43Å
264H93.7Very high92.7Very high118 Ų118120.9 Ų120.955%0.54656%0.562SS.*Hα-helixtrans-60.3-44.1175.1-174.2-91000112A260 R266 A267 Q268A260-H264 VanDerWaalsContact O-CB 3.31Å; A260-H264 WeakPolarHBondContact O-CB 3.17Å; A260-H264 PolarHBondContact O-N 2.97Å; H264-R266 VanDerWaalsContact C-N 3.31Å; H264-R266 PolarHBondContact O-N 3.4Å; H264-A267 PolarHBondContact O-N 2.95Å; H264-Q268 PolarHBondContact CE1-NE2 3.35Å; H264-Q268 WeakPolarHBondContact O-CG 3.39Å; H264-Q268 PolarHBondContact O-N 3.45Å
265A94.8Very high91.6Very high40 Ų40122.1 Ų122.133%0.33157%0.568SS.*Hα-helixtrans-66.4-31.3176.300000112.9R261 E262 E263 R269R261-A265 WeakPolarHBondContact O-CB 3.34Å; R261-A265 PolarHBondContact O-N 3.35Å; E262-A265 PolarHBondContact O-N 3.43Å; E263-A265 PolarHBondContact O-N 3.27Å; A265-R269 WeakPolarHBondContact O-CG 3.33Å; A265-R269 PolarHBondContact O-N 3.45Å
266R95.3Very high89.9Confident163 Ų163126 Ų12662%0.61558%0.583SS**Hα-helixtrans-70.4-46173.2-170.9179.4-1741743.6111.2E262 E263 H264 Q268 R269 D270E262-R266 WeakPolarHBondContact O-CB 3.07Å; E262-R266 PolarHBondContact O-N 2.85Å; E263-R266 WeakPolarHBondContact O-CB 3.32Å; E263-R266 PolarHBondContact O-N 2.95Å; H264-R266 VanDerWaalsContact C-N 3.31Å; H264-R266 PolarHBondContact O-N 3.4Å; R266-Q268 VanDerWaalsContact C-N 3.3Å; R266-Q268 PolarHBondContact O-N 2.89Å; R266-R269 PolarHBondContact O-N 2.96Å; R266-D270 PolarHBondContact O-N 3.27Å
267A92.5Very high87.8Confident53 Ų53120.6 Ų120.644%0.43858%0.583SS.*Hα-helixtrans-58-43176.300000111.7E263 H264 D270 E271E263-A267 WeakPolarHBondContact O-CB 3.47Å; E263-A267 PolarHBondContact O-N 3.43Å; H264-A267 PolarHBondContact O-N 2.95Å; A267-D270 PolarHBondContact O-N 3.17Å; A267-E271 WeakPolarHBondContact O-CB 3.41Å; A267-E271 PolarHBondContact O-N 3.42Å
268Q91.9Very high85.4Confident96 Ų96118.4 Ų118.445%0.44959%0.586SS.*Hα-helixtrans-59.6-47174.2-75.2-178.7-25.900112.6H264 R266 D270 E271 E272H264-Q268 PolarHBondContact CE1-NE2 3.35Å; H264-Q268 WeakPolarHBondContact O-CG 3.39Å; H264-Q268 PolarHBondContact O-N 3.45Å; R266-Q268 VanDerWaalsContact C-N 3.3Å; R266-Q268 PolarHBondContact O-N 2.89Å; Q268-D270 PolarHBondContact O-N 3.5Å; Q268-E271 PolarHBondContact O-N 3.11Å; Q268-E272 WeakPolarHBondContact O-CG 3.31Å; Q268-E272 PolarHBondContact O-N 3.22Å
269R91.9Very high82.6Confident165 Ų165115.8 Ų115.862%0.62360%0.596SS**Hα-helixtrans-63.9-39.3177.6-77.3-171.6-69.5164.3-3.3112.9A265 R266 E271 A273A265-R269 WeakPolarHBondContact O-CG 3.33Å; A265-R269 PolarHBondContact O-N 3.45Å; R266-R269 PolarHBondContact O-N 2.96Å; R269-E271 VanDerWaalsContact C-N 3.32Å; R269-A273 VanDerWaalsContact O-CB 3.29Å; R269-A273 WeakPolarHBondContact O-CB 3.39Å; R269-A273 PolarHBondContact O-N 3.43Å
270D90.4Very high79.6Confident84 Ų84119 Ų11945%0.44961%0.606SS.*Hα-helixtrans-66.9-35.6177.3-70.5-14.6000111.2R266 A267 Q268 R274R266-D270 PolarHBondContact O-N 3.27Å; A267-D270 PolarHBondContact O-N 3.17Å; Q268-D270 PolarHBondContact O-N 3.5Å; D270-R274 WeakPolarHBondContact O-CG 3.36Å; D270-R274 PolarHBondContact O-N 3.33Å
271E86.4Confident76.7Confident138 Ų138126.1 Ų126.165%0.64563%0.627SS**Hα-helixtrans-68.9-46.2174.5-170167.5-161.700112.1A267 Q268 R269 A273 R274 Q275A267-E271 WeakPolarHBondContact O-CB 3.41Å; A267-E271 PolarHBondContact O-N 3.42Å; Q268-E271 PolarHBondContact O-N 3.11Å; R269-E271 VanDerWaalsContact C-N 3.32Å; E271-A273 VanDerWaalsContact C-N 3.33Å; E271-A273 PolarHBondContact O-N 2.95Å; E271-R274 PolarHBondContact O-N 2.89Å; E271-Q275 WeakPolarHBondContact O-CB 3.42Å; E271-Q275 PolarHBondContact O-N 2.97Å
272E87.1Confident74.6Confident114 Ų114121.1 Ų121.153%0.53362%0.62SS.*Hα-helixtrans-58.8-43.2173.2-73.6175.2175.600111.7Q268 R274 Q275 F276Q268-E272 WeakPolarHBondContact O-CG 3.31Å; Q268-E272 PolarHBondContact O-N 3.22Å; E272-R274 PolarHBondContact O-N 3.38Å; E272-Q275 PolarHBondContact O-N 3.01Å; E272-F276 PolarHBondContact O-N 3.41Å
273A84.8Confident71.3Confident61 Ų61119.4 Ų119.450%0.50463%0.633SS.*Hα-helixtrans-65.1-36.617700000112.4R269 E271 G277R269-A273 VanDerWaalsContact O-CB 3.29Å; R269-A273 WeakPolarHBondContact O-CB 3.39Å; R269-A273 PolarHBondContact O-N 3.43Å; E271-A273 VanDerWaalsContact C-N 3.33Å; E271-A273 PolarHBondContact O-N 2.95Å; A273-G277 WeakPolarHBondContact O-CA 3.5Å; A273-G277 PolarHBondContact O-N 2.88Å
274R82.2Confident68.3Low206 Ų206117.8 Ų117.878%0.77764%0.642SS**Hα-helixtrans-67-37.7171.9-76.8174.4-179.2172.42.6112D270 E271 E272 G278D270-R274 WeakPolarHBondContact O-CG 3.36Å; D270-R274 PolarHBondContact O-N 3.33Å; E271-R274 PolarHBondContact O-N 2.89Å; E272-R274 PolarHBondContact O-N 3.38Å; R274-G278 PolarHBondContact O-N 2.94Å
