A0A087XTF3_POEFO Loading...

Transmembrane protein 184C

AlphaFold DB , UniProt , Accession A0A087XTF3, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 447 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
1M34.2Very low56.9Low227 Ų227112.2 Ų112.2100%1.11861%0.606SS**  01070-67.6179.3173.200107.5
2P42Very low59Low134 Ų134104.8 Ų104.887%0.8757%0.566SS**  trans-83.2113.3171.731.3-24.4000107.8S4P2-S4 PolarHBondContact O-N 2.82Å
3C44.6Very low60.7Low110 Ų110102.2 Ų102.274%0.74354%0.543SS*.  trans-72.7112-179.8-65.60000110.4C5C3-C5 VanDerWaalsContact C-N 3.26Å; C3-C5 PolarHBondContact O-N 3.28Å
4S45.3Very low62.2Low125 Ų12599.4 Ų99.487%0.87453%0.533SS*.SBendtrans40.224.7131.9-161.40000120.9P2P2-S4 PolarHBondContact O-N 2.82Å
5C49.4Very low63.7Low79 Ų7999.2 Ų99.253%0.53453%0.531SS..  trans-1019.4-175.1-135.50000114.8C3C3-C5 VanDerWaalsContact C-N 3.26Å; C3-C5 PolarHBondContact O-N 3.28Å
6G53.7Low65Low45 Ų4595.1 Ų95.146%0.46451%0.511SS..THydrogen-bonded Turntrans-71.5-27.6177.600000114
7D63.4Low66.1Low76 Ų7693.2 Ų93.241%0.40650%0.503SS..THydrogen-bonded Turntrans-109.322.8-174.6-82-55.6000113.9R9 R10 W11D7-R9 PolarHBondContact O-N 2.73Å; D7-R9 VanDerWaalsContact O-N 3.11Å; D7-R10 WeakPolarHBondContact O-CB 3.41Å; D7-R10 PolarHBondContact O-N 3.38Å; D7-R10 WeakPolarHBondContact OD1-CD 3.46Å; D7-R10 IonicContact OD1-CZ 3.46Å; D7-R10 IonicContact OD1-NE 3.64Å; D7-R10 IonicContact OD1-NH1 2.82Å; D7-R10 PolarHBondContact OD1-NH1 2.79Å; D7-R10 IonicContact OD2-NH1 3.82Å; D7-W11 PolarHBondContact O-N 2.92Å
8W73.5Confident67.2Low24 Ų2492.4 Ų92.49%0.09150%0.502CS..Hα-helixtrans-56.7-34.6-174.575.7-96.1000113R10 W11 I12 L69 V322 C324W8-R10 PolarHBondContact O-N 3.45Å; W8-W11 PolarHBondContact O-N 3.16Å; W8-I12 HydrophobicContact CE3-CB 4.31Å; W8-I12 HydrophobicContact CE3-CD1 4.03Å; W8-I12 HydrophobicContact CE3-CG2 4.17Å; W8-I12 HydrophobicContact CZ3-CD1 3.81Å; W8-I12 HydrophobicContact CZ3-CG2 4.23Å; W8-I12 WeakPolarHBondContact O-CB 3.33Å; W8-I12 PolarHBondContact O-N 3.42Å; W8-L69 HydrophobicContact CH2-CG 4.33Å; W8-V322 PolarHBondContact NE1-O 3.11Å; W8-C324 HydrophobicContact CB-CB 3.96Å; W8-C324 HydrophobicContact CD2-CB 3.37Å; W8-C324 HydrophobicContact CE3-CB 3.48Å; W8-C324 VanDerWaalsContact CE3-CB 3.48Å; W8-C324 HydrophobicContact CG-CB 3.61Å; W8-C324 HydrophobicContact CZ2-CB 4.45Å; W8-C324 HydrophobicContact CZ3-CB 4.08Å
9R71.3Confident68.3Low45 Ų4592.9 Ų92.917%0.1750%0.503CS..Hα-helixtrans-59.8-28.8176.6-68.6-175.4-168.6-78.12.8112.9D7 L69 V70 E320D7-R9 PolarHBondContact O-N 2.73Å; D7-R9 VanDerWaalsContact O-N 3.11Å; R9-L69 PolarHBondContact NH1-O 2.86Å; R9-V70 HydrophobicContact CB-CG1 4.03Å; R9-V70 WeakPolarHBondContact CD-O 2.8Å; R9-V70 HydrophobicContact CG-CG1 4.38Å; R9-V70 VanDerWaalsContact NH1-C 3.29Å; R9-V70 PolarHBondContact NH1-O 3.31Å; R9-E320 PolarHBondContact NH2-O 2.88Å
10R71.3Confident69.2Low180 Ų18089.9 Ų89.968%0.67949%0.485SS*.Hα-helixtrans-82.8-38.1178.1-68.3-178.5175.3157.5-8.8112.4D7 W8 P14D7-R10 WeakPolarHBondContact O-CB 3.41Å; D7-R10 PolarHBondContact O-N 3.38Å; D7-R10 WeakPolarHBondContact OD1-CD 3.46Å; D7-R10 IonicContact OD1-CZ 3.46Å; D7-R10 IonicContact OD1-NE 3.64Å; D7-R10 IonicContact OD1-NH1 2.82Å; D7-R10 PolarHBondContact OD1-NH1 2.79Å; D7-R10 IonicContact OD2-NH1 3.82Å; W8-R10 PolarHBondContact O-N 3.45Å; R10-P14 WeakPolarHBondContact O-CD 3.24Å
11W77.6Confident70.1Confident189 Ų18989.6 Ų89.672%0.71648%0.482SS*.Hα-helixtrans-84.9-23.6-177.3-70.486.8000113.8D7 W8 R13 P14 L15D7-W11 PolarHBondContact O-N 2.92Å; W8-W11 PolarHBondContact O-N 3.16Å; W11-R13 PolarHBondContact O-N 3.48Å; W11-P14 VanDerWaalsContact O-CD 3.24Å; W11-P14 WeakPolarHBondContact O-CD 3.1Å; W11-P14 VanDerWaalsContact O-CG 3.28Å; W11-P14 WeakPolarHBondContact O-CG 3.13Å; W11-L15 WeakPolarHBondContact O-CB 3.23Å; W11-L15 PolarHBondContact O-N 3Å
12I81.4Confident72.6Confident24 Ų2483.4 Ų83.412%0.12345%0.453CS..Hα-helixtrans-66.5-35.7-177.7-163.3164.4000113.2W8 L15 V16 L66 L69 V70W8-I12 HydrophobicContact CE3-CB 4.31Å; W8-I12 HydrophobicContact CE3-CD1 4.03Å; W8-I12 HydrophobicContact CE3-CG2 4.17Å; W8-I12 HydrophobicContact CZ3-CD1 3.81Å; W8-I12 HydrophobicContact CZ3-CG2 4.23Å; W8-I12 WeakPolarHBondContact O-CB 3.33Å; W8-I12 PolarHBondContact O-N 3.42Å; I12-L15 PolarHBondContact O-N 3.26Å; I12-V16 HydrophobicContact CG1-CG2 4.36Å; I12-V16 WeakPolarHBondContact O-CG2 3.28Å; I12-V16 PolarHBondContact O-N 2.89Å; I12-L66 HydrophobicContact CD1-CD2 4.4Å; I12-L66 HydrophobicContact CG1-CD2 4.26Å; I12-L69 HydrophobicContact CD1-CD2 4.22Å; I12-V70 HydrophobicContact CG2-CG2 3.68Å
13R81.1Confident74.8Confident70 Ų7081.1 Ų81.126%0.26443%0.433SS..Hα-helixtrans-62.4-57177.4-65-179.5-176.8168.63.1112.2W11 L15 V16 V17 W63 V70 H71W11-R13 PolarHBondContact O-N 3.48Å; R13-L15 VanDerWaalsContact C-N 3.27Å; R13-L15 PolarHBondContact O-N 3.24Å; R13-V16 PolarHBondContact O-N 2.68Å; R13-V17 WeakPolarHBondContact O-CG2 3.42Å; R13-V17 PolarHBondContact O-N 3.26Å; R13-V17 VanDerWaalsContact O-N 3.17Å; R13-W63 HydrophobicContact CB-CH2 4.48Å; R13-W63 HydrophobicContact CB-CZ3 4.27Å; R13-V70 HydrophobicContact CG-CG2 4.36Å; R13-V70 VanDerWaalsContact NH2-CG1 3.31Å; R13-H71 PolarHBondContact NH2-CE1 2.94Å
14P82.5Confident76.8Confident64 Ų6477.6 Ų77.642%0.41641%0.407SS..Hα-helixtrans-64.3-33.8176.525.2-33.1000111.7R10 W11 V17 V18R10-P14 WeakPolarHBondContact O-CD 3.24Å; W11-P14 VanDerWaalsContact O-CD 3.24Å; W11-P14 WeakPolarHBondContact O-CD 3.1Å; W11-P14 VanDerWaalsContact O-CG 3.28Å; W11-P14 WeakPolarHBondContact O-CG 3.13Å; P14-V17 PolarHBondContact O-N 2.85Å; P14-V18 WeakPolarHBondContact O-CB 3.37Å; P14-V18 WeakPolarHBondContact O-CG2 3.07Å; P14-V18 PolarHBondContact O-N 3.32Å
15L84.8Confident78.9Confident96 Ų9676.7 Ų76.750%0.50339%0.391SS..Hα-helixtrans-61.2-47.5177.3-179.1145.9000112.3W11 I12 R13 V17 V18 L19W11-L15 WeakPolarHBondContact O-CB 3.23Å; W11-L15 PolarHBondContact O-N 3Å; I12-L15 PolarHBondContact O-N 3.26Å; R13-L15 VanDerWaalsContact C-N 3.27Å; R13-L15 PolarHBondContact O-N 3.24Å; L15-V17 VanDerWaalsContact C-N 3.35Å; L15-V17 PolarHBondContact O-N 2.78Å; L15-V18 PolarHBondContact O-N 3.5Å; L15-L19 HydrophobicContact CD2-CD1 3.54Å; L15-L19 HydrophobicContact CD2-CG 4.25Å; L15-L19 HydrophobicContact CG-CD1 4.34Å; L15-L19 WeakPolarHBondContact O-CB 3.39Å; L15-L19 VanDerWaalsContact O-CG 3.32Å; L15-L19 WeakPolarHBondContact O-CG 3.41Å; L15-L19 PolarHBondContact O-N 3.44Å
16V84Confident80.7Confident34 Ų3477.1 Ų77.121%0.20639%0.391CS..Hα-helixtrans-67.6-37.3178.4175.60000111.6I12 R13 L19 Y20 L66I12-V16 HydrophobicContact CG1-CG2 4.36Å; I12-V16 WeakPolarHBondContact O-CG2 3.28Å; I12-V16 PolarHBondContact O-N 2.89Å; R13-V16 PolarHBondContact O-N 2.68Å; V16-L19 PolarHBondContact O-N 3.35Å; V16-Y20 VanDerWaalsContact O-CB 3.24Å; V16-Y20 WeakPolarHBondContact O-CB 3.36Å; V16-Y20 PolarHBondContact O-N 3Å; V16-L66 HydrophobicContact CB-CD1 3.67Å; V16-L66 HydrophobicContact CG1-CD1 3.71Å; V16-L66 HydrophobicContact CG2-CD1 3.91Å; V16-L66 HydrophobicContact CG2-CD2 3.99Å
17V84.5Confident82.1Confident62 Ų6276.6 Ų76.638%0.37638%0.378SS..Hα-helixtrans-62.1-45.5174.1172.70000110.8R13 P14 L15 Y20 I21 W63R13-V17 WeakPolarHBondContact O-CG2 3.42Å; R13-V17 PolarHBondContact O-N 3.26Å; R13-V17 VanDerWaalsContact O-N 3.17Å; P14-V17 PolarHBondContact O-N 2.85Å; L15-V17 VanDerWaalsContact C-N 3.35Å; L15-V17 PolarHBondContact O-N 2.78Å; V17-Y20 PolarHBondContact O-N 3.46Å; V17-I21 HydrophobicContact CG1-CD1 3.78Å; V17-I21 HydrophobicContact CG1-CG1 4.47Å; V17-I21 VanDerWaalsContact O-CG1 3.24Å; V17-I21 WeakPolarHBondContact O-CG1 3.41Å; V17-I21 PolarHBondContact O-N 3.33Å; V17-W63 HydrophobicContact CG2-CZ3 4.25Å
18V85.8Confident83.1Confident79 Ų7976.3 Ų76.348%0.47938%0.377SS..Hα-helixtrans-63.8-46.2177.4169.80000111P14 L15 Y20 I21 L22P14-V18 WeakPolarHBondContact O-CB 3.37Å; P14-V18 WeakPolarHBondContact O-CG2 3.07Å; P14-V18 PolarHBondContact O-N 3.32Å; L15-V18 PolarHBondContact O-N 3.5Å; V18-Y20 VanDerWaalsContact C-N 3.29Å; V18-Y20 PolarHBondContact O-N 3.03Å; V18-I21 PolarHBondContact O-N 2.82Å; V18-L22 HydrophobicContact CG1-CD1 4Å; V18-L22 HydrophobicContact CG1-CG 4.32Å; V18-L22 WeakPolarHBondContact O-CB 3.26Å; V18-L22 VanDerWaalsContact O-CG 3.29Å; V18-L22 WeakPolarHBondContact O-CG 3.43Å; V18-L22 PolarHBondContact O-N 2.85Å
19L87.2Confident83.7Confident102 Ų10278.7 Ų78.753%0.53440%0.395SS..Hα-helixtrans-59.5-41.4176.3-74.9178000111.9L15 V16 L22 L23L15-L19 HydrophobicContact CD2-CD1 3.54Å; L15-L19 HydrophobicContact CD2-CG 4.25Å; L15-L19 HydrophobicContact CG-CD1 4.34Å; L15-L19 WeakPolarHBondContact O-CB 3.39Å; L15-L19 VanDerWaalsContact O-CG 3.32Å; L15-L19 WeakPolarHBondContact O-CG 3.41Å; L15-L19 PolarHBondContact O-N 3.44Å; V16-L19 PolarHBondContact O-N 3.35Å; L19-L22 PolarHBondContact O-N 3.44Å; L19-L23 WeakPolarHBondContact O-CB 3.2Å; L19-L23 PolarHBondContact O-N 3.5Å
20Y87.2Confident84.2Confident33 Ų3381.2 Ų81.213%0.12941%0.411CS..Hα-helixtrans-67.4-40.1177.1179.5-95.9000112V16 V17 V18 L23 L24 F55 I58 P59V16-Y20 VanDerWaalsContact O-CB 3.24Å; V16-Y20 WeakPolarHBondContact O-CB 3.36Å; V16-Y20 PolarHBondContact O-N 3Å; V17-Y20 PolarHBondContact O-N 3.46Å; V18-Y20 VanDerWaalsContact C-N 3.29Å; V18-Y20 PolarHBondContact O-N 3.03Å; Y20-L23 WeakPolarHBondContact O-CB 3.43Å; Y20-L23 PolarHBondContact O-N 3.35Å; Y20-L24 HydrophobicContact CD1-CD1 4.03Å; Y20-L24 HydrophobicContact CD1-CG 4.45Å; Y20-L24 HydrophobicContact CE1-CD1 3.29Å; Y20-L24 HydrophobicContact CE1-CG 3.83Å; Y20-L24 PolarHBondContact O-N 3.43Å; Y20-F55 PolarHBondContact OH-O 3Å; Y20-I58 HydrophobicContact CD2-CG2 4.22Å; Y20-I58 HydrophobicContact CE2-CB 4.3Å; Y20-I58 HydrophobicContact CE2-CG2 3.9Å; Y20-P59 HydrophobicContact CD1-CB 4.28Å; Y20-P59 HydrophobicContact CE1-CB 4Å; Y20-P59 HydrophobicContact CE1-CG 3.96Å; Y20-P59 HydrophobicContact CE2-CB 4.44Å; Y20-P59 HydrophobicContact CE2-CG 4.37Å