275Q71.7Confident65.5Low154 Ų154117.2 Ų117.272%0.7266%0.658SS**Hα-helixtrans-68.4-36.1178.2-162.6171.923.100112.1E271 E272E271-Q275 WeakPolarHBondContact O-CB 3.42Å; E271-Q275 PolarHBondContact O-N 2.97Å; E272-Q275 PolarHBondContact O-N 3.01Å
276F59.9Low62.4Low189 Ų189119 Ų11983%0.82968%0.681SS**Hα-helixtrans-89.9-19.3177.1-88.8-87.3000114.9E272E272-F276 PolarHBondContact O-N 3.41Å
277G52.5Low59.6Low65 Ų65121.4 Ų121.467%0.6770%0.696SS**Hα-helixtrans-83.4-8.9176.500000114.6A273 G279A273-G277 WeakPolarHBondContact O-CA 3.5Å; A273-G277 PolarHBondContact O-N 2.88Å; G277-G279 PolarHBondContact O-N 3.38Å
278G44.6Very low57.1Low59 Ų59124.3 Ų124.361%0.60871%0.71SS**SBendtrans-82.483.117400000112.7R274R274-G278 PolarHBondContact O-N 2.94Å
279G38.5Very low54.4Low74 Ų74123.7 Ų123.776%0.76373%0.73SS**  trans41.8100.9152.400000119.2G277G277-G279 PolarHBondContact O-N 3.38Å
280Y34.2Very low51.7Low216 Ų216120.4 Ų120.485%0.84774%0.738SS**  trans-82.4122.7159.7-150.3-98.8000109.9P282Y280-P282 HydrophobicContact CE1-CB 4.22Å
281F33.6Very low49.1Very low205 Ų205122.9 Ų122.990%0.89976%0.757SS**  trans-133.5138.8151.5-132.7-96.7000109.1
282P49.8Very low46.8Very low96 Ų96121.8 Ų121.862%0.62376%0.761SS**  trans-97.6138.3-15434.7-25.4000112.3Y280Y280-P282 HydrophobicContact CE1-CB 4.22Å
283G27.3Very low44.5Very low77 Ų77122.9 Ų122.979%0.79478%0.778SS**  trans-156.3106177.400000112.3
284A32.1Very low42.7Very low100 Ų100123.8 Ų123.883%0.82679%0.794SS**  trans1.5132.5161.200000120.6
285A34.5Very low40.4Very low107 Ų107117 Ų11788%0.88479%0.788SS**  trans66.4111.2139.100000119.6
286G29Very low39Very low78 Ų78117.5 Ų117.580%0.80479%0.792SS**  trans148.5116.5156.500000114.4
287F35.8Very low37.8Very low212 Ų212115.1 Ų115.193%0.9380%0.796SS**  trans-64.9172.7178.3-114.1-107.8000112.8
288P40Very low37.7Very low114 Ų114114 Ų11474%0.7479%0.785SS**  -117.4130.1-117.828.8-6.6000112.7
289G36.5Very low38.1Very low84 Ų84115 Ų11587%0.86678%0.775SS**  trans-129.587172.300000110
290A34.8Very low38.8Very low96 Ų96113.9 Ų113.979%0.79376%0.764SS**  trans-148.291.5172.100000109.9
291T35.7Very low39.8Very low136 Ų136109.8 Ų109.883%0.83475%0.753SS**  trans-68.2126.3160.735.70000109.5
292P37.5Very low40.9Very low114 Ų114101 Ų10174%0.7472%0.715SS**  trans-70.1138.5171.5-12.426.7000110.7G294P292-G294 PolarHBondContact O-N 2.92Å
293P39.6Very low41.5Very low137 Ų137101.8 Ų101.889%0.8971%0.709SS**THydrogen-bonded Turntrans-78115.9175.129.4-28.3000109.7
294G46.5Very low43.3Very low80 Ų80106 Ų10683%0.82571%0.706SS**THydrogen-bonded Turntrans140.812.7174.300000117.2P292P292-G294 PolarHBondContact O-N 2.92Å
295G34.8Very low45.2Very low65 Ų65102.2 Ų102.267%0.6767%0.671SS**  trans-76.9128.3-179.300000113.6
296M41.3Very low46.9Very low163 Ų163101.5 Ų101.580%0.80366%0.657SS**  trans-36.1138.3166-89.2-177.1161.800112.7G298 L299M296-G298 PolarHBondContact O-N 3.18Å; M296-L299 PolarHBondContact O-N 2.88Å
297P34.3Very low48.9Very low140 Ų140103.2 Ų103.291%0.90965%0.645SS**THydrogen-bonded Turntrans-58.8123.6175.3-15.427.6000110
298G50.9Low50.5Low42 Ų4293.3 Ų93.343%0.43360%0.601SS.*THydrogen-bonded Turntrans112.2-15.7175.100000116.1M296 G300M296-G298 PolarHBondContact O-N 3.18Å; G298-G300 VanDerWaalsContact C-N 3.33Å; G298-G300 PolarHBondContact O-N 3.28Å
299L53Low52Low78 Ų7890.7 Ų90.741%0.40858%0.581SS.*Hα-helixtrans-72.4-26.9178.6-150.386.6000112.6M296 E301 L302 F303M296-L299 PolarHBondContact O-N 2.88Å; L299-E301 VanDerWaalsContact C-N 3.31Å; L299-E301 PolarHBondContact O-N 2.91Å; L299-L302 WeakPolarHBondContact O-CB 3.48Å; L299-L302 PolarHBondContact O-N 3.39Å; L299-L302 VanDerWaalsContact O-N 3.16Å; L299-F303 HydrophobicContact CD2-CE2 3.76Å; L299-F303 HydrophobicContact CG-CE2 4.04Å; L299-F303 VanDerWaalsContact O-CD2 3.3Å; L299-F303 WeakPolarHBondContact O-CD2 3.04Å
300G53.7Low53.9Low51 Ų5191.5 Ų91.553%0.52657%0.565SS.*Hα-helixtrans-69.6-21.1-178.200000115.2G298G298-G300 VanDerWaalsContact C-N 3.33Å; G298-G300 PolarHBondContact O-N 3.28Å
301E54.3Low55.7Low131 Ų13188.4 Ų88.461%0.61254%0.539SS*.Hα-helixtrans-80.9-25.3172-79.3-176.5149.300112.3L299 F303 K304 F351L299-E301 VanDerWaalsContact C-N 3.31Å; L299-E301 PolarHBondContact O-N 2.91Å; E301-F303 VanDerWaalsContact C-N 3.35Å; E301-F303 PolarHBondContact O-N 3.24Å; E301-K304 PolarHBondContact O-N 2.92Å; E301-F351 HydrophobicContact CB-CZ 4.4Å
302L57.3Low57.6Low19 Ų1983.6 Ų83.610%0.09951%0.508CS..Hα-helixtrans-64-39.9178-138.3112.9000111.8L299 K304 D305 L308 M312 L347 F351L299-L302 WeakPolarHBondContact O-CB 3.48Å; L299-L302 PolarHBondContact O-N 3.39Å; L299-L302 VanDerWaalsContact O-N 3.16Å; L302-K304 PolarHBondContact O-N 3.42Å; L302-D305 PolarHBondContact O-N 3.46Å; L302-L308 HydrophobicContact CG-CD1 4.18Å; L302-M312 HydrophobicContact CD2-CE 3.44Å; L302-M312 VanDerWaalsContact CD2-CE 3.44Å; L302-M312 HydrophobicContact CD2-SD 4.24Å; L302-L347 HydrophobicContact CD1-CD2 3.49Å; L302-L347 VanDerWaalsContact CD1-CD2 3.49Å; L302-L347 HydrophobicContact CG-CD2 4.03Å; L302-F351 HydrophobicContact CD1-CE2 3.9Å; L302-F351 HydrophobicContact CD1-CZ 4.26Å
303F62.5Low59.5Low113 Ų11385 Ų8550%0.49650%0.502SS..THydrogen-bonded Turntrans-76.2-4.3179-73.2-82000114L299 E301 L309L299-F303 HydrophobicContact CD2-CE2 3.76Å; L299-F303 HydrophobicContact CG-CE2 4.04Å; L299-F303 VanDerWaalsContact O-CD2 3.3Å; L299-F303 WeakPolarHBondContact O-CD2 3.04Å; E301-F303 VanDerWaalsContact C-N 3.35Å; E301-F303 PolarHBondContact O-N 3.24Å; F303-L309 HydrophobicContact CB-CD2 4.49Å; F303-L309 HydrophobicContact CD1-CD2 3.66Å; F303-L309 HydrophobicContact CE1-CD2 4.38Å; F303-L309 HydrophobicContact CG-CD2 4.49Å; F303-L309 WeakPolarHBondContact O-CD1 3.46Å
304K64.8Low61.5Low167 Ų16780.4 Ų80.473%0.72647%0.471SS*.THydrogen-bonded Turntrans-93.7-8.3177.1-68.3178.9-178.3176.60113.1E301 L302 P306E301-K304 PolarHBondContact O-N 2.92Å; L302-K304 PolarHBondContact O-N 3.42Å; K304-P306 WeakPolarHBondContact O-CD 2.95Å
305D72.6Confident63Low20 Ų2081.5 Ų81.511%0.10746%0.463CS..  trans-92.3112.4176.5-173.2-15.3000110.8L302 E307 L308 L309 K350L302-D305 PolarHBondContact O-N 3.46Å; D305-E307 PolarHBondContact O-N 2.87Å; D305-E307 VanDerWaalsContact O-N 3.17Å; D305-E307 WeakPolarHBondContact OD1-CB 3.46Å; D305-E307 PolarHBondContact OD1-N 3.47Å; D305-L308 HydrophobicContact CB-CB 3.97Å; D305-L308 HydrophobicContact CB-CD1 3.74Å; D305-L308 HydrophobicContact CB-CG 3.85Å; D305-L308 PolarHBondContact O-N 3.32Å; D305-L308 WeakPolarHBondContact OD2-CG 3.33Å; D305-L309 WeakPolarHBondContact O-CG 3.45Å; D305-L309 PolarHBondContact O-N 2.96Å; D305-K350 VanDerWaalsContact CG-NZ 3.35Å; D305-K350 WeakPolarHBondContact OD2-CE 3.17Å; D305-K350 IonicContact OD2-NZ 2.75Å; D305-K350 PolarHBondContact OD2-NZ 3.45Å
306P69.9Low65.2Low91 Ų9182.7 Ų82.759%0.59145%0.451SS*.Hα-helixtrans-58.5-27.9179.3-21.332.9000113.5K304 N310K304-P306 WeakPolarHBondContact O-CD 2.95Å; P306-N310 PolarHBondContact O-N 3.39Å; P306-N310 VanDerWaalsContact O-N 3.17Å
307E70.2Confident67.1Low115 Ų11575.2 Ų75.254%0.53741%0.414SS..Hα-helixtrans-79.6-38.4179.4-64.7-166.9163.800112.3D305 L309 N310 A311 K346D305-E307 PolarHBondContact O-N 2.87Å; D305-E307 VanDerWaalsContact O-N 3.17Å; D305-E307 WeakPolarHBondContact OD1-CB 3.46Å; D305-E307 PolarHBondContact OD1-N 3.47Å; E307-L309 VanDerWaalsContact C-N 3.34Å; E307-N310 PolarHBondContact O-N 3.24Å; E307-A311 PolarHBondContact O-N 3.43Å; E307-K346 IonicContact OE2-NZ 3.99Å; E307-K346 PolarHBondContact OE2-NZ 3.46Å
308L69.4Low69.3Low4 Ų473.7 Ų73.72%0.02140%0.397CS..Hα-helixtrans-66.9-38.7174-66.5174.8000110.9L302 D305 N310 A311 M312 L343 K346 L347L302-L308 HydrophobicContact CG-CD1 4.18Å; D305-L308 HydrophobicContact CB-CB 3.97Å; D305-L308 HydrophobicContact CB-CD1 3.74Å; D305-L308 HydrophobicContact CB-CG 3.85Å; D305-L308 PolarHBondContact O-N 3.32Å; D305-L308 WeakPolarHBondContact OD2-CG 3.33Å; L308-N310 VanDerWaalsContact C-N 3.32Å; L308-N310 PolarHBondContact O-N 3.28Å; L308-A311 PolarHBondContact O-N 3.2Å; L308-M312 PolarHBondContact O-N 3.05Å; L308-L343 HydrophobicContact CD2-CD1 3.31Å; L308-L343 HydrophobicContact CD2-CG 4.49Å; L308-K346 HydrophobicContact CD2-CB 4.49Å; L308-L347 HydrophobicContact CD1-CD2 3.92Å; L308-L347 HydrophobicContact CD2-CD2 4.11Å; L308-L347 HydrophobicContact CD2-CG 4.32Å
309L72.1Confident70.8Confident58 Ų5874.3 Ų74.330%0.30440%0.398SS..Hα-helixtrans-61.4-40173.4-76.3178000112.5F303 D305 E307 K313F303-L309 HydrophobicContact CB-CD2 4.49Å; F303-L309 HydrophobicContact CD1-CD2 3.66Å; F303-L309 HydrophobicContact CE1-CD2 4.38Å; F303-L309 HydrophobicContact CG-CD2 4.49Å; F303-L309 WeakPolarHBondContact O-CD1 3.46Å; D305-L309 WeakPolarHBondContact O-CG 3.45Å; D305-L309 PolarHBondContact O-N 2.96Å; E307-L309 VanDerWaalsContact C-N 3.34Å; L309-K313 WeakPolarHBondContact O-CG 3.38Å; L309-K313 PolarHBondContact O-N 2.95Å