21I86.6Confident84.7Confident84 Ų8473 Ų7343%0.43138%0.381SS..Hα-helixtrans-63.3-44.7173.5-69.6165.8000110.8V17 V18 L23 L24 I25V17-I21 HydrophobicContact CG1-CD1 3.78Å; V17-I21 HydrophobicContact CG1-CG1 4.47Å; V17-I21 VanDerWaalsContact O-CG1 3.24Å; V17-I21 WeakPolarHBondContact O-CG1 3.41Å; V17-I21 PolarHBondContact O-N 3.33Å; V18-I21 PolarHBondContact O-N 2.82Å; I21-L23 VanDerWaalsContact C-N 3.3Å; I21-L23 PolarHBondContact O-N 3.17Å; I21-L24 WeakPolarHBondContact O-CB 3.32Å; I21-L24 PolarHBondContact O-N 2.81Å; I21-I25 HydrophobicContact CG2-CD1 3.91Å; I21-I25 HydrophobicContact CG2-CG1 4.46Å; I21-I25 VanDerWaalsContact O-CG1 3.3Å; I21-I25 WeakPolarHBondContact O-CG1 3.4Å; I21-I25 PolarHBondContact O-N 3.46Å
22L88.3Confident84.9Confident96 Ų9667.8 Ų67.850%0.50337%0.367SS..Hα-helixtrans-60.5-41.7175.6-71173.4000111.2V18 L19 I25 V26V18-L22 HydrophobicContact CG1-CD1 4Å; V18-L22 HydrophobicContact CG1-CG 4.32Å; V18-L22 WeakPolarHBondContact O-CB 3.26Å; V18-L22 VanDerWaalsContact O-CG 3.29Å; V18-L22 WeakPolarHBondContact O-CG 3.43Å; V18-L22 PolarHBondContact O-N 2.85Å; L19-L22 PolarHBondContact O-N 3.44Å; L22-I25 PolarHBondContact O-N 3.32Å; L22-V26 WeakPolarHBondContact O-CG2 3.34Å; L22-V26 PolarHBondContact O-N 2.82Å
23L87.3Confident85Confident86 Ų8673.2 Ų73.245%0.4539%0.386SS..Hα-helixtrans-61.5-45.1174.2-176.2147.5000111.1L19 Y20 I21 I25 V26 V27L19-L23 WeakPolarHBondContact O-CB 3.2Å; L19-L23 PolarHBondContact O-N 3.5Å; Y20-L23 WeakPolarHBondContact O-CB 3.43Å; Y20-L23 PolarHBondContact O-N 3.35Å; I21-L23 VanDerWaalsContact C-N 3.3Å; I21-L23 PolarHBondContact O-N 3.17Å; L23-I25 VanDerWaalsContact C-N 3.33Å; L23-I25 PolarHBondContact O-N 3.41Å; L23-V26 PolarHBondContact O-N 3.43Å; L23-V26 VanDerWaalsContact O-N 3.15Å; L23-V27 HydrophobicContact CD2-CB 4.38Å; L23-V27 HydrophobicContact CD2-CG2 3.8Å; L23-V27 HydrophobicContact CG-CG2 3.98Å; L23-V27 WeakPolarHBondContact O-CB 3.29Å; L23-V27 VanDerWaalsContact O-CG2 3.25Å; L23-V27 WeakPolarHBondContact O-CG2 3.48Å; L23-V27 PolarHBondContact O-N 2.91Å
24L87.1Confident84.9Confident37 Ų3772.3 Ų72.319%0.19439%0.385CS..Hα-helixtrans-60.7-40.5174.9-83.1177.2000112.5Y20 I21 V26 V27 L28 F55Y20-L24 HydrophobicContact CD1-CD1 4.03Å; Y20-L24 HydrophobicContact CD1-CG 4.45Å; Y20-L24 HydrophobicContact CE1-CD1 3.29Å; Y20-L24 HydrophobicContact CE1-CG 3.83Å; Y20-L24 PolarHBondContact O-N 3.43Å; I21-L24 WeakPolarHBondContact O-CB 3.32Å; I21-L24 PolarHBondContact O-N 2.81Å; L24-V26 PolarHBondContact O-N 3.33Å; L24-V27 PolarHBondContact O-N 3.17Å; L24-L28 HydrophobicContact CB-CD1 4.18Å; L24-L28 HydrophobicContact CD2-CD1 4.05Å; L24-L28 HydrophobicContact CD2-CG 4.07Å; L24-L28 WeakPolarHBondContact O-CB 3.49Å; L24-L28 WeakPolarHBondContact O-CG 2.95Å; L24-L28 PolarHBondContact O-N 2.95Å; L24-F55 HydrophobicContact CD2-CB 4.16Å; L24-F55 HydrophobicContact CD2-CD1 3.68Å; L24-F55 HydrophobicContact CD2-CE1 4.32Å; L24-F55 HydrophobicContact CD2-CG 3.88Å
25I88.1Confident84.7Confident106 Ų10671.6 Ų71.654%0.54438%0.377SS..Hα-helixtrans-61.9-29.8177.3-70.6166.2000111.5I21 L22 L23 P29I21-I25 HydrophobicContact CG2-CD1 3.91Å; I21-I25 HydrophobicContact CG2-CG1 4.46Å; I21-I25 VanDerWaalsContact O-CG1 3.3Å; I21-I25 WeakPolarHBondContact O-CG1 3.4Å; I21-I25 PolarHBondContact O-N 3.46Å; L22-I25 PolarHBondContact O-N 3.32Å; L23-I25 VanDerWaalsContact C-N 3.33Å; L23-I25 PolarHBondContact O-N 3.41Å; I25-P29 WeakPolarHBondContact O-CD 3.29Å; I25-P29 WeakPolarHBondContact O-CG 3.45Å
26V87.2Confident84.4Confident88 Ų8874.1 Ų74.153%0.53339%0.386SS..Hα-helixtrans-86.9-45.7176.8176.10000111.4L22 L23 L24 P29 L30L22-V26 WeakPolarHBondContact O-CG2 3.34Å; L22-V26 PolarHBondContact O-N 2.82Å; L23-V26 PolarHBondContact O-N 3.43Å; L23-V26 VanDerWaalsContact O-N 3.15Å; L24-V26 PolarHBondContact O-N 3.33Å; V26-P29 WeakPolarHBondContact O-CD 3.4Å; V26-L30 HydrophobicContact CG1-CD1 3.95Å; V26-L30 VanDerWaalsContact O-CG 3.28Å; V26-L30 WeakPolarHBondContact O-CG 3.33Å; V26-L30 PolarHBondContact O-N 3.21Å
27V84.4Confident84.2Confident33 Ų3379.1 Ų79.120%0.241%0.405CS..Hα-helixtrans-76.3-38.4-171.6178.60000111.9L23 L24 L30 V31 F55 W96L23-V27 HydrophobicContact CD2-CB 4.38Å; L23-V27 HydrophobicContact CD2-CG2 3.8Å; L23-V27 HydrophobicContact CG-CG2 3.98Å; L23-V27 WeakPolarHBondContact O-CB 3.29Å; L23-V27 VanDerWaalsContact O-CG2 3.25Å; L23-V27 WeakPolarHBondContact O-CG2 3.48Å; L23-V27 PolarHBondContact O-N 2.91Å; L24-V27 PolarHBondContact O-N 3.17Å; V27-L30 PolarHBondContact O-N 3.26Å; V27-V31 HydrophobicContact CG1-CG2 3.85Å; V27-V31 WeakPolarHBondContact O-CB 3.34Å; V27-V31 WeakPolarHBondContact O-CG2 3.15Å; V27-V31 PolarHBondContact O-N 3.32Å; V27-F55 HydrophobicContact CB-CE1 4.39Å; V27-F55 HydrophobicContact CB-CZ 4.35Å; V27-F55 HydrophobicContact CG1-CE1 3.73Å; V27-F55 HydrophobicContact CG1-CE2 4.33Å; V27-F55 HydrophobicContact CG1-CZ 3.31Å; V27-W96 HydrophobicContact CG1-CH2 4.49Å
28L83.7Confident83.3Confident71 Ų7178.5 Ų78.537%0.37240%0.404SS..Hα-helixtrans-60.4-48.8178.3-75.3167.1000112.2L24 L30 V31 I32L24-L28 HydrophobicContact CB-CD1 4.18Å; L24-L28 HydrophobicContact CD2-CD1 4.05Å; L24-L28 HydrophobicContact CD2-CG 4.07Å; L24-L28 WeakPolarHBondContact O-CB 3.49Å; L24-L28 WeakPolarHBondContact O-CG 2.95Å; L24-L28 PolarHBondContact O-N 2.95Å; L28-L30 VanDerWaalsContact C-N 3.32Å; L28-L30 PolarHBondContact O-N 2.95Å; L28-V31 PolarHBondContact O-N 3.09Å; L28-I32 WeakPolarHBondContact O-CB 3.11Å; L28-I32 WeakPolarHBondContact O-CD1 3.34Å; L28-I32 WeakPolarHBondContact O-CG1 3.24Å; L28-I32 PolarHBondContact O-N 3.21Å
29P85.7Confident82Confident74 Ų7476.4 Ų76.448%0.48140%0.398SS..Hα-helixtrans-61.2-37.7174.4-26.837.3000113.5I25 V26 I32 W33I25-P29 WeakPolarHBondContact O-CD 3.29Å; I25-P29 WeakPolarHBondContact O-CG 3.45Å; V26-P29 WeakPolarHBondContact O-CD 3.4Å; P29-I32 PolarHBondContact O-N 2.95Å; P29-W33 WeakPolarHBondContact O-CB 2.95Å; P29-W33 PolarHBondContact O-N 2.8Å
30L82.7Confident80.8Confident97 Ų9777 Ų7751%0.50841%0.406SS..Hα-helixtrans-64.4-44.2176.3-72.8172.3000111.8V26 V27 L28 W33 E34V26-L30 HydrophobicContact CG1-CD1 3.95Å; V26-L30 VanDerWaalsContact O-CG 3.28Å; V26-L30 WeakPolarHBondContact O-CG 3.33Å; V26-L30 PolarHBondContact O-N 3.21Å; V27-L30 PolarHBondContact O-N 3.26Å; L28-L30 VanDerWaalsContact C-N 3.32Å; L28-L30 PolarHBondContact O-N 2.95Å; L30-W33 PolarHBondContact O-N 2.8Å; L30-E34 VanDerWaalsContact O-CB 3.3Å; L30-E34 WeakPolarHBondContact O-CB 3.15Å; L30-E34 PolarHBondContact O-N 3.34Å
31V81.9Confident79.9Confident8 Ų876.3 Ų76.35%0.04841%0.408CS..Hα-helixtrans-64.1-41.6177.2169.20000110.9V27 L28 L35 W47 F48 W96V27-V31 HydrophobicContact CG1-CG2 3.85Å; V27-V31 WeakPolarHBondContact O-CB 3.34Å; V27-V31 WeakPolarHBondContact O-CG2 3.15Å; V27-V31 PolarHBondContact O-N 3.32Å; L28-V31 PolarHBondContact O-N 3.09Å; V31-L35 WeakPolarHBondContact O-CB 3.28Å; V31-L35 PolarHBondContact O-N 3.49Å; V31-W47 HydrophobicContact CB-CH2 4.41Å; V31-W47 HydrophobicContact CB-CZ3 4.42Å; V31-W47 HydrophobicContact CG1-CH2 4.19Å; V31-W47 HydrophobicContact CG1-CZ3 3.82Å; V31-W47 HydrophobicContact CG2-CH2 3.89Å; V31-W47 HydrophobicContact CG2-CZ3 4.36Å; V31-F48 HydrophobicContact CG1-CD2 3.41Å; V31-F48 VanDerWaalsContact CG1-CD2 3.41Å; V31-F48 HydrophobicContact CG1-CE2 3.63Å; V31-W96 HydrophobicContact CG2-CH2 4.29Å; V31-W96 HydrophobicContact CG2-CZ2 4.07Å
32I82.3Confident79.1Confident79 Ų7974.8 Ų74.841%0.40540%0.403SS..Hα-helixtrans-68.1-42.6177-67.3164.2000111L28 P29 L35 Q36 F48L28-I32 WeakPolarHBondContact O-CB 3.11Å; L28-I32 WeakPolarHBondContact O-CD1 3.34Å; L28-I32 WeakPolarHBondContact O-CG1 3.24Å; L28-I32 PolarHBondContact O-N 3.21Å; P29-I32 PolarHBondContact O-N 2.95Å; I32-L35 WeakPolarHBondContact O-CB 3.3Å; I32-L35 PolarHBondContact O-N 3.34Å; I32-Q36 WeakPolarHBondContact O-CG 3.48Å; I32-Q36 PolarHBondContact O-N 3.45Å; I32-F48 HydrophobicContact CG1-CE2 4.3Å
33W82.8Confident78.3Confident139 Ų13972 Ų7253%0.52739%0.387SS..Hα-helixtrans-63.1-43.6177.4178.865.6000111.6P29 L30 Q36 K37P29-W33 WeakPolarHBondContact O-CB 2.95Å; P29-W33 PolarHBondContact O-N 2.8Å; L30-W33 PolarHBondContact O-N 2.8Å; W33-Q36 PolarHBondContact O-N 3.34Å; W33-K37 HydrophobicContact CH2-CD 4.24Å; W33-K37 HydrophobicContact CZ2-CD 4.1Å; W33-K37 VanDerWaalsContact O-CB 3.3Å; W33-K37 WeakPolarHBondContact O-CB 3.29Å; W33-K37 PolarHBondContact O-N 3.49Å
34E79.3Confident77.9Confident51 Ų5168.8 Ų68.824%0.23837%0.37CS..Hα-helixtrans-62.8-42.4174.8-172.467.2-170.400111.1L30 Q36 K37 S38 K100L30-E34 VanDerWaalsContact O-CB 3.3Å; L30-E34 WeakPolarHBondContact O-CB 3.15Å; L30-E34 PolarHBondContact O-N 3.34Å; E34-Q36 VanDerWaalsContact C-N 3.31Å; E34-Q36 PolarHBondContact O-N 2.94Å; E34-K37 PolarHBondContact O-N 3.17Å; E34-S38 WeakPolarHBondContact O-CB 3.49Å; E34-S38 PolarHBondContact O-N 3.21Å; E34-S38 PolarHBondContact O-OG 3.17Å; E34-S38 VanDerWaalsContact O-OG 3.08Å; E34-S38 PolarHBondContact OE1-OG 3.48Å; E34-K100 IonicContact OE1-NZ 3.48Å; E34-K100 PolarHBondContact OE1-NZ 2.91Å
35L78.4Confident77.5Confident49 Ų4971.6 Ų71.626%0.25738%0.381SS..Hα-helixtrans-60.6-38.8175.4-173.169.8000112.3V31 I32 N44 F48V31-L35 WeakPolarHBondContact O-CB 3.28Å; V31-L35 PolarHBondContact O-N 3.49Å; I32-L35 WeakPolarHBondContact O-CB 3.3Å; I32-L35 PolarHBondContact O-N 3.34Å; L35-N44 HydrophobicContact CD1-CB 3.95Å; L35-F48 HydrophobicContact CD1-CB 4.3Å; L35-F48 HydrophobicContact CD2-CD2 3.95Å; L35-F48 HydrophobicContact CD2-CE2 4.26Å; L35-F48 HydrophobicContact CD2-CG 4.12Å
36Q78.8Confident77.3Confident149 Ų14968 Ų6870%0.69637%0.367SS*.Hα-helixtrans-72.5-39.6176.8-73.7-177.8-39.900112.3I32 W33 E34I32-Q36 WeakPolarHBondContact O-CG 3.48Å; I32-Q36 PolarHBondContact O-N 3.45Å; W33-Q36 PolarHBondContact O-N 3.34Å; E34-Q36 VanDerWaalsContact C-N 3.31Å; E34-Q36 PolarHBondContact O-N 2.94Å
37K78.3Confident77.2Confident138 Ų13864.9 Ų64.960%0.635%0.346SS*.Hα-helixtrans-72.5-40-177.6-175.3179.2179.7-175.40112.8W33 E34 G39W33-K37 HydrophobicContact CH2-CD 4.24Å; W33-K37 HydrophobicContact CZ2-CD 4.1Å; W33-K37 VanDerWaalsContact O-CB 3.3Å; W33-K37 WeakPolarHBondContact O-CB 3.29Å; W33-K37 PolarHBondContact O-N 3.49Å; E34-K37 PolarHBondContact O-N 3.17Å; K37-G39 PolarHBondContact O-N 3.41Å
38S66.6Low77.4Confident50 Ų5066 Ų6635%0.3535%0.348SS..THydrogen-bonded Turntrans-79.8-0.8-174.9-57.50000114.2E34 N44E34-S38 WeakPolarHBondContact O-CB 3.49Å; E34-S38 PolarHBondContact O-N 3.21Å; E34-S38 PolarHBondContact O-OG 3.17Å; E34-S38 VanDerWaalsContact O-OG 3.08Å; E34-S38 PolarHBondContact OE1-OG 3.48Å; S38-N44 WeakPolarHBondContact CB-ND2 3.49Å; S38-N44 PolarHBondContact O-ND2 3.39Å
39G58.9Low77.6Confident34 Ų3466.2 Ų66.235%0.35135%0.349SS..  trans67.6161.6-175.900000112.7K37 G41 N44K37-G39 PolarHBondContact O-N 3.41Å; G39-G41 PolarHBondContact O-N 3.07Å; G39-N44 PolarHBondContact O-ND2 3.21Å
40V62Low77.7Confident116 Ų11662.7 Ų62.770%0.70333%0.326SS*.SBendtrans-77.946-166.3-164.50000112.4
41G67.8Low78Confident17 Ų1758.1 Ų58.118%0.17530%0.302CS..  trans-67.5139.2170.800000110.8G39 H43 N44 K45G39-G41 PolarHBondContact O-N 3.07Å; G41-H43 PolarHBondContact O-N 2.96Å; G41-N44 PolarHBondContact O-N 3.11Å; G41-N44 VanDerWaalsContact O-N 3.11Å; G41-K45 PolarHBondContact O-N 2.96Å
42T69.9Low78.4Confident53 Ų5361.1 Ų61.133%0.32532%0.317SS..Hα-helixtrans-58.9-31.9-179.8-50.90000112.5N44 K45 A46 W278T42-N44 PolarHBondContact O-N 3.31Å; T42-K45 WeakPolarHBondContact O-CB 3.22Å; T42-K45 PolarHBondContact O-N 2.88Å; T42-A46 PolarHBondContact O-N 3.42Å; T42-W278 VanDerWaalsContact CB-CZ3 3.42Å; T42-W278 HydrophobicContact CG2-CD2 4.03Å; T42-W278 HydrophobicContact CG2-CE3 3.34Å; T42-W278 HydrophobicContact CG2-CH2 3.62Å; T42-W278 HydrophobicContact CG2-CZ2 4.3Å; T42-W278 HydrophobicContact CG2-CZ3 3.12Å; T42-W278 WeakPolarHBondContact OG1-CZ3 3.4Å
43H71.7Confident78.8Confident38 Ų3860.1 Ų60.118%0.17631%0.31CS..Hα-helixtrans-55.2-50.9173.3178.279.5000112.4G41 K45 A46 W47 L99 W280G41-H43 PolarHBondContact O-N 2.96Å; H43-K45 VanDerWaalsContact C-N 3.27Å; H43-K45 PolarHBondContact O-N 3.28Å; H43-A46 PolarHBondContact O-N 2.84Å; H43-W47 PolarHBondContact O-N 2.89Å; H43-L99 PolarHBondContact CE1-O 2.57Å; H43-L99 PolarHBondContact NE2-O 3.44Å; H43-W280 AromaticContact CE1-CH2 3.33Å; H43-W280 WeakPolarHBondContact CE1-CH2 3.35Å; H43-W280 AromaticContact CE1-CZ2 3.32Å; H43-W280 WeakPolarHBondContact CE1-CZ2 3.18Å; H43-W280 AromaticContact ND1-CE2 3.39Å; H43-W280 AromaticContact ND1-CH2 3.39Å; H43-W280 WeakPolarHBondContact ND1-CH2 3.24Å; H43-W280 AromaticContact ND1-CZ2 2.84Å; H43-W280 WeakPolarHBondContact ND1-CZ2 3.35Å; H43-W280 AromaticContact ND1-NE1 3.85Å
44N78.1Confident79.2Confident18 Ų1853.5 Ų53.510%0.09629%0.285CS..Hα-helixtrans-65.6-32179.6-62.3-34000111.8L35 S38 G39 G41 T42 F48L35-N44 HydrophobicContact CD1-CB 3.95Å; S38-N44 WeakPolarHBondContact CB-ND2 3.49Å; S38-N44 PolarHBondContact O-ND2 3.39Å; G39-N44 PolarHBondContact O-ND2 3.21Å; G41-N44 PolarHBondContact O-N 3.11Å; G41-N44 VanDerWaalsContact O-N 3.11Å; T42-N44 PolarHBondContact O-N 3.31Å; N44-F48 VanDerWaalsContact O-CB 3.31Å; N44-F48 WeakPolarHBondContact O-CB 3.25Å; N44-F48 PolarHBondContact O-N 2.89Å
45K80.1Confident79.7Confident96 Ų9652 Ų5242%0.41728%0.278SS..Hα-helixtrans-66-46.2173.2-63.8179.7-176.2171.20111.8G41 T42 H43 W47 F48 I49G41-K45 PolarHBondContact O-N 2.96Å; T42-K45 WeakPolarHBondContact O-CB 3.22Å; T42-K45 PolarHBondContact O-N 2.88Å; H43-K45 VanDerWaalsContact C-N 3.27Å; H43-K45 PolarHBondContact O-N 3.28Å; K45-W47 VanDerWaalsContact C-N 3.34Å; K45-F48 PolarHBondContact O-N 3.39Å; K45-I49 WeakPolarHBondContact O-CD1 3.5Å; K45-I49 VanDerWaalsContact O-CG1 3.27Å; K45-I49 WeakPolarHBondContact O-CG1 3.41Å; K45-I49 PolarHBondContact O-N 3.17Å
46A82.8Confident80.3Confident30 Ų3054.3 Ų54.325%0.24829%0.288CS..Hα-helixtrans-62-44.1177.600000110.9T42 H43 F48 I49 A50 F293T42-A46 PolarHBondContact O-N 3.42Å; H43-A46 PolarHBondContact O-N 2.84Å; A46-F48 PolarHBondContact O-N 3.34Å; A46-I49 PolarHBondContact O-N 2.89Å; A46-A50 WeakPolarHBondContact O-CB 3.45Å; A46-A50 PolarHBondContact O-N 3.32Å; A46-F293 HydrophobicContact CB-CD2 4.26Å
47W86.2Confident80.9Confident23 Ų2347.2 Ų47.29%0.08726%0.255CS..Hα-helixtrans-61.2-41175.2179.779.4000113.4V31 H43 K45 G51 W96 L99V31-W47 HydrophobicContact CB-CH2 4.41Å; V31-W47 HydrophobicContact CB-CZ3 4.42Å; V31-W47 HydrophobicContact CG1-CH2 4.19Å; V31-W47 HydrophobicContact CG1-CZ3 3.82Å; V31-W47 HydrophobicContact CG2-CH2 3.89Å; V31-W47 HydrophobicContact CG2-CZ3 4.36Å; H43-W47 PolarHBondContact O-N 2.89Å; K45-W47 VanDerWaalsContact C-N 3.34Å; W47-G51 PolarHBondContact O-N 2.84Å; W47-W96 AromaticContact CD1-CD1 3.69Å; W47-W96 AromaticContact CD1-NE1 3.61Å; W47-W96 AromaticContact CD2-NE1 3.79Å; W47-W96 AromaticContact CE2-CE2 3.53Å; W47-W96 AromaticContact CE2-CZ2 3.72Å; W47-W96 AromaticContact CE2-NE1 3.28Å; W47-W96 VanDerWaalsContact CE2-NE1 3.28Å; W47-W96 HydrophobicContact CH2-CH2 4.45Å; W47-W96 AromaticContact CH2-CZ2 3.71Å; W47-W96 HydrophobicContact CH2-CZ2 3.71Å; W47-W96 HydrophobicContact CZ2-CD2 4.5Å; W47-W96 AromaticContact CZ2-CE2 3.51Å; W47-W96 AromaticContact CZ2-CH2 3.92Å; W47-W96 HydrophobicContact CZ2-CH2 3.92Å; W47-W96 AromaticContact CZ2-CZ2 3.17Å; W47-W96 HydrophobicContact CZ2-CZ2 3.17Å; W47-W96 AromaticContact CZ2-NE1 3.75Å; W47-W96 AromaticContact NE1-CD1 3.44Å; W47-W96 AromaticContact NE1-CE2 3.54Å; W47-W96 AromaticContact NE1-CG 4Å; W47-W96 AromaticContact NE1-NE1 3.11Å; W47-W96 VanDerWaalsContact NE1-NE1 3.11Å; W47-W96 PolarHBondContact NE1-O 3.22Å; W47-W96 PolarHBondContact O-NE1 3.19Å; W47-W96 VanDerWaalsContact O-NE1 3.17Å; W47-L99 HydrophobicContact CB-CD2 4.13Å; W47-L99 HydrophobicContact CB-CG 4.38Å
48F86.8Confident81.5Confident55 Ų5541.8 Ų41.824%0.24123%0.232CC..Hα-helixtrans-63.5-46.4175.6-177.1-97.4000112V31 I32 L35 N44 K45 A46 G51 I52V31-F48 HydrophobicContact CG1-CD2 3.41Å; V31-F48 VanDerWaalsContact CG1-CD2 3.41Å; V31-F48 HydrophobicContact CG1-CE2 3.63Å; I32-F48 HydrophobicContact CG1-CE2 4.3Å; L35-F48 HydrophobicContact CD1-CB 4.3Å; L35-F48 HydrophobicContact CD2-CD2 3.95Å; L35-F48 HydrophobicContact CD2-CE2 4.26Å; L35-F48 HydrophobicContact CD2-CG 4.12Å; N44-F48 VanDerWaalsContact O-CB 3.31Å; N44-F48 WeakPolarHBondContact O-CB 3.25Å; N44-F48 PolarHBondContact O-N 2.89Å; K45-F48 PolarHBondContact O-N 3.39Å; A46-F48 PolarHBondContact O-N 3.34Å; F48-G51 PolarHBondContact O-N 3.34Å; F48-I52 HydrophobicContact CD1-CD1 4.1Å; F48-I52 HydrophobicContact CE1-CD1 3.72Å; F48-I52 HydrophobicContact CE1-CG1 4.42Å; F48-I52 HydrophobicContact CZ-CD1 4.43Å; F48-I52 PolarHBondContact O-N 2.97Å; F48-I52 VanDerWaalsContact O-N 3.13Å
49I87.9Confident82.6Confident77 Ų7741.3 Ų41.340%0.39523%0.228SC..Hα-helixtrans-64-45.8178.7-66163.8000110.6K45 A46 G51 I52 F53 F293K45-I49 WeakPolarHBondContact O-CD1 3.5Å; K45-I49 VanDerWaalsContact O-CG1 3.27Å; K45-I49 WeakPolarHBondContact O-CG1 3.41Å; K45-I49 PolarHBondContact O-N 3.17Å; A46-I49 PolarHBondContact O-N 2.89Å; I49-G51 VanDerWaalsContact C-N 3.27Å; I49-G51 PolarHBondContact O-N 3.47Å; I49-I52 WeakPolarHBondContact O-CB 3.45Å; I49-I52 PolarHBondContact O-N 2.86Å; I49-I52 VanDerWaalsContact O-N 3.15Å; I49-F53 HydrophobicContact CG2-CD2 4.22Å; I49-F53 HydrophobicContact CG2-CE2 3.83Å; I49-F53 VanDerWaalsContact O-CD2 3.3Å; I49-F53 WeakPolarHBondContact O-CD2 3.43Å; I49-F53 PolarHBondContact O-N 3.2Å; I49-F293 HydrophobicContact CB-CE2 4.06Å; I49-F293 HydrophobicContact CG2-CE2 3.81Å; I49-F293 HydrophobicContact CG2-CZ 3.99Å
50A88.4Confident84.1Confident0 Ų042.1 Ų42.10%022%0.224CC..Hα-helixtrans-56.1-44.2173.500000111.2A46 I52 F53 V54 L99 F293 C296A46-A50 WeakPolarHBondContact O-CB 3.45Å; A46-A50 PolarHBondContact O-N 3.32Å; A50-I52 VanDerWaalsContact C-N 3.3Å; A50-I52 PolarHBondContact O-N 3.41Å; A50-F53 WeakPolarHBondContact O-CB 3.44Å; A50-F53 PolarHBondContact O-N 3.04Å; A50-V54 WeakPolarHBondContact O-CG2 3.37Å; A50-V54 PolarHBondContact O-N 3.21Å; A50-L99 HydrophobicContact CB-CD2 3.92Å; A50-F293 HydrophobicContact CB-CD2 3.92Å; A50-F293 HydrophobicContact CB-CE2 4.33Å; A50-C296 HydrophobicContact CB-CB 3.98Å
51G89.5Confident85.4Confident1 Ų136.9 Ų36.91%0.0119%0.192CC..Hα-helixtrans-54.4-43.5175.900000112.9W47 F48 I49 F53 V54 F55 W96W47-G51 PolarHBondContact O-N 2.84Å; F48-G51 PolarHBondContact O-N 3.34Å; I49-G51 VanDerWaalsContact C-N 3.27Å; I49-G51 PolarHBondContact O-N 3.47Å; G51-F53 VanDerWaalsContact C-N 3.33Å; G51-F53 PolarHBondContact O-N 3.11Å; G51-V54 PolarHBondContact O-N 3.28Å; G51-F55 WeakPolarHBondContact O-CD2 3.34Å; G51-F55 WeakPolarHBondContact O-CG 3.21Å; G51-F55 PolarHBondContact O-N 2.89Å; G51-W96 VanDerWaalsContact CA-NE1 3.26Å