310N76.3Confident72.2Confident101 Ų10170.7 Ų70.754%0.5438%0.379SS..Hα-helixtrans-72.5-34.2177.3-81.3-14.6000112.4P306 E307 L308 K313P306-N310 PolarHBondContact O-N 3.39Å; P306-N310 VanDerWaalsContact O-N 3.17Å; E307-N310 PolarHBondContact O-N 3.24Å; L308-N310 VanDerWaalsContact C-N 3.32Å; L308-N310 PolarHBondContact O-N 3.28Å; N310-K313 PolarHBondContact O-N 3.19Å; N310-K313 PolarHBondContact OD1-NZ 2.83Å
311A73.6Confident73.6Confident31 Ų3172.8 Ų72.826%0.25637%0.374SS..Hα-helixtrans-67.5-36.2173.200000112.5E307 L308 K313 D314 V317 L343E307-A311 PolarHBondContact O-N 3.43Å; L308-A311 PolarHBondContact O-N 3.2Å; A311-K313 PolarHBondContact O-N 2.71Å; A311-D314 WeakPolarHBondContact O-CB 3.29Å; A311-D314 PolarHBondContact O-N 2.87Å; A311-V317 WeakPolarHBondContact O-CB 3.32Å; A311-V317 WeakPolarHBondContact O-CG1 3.43Å; A311-L343 HydrophobicContact CB-CD1 3.82Å
312M74.8Confident74.8Confident35 Ų3572 Ų7217%0.17237%0.37CS..Hα-helixtrans-71.1-14.7175.7-79.4-172.7160.300114.4L302 L308 D314 M318 F321L302-M312 HydrophobicContact CD2-CE 3.44Å; L302-M312 VanDerWaalsContact CD2-CE 3.44Å; L302-M312 HydrophobicContact CD2-SD 4.24Å; L308-M312 PolarHBondContact O-N 3.05Å; M312-D314 VanDerWaalsContact C-N 3.28Å; M312-M318 VanDerWaalsContact O-CE 3.26Å; M312-M318 WeakPolarHBondContact O-CE 3.39Å; M312-F321 HydrophobicContact CE-CD2 4.45Å; M312-F321 HydrophobicContact CE-CE1 4.37Å; M312-F321 HydrophobicContact CE-CE2 4.31Å; M312-F321 HydrophobicContact CE-CZ 4.27Å
313K77.5Confident76Confident144 Ų14473 Ų7363%0.62638%0.375SS*.THydrogen-bonded Turntrans-78.3-14.2172.1-70.7170.1-168.8167.30112.7L309 N310 A311 P315L309-K313 WeakPolarHBondContact O-CG 3.38Å; L309-K313 PolarHBondContact O-N 2.95Å; N310-K313 PolarHBondContact O-N 3.19Å; N310-K313 PolarHBondContact OD1-NZ 2.83Å; A311-K313 PolarHBondContact O-N 2.71Å; K313-P315 WeakPolarHBondContact O-CD 3.46Å
314D81.3Confident76.7Confident41 Ų4169.1 Ų69.122%0.21936%0.361CS..SBendtrans-72.9119.2172.6-168.9-43.8000108.7A311 M312 E316 V317 M318 K339A311-D314 WeakPolarHBondContact O-CB 3.29Å; A311-D314 PolarHBondContact O-N 2.87Å; M312-D314 VanDerWaalsContact C-N 3.28Å; D314-E316 PolarHBondContact O-N 3.05Å; D314-E316 VanDerWaalsContact O-N 3.15Å; D314-E316 WeakPolarHBondContact OD1-CB 3.42Å; D314-E316 PolarHBondContact OD1-N 2.9Å; D314-V317 HydrophobicContact CB-CB 4.11Å; D314-V317 HydrophobicContact CB-CG2 3.85Å; D314-V317 PolarHBondContact O-N 2.87Å; D314-V317 VanDerWaalsContact O-N 3.12Å; D314-M318 PolarHBondContact O-N 3.12Å; D314-K339 IonicContact OD1-NZ 2.77Å; D314-K339 WeakPolarHBondContact OD2-CD 3.28Å; D314-K339 WeakPolarHBondContact OD2-CE 3.41Å; D314-K339 IonicContact OD2-NZ 3.3Å; D314-K339 PolarHBondContact OD2-NZ 3.2Å
315P78Confident77.3Confident102 Ų10264.6 Ų64.666%0.66236%0.355SS*.Hα-helixtrans-57-31-178.4-22.932.5000113.1K313 A319K313-P315 WeakPolarHBondContact O-CD 3.46Å; P315-A319 WeakPolarHBondContact O-CB 3.46Å; P315-A319 PolarHBondContact O-N 3.35Å
316E80.4Confident77.5Confident91 Ų9170.7 Ų70.743%0.42538%0.382SS..Hα-helixtrans-71.1-39.6-179.1-163.2-177.3174.600111.4D314 A320 N337 K339D314-E316 PolarHBondContact O-N 3.05Å; D314-E316 VanDerWaalsContact O-N 3.15Å; D314-E316 WeakPolarHBondContact OD1-CB 3.42Å; D314-E316 PolarHBondContact OD1-N 2.9Å; E316-A320 PolarHBondContact O-N 2.99Å; E316-N337 PolarHBondContact OE1-ND2 3.39Å; E316-K339 IonicContact OE2-NZ 3.52Å; E316-K339 PolarHBondContact OE2-NZ 3.47Å
317V81.8Confident78Confident5 Ų569.9 Ų69.93%0.0337%0.373CS..Hα-helixtrans-72.8-38.7178.3176.80000110.8A311 D314 A320 F321 K339 I340 L343A311-V317 WeakPolarHBondContact O-CB 3.32Å; A311-V317 WeakPolarHBondContact O-CG1 3.43Å; D314-V317 HydrophobicContact CB-CB 4.11Å; D314-V317 HydrophobicContact CB-CG2 3.85Å; D314-V317 PolarHBondContact O-N 2.87Å; D314-V317 VanDerWaalsContact O-N 3.12Å; V317-A320 PolarHBondContact O-N 3.01Å; V317-F321 WeakPolarHBondContact O-CB 3.41Å; V317-F321 PolarHBondContact O-N 3.02Å; V317-K339 HydrophobicContact CG2-CB 4Å; V317-I340 HydrophobicContact CG2-CG1 4.32Å; V317-L343 HydrophobicContact CG1-CD2 3.54Å
318M81Confident78.4Confident109 Ų10969.1 Ų69.154%0.53738%0.378SS..Hα-helixtrans-65.3-44.5176.5-171.6-172.4-66.300111.8M312 D314 A320 F321 Q322M312-M318 VanDerWaalsContact O-CE 3.26Å; M312-M318 WeakPolarHBondContact O-CE 3.39Å; D314-M318 PolarHBondContact O-N 3.12Å; M318-A320 VanDerWaalsContact C-N 3.32Å; M318-A320 PolarHBondContact O-N 2.95Å; M318-F321 PolarHBondContact O-N 3.36Å; M318-Q322 PolarHBondContact O-N 3.41Å
319A82.9Confident79Confident55 Ų5572.2 Ų72.246%0.45541%0.405SS..Hα-helixtrans-61-42.3177.300000111.7P315 Q322 D323P315-A319 WeakPolarHBondContact O-CB 3.46Å; P315-A319 PolarHBondContact O-N 3.35Å; A319-Q322 PolarHBondContact O-N 3.44Å; A319-D323 PolarHBondContact O-N 3.44Å