52I89.7Confident86.4Confident70 Ų7038 Ų3836%0.35919%0.194SC..Hα-helixtrans-58-45.7176.2-64.1168.9000111.1F48 I49 A50 V54 F55 M56F48-I52 HydrophobicContact CD1-CD1 4.1Å; F48-I52 HydrophobicContact CE1-CD1 3.72Å; F48-I52 HydrophobicContact CE1-CG1 4.42Å; F48-I52 HydrophobicContact CZ-CD1 4.43Å; F48-I52 PolarHBondContact O-N 2.97Å; F48-I52 VanDerWaalsContact O-N 3.13Å; I49-I52 WeakPolarHBondContact O-CB 3.45Å; I49-I52 PolarHBondContact O-N 2.86Å; I49-I52 VanDerWaalsContact O-N 3.15Å; A50-I52 VanDerWaalsContact C-N 3.3Å; A50-I52 PolarHBondContact O-N 3.41Å; I52-V54 PolarHBondContact O-N 3.25Å; I52-F55 PolarHBondContact O-N 3.48Å; I52-M56 HydrophobicContact CG2-CE 3.95Å; I52-M56 WeakPolarHBondContact O-CG 3.43Å; I52-M56 PolarHBondContact O-N 2.57Å
53F91.1Very high87.3Confident58 Ų5840 Ų4025%0.25420%0.196SC..Hα-helixtrans-63.7-40.1177.1-72.9-73.1000112.1I49 A50 G51 M56 T57 V297 F300I49-F53 HydrophobicContact CG2-CD2 4.22Å; I49-F53 HydrophobicContact CG2-CE2 3.83Å; I49-F53 VanDerWaalsContact O-CD2 3.3Å; I49-F53 WeakPolarHBondContact O-CD2 3.43Å; I49-F53 PolarHBondContact O-N 3.2Å; A50-F53 WeakPolarHBondContact O-CB 3.44Å; A50-F53 PolarHBondContact O-N 3.04Å; G51-F53 VanDerWaalsContact C-N 3.33Å; G51-F53 PolarHBondContact O-N 3.11Å; F53-M56 PolarHBondContact O-N 3.13Å; F53-T57 WeakPolarHBondContact O-CB 3.46Å; F53-T57 PolarHBondContact O-N 3.43Å; F53-T57 PolarHBondContact O-OG1 3.37Å; F53-V297 HydrophobicContact CD2-CG2 3.83Å; F53-V297 HydrophobicContact CE2-CG2 3.87Å; F53-V297 HydrophobicContact CG-CG2 4.21Å; F53-V297 HydrophobicContact CZ-CG2 4.28Å; F53-F300 HydrophobicContact CD1-CB 4.3Å; F53-F300 HydrophobicContact CD1-CD1 4.28Å; F53-F300 HydrophobicContact CD1-CG 4.29Å
54V91Very high87.9Confident0 Ų038.4 Ų38.40%019%0.189CC..Hα-helixtrans-63.7-44.8175.3177.20000111.4A50 G51 I52 M56 T57 I58 S92 L93 W96 C296A50-V54 WeakPolarHBondContact O-CG2 3.37Å; A50-V54 PolarHBondContact O-N 3.21Å; G51-V54 PolarHBondContact O-N 3.28Å; I52-V54 PolarHBondContact O-N 3.25Å; V54-M56 PolarHBondContact O-N 3.36Å; V54-T57 WeakPolarHBondContact O-CB 3.46Å; V54-T57 PolarHBondContact O-N 2.95Å; V54-T57 VanDerWaalsContact O-N 3.07Å; V54-I58 HydrophobicContact CG1-CD1 3.72Å; V54-I58 HydrophobicContact CG1-CG1 4.19Å; V54-I58 WeakPolarHBondContact O-CG1 3.45Å; V54-I58 PolarHBondContact O-N 2.89Å; V54-S92 VanDerWaalsContact CG2-O 3.31Å; V54-S92 WeakPolarHBondContact CG2-O 3.36Å; V54-L93 HydrophobicContact CG1-CD2 4.04Å; V54-L93 HydrophobicContact CG1-CG 4.39Å; V54-W96 HydrophobicContact CG2-CB 3.83Å; V54-W96 HydrophobicContact CG2-CG 4.25Å; V54-C296 HydrophobicContact CG2-CB 4.21Å
55F90.2Very high88.4Confident20 Ų2037.9 Ų37.99%0.08819%0.186CC..Hα-helixtrans-61.9-32.4175.1-68.6-56.7000111.8Y20 L24 V27 G51 I52 P59 W96Y20-F55 PolarHBondContact OH-O 3Å; L24-F55 HydrophobicContact CD2-CB 4.16Å; L24-F55 HydrophobicContact CD2-CD1 3.68Å; L24-F55 HydrophobicContact CD2-CE1 4.32Å; L24-F55 HydrophobicContact CD2-CG 3.88Å; V27-F55 HydrophobicContact CB-CE1 4.39Å; V27-F55 HydrophobicContact CB-CZ 4.35Å; V27-F55 HydrophobicContact CG1-CE1 3.73Å; V27-F55 HydrophobicContact CG1-CE2 4.33Å; V27-F55 HydrophobicContact CG1-CZ 3.31Å; G51-F55 WeakPolarHBondContact O-CD2 3.34Å; G51-F55 WeakPolarHBondContact O-CG 3.21Å; G51-F55 PolarHBondContact O-N 2.89Å; I52-F55 PolarHBondContact O-N 3.48Å; F55-P59 WeakPolarHBondContact O-CD 3.21Å; F55-P59 WeakPolarHBondContact O-CG 3.45Å; F55-W96 HydrophobicContact CE2-CH2 4.5Å; F55-W96 HydrophobicContact CE2-CZ2 4.34Å; F55-W96 AromaticContact CZ-CH2 3.91Å; F55-W96 HydrophobicContact CZ-CH2 3.91Å; F55-W96 HydrophobicContact CZ-CZ2 4.21Å; F55-W96 HydrophobicContact CZ-CZ3 4.49Å
56M90Very high88.6Confident97 Ų9733.9 Ų33.948%0.47817%0.17SC..Hα-helixtrans-75.1-34.2171.8-67.4-174.4-178.500113.1I52 F53 V54 P59 I60 F300I52-M56 HydrophobicContact CG2-CE 3.95Å; I52-M56 WeakPolarHBondContact O-CG 3.43Å; I52-M56 PolarHBondContact O-N 2.57Å; F53-M56 PolarHBondContact O-N 3.13Å; V54-M56 PolarHBondContact O-N 3.36Å; M56-P59 WeakPolarHBondContact O-CD 3.39Å; M56-P59 WeakPolarHBondContact O-CG 3.43Å; M56-I60 WeakPolarHBondContact O-CD1 3.21Å; M56-I60 VanDerWaalsContact O-CG1 3.31Å; M56-I60 WeakPolarHBondContact O-CG1 3.5Å; M56-F300 HydrophobicContact CB-CD2 3.82Å; M56-F300 HydrophobicContact CB-CE2 3.68Å; M56-F300 HydrophobicContact SD-CE2 4.38Å
57T91.9Very high88.5Confident0 Ų032.8 Ų32.80%016%0.159CC..Hα-helixtrans-68-47.7-177.1-60.80000112.5F53 V54 I60 S61 V88 M299 F300 A303F53-T57 WeakPolarHBondContact O-CB 3.46Å; F53-T57 PolarHBondContact O-N 3.43Å; F53-T57 PolarHBondContact O-OG1 3.37Å; V54-T57 WeakPolarHBondContact O-CB 3.46Å; V54-T57 PolarHBondContact O-N 2.95Å; V54-T57 VanDerWaalsContact O-N 3.07Å; T57-I60 PolarHBondContact O-N 3.3Å; T57-S61 PolarHBondContact O-N 3.3Å; T57-V88 HydrophobicContact CG2-CG1 3.57Å; T57-M299 HydrophobicContact CG2-CB 4.17Å; T57-M299 WeakPolarHBondContact CG2-O 3.46Å; T57-F300 WeakPolarHBondContact OG1-CA 3.21Å; T57-F300 VanDerWaalsContact OG1-CB 3.32Å; T57-F300 WeakPolarHBondContact OG1-CB 3.37Å; T57-F300 PolarHBondContact OG1-N 2.84Å; T57-A303 HydrophobicContact CG2-CB 3.98Å
58I91.2Very high88.4Confident24 Ų2431.8 Ų31.812%0.12316%0.156CC..Hα-helixtrans-54.4-54.2-177.6-69.6170.2000112.9Y20 V54 I60 S61 L62 L93Y20-I58 HydrophobicContact CD2-CG2 4.22Å; Y20-I58 HydrophobicContact CE2-CB 4.3Å; Y20-I58 HydrophobicContact CE2-CG2 3.9Å; V54-I58 HydrophobicContact CG1-CD1 3.72Å; V54-I58 HydrophobicContact CG1-CG1 4.19Å; V54-I58 WeakPolarHBondContact O-CG1 3.45Å; V54-I58 PolarHBondContact O-N 2.89Å; I58-I60 VanDerWaalsContact C-N 3.33Å; I58-I60 PolarHBondContact O-N 3.46Å; I58-S61 PolarHBondContact O-N 3.04Å; I58-L62 HydrophobicContact CG2-CD1 3.48Å; I58-L62 VanDerWaalsContact CG2-CD1 3.48Å; I58-L62 HydrophobicContact CG2-CG 4Å; I58-L62 VanDerWaalsContact O-CB 3.29Å; I58-L62 WeakPolarHBondContact O-CB 3.27Å; I58-L62 VanDerWaalsContact O-CG 3.23Å; I58-L62 WeakPolarHBondContact O-CG 3.33Å; I58-L62 PolarHBondContact O-N 3.31Å; I58-L93 HydrophobicContact CD1-CD1 4.27Å; I58-L93 HydrophobicContact CD1-CD2 3.67Å; I58-L93 HydrophobicContact CD1-CG 3.92Å
59P90.2Very high88.1Confident41 Ų4129.4 Ų29.427%0.26615%0.146SC..Hα-helixtrans-66.4-33.7-177.426-34.2000112.3Y20 F55 M56 W63Y20-P59 HydrophobicContact CD1-CB 4.28Å; Y20-P59 HydrophobicContact CE1-CB 4Å; Y20-P59 HydrophobicContact CE1-CG 3.96Å; Y20-P59 HydrophobicContact CE2-CB 4.44Å; Y20-P59 HydrophobicContact CE2-CG 4.37Å; F55-P59 WeakPolarHBondContact O-CD 3.21Å; F55-P59 WeakPolarHBondContact O-CG 3.45Å; M56-P59 WeakPolarHBondContact O-CD 3.39Å; M56-P59 WeakPolarHBondContact O-CG 3.43Å; P59-W63 WeakPolarHBondContact O-CB 3.42Å; P59-W63 PolarHBondContact O-N 3.1Å
60I89.1Confident87.6Confident50 Ų5026.2 Ų26.226%0.25613%0.13SC..Hα-helixtrans-63.5-48.8175.7-64.5170.4000110.1M56 T57 I58 W63 G64 F300 A303 I304M56-I60 WeakPolarHBondContact O-CD1 3.21Å; M56-I60 VanDerWaalsContact O-CG1 3.31Å; M56-I60 WeakPolarHBondContact O-CG1 3.5Å; T57-I60 PolarHBondContact O-N 3.3Å; I58-I60 VanDerWaalsContact C-N 3.33Å; I58-I60 PolarHBondContact O-N 3.46Å; I60-W63 PolarHBondContact O-N 3.35Å; I60-G64 PolarHBondContact O-N 3.12Å; I60-G64 VanDerWaalsContact O-N 3.11Å; I60-F300 HydrophobicContact CD1-CD2 4.17Å; I60-F300 HydrophobicContact CD1-CE2 3.62Å; I60-A303 HydrophobicContact CB-CB 4.2Å; I60-A303 HydrophobicContact CG2-CB 3.89Å; I60-I304 HydrophobicContact CD1-CG1 4.29Å
61S90.3Very high87.1Confident6 Ų627.9 Ų27.94%0.04214%0.137CC..Hα-helixtrans-67.3-46.1178.7-178.80000112T57 I58 W63 G64 I65 L85 P89T57-S61 PolarHBondContact O-N 3.3Å; I58-S61 PolarHBondContact O-N 3.04Å; S61-W63 VanDerWaalsContact C-N 3.28Å; S61-W63 PolarHBondContact O-N 2.8Å; S61-G64 WeakPolarHBondContact O-CA 3.08Å; S61-G64 PolarHBondContact O-N 3.09Å; S61-I65 WeakPolarHBondContact O-CG1 3.46Å; S61-I65 PolarHBondContact O-N 2.9Å; S61-L85 PolarHBondContact OG-O 3.46Å; S61-P89 WeakPolarHBondContact OG-CD 3.29Å
62L88.8Confident86.5Confident40 Ų4028.6 Ų28.621%0.20914%0.14CC..Hα-helixtrans-58.7-40176.5-73.1179.6000111.7I58 I65 L66 W86I58-L62 HydrophobicContact CG2-CD1 3.48Å; I58-L62 VanDerWaalsContact CG2-CD1 3.48Å; I58-L62 HydrophobicContact CG2-CG 4Å; I58-L62 VanDerWaalsContact O-CB 3.29Å; I58-L62 WeakPolarHBondContact O-CB 3.27Å; I58-L62 VanDerWaalsContact O-CG 3.23Å; I58-L62 WeakPolarHBondContact O-CG 3.33Å; I58-L62 PolarHBondContact O-N 3.31Å; L62-I65 PolarHBondContact O-N 3.18Å; L62-L66 WeakPolarHBondContact O-CB 3.28Å; L62-L66 WeakPolarHBondContact O-CG 3.36Å; L62-L66 PolarHBondContact O-N 3.31Å; L62-W86 HydrophobicContact CD2-CH2 4.18Å
63W88Confident85.9Confident96 Ų9627 Ų2736%0.36413%0.134SC..Hα-helixtrans-62.2-43.9174.4-172.2-102.4000111.6R13 V17 P59 I60 S61 L66 Q67R13-W63 HydrophobicContact CB-CH2 4.48Å; R13-W63 HydrophobicContact CB-CZ3 4.27Å; V17-W63 HydrophobicContact CG2-CZ3 4.25Å; P59-W63 WeakPolarHBondContact O-CB 3.42Å; P59-W63 PolarHBondContact O-N 3.1Å; I60-W63 PolarHBondContact O-N 3.35Å; S61-W63 VanDerWaalsContact C-N 3.28Å; S61-W63 PolarHBondContact O-N 2.8Å; W63-L66 PolarHBondContact O-N 3.1Å; W63-Q67 VanDerWaalsContact CE2-NE2 3.32Å; W63-Q67 VanDerWaalsContact O-CG 3.25Å; W63-Q67 WeakPolarHBondContact O-CG 2.96Å; W63-Q67 PolarHBondContact O-N 2.93Å
64G85.8Confident85.3Confident4 Ų426.1 Ų26.14%0.04113%0.13CC..Hα-helixtrans-56.5-49.6173.100000112.5I60 S61 L66 Q67 H68I60-G64 PolarHBondContact O-N 3.12Å; I60-G64 VanDerWaalsContact O-N 3.11Å; S61-G64 WeakPolarHBondContact O-CA 3.08Å; S61-G64 PolarHBondContact O-N 3.09Å; G64-L66 PolarHBondContact O-N 2.89Å; G64-Q67 PolarHBondContact O-N 2.97Å; G64-H68 PolarHBondContact O-CD2 2.88Å; G64-H68 PolarHBondContact O-N 3.39Å
65I86.9Confident84.8Confident7 Ų728.7 Ų28.74%0.03615%0.147CC..Hα-helixtrans-60.6-45.6178.3-66.2163.4000111.1S61 L62 Q67 H68 L69 I82 L85 W86 M331S61-I65 WeakPolarHBondContact O-CG1 3.46Å; S61-I65 PolarHBondContact O-N 2.9Å; L62-I65 PolarHBondContact O-N 3.18Å; I65-Q67 VanDerWaalsContact C-N 3.32Å; I65-Q67 PolarHBondContact O-N 3.06Å; I65-H68 PolarHBondContact O-N 3.16Å; I65-L69 PolarHBondContact O-N 2.77Å; I65-I82 HydrophobicContact CG2-CG2 3.9Å; I65-L85 HydrophobicContact CD1-CB 4.29Å; I65-L85 HydrophobicContact CG1-CB 3.73Å; I65-W86 HydrophobicContact CD1-CD2 3.93Å; I65-W86 HydrophobicContact CD1-CE3 4.5Å; I65-W86 HydrophobicContact CD1-CG 4.06Å; I65-W86 HydrophobicContact CD1-CZ2 4.41Å; I65-M331 HydrophobicContact CG2-SD 4.45Å
66L84.6Confident84.4Confident13 Ų1332.7 Ų32.77%0.06817%0.166CC..Hα-helixtrans-63.3-36.9178.5-75.1171.4000112.8I12 V16 L62 W63 G64 H68 L69 V70I12-L66 HydrophobicContact CD1-CD2 4.4Å; I12-L66 HydrophobicContact CG1-CD2 4.26Å; V16-L66 HydrophobicContact CB-CD1 3.67Å; V16-L66 HydrophobicContact CG1-CD1 3.71Å; V16-L66 HydrophobicContact CG2-CD1 3.91Å; V16-L66 HydrophobicContact CG2-CD2 3.99Å; L62-L66 WeakPolarHBondContact O-CB 3.28Å; L62-L66 WeakPolarHBondContact O-CG 3.36Å; L62-L66 PolarHBondContact O-N 3.31Å; W63-L66 PolarHBondContact O-N 3.1Å; G64-L66 PolarHBondContact O-N 2.89Å; L66-H68 VanDerWaalsContact C-N 3.31Å; L66-H68 PolarHBondContact O-N 3.16Å; L66-L69 PolarHBondContact O-N 3.27Å; L66-V70 WeakPolarHBondContact O-CB 3.49Å; L66-V70 VanDerWaalsContact O-CG2 3.26Å; L66-V70 WeakPolarHBondContact O-CG2 3.21Å; L66-V70 PolarHBondContact O-N 2.86Å
67Q81.8Confident84.1Confident6 Ų628.3 Ų28.33%0.02814%0.144CC..Hα-helixtrans-65.5-37177.1-69.9-66.7-14.400111.8W63 G64 I65 H71 Y312W63-Q67 VanDerWaalsContact CE2-NE2 3.32Å; W63-Q67 VanDerWaalsContact O-CG 3.25Å; W63-Q67 WeakPolarHBondContact O-CG 2.96Å; W63-Q67 PolarHBondContact O-N 2.93Å; G64-Q67 PolarHBondContact O-N 2.97Å; I65-Q67 VanDerWaalsContact C-N 3.32Å; I65-Q67 PolarHBondContact O-N 3.06Å; Q67-H71 PolarHBondContact O-N 3.29Å; Q67-H71 PolarHBondContact O-ND1 3.41Å; Q67-H71 PolarHBondContact OE1-CE1 2.59Å; Q67-Y312 HydrophobicContact CB-CD1 3.49Å; Q67-Y312 VanDerWaalsContact CB-CD1 3.49Å; Q67-Y312 HydrophobicContact CB-CD2 4.05Å; Q67-Y312 HydrophobicContact CB-CE1 3.9Å; Q67-Y312 HydrophobicContact CB-CE2 4.4Å; Q67-Y312 HydrophobicContact CB-CG 3.58Å; Q67-Y312 HydrophobicContact CG-CD1 3.95Å; Q67-Y312 HydrophobicContact CG-CE1 3.81Å; Q67-Y312 HydrophobicContact CG-CE2 4.48Å; Q67-Y312 HydrophobicContact CG-CG 4.36Å
68H83.4Confident83.8Confident2 Ų228.3 Ų28.31%0.00914%0.144CC..Hα-helixtrans-68.5-36.8171.9-75-69.9000112.5G64 I65 L66 H71 Y72 Q78 I82 L85 F310G64-H68 PolarHBondContact O-CD2 2.88Å; G64-H68 PolarHBondContact O-N 3.39Å; I65-H68 PolarHBondContact O-N 3.16Å; L66-H68 VanDerWaalsContact C-N 3.31Å; L66-H68 PolarHBondContact O-N 3.16Å; H68-H71 CarbonylContact O-C 3.59Å; H68-Y72 PolarHBondContact O-N 3Å; H68-Q78 PolarHBondContact O-NE2 3.38Å; H68-I82 HydrophobicContact CB-CD1 4.04Å; H68-I82 HydrophobicContact CB-CG1 3.8Å; H68-L85 VanDerWaalsContact CD2-CD1 3.5Å; H68-L85 WeakPolarHBondContact CD2-CD1 3.34Å; H68-F310 PolarHBondContact CE1-O 3.14Å; H68-F310 PolarHBondContact NE2-O 3.33Å
69L79.4Confident83.6Confident6 Ų629.4 Ų29.43%0.03115%0.148CC..Hα-helixtrans-71.3-38.4177.2-170.567.7000112.7W8 R9 I12 I65 L66 H71 Y72W8-L69 HydrophobicContact CH2-CG 4.33Å; R9-L69 PolarHBondContact NH1-O 2.86Å; I12-L69 HydrophobicContact CD1-CD2 4.22Å; I65-L69 PolarHBondContact O-N 2.77Å; L66-L69 PolarHBondContact O-N 3.27Å; L69-H71 VanDerWaalsContact C-N 3.33Å; L69-Y72 VanDerWaalsContact O-CB 3.29Å; L69-Y72 WeakPolarHBondContact O-CB 3.25Å; L69-Y72 PolarHBondContact O-N 2.99Å
70V77.8Confident83.6Confident10 Ų1027.5 Ų27.56%0.06114%0.136CC..Hα-helixtrans-73-27.81791700000111.6R9 I12 R13 L66R9-V70 HydrophobicContact CB-CG1 4.03Å; R9-V70 WeakPolarHBondContact CD-O 2.8Å; R9-V70 HydrophobicContact CG-CG1 4.38Å; R9-V70 VanDerWaalsContact NH1-C 3.29Å; R9-V70 PolarHBondContact NH1-O 3.31Å; I12-V70 HydrophobicContact CG2-CG2 3.68Å; R13-V70 HydrophobicContact CG-CG2 4.36Å; R13-V70 VanDerWaalsContact NH2-CG1 3.31Å; L66-V70 WeakPolarHBondContact O-CB 3.49Å; L66-V70 VanDerWaalsContact O-CG2 3.26Å; L66-V70 WeakPolarHBondContact O-CG2 3.21Å; L66-V70 PolarHBondContact O-N 2.86Å
71H78.2Confident83.6Confident34 Ų3425.2 Ų25.216%0.15712%0.124CC..THydrogen-bonded Turntrans-109.745.2174.2-53.499.4000110.9R13 Q67 H68 L69 T73 Q78 Y312R13-H71 PolarHBondContact NH2-CE1 2.94Å; Q67-H71 PolarHBondContact O-N 3.29Å; Q67-H71 PolarHBondContact O-ND1 3.41Å; Q67-H71 PolarHBondContact OE1-CE1 2.59Å; H68-H71 CarbonylContact O-C 3.59Å; L69-H71 VanDerWaalsContact C-N 3.33Å; H71-T73 PolarHBondContact O-N 3.48Å; H71-T73 PolarHBondContact O-OG1 2.73Å; H71-Q78 PolarHBondContact O-NE2 3.28Å; H71-Q78 PolarHBondContact O-OE1 3.15Å; H71-Y312 AromaticContact ND1-CD2 3.88Å
72Y76.5Confident83.5Confident17 Ų1725 Ų257%0.06712%0.122CC..  trans-75.474.8-177.1-161.7-109.6000111.5H68 L69 P75 Q78 K79 I82H68-Y72 PolarHBondContact O-N 3Å; L69-Y72 VanDerWaalsContact O-CB 3.29Å; L69-Y72 WeakPolarHBondContact O-CB 3.25Å; L69-Y72 PolarHBondContact O-N 2.99Å; Y72-P75 HydrophobicContact CE1-CB 3.68Å; Y72-P75 HydrophobicContact CE2-CB 4.5Å; Y72-P75 WeakPolarHBondContact OH-CB 3.23Å; Y72-Q78 VanDerWaalsContact CA-OE1 3.25Å; Y72-Q78 HydrophobicContact CD2-CB 4Å; Y72-Q78 HydrophobicContact CE2-CB 3.93Å; Y72-K79 HydrophobicContact CE2-CG 4.38Å; Y72-K79 WeakPolarHBondContact OH-CE 3.27Å; Y72-K79 WeakPolarHBondContact OH-CG 3.29Å; Y72-I82 HydrophobicContact CD2-CD1 4.4Å; Y72-I82 HydrophobicContact CE2-CD1 4.21Å
73T77.1Confident83.6Confident37 Ų3723.5 Ų23.523%0.22711%0.114CC..  trans-94.7-31.3-177.848.50000112.3H71 Y315 Q317 A319H71-T73 PolarHBondContact O-N 3.48Å; H71-T73 PolarHBondContact O-OG1 2.73Å; T73-Y315 VanDerWaalsContact CG2-O 3.29Å; T73-Y315 WeakPolarHBondContact CG2-O 3.47Å; T73-Y315 PolarHBondContact OG1-O 3.44Å; T73-Y315 VanDerWaalsContact OG1-O 3.09Å; T73-Q317 HydrophobicContact CG2-CB 4.17Å; T73-Q317 VanDerWaalsContact CG2-O 3.23Å; T73-Q317 WeakPolarHBondContact CG2-O 3.42Å; T73-A319 HydrophobicContact CG2-CB 3.64Å
74Q79.1Confident83.7Confident39 Ų3919 Ų1918%0.18210%0.097CC..  trans-130.182.7-173.5-68-174.2-9.800110.2E76 L77 Q78 Y315Q74-E76 VanDerWaalsContact C-N 3.25Å; Q74-E76 PolarHBondContact O-N 3.4Å; Q74-L77 PolarHBondContact O-N 2.82Å; Q74-L77 VanDerWaalsContact O-N 3.17Å; Q74-Q78 WeakPolarHBondContact O-CB 3.43Å; Q74-Q78 WeakPolarHBondContact O-CG 3.4Å; Q74-Q78 PolarHBondContact O-N 3.24Å; Q74-Q78 PolarHBondContact O-OE1 3.43Å; Q74-Y315 HydrophobicContact CB-CD1 4.25Å; Q74-Y315 HydrophobicContact CB-CE1 4.31Å
75P80.6Confident83.9Confident53 Ų5318.9 Ų18.934%0.34410%0.095SC..Hα-helixtrans-57.6-36.7-175.120.2-32000113Y72 L77 K79Y72-P75 HydrophobicContact CE1-CB 3.68Å; Y72-P75 HydrophobicContact CE2-CB 4.5Å; Y72-P75 WeakPolarHBondContact OH-CB 3.23Å; P75-L77 VanDerWaalsContact C-N 3.28Å; P75-L77 PolarHBondContact O-N 3.17Å; P75-K79 VanDerWaalsContact O-CB 3.28Å; P75-K79 WeakPolarHBondContact O-CB 3.25Å; P75-K79 WeakPolarHBondContact O-CG 3.34Å; P75-K79 PolarHBondContact O-N 2.8Å
76E81Confident84Confident104 Ų10421.4 Ų21.449%0.48611%0.105SC..Hα-helixtrans-61.1-33.7-178.9-64.5171171.700113.3Q74 P80 N129 R133Q74-E76 VanDerWaalsContact C-N 3.25Å; Q74-E76 PolarHBondContact O-N 3.4Å; E76-P80 VanDerWaalsContact O-CD 3.27Å; E76-P80 WeakPolarHBondContact O-CD 3.19Å; E76-N129 PolarHBondContact O-ND2 2.92Å; E76-R133 IonicContact OE2-NH1 3.39Å; E76-R133 PolarHBondContact OE2-NH1 2.9Å
77L84Confident84.3Confident5 Ų520.9 Ų20.93%0.02610%0.102CC..Hα-helixtrans-95.4-37179.2-60.5-173.9000112.2Q74 P75 P80 I81 F126 N129 Y130 Y315Q74-L77 PolarHBondContact O-N 2.82Å; Q74-L77 VanDerWaalsContact O-N 3.17Å; P75-L77 VanDerWaalsContact C-N 3.28Å; P75-L77 PolarHBondContact O-N 3.17Å; L77-P80 WeakPolarHBondContact O-CD 3.33Å; L77-I81 WeakPolarHBondContact O-CD1 3.06Å; L77-I81 VanDerWaalsContact O-CG1 3.27Å; L77-I81 WeakPolarHBondContact O-CG1 3.26Å; L77-I81 PolarHBondContact O-N 3.3Å; L77-F126 HydrophobicContact CB-CE2 4.27Å; L77-F126 HydrophobicContact CD2-CD2 4.41Å; L77-F126 HydrophobicContact CD2-CE2 4.38Å; L77-N129 HydrophobicContact CD2-CB 3.69Å; L77-Y130 HydrophobicContact CD1-CD2 4.19Å; L77-Y315 HydrophobicContact CB-CE1 4.31Å; L77-Y315 HydrophobicContact CD1-CE1 4.35Å
78Q85.9Confident84.7Confident0 Ų020.6 Ų20.60%010%0.1CC..Hα-helixtrans-78.6-32.2-174.9-67.3177.5-63.600112.6H68 H71 Y72 Q74 I81 I82 Y315H68-Q78 PolarHBondContact O-NE2 3.38Å; H71-Q78 PolarHBondContact O-NE2 3.28Å; H71-Q78 PolarHBondContact O-OE1 3.15Å; Y72-Q78 VanDerWaalsContact CA-OE1 3.25Å; Y72-Q78 HydrophobicContact CD2-CB 4Å; Y72-Q78 HydrophobicContact CE2-CB 3.93Å; Q74-Q78 WeakPolarHBondContact O-CB 3.43Å; Q74-Q78 WeakPolarHBondContact O-CG 3.4Å; Q74-Q78 PolarHBondContact O-N 3.24Å; Q74-Q78 PolarHBondContact O-OE1 3.43Å; Q78-I81 PolarHBondContact O-N 3.4Å; Q78-I82 HydrophobicContact CB-CD1 4.48Å; Q78-I82 WeakPolarHBondContact O-CB 3.44Å; Q78-I82 WeakPolarHBondContact O-CD1 3.27Å; Q78-I82 WeakPolarHBondContact O-CG1 3.47Å; Q78-I82 PolarHBondContact O-N 2.87Å; Q78-Y315 HydrophobicContact CG-CD1 4.04Å; Q78-Y315 HydrophobicContact CG-CD2 4.3Å; Q78-Y315 HydrophobicContact CG-CE1 4.09Å; Q78-Y315 HydrophobicContact CG-CE2 4.35Å; Q78-Y315 HydrophobicContact CG-CG 4.16Å