320A82.3Confident79.5Confident2 Ų270.7 Ų70.72%0.01740%0.397CS..Hα-helixtrans-67.5-40.1176.600000113E316 V317 M318 Q322 D323 V324 Y334 I340E316-A320 PolarHBondContact O-N 2.99Å; V317-A320 PolarHBondContact O-N 3.01Å; M318-A320 VanDerWaalsContact C-N 3.32Å; M318-A320 PolarHBondContact O-N 2.95Å; A320-Q322 VanDerWaalsContact C-N 3.3Å; A320-Q322 PolarHBondContact O-N 3.3Å; A320-D323 PolarHBondContact O-N 3.06Å; A320-V324 VanDerWaalsContact O-CG2 3.31Å; A320-V324 WeakPolarHBondContact O-CG2 3.31Å; A320-V324 PolarHBondContact O-N 3.03Å; A320-Y334 HydrophobicContact CB-CD1 3.72Å; A320-Y334 HydrophobicContact CB-CD2 4.08Å; A320-Y334 HydrophobicContact CB-CE1 3.59Å; A320-Y334 HydrophobicContact CB-CE2 3.98Å; A320-Y334 HydrophobicContact CB-CG 3.95Å; A320-I340 HydrophobicContact CB-CD1 3.27Å; A320-I340 HydrophobicContact CB-CG1 4.05Å
321F81.7Confident79.7Confident94 Ų9468.9 Ų68.941%0.41239%0.386SS..Hα-helixtrans-61.6-40.7175.5-175.5-97.8000111.5M312 V317 M318 A325M312-F321 HydrophobicContact CE-CD2 4.45Å; M312-F321 HydrophobicContact CE-CE1 4.37Å; M312-F321 HydrophobicContact CE-CE2 4.31Å; M312-F321 HydrophobicContact CE-CZ 4.27Å; V317-F321 WeakPolarHBondContact O-CB 3.41Å; V317-F321 PolarHBondContact O-N 3.02Å; M318-F321 PolarHBondContact O-N 3.36Å; F321-A325 VanDerWaalsContact O-CB 3.23Å; F321-A325 WeakPolarHBondContact O-CB 3.26Å; F321-A325 PolarHBondContact O-N 3.01Å
322Q81.1Confident80.1Confident116 Ų11670.7 Ų70.754%0.54240%0.397SS..Hα-helixtrans-66.6-41.8176.7-169.6175.41000112.4M318 A319 A320 V324 A325 Q326M318-Q322 PolarHBondContact O-N 3.41Å; A319-Q322 PolarHBondContact O-N 3.44Å; A320-Q322 VanDerWaalsContact C-N 3.3Å; A320-Q322 PolarHBondContact O-N 3.3Å; Q322-V324 PolarHBondContact O-N 3.34Å; Q322-A325 PolarHBondContact O-N 3.15Å; Q322-Q326 WeakPolarHBondContact O-CG 3.43Å; Q322-Q326 PolarHBondContact O-N 3.04Å
323D81.2Confident80.6Confident38 Ų3875.2 Ų75.220%0.20342%0.416CS..Hα-helixtrans-62.4-42176.8-171.241.2000111.6A319 A320 N327 N330 K333 Y334A319-D323 PolarHBondContact O-N 3.44Å; A320-D323 PolarHBondContact O-N 3.06Å; D323-N327 PolarHBondContact O-N 3.5Å; D323-N330 VanDerWaalsContact CG-ND2 3.26Å; D323-N330 PolarHBondContact OD1-ND2 3.03Å; D323-N330 VanDerWaalsContact OD2-CB 3.28Å; D323-N330 WeakPolarHBondContact OD2-CB 3.42Å; D323-N330 PolarHBondContact OD2-ND2 3.11Å; D323-N330 VanDerWaalsContact OD2-ND2 3.1Å; D323-K333 IonicContact OD2-NZ 2.94Å; D323-K333 PolarHBondContact OD2-NZ 3.01Å; D323-Y334 HydrophobicContact CB-CE2 4.2Å; D323-Y334 PolarHBondContact OD2-OH 3.32Å
324V78.7Confident81Confident32 Ų3271 Ų7119%0.19440%0.396CS..Hα-helixtrans-72.7-36.5178177.10000112A320 Q322 Q326 N327 P328 I331 Y334A320-V324 VanDerWaalsContact O-CG2 3.31Å; A320-V324 WeakPolarHBondContact O-CG2 3.31Å; A320-V324 PolarHBondContact O-N 3.03Å; Q322-V324 PolarHBondContact O-N 3.34Å; V324-Q326 VanDerWaalsContact C-N 3.29Å; V324-Q326 PolarHBondContact O-N 3.2Å; V324-N327 CarbonylContact O-C 3.44Å; V324-N327 PolarHBondContact O-N 2.97Å; V324-P328 WeakPolarHBondContact O-CA 3.37Å; V324-P328 VanDerWaalsContact O-N 3.13Å; V324-I331 HydrophobicContact CG1-CB 4.25Å; V324-I331 HydrophobicContact CG1-CD1 4.24Å; V324-I331 HydrophobicContact CG2-CB 4.17Å; V324-I331 HydrophobicContact CG2-CD1 3.91Å; V324-Y334 HydrophobicContact CG2-CD2 4.12Å; V324-Y334 HydrophobicContact CG2-CE2 4.24Å
325A75.8Confident80.9Confident72 Ų7274.1 Ų74.160%0.59541%0.41SS*.Hα-helixtrans-65.3-33.8176.300000112.2F321 Q322F321-A325 VanDerWaalsContact O-CB 3.23Å; F321-A325 WeakPolarHBondContact O-CB 3.26Å; F321-A325 PolarHBondContact O-N 3.01Å; Q322-A325 PolarHBondContact O-N 3.15Å
326Q78.3Confident81.1Confident148 Ų14876.8 Ų76.869%0.69242%0.418SS*.Hα-helixtrans-76.4-33.7173.8-70.8-179.73.500112.3Q322 V324Q322-Q326 WeakPolarHBondContact O-CG 3.43Å; Q322-Q326 PolarHBondContact O-N 3.04Å; V324-Q326 VanDerWaalsContact C-N 3.29Å; V324-Q326 PolarHBondContact O-N 3.2Å
327N80.6Confident81.3Confident75 Ų7573.7 Ų73.740%0.40141%0.405SS..  trans-147.2104.2176.5-173.3-8.7000111.9D323 V324 A329 N330D323-N327 PolarHBondContact O-N 3.5Å; V324-N327 CarbonylContact O-C 3.44Å; V324-N327 PolarHBondContact O-N 2.97Å; N327-A329 PolarHBondContact O-N 3.12Å; N327-A329 WeakPolarHBondContact OD1-CB 3.38Å; N327-A329 PolarHBondContact OD1-N 2.95Å; N327-N330 WeakPolarHBondContact O-CB 3.47Å; N327-N330 PolarHBondContact O-N 3.2Å