79K87.6Confident85.1Confident47 Ų4720.8 Ų20.820%0.20410%0.102CC..Hα-helixtrans-57.1-53.2175.6-71.6174.6-175.5-1690111.7Y72 P75 I81 I82 R83 A330Y72-K79 HydrophobicContact CE2-CG 4.38Å; Y72-K79 WeakPolarHBondContact OH-CE 3.27Å; Y72-K79 WeakPolarHBondContact OH-CG 3.29Å; P75-K79 VanDerWaalsContact O-CB 3.28Å; P75-K79 WeakPolarHBondContact O-CB 3.25Å; P75-K79 WeakPolarHBondContact O-CG 3.34Å; P75-K79 PolarHBondContact O-N 2.8Å; K79-I81 PolarHBondContact O-N 3.43Å; K79-I82 PolarHBondContact O-N 2.88Å; K79-R83 WeakPolarHBondContact O-CG 3.45Å; K79-R83 PolarHBondContact O-N 2.86Å; K79-R83 VanDerWaalsContact O-N 3.13Å; K79-A330 WeakPolarHBondContact CD-O 3.4Å; K79-A330 WeakPolarHBondContact CE-O 3.34Å
80P89.2Confident85.6Confident2 Ų223.1 Ų23.11%0.01311%0.114CC..Hα-helixtrans-61.9-39.4176.9-25.436.5000113.6E76 L77 I82 R83 I84 N122 T125 F126E76-P80 VanDerWaalsContact O-CD 3.27Å; E76-P80 WeakPolarHBondContact O-CD 3.19Å; L77-P80 WeakPolarHBondContact O-CD 3.33Å; P80-I82 PolarHBondContact O-N 2.56Å; P80-R83 PolarHBondContact O-N 3.31Å; P80-I84 WeakPolarHBondContact O-CD1 3.4Å; P80-I84 VanDerWaalsContact O-CG1 3.27Å; P80-I84 WeakPolarHBondContact O-CG1 3.15Å; P80-I84 PolarHBondContact O-N 3.43Å; P80-N122 HydrophobicContact CB-CB 4.25Å; P80-N122 WeakPolarHBondContact CB-O 3.49Å; P80-T125 HydrophobicContact CG-CG2 4.31Å; P80-F126 HydrophobicContact CB-CB 3.82Å; P80-F126 HydrophobicContact CG-CB 4.48Å
81I88.6Confident86.1Confident2 Ų223 Ų231%0.0111%0.112CC..Hα-helixtrans-60.5-47.2177.5-70.4168.7000111L77 Q78 K79 R83 I84 L85 F126 F310 Y315L77-I81 WeakPolarHBondContact O-CD1 3.06Å; L77-I81 VanDerWaalsContact O-CG1 3.27Å; L77-I81 WeakPolarHBondContact O-CG1 3.26Å; L77-I81 PolarHBondContact O-N 3.3Å; Q78-I81 PolarHBondContact O-N 3.4Å; K79-I81 PolarHBondContact O-N 3.43Å; I81-R83 VanDerWaalsContact C-N 3.32Å; I81-R83 PolarHBondContact O-N 3.03Å; I81-I84 WeakPolarHBondContact O-CB 3.47Å; I81-I84 PolarHBondContact O-N 2.87Å; I81-I84 VanDerWaalsContact O-N 3.09Å; I81-L85 HydrophobicContact CG2-CD1 3.57Å; I81-L85 HydrophobicContact CG2-CG 4.44Å; I81-L85 WeakPolarHBondContact O-CD1 3.28Å; I81-L85 PolarHBondContact O-N 3.23Å; I81-F126 HydrophobicContact CD1-CD2 4Å; I81-F126 HydrophobicContact CD1-CE2 3.46Å; I81-F126 VanDerWaalsContact CD1-CE2 3.46Å; I81-F126 HydrophobicContact CD1-CZ 4.03Å; I81-F126 HydrophobicContact CG1-CD2 3.72Å; I81-F126 HydrophobicContact CG1-CE2 3.69Å; I81-F126 HydrophobicContact CG1-CG 4.37Å; I81-F126 HydrophobicContact CG1-CZ 4.27Å; I81-F310 HydrophobicContact CG1-CD1 4.2Å; I81-F310 HydrophobicContact CG2-CB 4.08Å; I81-F310 HydrophobicContact CG2-CD1 3.96Å; I81-F310 HydrophobicContact CG2-CG 4.28Å; I81-Y315 HydrophobicContact CD1-CE2 4.16Å; I81-Y315 WeakPolarHBondContact CD1-OH 3.3Å
82I88.8Confident86.8Confident0 Ų021.4 Ų21.40%011%0.105CC..Hα-helixtrans-62.4-42.4-179.6-67.5162.9000110.5I65 H68 Y72 Q78 K79 P80 I84 L85 W86 M331I65-I82 HydrophobicContact CG2-CG2 3.9Å; H68-I82 HydrophobicContact CB-CD1 4.04Å; H68-I82 HydrophobicContact CB-CG1 3.8Å; Y72-I82 HydrophobicContact CD2-CD1 4.4Å; Y72-I82 HydrophobicContact CE2-CD1 4.21Å; Q78-I82 HydrophobicContact CB-CD1 4.48Å; Q78-I82 WeakPolarHBondContact O-CB 3.44Å; Q78-I82 WeakPolarHBondContact O-CD1 3.27Å; Q78-I82 WeakPolarHBondContact O-CG1 3.47Å; Q78-I82 PolarHBondContact O-N 2.87Å; K79-I82 PolarHBondContact O-N 2.88Å; P80-I82 PolarHBondContact O-N 2.56Å; I82-I84 VanDerWaalsContact C-N 3.27Å; I82-I84 PolarHBondContact O-N 2.81Å; I82-L85 PolarHBondContact O-N 3.04Å; I82-W86 VanDerWaalsContact O-CD1 3.23Å; I82-W86 PolarHBondContact O-N 2.7Å; I82-W86 VanDerWaalsContact O-N 3.12Å; I82-M331 HydrophobicContact CB-CG 4.39Å; I82-M331 HydrophobicContact CD1-CG 4.39Å; I82-M331 HydrophobicContact CG2-CG 3.6Å; I82-M331 HydrophobicContact CG2-SD 3.5Å; I82-M331 VanDerWaalsContact CG2-SD 3.5Å
83R90.8Very high87.4Confident10 Ų1023.9 Ų23.94%0.03812%0.119CC..Hα-helixtrans-60.8-35.5174.2-67.2164.4178.4179.23.4112.1K79 P80 I81 Y115 Y118 N122 D333 D336K79-R83 WeakPolarHBondContact O-CG 3.45Å; K79-R83 PolarHBondContact O-N 2.86Å; K79-R83 VanDerWaalsContact O-N 3.13Å; P80-R83 PolarHBondContact O-N 3.31Å; I81-R83 VanDerWaalsContact C-N 3.32Å; I81-R83 PolarHBondContact O-N 3.03Å; R83-Y115 PolarHBondContact O-OH 3.39Å; R83-Y118 HydrophobicContact CB-CE1 4.06Å; R83-Y118 WeakPolarHBondContact CD-OH 3.41Å; R83-Y118 HydrophobicContact CG-CE1 4.16Å; R83-Y118 PolarHBondContact NE-OH 3.32Å; R83-Y118 VanDerWaalsContact NE-OH 3.09Å; R83-N122 HydrophobicContact CB-CB 4.5Å; R83-N122 WeakPolarHBondContact CD-OD1 3.45Å; R83-N122 PolarHBondContact NH1-OD1 2.76Å; R83-D333 PolarHBondContact NH2-O 2.92Å; R83-D336 IonicContact CZ-OD1 3.6Å; R83-D336 IonicContact CZ-OD2 3.43Å; R83-D336 IonicContact NH1-OD1 2.82Å; R83-D336 PolarHBondContact NH1-OD1 2.82Å; R83-D336 IonicContact NH1-OD2 2.77Å; R83-D336 PolarHBondContact NH1-OD2 3.44Å; R83-D336 VanDerWaalsContact NH2-CG 3.32Å; R83-D336 IonicContact NH2-OD1 3.34Å; R83-D336 PolarHBondContact NH2-OD1 3.45Å; R83-D336 IonicContact NH2-OD2 3.14Å; R83-D336 PolarHBondContact NH2-OD2 3.38Å; R83-D336 VanDerWaalsContact NH2-OD2 3.16Å
84I90.1Very high88.1Confident0 Ų022.2 Ų22.20%011%0.109CC..Hα-helixtrans-68.4-42.8174-65.7160.5000111.3P80 I81 I82 W86 M87 V119 N122 F123 V249 F310P80-I84 WeakPolarHBondContact O-CD1 3.4Å; P80-I84 VanDerWaalsContact O-CG1 3.27Å; P80-I84 WeakPolarHBondContact O-CG1 3.15Å; P80-I84 PolarHBondContact O-N 3.43Å; I81-I84 WeakPolarHBondContact O-CB 3.47Å; I81-I84 PolarHBondContact O-N 2.87Å; I81-I84 VanDerWaalsContact O-N 3.09Å; I82-I84 VanDerWaalsContact C-N 3.27Å; I82-I84 PolarHBondContact O-N 2.81Å; I84-W86 VanDerWaalsContact C-N 3.26Å; I84-W86 PolarHBondContact O-N 3.23Å; I84-M87 WeakPolarHBondContact O-CB 3.37Å; I84-M87 PolarHBondContact O-N 3.46Å; I84-M87 VanDerWaalsContact O-N 3.1Å; I84-V119 HydrophobicContact CB-CG1 4.45Å; I84-V119 HydrophobicContact CG1-CG1 4.09Å; I84-V119 HydrophobicContact CG2-CG1 4.22Å; I84-N122 HydrophobicContact CG1-CB 4.25Å; I84-F123 HydrophobicContact CD1-CB 4.07Å; I84-F123 HydrophobicContact CD1-CD2 4.03Å; I84-V249 HydrophobicContact CG2-CG2 3.47Å; I84-V249 VanDerWaalsContact CG2-CG2 3.47Å; I84-F310 HydrophobicContact CG2-CE2 4.06Å; I84-F310 HydrophobicContact CG2-CZ 3.95Å
85L89.8Confident88.6Confident3 Ų320.4 Ų20.42%0.01610%0.1CC..Hα-helixtrans-62.7-31.3-179.3-77.7150.6000113.2S61 I65 H68 I81 I82 M87 P89 H306 F310S61-L85 PolarHBondContact OG-O 3.46Å; I65-L85 HydrophobicContact CD1-CB 4.29Å; I65-L85 HydrophobicContact CG1-CB 3.73Å; H68-L85 VanDerWaalsContact CD2-CD1 3.5Å; H68-L85 WeakPolarHBondContact CD2-CD1 3.34Å; I81-L85 HydrophobicContact CG2-CD1 3.57Å; I81-L85 HydrophobicContact CG2-CG 4.44Å; I81-L85 WeakPolarHBondContact O-CD1 3.28Å; I81-L85 PolarHBondContact O-N 3.23Å; I82-L85 PolarHBondContact O-N 3.04Å; L85-M87 PolarHBondContact O-N 3.25Å; L85-P89 WeakPolarHBondContact O-CD 3.44Å; L85-H306 HydrophobicContact CD2-CB 4.17Å; L85-F310 HydrophobicContact CD2-CB 4.46Å
86W90.4Very high89Confident60 Ų6019.4 Ų19.423%0.2279%0.09CC..THydrogen-bonded Turntrans-65.3-16.1175.7-88.9108.9000114L62 I65 I82 I84 V88 P89 I90 Y115L62-W86 HydrophobicContact CD2-CH2 4.18Å; I65-W86 HydrophobicContact CD1-CD2 3.93Å; I65-W86 HydrophobicContact CD1-CE3 4.5Å; I65-W86 HydrophobicContact CD1-CG 4.06Å; I65-W86 HydrophobicContact CD1-CZ2 4.41Å; I82-W86 VanDerWaalsContact O-CD1 3.23Å; I82-W86 PolarHBondContact O-N 2.7Å; I82-W86 VanDerWaalsContact O-N 3.12Å; I84-W86 VanDerWaalsContact C-N 3.26Å; I84-W86 PolarHBondContact O-N 3.23Å; W86-V88 PolarHBondContact O-N 2.9Å; W86-P89 HydrophobicContact CE3-CG 3.82Å; W86-P89 HydrophobicContact CZ3-CG 4.33Å; W86-P89 VanDerWaalsContact O-CD 3.22Å; W86-P89 WeakPolarHBondContact O-CD 3.23Å; W86-P89 VanDerWaalsContact O-CG 3.3Å; W86-P89 WeakPolarHBondContact O-CG 3.39Å; W86-I90 HydrophobicContact CB-CD1 4.33Å; W86-I90 WeakPolarHBondContact O-CB 3.47Å; W86-I90 WeakPolarHBondContact O-CD1 3.46Å; W86-I90 WeakPolarHBondContact O-CG1 3.34Å; W86-I90 PolarHBondContact O-N 2.94Å; W86-Y115 WeakPolarHBondContact CB-OH 3.41Å
87M89.3Confident89.4Confident1 Ų117.6 Ų17.61%0.0058%0.083CC..Hα-helixtrans-56.2-48.8175.3-173.9-174.2179.300112.1I84 L85 I90 Y91 Y115 V119 V252 V253I84-M87 WeakPolarHBondContact O-CB 3.37Å; I84-M87 PolarHBondContact O-N 3.46Å; I84-M87 VanDerWaalsContact O-N 3.1Å; L85-M87 PolarHBondContact O-N 3.25Å; M87-I90 PolarHBondContact O-N 2.77Å; M87-Y91 HydrophobicContact CE-CD1 4.4Å; M87-Y91 HydrophobicContact CE-CE1 3.68Å; M87-Y91 HydrophobicContact CE-CE2 4.13Å; M87-Y91 HydrophobicContact CG-CD2 3.86Å; M87-Y91 HydrophobicContact CG-CE2 3.59Å; M87-Y91 HydrophobicContact CG-CG 4.45Å; M87-Y91 WeakPolarHBondContact O-CB 3.14Å; M87-Y91 WeakPolarHBondContact O-CD2 3.24Å; M87-Y91 PolarHBondContact O-N 3.41Å; M87-Y115 VanDerWaalsContact CA-CE1 3.49Å; M87-Y115 HydrophobicContact CB-CD1 4.28Å; M87-Y115 HydrophobicContact CB-CE1 3.85Å; M87-Y115 HydrophobicContact CG-CD1 4.36Å; M87-Y115 HydrophobicContact CG-CE1 4.42Å; M87-V119 HydrophobicContact CB-CG2 4.15Å; M87-V119 HydrophobicContact CG-CG2 4.34Å; M87-V119 HydrophobicContact SD-CG1 4.04Å; M87-V119 HydrophobicContact SD-CG2 4.41Å; M87-V252 HydrophobicContact CE-CB 4.12Å; M87-V252 HydrophobicContact CE-CG1 3.67Å; M87-V253 HydrophobicContact CE-CG2 3.68Å
88V90.6Very high89.5Confident1 Ų117.6 Ų17.61%0.0068%0.083CC..Hα-helixtrans-62.2-49.4-174.9-178.20000113.6T57 W86 Y91 S92 M299 A302 A303T57-V88 HydrophobicContact CG2-CG1 3.57Å; W86-V88 PolarHBondContact O-N 2.9Å; V88-Y91 PolarHBondContact O-N 3.36Å; V88-S92 WeakPolarHBondContact O-CB 2.96Å; V88-S92 PolarHBondContact O-N 3.25Å; V88-S92 PolarHBondContact O-OG 3.12Å; V88-M299 HydrophobicContact CG1-CB 4.16Å; V88-M299 WeakPolarHBondContact CG1-O 2.84Å; V88-A302 HydrophobicContact CG2-CB 4.3Å; V88-A303 HydrophobicContact CG1-CB 3.83Å
89P91.5Very high89.4Confident5 Ų517.8 Ų17.83%0.0328%0.084CC..Hα-helixtrans-67.9-34177.924.7-33.2000112.4S61 L85 W86 S92 L93S61-P89 WeakPolarHBondContact OG-CD 3.29Å; L85-P89 WeakPolarHBondContact O-CD 3.44Å; W86-P89 HydrophobicContact CE3-CG 3.82Å; W86-P89 HydrophobicContact CZ3-CG 4.33Å; W86-P89 VanDerWaalsContact O-CD 3.22Å; W86-P89 WeakPolarHBondContact O-CD 3.23Å; W86-P89 VanDerWaalsContact O-CG 3.3Å; W86-P89 WeakPolarHBondContact O-CG 3.39Å; P89-S92 WeakPolarHBondContact CA-OG 3.35Å; P89-S92 PolarHBondContact O-OG 3.31Å; P89-S92 VanDerWaalsContact O-OG 3.13Å; P89-L93 WeakPolarHBondContact O-CB 3.43Å; P89-L93 WeakPolarHBondContact O-CG 3.47Å; P89-L93 PolarHBondContact O-N 3.17Å; P89-L93 VanDerWaalsContact O-N 3.13Å
90I90.3Very high89.2Confident56 Ų5617.1 Ų17.129%0.2878%0.081SC..Hα-helixtrans-64.2-49.2175.9-68.6168.7000110W86 M87 S92 L93 D94 Y115W86-I90 HydrophobicContact CB-CD1 4.33Å; W86-I90 WeakPolarHBondContact O-CB 3.47Å; W86-I90 WeakPolarHBondContact O-CD1 3.46Å; W86-I90 WeakPolarHBondContact O-CG1 3.34Å; W86-I90 PolarHBondContact O-N 2.94Å; M87-I90 PolarHBondContact O-N 2.77Å; I90-S92 PolarHBondContact O-N 3.44Å; I90-L93 PolarHBondContact O-N 3.5Å; I90-D94 WeakPolarHBondContact O-CB 3.23Å; I90-D94 PolarHBondContact O-N 3.1Å; I90-Y115 HydrophobicContact CD1-CD1 4.39Å; I90-Y115 HydrophobicContact CD1-CD2 4.1Å; I90-Y115 HydrophobicContact CD1-CE1 4.01Å; I90-Y115 HydrophobicContact CD1-CE2 3.67Å; I90-Y115 HydrophobicContact CD1-CG 4.42Å
91Y89.3Confident88.9Confident7 Ų722.7 Ų22.73%0.02710%0.103CC..Hα-helixtrans-65.4-41.2-177.3-81.6-133.4000111.9M87 V88 S95 R112 Y115 E116 V252 M299M87-Y91 HydrophobicContact CE-CD1 4.4Å; M87-Y91 HydrophobicContact CE-CE1 3.68Å; M87-Y91 HydrophobicContact CE-CE2 4.13Å; M87-Y91 HydrophobicContact CG-CD2 3.86Å; M87-Y91 HydrophobicContact CG-CE2 3.59Å; M87-Y91 HydrophobicContact CG-CG 4.45Å; M87-Y91 WeakPolarHBondContact O-CB 3.14Å; M87-Y91 WeakPolarHBondContact O-CD2 3.24Å; M87-Y91 PolarHBondContact O-N 3.41Å; V88-Y91 PolarHBondContact O-N 3.36Å; Y91-S95 PolarHBondContact O-N 3.37Å; Y91-S95 PolarHBondContact O-OG 3.09Å; Y91-R112 HydrophobicContact CD1-CG 3.76Å; Y91-R112 HydrophobicContact CD2-CG 3.66Å; Y91-R112 HydrophobicContact CE1-CG 3.46Å; Y91-R112 VanDerWaalsContact CE1-CG 3.46Å; Y91-R112 HydrophobicContact CE2-CB 4.42Å; Y91-R112 HydrophobicContact CE2-CG 3.37Å; Y91-R112 HydrophobicContact CG-CG 3.86Å; Y91-R112 PolarHBondContact OH-O 3Å; Y91-Y115 HydrophobicContact CE2-CD1 4.28Å; Y91-E116 WeakPolarHBondContact OH-CB 2.89Å; Y91-V252 HydrophobicContact CD1-CG1 4.16Å; Y91-V252 HydrophobicContact CE1-CG1 4.25Å; Y91-M299 VanDerWaalsContact CB-SD 3.54Å; Y91-M299 HydrophobicContact CD1-SD 4.19Å; Y91-M299 HydrophobicContact CG-SD 4.21Å
92S91.4Very high88.4Confident0 Ų026.1 Ų26.10%013%0.125CC..Hα-helixtrans-66.8-43.8179.149.70000112.8V54 V88 P89 I90 W96V54-S92 VanDerWaalsContact CG2-O 3.31Å; V54-S92 WeakPolarHBondContact CG2-O 3.36Å; V88-S92 WeakPolarHBondContact O-CB 2.96Å; V88-S92 PolarHBondContact O-N 3.25Å; V88-S92 PolarHBondContact O-OG 3.12Å; P89-S92 WeakPolarHBondContact CA-OG 3.35Å; P89-S92 PolarHBondContact O-OG 3.31Å; P89-S92 VanDerWaalsContact O-OG 3.13Å; I90-S92 PolarHBondContact O-N 3.44Å; S92-W96 WeakPolarHBondContact O-CB 3.26Å; S92-W96 PolarHBondContact O-N 3.35Å
93L90.9Very high87.8Confident69 Ų6930.3 Ų30.336%0.36115%0.154SC..Hα-helixtrans-64.7-43.9176.4-79.1170.6000112.1V54 I58 P89 I90 W96 I97V54-L93 HydrophobicContact CG1-CD2 4.04Å; V54-L93 HydrophobicContact CG1-CG 4.39Å; I58-L93 HydrophobicContact CD1-CD1 4.27Å; I58-L93 HydrophobicContact CD1-CD2 3.67Å; I58-L93 HydrophobicContact CD1-CG 3.92Å; P89-L93 WeakPolarHBondContact O-CB 3.43Å; P89-L93 WeakPolarHBondContact O-CG 3.47Å; P89-L93 PolarHBondContact O-N 3.17Å; P89-L93 VanDerWaalsContact O-N 3.13Å; I90-L93 PolarHBondContact O-N 3.5Å; L93-W96 PolarHBondContact O-N 2.76Å; L93-I97 VanDerWaalsContact O-CG1 3.29Å; L93-I97 WeakPolarHBondContact O-CG1 3.36Å; L93-I97 PolarHBondContact O-N 2.82Å
94D90.2Very high87.4Confident3 Ų333.3 Ų33.32%0.01617%0.17CC..Hα-helixtrans-58.6-57178.5173.613.7000111.4I90 W96 I97 A98 V108 R112I90-D94 WeakPolarHBondContact O-CB 3.23Å; I90-D94 PolarHBondContact O-N 3.1Å; D94-W96 PolarHBondContact O-N 3.48Å; D94-W96 VanDerWaalsContact O-N 3.15Å; D94-I97 PolarHBondContact O-N 3.39Å; D94-A98 WeakPolarHBondContact O-CB 3.47Å; D94-A98 PolarHBondContact O-N 3.43Å; D94-V108 HydrophobicContact CB-CG1 3.59Å; D94-V108 WeakPolarHBondContact OD1-CB 3.03Å; D94-V108 WeakPolarHBondContact OD1-CG1 3.38Å; D94-R112 IonicContact OD1-NH2 2.86Å; D94-R112 PolarHBondContact OD1-NH2 3.29Å; D94-R112 WeakPolarHBondContact OD2-CB 3.28Å; D94-R112 IonicContact OD2-CZ 3.41Å; D94-R112 IonicContact OD2-NE 2.68Å; D94-R112 PolarHBondContact OD2-NE 3.23Å; D94-R112 IonicContact OD2-NH2 3.02Å; D94-R112 PolarHBondContact OD2-NH2 2.83Å
95S89.5Confident86.8Confident0 Ų033.6 Ų33.60%017%0.173CC..Hα-helixtrans-58.9-32.4179.1-61.30000112.8Y91 L99 R112 I295Y91-S95 PolarHBondContact O-N 3.37Å; Y91-S95 PolarHBondContact O-OG 3.09Å; S95-L99 VanDerWaalsContact O-CB 3.28Å; S95-L99 WeakPolarHBondContact O-CB 3.35Å; S95-L99 PolarHBondContact O-N 2.79Å; S95-R112 PolarHBondContact OG-NH2 3.5Å; S95-I295 WeakPolarHBondContact OG-CG2 3.37Å
96W90.4Very high86.3Confident33 Ų3336.3 Ų36.313%0.12519%0.187CC..Hα-helixtrans-71.5-34.7175.3-177.660.2000113.7V27 V31 W47 G51 V54 F55 S92 L93 D94V27-W96 HydrophobicContact CG1-CH2 4.49Å; V31-W96 HydrophobicContact CG2-CH2 4.29Å; V31-W96 HydrophobicContact CG2-CZ2 4.07Å; W47-W96 AromaticContact CD1-CD1 3.69Å; W47-W96 AromaticContact CD1-NE1 3.61Å; W47-W96 AromaticContact CD2-NE1 3.79Å; W47-W96 AromaticContact CE2-CE2 3.53Å; W47-W96 AromaticContact CE2-CZ2 3.72Å; W47-W96 AromaticContact CE2-NE1 3.28Å; W47-W96 VanDerWaalsContact CE2-NE1 3.28Å; W47-W96 HydrophobicContact CH2-CH2 4.45Å; W47-W96 AromaticContact CH2-CZ2 3.71Å; W47-W96 HydrophobicContact CH2-CZ2 3.71Å; W47-W96 HydrophobicContact CZ2-CD2 4.5Å; W47-W96 AromaticContact CZ2-CE2 3.51Å; W47-W96 AromaticContact CZ2-CH2 3.92Å; W47-W96 HydrophobicContact CZ2-CH2 3.92Å; W47-W96 AromaticContact CZ2-CZ2 3.17Å; W47-W96 HydrophobicContact CZ2-CZ2 3.17Å; W47-W96 AromaticContact CZ2-NE1 3.75Å; W47-W96 AromaticContact NE1-CD1 3.44Å; W47-W96 AromaticContact NE1-CE2 3.54Å; W47-W96 AromaticContact NE1-CG 4Å; W47-W96 AromaticContact NE1-NE1 3.11Å; W47-W96 VanDerWaalsContact NE1-NE1 3.11Å; W47-W96 PolarHBondContact NE1-O 3.22Å; W47-W96 PolarHBondContact O-NE1 3.19Å; W47-W96 VanDerWaalsContact O-NE1 3.17Å; G51-W96 VanDerWaalsContact CA-NE1 3.26Å; V54-W96 HydrophobicContact CG2-CB 3.83Å; V54-W96 HydrophobicContact CG2-CG 4.25Å; F55-W96 HydrophobicContact CE2-CH2 4.5Å; F55-W96 HydrophobicContact CE2-CZ2 4.34Å; F55-W96 AromaticContact CZ-CH2 3.91Å; F55-W96 HydrophobicContact CZ-CH2 3.91Å; F55-W96 HydrophobicContact CZ-CZ2 4.21Å; F55-W96 HydrophobicContact CZ-CZ3 4.49Å; S92-W96 WeakPolarHBondContact O-CB 3.26Å; S92-W96 PolarHBondContact O-N 3.35Å; L93-W96 PolarHBondContact O-N 2.76Å; D94-W96 PolarHBondContact O-N 3.48Å; D94-W96 VanDerWaalsContact O-N 3.15Å
97I88.8Confident85.9Confident66 Ų6640.3 Ų40.334%0.33820%0.203SC..Hα-helixtrans-72.6-45.6174-68.2166.2000110.2L93 D94 L99 K100 Y101 I104L93-I97 VanDerWaalsContact O-CG1 3.29Å; L93-I97 WeakPolarHBondContact O-CG1 3.36Å; L93-I97 PolarHBondContact O-N 2.82Å; D94-I97 PolarHBondContact O-N 3.39Å; I97-L99 PolarHBondContact O-N 2.92Å; I97-K100 PolarHBondContact O-N 3.39Å; I97-Y101 HydrophobicContact CG2-CD2 4.4Å; I97-Y101 PolarHBondContact O-N 3.24Å; I97-I104 HydrophobicContact CG2-CG2 4.17Å
98A86.3Confident85.7Confident4 Ų442.1 Ų42.13%0.03321%0.214CC..Hα-helixtrans-56.3-39.8177.100000111.5D94 K100 Y101 A105D94-A98 WeakPolarHBondContact O-CB 3.47Å; D94-A98 PolarHBondContact O-N 3.43Å; A98-K100 VanDerWaalsContact C-N 3.28Å; A98-K100 PolarHBondContact O-N 3Å; A98-Y101 CarbonylContact O-C 3.6Å; A98-Y101 PolarHBondContact O-N 3.31Å; A98-A105 HydrophobicContact CB-CB 3.64Å
99L84Confident85.2Confident4 Ų444.1 Ų44.12%0.02123%0.225CC..Hα-helixtrans-62.6-30.3177.1-169.962.3000113.2H43 W47 A50 S95 I97 G289 D292 F293H43-L99 PolarHBondContact CE1-O 2.57Å; H43-L99 PolarHBondContact NE2-O 3.44Å; W47-L99 HydrophobicContact CB-CD2 4.13Å; W47-L99 HydrophobicContact CB-CG 4.38Å; A50-L99 HydrophobicContact CB-CD2 3.92Å; S95-L99 VanDerWaalsContact O-CB 3.28Å; S95-L99 WeakPolarHBondContact O-CB 3.35Å; S95-L99 PolarHBondContact O-N 2.79Å; I97-L99 PolarHBondContact O-N 2.92Å; L99-G289 WeakPolarHBondContact CD1-O 3.5Å; L99-D292 HydrophobicContact CB-CB 4.41Å; L99-D292 HydrophobicContact CD1-CB 4.45Å; L99-F293 HydrophobicContact CD2-CB 4.48Å
100K83.3Confident84.8Confident34 Ų3445.7 Ų45.715%0.14823%0.234CC..Hα-helixtrans-91.5-35.6176.9-178.968.6174.4-168.90112.8E34 I97 A98E34-K100 IonicContact OE1-NZ 3.48Å; E34-K100 PolarHBondContact OE1-NZ 2.91Å; I97-K100 PolarHBondContact O-N 3.39Å; A98-K100 VanDerWaalsContact C-N 3.28Å; A98-K100 PolarHBondContact O-N 3Å