328P78.8Confident81.2Confident98 Ų9878.4 Ų78.464%0.63644%0.435SS*.G310 helixtrans-57.3-23.5-177.3-28.836000115.2V324 N330 I331V324-P328 WeakPolarHBondContact O-CA 3.37Å; V324-P328 VanDerWaalsContact O-N 3.13Å; P328-N330 PolarHBondContact O-N 3.46Å; P328-I331 WeakPolarHBondContact O-CG2 3.5Å
329A80.8Confident81.2Confident70 Ų7077.8 Ų77.858%0.57943%0.43SS*.G310 helixtrans-70-17.8177.700000113.5N327 I331N327-A329 PolarHBondContact O-N 3.12Å; N327-A329 WeakPolarHBondContact OD1-CB 3.38Å; N327-A329 PolarHBondContact OD1-N 2.95Å; A329-I331 PolarHBondContact O-N 3.1Å
330N83.4Confident81.1Confident25 Ų2575.7 Ų75.713%0.13441%0.411CS..G310 helixtrans-74.4-9-178.4-72.9-13.2000113.6D323 N327 P328 S332 K333 Y334D323-N330 VanDerWaalsContact CG-ND2 3.26Å; D323-N330 PolarHBondContact OD1-ND2 3.03Å; D323-N330 VanDerWaalsContact OD2-CB 3.28Å; D323-N330 WeakPolarHBondContact OD2-CB 3.42Å; D323-N330 PolarHBondContact OD2-ND2 3.11Å; D323-N330 VanDerWaalsContact OD2-ND2 3.1Å; N327-N330 WeakPolarHBondContact O-CB 3.47Å; N327-N330 PolarHBondContact O-N 3.2Å; P328-N330 PolarHBondContact O-N 3.46Å; N330-S332 PolarHBondContact O-N 3.2Å; N330-S332 VanDerWaalsContact O-N 3.11Å; N330-K333 HydrophobicContact CB-CD 4.24Å; N330-K333 PolarHBondContact ND2-NZ 3.09Å; N330-K333 VanDerWaalsContact ND2-NZ 3.19Å; N330-K333 WeakPolarHBondContact O-CB 3.48Å; N330-K333 WeakPolarHBondContact O-CG 3.4Å; N330-K333 PolarHBondContact O-N 2.99Å; N330-K333 VanDerWaalsContact OD1-CE 3.26Å; N330-K333 WeakPolarHBondContact OD1-CE 3.31Å; N330-K333 PolarHBondContact OD1-NZ 3.19Å; N330-K333 VanDerWaalsContact OD1-NZ 3.09Å; N330-Y334 WeakPolarHBondContact O-CD2 3.32Å
331I79.6Confident80.9Confident63 Ų6379 Ų7932%0.32343%0.427SS..G310 helixtrans-55.5-32.4178.9-167.563.5000112.4V324 P328 A329 K333 Y334 V344V324-I331 HydrophobicContact CG1-CB 4.25Å; V324-I331 HydrophobicContact CG1-CD1 4.24Å; V324-I331 HydrophobicContact CG2-CB 4.17Å; V324-I331 HydrophobicContact CG2-CD1 3.91Å; P328-I331 WeakPolarHBondContact O-CG2 3.5Å; A329-I331 PolarHBondContact O-N 3.1Å; I331-K333 PolarHBondContact O-N 3.5Å; I331-Y334 PolarHBondContact O-N 3.25Å; I331-V344 HydrophobicContact CD1-CG2 4.17Å
332S82.4Confident80.8Confident70 Ų7077.1 Ų77.149%0.4943%0.428SS..G310 helixtrans-60.2-27.3178.2-580000113.6N330 Y334N330-S332 PolarHBondContact O-N 3.2Å; N330-S332 VanDerWaalsContact O-N 3.11Å; S332-Y334 PolarHBondContact O-N 3.05Å
333K85.1Confident80.6Confident130 Ų13072.2 Ų72.257%0.56541%0.406SS*.G310 helixtrans-66.9-25.7178-59.3177.4-170.6166.70112.5D323 N330 I331D323-K333 IonicContact OD2-NZ 2.94Å; D323-K333 PolarHBondContact OD2-NZ 3.01Å; N330-K333 HydrophobicContact CB-CD 4.24Å; N330-K333 PolarHBondContact ND2-NZ 3.09Å; N330-K333 VanDerWaalsContact ND2-NZ 3.19Å; N330-K333 WeakPolarHBondContact O-CB 3.48Å; N330-K333 WeakPolarHBondContact O-CG 3.4Å; N330-K333 PolarHBondContact O-N 2.99Å; N330-K333 VanDerWaalsContact OD1-CE 3.26Å; N330-K333 WeakPolarHBondContact OD1-CE 3.31Å; N330-K333 PolarHBondContact OD1-NZ 3.19Å; N330-K333 VanDerWaalsContact OD1-NZ 3.09Å; I331-K333 PolarHBondContact O-N 3.5Å
334Y85.4Confident80.4Confident54 Ų5472.9 Ų72.921%0.21241%0.411CS..G310 helixtrans-105.94-172.3-56.8-73000113.3A320 D323 V324 N330 I331 S332 N336 N337 I340A320-Y334 HydrophobicContact CB-CD1 3.72Å; A320-Y334 HydrophobicContact CB-CD2 4.08Å; A320-Y334 HydrophobicContact CB-CE1 3.59Å; A320-Y334 HydrophobicContact CB-CE2 3.98Å; A320-Y334 HydrophobicContact CB-CG 3.95Å; D323-Y334 HydrophobicContact CB-CE2 4.2Å; D323-Y334 PolarHBondContact OD2-OH 3.32Å; V324-Y334 HydrophobicContact CG2-CD2 4.12Å; V324-Y334 HydrophobicContact CG2-CE2 4.24Å; N330-Y334 WeakPolarHBondContact O-CD2 3.32Å; I331-Y334 PolarHBondContact O-N 3.25Å; S332-Y334 PolarHBondContact O-N 3.05Å; Y334-N336 PolarHBondContact O-N 2.98Å; Y334-N336 VanDerWaalsContact O-N 3.15Å; Y334-N337 PolarHBondContact O-N 3.15Å; Y334-I340 HydrophobicContact CD1-CD1 3.41Å; Y334-I340 VanDerWaalsContact CD1-CD1 3.41Å; Y334-I340 HydrophobicContact CE1-CD1 4.22Å; Y334-I340 HydrophobicContact CG-CD1 3.82Å
335Q78.9Confident80.2Confident108 Ų10875.2 Ų75.251%0.50543%0.426SS..THydrogen-bonded Turntrans-58.3-27.4178.8-74.9176.1-2.300113.5M341Q335-M341 WeakPolarHBondContact O-CG 3.44Å
336N82.3Confident80.1Confident157 Ų15776.3 Ų76.384%0.8442%0.417SS*.THydrogen-bonded Turntrans-94.4-1.1179.2-63.3-34.3000113.2Y334 P338Y334-N336 PolarHBondContact O-N 2.98Å; Y334-N336 VanDerWaalsContact O-N 3.15Å; N336-P338 WeakPolarHBondContact O-CD 3.43Å
337N84.9Confident79.8Confident26 Ų2670.9 Ų70.914%0.13939%0.393CS..  trans-89.1113177.7-170.8-44.7000109.9E316 Y334 K339 I340 M341E316-N337 PolarHBondContact OE1-ND2 3.39Å; Y334-N337 PolarHBondContact O-N 3.15Å; N337-K339 VanDerWaalsContact C-N 3.27Å; N337-K339 PolarHBondContact O-N 2.9Å; N337-K339 WeakPolarHBondContact OD1-CB 3.26Å; N337-K339 PolarHBondContact OD1-N 3.25Å; N337-I340 HydrophobicContact CB-CB 4.17Å; N337-I340 HydrophobicContact CB-CD1 3.8Å; N337-I340 HydrophobicContact CB-CG1 4.17Å; N337-I340 PolarHBondContact O-N 3.48Å; N337-I340 PolarHBondContact OD1-N 3.19Å; N337-M341 WeakPolarHBondContact O-CB 3.4Å; N337-M341 WeakPolarHBondContact O-CG 3.32Å; N337-M341 PolarHBondContact O-N 3.03Å
338P80Confident79.3Confident104 Ų10470.3 Ų70.368%0.67540%0.395SS*.Hα-helixtrans-64.1-30.2-173.424.9-33.7000113.1N336 A342N336-P338 WeakPolarHBondContact O-CD 3.43Å; P338-A342 VanDerWaalsContact O-CB 3.29Å; P338-A342 WeakPolarHBondContact O-CB 3.29Å; P338-A342 PolarHBondContact O-N 3.21Å
339K80.6Confident78.8Confident96 Ų9669.6 Ų69.642%0.41740%0.397SS..Hα-helixtrans-71.4-42178.9-61.2178.6-177.3172.90111.7D314 E316 V317 N337 L343D314-K339 IonicContact OD1-NZ 2.77Å; D314-K339 WeakPolarHBondContact OD2-CD 3.28Å; D314-K339 WeakPolarHBondContact OD2-CE 3.41Å; D314-K339 IonicContact OD2-NZ 3.3Å; D314-K339 PolarHBondContact OD2-NZ 3.2Å; E316-K339 IonicContact OE2-NZ 3.52Å; E316-K339 PolarHBondContact OE2-NZ 3.47Å; V317-K339 HydrophobicContact CG2-CB 4Å; N337-K339 VanDerWaalsContact C-N 3.27Å; N337-K339 PolarHBondContact O-N 2.9Å; N337-K339 WeakPolarHBondContact OD1-CB 3.26Å; N337-K339 PolarHBondContact OD1-N 3.25Å; K339-L343 PolarHBondContact O-N 3.19Å
340I80.9Confident78Confident11 Ų1172.3 Ų72.36%0.05640%0.396CS..Hα-helixtrans-73.7-40.4-178.7-60.8166.5000109.9V317 A320 Y334 N337 A342 L343 V344V317-I340 HydrophobicContact CG2-CG1 4.32Å; A320-I340 HydrophobicContact CB-CD1 3.27Å; A320-I340 HydrophobicContact CB-CG1 4.05Å; Y334-I340 HydrophobicContact CD1-CD1 3.41Å; Y334-I340 VanDerWaalsContact CD1-CD1 3.41Å; Y334-I340 HydrophobicContact CE1-CD1 4.22Å; Y334-I340 HydrophobicContact CG-CD1 3.82Å; N337-I340 HydrophobicContact CB-CB 4.17Å; N337-I340 HydrophobicContact CB-CD1 3.8Å; N337-I340 HydrophobicContact CB-CG1 4.17Å; N337-I340 PolarHBondContact O-N 3.48Å; N337-I340 PolarHBondContact OD1-N 3.19Å; I340-A342 PolarHBondContact O-N 2.91Å; I340-L343 WeakPolarHBondContact O-CB 3.38Å; I340-L343 PolarHBondContact O-N 2.91Å; I340-V344 HydrophobicContact CG2-CG2 4.34Å; I340-V344 VanDerWaalsContact O-CG2 3.31Å; I340-V344 WeakPolarHBondContact O-CG2 3.48Å; I340-V344 PolarHBondContact O-N 2.94Å
341M78.9Confident77.1Confident73 Ų7376 Ų7636%0.3641%0.411SS..Hα-helixtrans-63.9-40.6174.4-73.8-59.9-70.100112.5Q335 N337 L343 V344 T345Q335-M341 WeakPolarHBondContact O-CG 3.44Å; N337-M341 WeakPolarHBondContact O-CB 3.4Å; N337-M341 WeakPolarHBondContact O-CG 3.32Å; N337-M341 PolarHBondContact O-N 3.03Å; M341-L343 PolarHBondContact O-N 2.81Å; M341-V344 PolarHBondContact O-N 3.18Å; M341-T345 WeakPolarHBondContact O-CB 3.4Å; M341-T345 PolarHBondContact O-N 3.21Å; M341-T345 PolarHBondContact O-OG1 2.64Å
342A78.3Confident75.8Confident53 Ų5375.9 Ų75.944%0.43843%0.425SS..Hα-helixtrans-59.6-36.517400000112.3P338 I340 K346P338-A342 VanDerWaalsContact O-CB 3.29Å; P338-A342 WeakPolarHBondContact O-CB 3.29Å; P338-A342 PolarHBondContact O-N 3.21Å; I340-A342 PolarHBondContact O-N 2.91Å; A342-K346 WeakPolarHBondContact O-CG 3.48Å; A342-K346 PolarHBondContact O-N 3.41Å
343L77.6Confident73.6Confident14 Ų1476.8 Ų76.87%0.07344%0.436CS..Hα-helixtrans-68.9-47.6175-173.372.4000111.8L308 A311 V317 K339 I340 M341 T345 K346 L347L308-L343 HydrophobicContact CD2-CD1 3.31Å; L308-L343 HydrophobicContact CD2-CG 4.49Å; A311-L343 HydrophobicContact CB-CD1 3.82Å; V317-L343 HydrophobicContact CG1-CD2 3.54Å; K339-L343 PolarHBondContact O-N 3.19Å; I340-L343 WeakPolarHBondContact O-CB 3.38Å; I340-L343 PolarHBondContact O-N 2.91Å; M341-L343 PolarHBondContact O-N 2.81Å; L343-T345 PolarHBondContact O-N 2.9Å; L343-K346 PolarHBondContact O-N 3.47Å; L343-L347 HydrophobicContact CG-CD1 4.07Å; L343-L347 WeakPolarHBondContact O-CB 3.5Å; L343-L347 WeakPolarHBondContact O-CG 2.98Å; L343-L347 PolarHBondContact O-N 2.95Å
344V76.4Confident71.2Confident52 Ų5275.4 Ų75.432%0.31544%0.443SS..Hα-helixtrans-61.8-42.6179.7172.30000111.2I331 I340 M341 K346 L347 S348I331-V344 HydrophobicContact CD1-CG2 4.17Å; I340-V344 HydrophobicContact CG2-CG2 4.34Å; I340-V344 VanDerWaalsContact O-CG2 3.31Å; I340-V344 WeakPolarHBondContact O-CG2 3.48Å; I340-V344 PolarHBondContact O-N 2.94Å; M341-V344 PolarHBondContact O-N 3.18Å; V344-K346 PolarHBondContact O-N 2.58Å; V344-L347 PolarHBondContact O-N 2.92Å; V344-S348 WeakPolarHBondContact O-CB 3.41Å; V344-S348 PolarHBondContact O-N 2.71Å; V344-S348 PolarHBondContact O-OG 3.05Å
345T75.4Confident69Low81 Ų8179 Ų7950%0.49747%0.473SS..Hα-helixtrans-64.3-37.5175.9-570000112.3M341 L343 S348 A349M341-T345 WeakPolarHBondContact O-CB 3.4Å; M341-T345 PolarHBondContact O-N 3.21Å; M341-T345 PolarHBondContact O-OG1 2.64Å; L343-T345 PolarHBondContact O-N 2.9Å; T345-S348 WeakPolarHBondContact CA-OG 3.23Å; T345-S348 PolarHBondContact O-OG 2.89Å; T345-A349 VanDerWaalsContact O-CB 3.25Å; T345-A349 WeakPolarHBondContact O-CB 3.32Å; T345-A349 PolarHBondContact O-N 2.85Å
346K73.3Confident66.7Low94 Ų9482.3 Ų82.341%0.40949%0.488SS..Hα-helixtrans-69.7-39.9175.5-78.5-175.6179.7-171.90112.1E307 L308 A342 L343 V344 A349 K350E307-K346 IonicContact OE2-NZ 3.99Å; E307-K346 PolarHBondContact OE2-NZ 3.46Å; L308-K346 HydrophobicContact CD2-CB 4.49Å; A342-K346 WeakPolarHBondContact O-CG 3.48Å; A342-K346 PolarHBondContact O-N 3.41Å; L343-K346 PolarHBondContact O-N 3.47Å; V344-K346 PolarHBondContact O-N 2.58Å; K346-A349 PolarHBondContact O-N 3Å; K346-K350 WeakPolarHBondContact O-CB 3.37Å; K346-K350 PolarHBondContact O-N 2.94Å
347L71.4Confident64.9Low35 Ų3584.4 Ų84.418%0.18351%0.511CS..Hα-helixtrans-66.4-43176-72.1174000111.4L302 L308 L343 V344 K350 F351L302-L347 HydrophobicContact CD1-CD2 3.49Å; L302-L347 VanDerWaalsContact CD1-CD2 3.49Å; L302-L347 HydrophobicContact CG-CD2 4.03Å; L308-L347 HydrophobicContact CD1-CD2 3.92Å; L308-L347 HydrophobicContact CD2-CD2 4.11Å; L308-L347 HydrophobicContact CD2-CG 4.32Å; L343-L347 HydrophobicContact CG-CD1 4.07Å; L343-L347 WeakPolarHBondContact O-CB 3.5Å; L343-L347 WeakPolarHBondContact O-CG 2.98Å; L343-L347 PolarHBondContact O-N 2.95Å; V344-L347 PolarHBondContact O-N 2.92Å; L347-K350 PolarHBondContact O-N 3.24Å; L347-F351 HydrophobicContact CD2-CD2 4.32Å; L347-F351 HydrophobicContact CD2-CE2 4.08Å; L347-F351 WeakPolarHBondContact O-CD2 3.36Å; L347-F351 PolarHBondContact O-N 2.77Å
348S70.5Confident63.9Low63 Ų6387.3 Ų87.344%0.44153%0.529SS..Hα-helixtrans-66.9-36.3176.568.20000112.6V344 T345 G352V344-S348 WeakPolarHBondContact O-CB 3.41Å; V344-S348 PolarHBondContact O-N 2.71Å; V344-S348 PolarHBondContact O-OG 3.05Å; T345-S348 WeakPolarHBondContact CA-OG 3.23Å; T345-S348 PolarHBondContact O-OG 2.89Å; S348-G352 WeakPolarHBondContact O-CA 3.43Å; S348-G352 PolarHBondContact O-N 2.94Å
349A68.5Low63Low83 Ų8386.4 Ų86.469%0.68652%0.522SS*.Hα-helixtrans-67.7-33.5174.600000113.2T345 K346T345-A349 VanDerWaalsContact O-CB 3.25Å; T345-A349 WeakPolarHBondContact O-CB 3.32Å; T345-A349 PolarHBondContact O-N 2.85Å; K346-A349 PolarHBondContact O-N 3Å
350K64.1Low62.1Low127 Ų12785.9 Ų85.955%0.55253%0.527SS*.Hα-helixtrans-83.4-34.5-180-84-168.6167-1690114.4D305 K346 L347D305-K350 VanDerWaalsContact CG-NZ 3.35Å; D305-K350 WeakPolarHBondContact OD2-CE 3.17Å; D305-K350 IonicContact OD2-NZ 2.75Å; D305-K350 PolarHBondContact OD2-NZ 3.45Å; K346-K350 WeakPolarHBondContact O-CB 3.37Å; K346-K350 PolarHBondContact O-N 2.94Å; L347-K350 PolarHBondContact O-N 3.24Å
351F65.8Low60.9Low103 Ų10390.3 Ų90.345%0.45256%0.555SS.*Hα-helixtrans-105.6-6.5-176.4-67.1-78.7000113.9E301 L302 L347E301-F351 HydrophobicContact CB-CZ 4.4Å; L302-F351 HydrophobicContact CD1-CE2 3.9Å; L302-F351 HydrophobicContact CD1-CZ 4.26Å; L347-F351 HydrophobicContact CD2-CD2 4.32Å; L347-F351 HydrophobicContact CD2-CE2 4.08Å; L347-F351 WeakPolarHBondContact O-CD2 3.36Å; L347-F351 PolarHBondContact O-N 2.77Å
352G50.3Low59.8Low60 Ų6091.4 Ų91.462%0.61957%0.567SS**THydrogen-bonded Turntrans65.594.3161.100000116.4S348S348-G352 WeakPolarHBondContact O-CA 3.43Å; S348-G352 PolarHBondContact O-N 2.94Å
353A37.3Very low58.6Low88 Ų8893.9 Ų93.973%0.72758%0.576SS**  trans-121.2115.6138.200000106.7
354S33.9Very low57.2Low101 Ų10199.6 Ų99.671%0.70661%0.612SS**  trans-50.7140174.735.20000111.4Q356S354-Q356 PolarHBondContact O-N 2.8Å; S354-Q356 VanDerWaalsContact O-N 3.13Å
355P39.4Very low55.8Low131 Ų131103.3 Ų103.385%0.85164%0.635SS**  trans-70.1111.5172.228.9-29.2000107.5
356Q31.9Very low54.1Low176 Ų176105.2 Ų105.282%0.82265%0.646SS**  trans-86.4145.4165.2-87.3-164.5-20.800109.8S354S354-Q356 PolarHBondContact O-N 2.8Å; S354-Q356 VanDerWaalsContact O-N 3.13Å
357P43.3Very low52.4Low201 Ų201106.2 Ų106.2100%1.30567%0.668SS**  trans-66.30-162.927.3-36.7000115.4

Retrieved 357 of 357 residues in 116.6 ms (Link to these results)

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