101Y83.3Confident84.6Confident119 Ų11946.9 Ų46.947%0.46725%0.247SC..  trans-126.485.3-173.2-58.8-72.5000110.9I97 A98 S103 I104 A105I97-Y101 HydrophobicContact CG2-CD2 4.4Å; I97-Y101 PolarHBondContact O-N 3.24Å; A98-Y101 CarbonylContact O-C 3.6Å; A98-Y101 PolarHBondContact O-N 3.31Å; Y101-S103 PolarHBondContact O-N 3.38Å; Y101-S103 VanDerWaalsContact O-N 3.13Å; Y101-I104 HydrophobicContact CG-CD1 4.29Å; Y101-I104 PolarHBondContact O-N 3.32Å; Y101-A105 PolarHBondContact O-N 3.11Å
102P76.6Confident84.5Confident73 Ų7347.6 Ų47.647%0.47425%0.249SC..Hα-helixtrans-58.8-27.1179.3-25.934.7000114I104 A105 W280P102-I104 VanDerWaalsContact C-N 3.29Å; P102-I104 PolarHBondContact O-N 3.44Å; P102-A105 WeakPolarHBondContact O-CB 3.31Å; P102-A105 PolarHBondContact O-N 2.55Å; P102-W280 HydrophobicContact CG-CZ3 4.38Å
103S77.9Confident84.1Confident88 Ų8851.1 Ų51.162%0.61527%0.266SS*.Hα-helixtrans-68-28.4176.354.60000113.5Y101Y101-S103 PolarHBondContact O-N 3.38Å; Y101-S103 VanDerWaalsContact O-N 3.13Å
104I80.8Confident84Confident73 Ų7349.4 Ų49.437%0.37426%0.259SS..Hα-helixtrans-87.1-26.9177.7-64.3175.2000110.3I97 Y101 P102 I106 Y107 V108I97-I104 HydrophobicContact CG2-CG2 4.17Å; Y101-I104 HydrophobicContact CG-CD1 4.29Å; Y101-I104 PolarHBondContact O-N 3.32Å; P102-I104 VanDerWaalsContact C-N 3.29Å; P102-I104 PolarHBondContact O-N 3.44Å; I104-I106 VanDerWaalsContact C-N 3.3Å; I104-I106 PolarHBondContact O-N 3.35Å; I104-Y107 PolarHBondContact O-N 3.41Å; I104-V108 HydrophobicContact CG2-CG2 3.5Å; I104-V108 VanDerWaalsContact CG2-CG2 3.5Å; I104-V108 PolarHBondContact O-N 3.32Å
105A79.4Confident84Confident7 Ų751.3 Ų51.36%0.05827%0.266CS..Hα-helixtrans-49-47.4-176.900000112.9A98 Y101 P102 Y107 V108 D109A98-A105 HydrophobicContact CB-CB 3.64Å; Y101-A105 PolarHBondContact O-N 3.11Å; P102-A105 WeakPolarHBondContact O-CB 3.31Å; P102-A105 PolarHBondContact O-N 2.55Å; A105-Y107 VanDerWaalsContact C-N 3.29Å; A105-Y107 PolarHBondContact O-N 2.86Å; A105-V108 PolarHBondContact O-N 3.47Å; A105-V108 VanDerWaalsContact O-N 3.12Å; A105-D109 VanDerWaalsContact O-CB 3.28Å; A105-D109 WeakPolarHBondContact O-CB 3.48Å; A105-D109 VanDerWaalsContact O-CG 3.26Å; A105-D109 PolarHBondContact O-N 3.35Å
106I77.8Confident83.9Confident59 Ų5952 Ų5230%0.30327%0.27SS..Hα-helixtrans-54.8-44.2-179.3-58.4172.2000111.9I104 T110I104-I106 VanDerWaalsContact C-N 3.3Å; I104-I106 PolarHBondContact O-N 3.35Å; I106-T110 WeakPolarHBondContact O-CB 3.44Å; I106-T110 PolarHBondContact O-N 2.78Å; I106-T110 VanDerWaalsContact O-N 3.12Å; I106-T110 PolarHBondContact O-OG1 2.91Å
107Y82.3Confident83.8Confident144 Ų14450.5 Ų50.557%0.56526%0.264SS*.Hα-helixtrans-69.5-42.5-178.9-65.2-77.1000111.8I104 A105 T110 C111I104-Y107 PolarHBondContact O-N 3.41Å; A105-Y107 VanDerWaalsContact C-N 3.29Å; A105-Y107 PolarHBondContact O-N 2.86Å; Y107-T110 WeakPolarHBondContact O-CB 3.38Å; Y107-T110 PolarHBondContact O-N 2.94Å; Y107-C111 PolarHBondContact O-N 3.43Å; Y107-C111 PolarHBondContact O-SG 2.94Å; Y107-C111 VanDerWaalsContact O-SG 3.38Å
108V84.7Confident83.9Confident40 Ų4049 Ų4924%0.24225%0.254CS..Hα-helixtrans-79.4-34.4-173.9-160.50000110.9D94 I104 A105 T110 C111 R112D94-V108 HydrophobicContact CB-CG1 3.59Å; D94-V108 WeakPolarHBondContact OD1-CB 3.03Å; D94-V108 WeakPolarHBondContact OD1-CG1 3.38Å; I104-V108 HydrophobicContact CG2-CG2 3.5Å; I104-V108 VanDerWaalsContact CG2-CG2 3.5Å; I104-V108 PolarHBondContact O-N 3.32Å; A105-V108 PolarHBondContact O-N 3.47Å; A105-V108 VanDerWaalsContact O-N 3.12Å; V108-T110 VanDerWaalsContact C-N 3.31Å; V108-T110 PolarHBondContact O-N 3.46Å; V108-C111 CarbonylContact O-C 3.59Å; V108-C111 WeakPolarHBondContact O-CA 3.2Å; V108-C111 WeakPolarHBondContact O-CB 3.44Å; V108-C111 PolarHBondContact O-N 2.96Å; V108-C111 VanDerWaalsContact O-N 3.09Å; V108-R112 WeakPolarHBondContact O-CB 3.35Å; V108-R112 PolarHBondContact O-N 3.48Å
109D81.3Confident84.1Confident43 Ų4348.9 Ų48.923%0.2325%0.253CS..Hα-helixtrans-57.7-44.4167.3-73.9-25.2000110.9A105 C111 R112 E113A105-D109 VanDerWaalsContact O-CB 3.28Å; A105-D109 WeakPolarHBondContact O-CB 3.48Å; A105-D109 VanDerWaalsContact O-CG 3.26Å; A105-D109 PolarHBondContact O-N 3.35Å; D109-C111 VanDerWaalsContact C-N 3.31Å; D109-C111 PolarHBondContact O-N 2.86Å; D109-R112 VanDerWaalsContact O-CB 3.28Å; D109-R112 WeakPolarHBondContact O-CB 3.37Å; D109-R112 PolarHBondContact O-N 2.83Å; D109-R112 VanDerWaalsContact O-N 3.14Å; D109-R112 IonicContact OD1-CZ 2.73Å; D109-R112 IonicContact OD1-NE 2.69Å; D109-R112 IonicContact OD1-NH1 3.09Å; D109-R112 PolarHBondContact OD1-NH1 3.5Å; D109-R112 IonicContact OD1-NH2 2.78Å; D109-R112 PolarHBondContact OD1-NH2 2.93Å; D109-E113 VanDerWaalsContact O-CG 3.28Å; D109-E113 WeakPolarHBondContact O-CG 3.34Å; D109-E113 PolarHBondContact O-N 3.23Å
110T83.1Confident84.4Confident37 Ų3749 Ų4923%0.22725%0.254CS..Hα-helixtrans-59.6-42174.8-63.60000111.9I106 Y107 V108 E113 C114 T185I106-T110 WeakPolarHBondContact O-CB 3.44Å; I106-T110 PolarHBondContact O-N 2.78Å; I106-T110 VanDerWaalsContact O-N 3.12Å; I106-T110 PolarHBondContact O-OG1 2.91Å; Y107-T110 WeakPolarHBondContact O-CB 3.38Å; Y107-T110 PolarHBondContact O-N 2.94Å; V108-T110 VanDerWaalsContact C-N 3.31Å; V108-T110 PolarHBondContact O-N 3.46Å; T110-E113 PolarHBondContact O-N 2.98Å; T110-C114 PolarHBondContact O-N 3.36Å; T110-C114 VanDerWaalsContact O-N 3.12Å; T110-C114 PolarHBondContact O-SG 2.9Å; T110-T185 HydrophobicContact CG2-CG2 3.13Å
111C85.2Confident84.7Confident82 Ų8247.4 Ų47.455%0.55425%0.247SC*.Hα-helixtrans-63.9-41.6174.4-70.20000112.1Y107 V108 D109 E113 C114 Y115Y107-C111 PolarHBondContact O-N 3.43Å; Y107-C111 PolarHBondContact O-SG 2.94Å; Y107-C111 VanDerWaalsContact O-SG 3.38Å; V108-C111 CarbonylContact O-C 3.59Å; V108-C111 WeakPolarHBondContact O-CA 3.2Å; V108-C111 WeakPolarHBondContact O-CB 3.44Å; V108-C111 PolarHBondContact O-N 2.96Å; V108-C111 VanDerWaalsContact O-N 3.09Å; D109-C111 VanDerWaalsContact C-N 3.31Å; D109-C111 PolarHBondContact O-N 2.86Å; C111-E113 VanDerWaalsContact C-N 3.34Å; C111-E113 PolarHBondContact O-N 3.48Å; C111-C114 PolarHBondContact O-N 2.93Å; C111-Y115 WeakPolarHBondContact O-CB 3.31Å; C111-Y115 PolarHBondContact O-N 3.22Å
112R86.4Confident85.1Confident21 Ų2141.7 Ų41.78%0.07922%0.224CC..Hα-helixtrans-57.4-47.3176.4-172-168.5-58.9162.114.2111.1Y91 D94 S95 V108 D109 C114 Y115 E116Y91-R112 HydrophobicContact CD1-CG 3.76Å; Y91-R112 HydrophobicContact CD2-CG 3.66Å; Y91-R112 HydrophobicContact CE1-CG 3.46Å; Y91-R112 VanDerWaalsContact CE1-CG 3.46Å; Y91-R112 HydrophobicContact CE2-CB 4.42Å; Y91-R112 HydrophobicContact CE2-CG 3.37Å; Y91-R112 HydrophobicContact CG-CG 3.86Å; Y91-R112 PolarHBondContact OH-O 3Å; D94-R112 IonicContact OD1-NH2 2.86Å; D94-R112 PolarHBondContact OD1-NH2 3.29Å; D94-R112 WeakPolarHBondContact OD2-CB 3.28Å; D94-R112 IonicContact OD2-CZ 3.41Å; D94-R112 IonicContact OD2-NE 2.68Å; D94-R112 PolarHBondContact OD2-NE 3.23Å; D94-R112 IonicContact OD2-NH2 3.02Å; D94-R112 PolarHBondContact OD2-NH2 2.83Å; S95-R112 PolarHBondContact OG-NH2 3.5Å; V108-R112 WeakPolarHBondContact O-CB 3.35Å; V108-R112 PolarHBondContact O-N 3.48Å; D109-R112 VanDerWaalsContact O-CB 3.28Å; D109-R112 WeakPolarHBondContact O-CB 3.37Å; D109-R112 PolarHBondContact O-N 2.83Å; D109-R112 VanDerWaalsContact O-N 3.14Å; D109-R112 IonicContact OD1-CZ 2.73Å; D109-R112 IonicContact OD1-NE 2.69Å; D109-R112 IonicContact OD1-NH1 3.09Å; D109-R112 PolarHBondContact OD1-NH1 3.5Å; D109-R112 IonicContact OD1-NH2 2.78Å; D109-R112 PolarHBondContact OD1-NH2 2.93Å; R112-C114 PolarHBondContact O-N 2.83Å; R112-Y115 WeakPolarHBondContact O-CB 3.15Å; R112-Y115 PolarHBondContact O-N 3.32Å; R112-Y115 VanDerWaalsContact O-N 3.15Å; R112-E116 PolarHBondContact O-N 3.24Å
113E84.4Confident85.7Confident75 Ų7538.4 Ų38.435%0.3520%0.203SC..Hα-helixtrans-64.9-38.6178.6-67.5179.9149.700113.1D109 T110 C111 Y115 E116 A117 R181D109-E113 VanDerWaalsContact O-CG 3.28Å; D109-E113 WeakPolarHBondContact O-CG 3.34Å; D109-E113 PolarHBondContact O-N 3.23Å; T110-E113 PolarHBondContact O-N 2.98Å; C111-E113 VanDerWaalsContact C-N 3.34Å; C111-E113 PolarHBondContact O-N 3.48Å; E113-Y115 VanDerWaalsContact C-N 3.3Å; E113-E116 WeakPolarHBondContact O-CB 3.19Å; E113-E116 PolarHBondContact O-N 3.45Å; E113-A117 PolarHBondContact O-N 2.81Å; E113-R181 IonicContact OE1-NH2 2.99Å; E113-R181 PolarHBondContact OE1-NH2 3.21Å; E113-R181 IonicContact OE2-CZ 2.83Å; E113-R181 IonicContact OE2-NE 2.76Å; E113-R181 PolarHBondContact OE2-NE 3.29Å; E113-R181 IonicContact OE2-NH2 3.22Å; E113-R181 PolarHBondContact OE2-NH2 2.96Å
114C88.3Confident86.2Confident33 Ų3334.2 Ų34.222%0.22317%0.173CC..Hα-helixtrans-64.8-38.6172.5-68.80000111.4T110 C111 R112 E116 A117 Y118T110-C114 PolarHBondContact O-N 3.36Å; T110-C114 VanDerWaalsContact O-N 3.12Å; T110-C114 PolarHBondContact O-SG 2.9Å; C111-C114 PolarHBondContact O-N 2.93Å; R112-C114 PolarHBondContact O-N 2.83Å; C114-E116 VanDerWaalsContact C-N 3.35Å; C114-A117 PolarHBondContact O-N 3.44Å; C114-Y118 PolarHBondContact O-N 2.91Å
115Y89.8Confident86.7Confident43 Ų4331.2 Ų31.217%0.16916%0.158CC..Hα-helixtrans-66.5-36.3177.5-160.3-97.1000112.2R83 W86 M87 I90 Y91 C111 R112 E113 A117 Y118 V119R83-Y115 PolarHBondContact O-OH 3.39Å; W86-Y115 WeakPolarHBondContact CB-OH 3.41Å; M87-Y115 VanDerWaalsContact CA-CE1 3.49Å; M87-Y115 HydrophobicContact CB-CD1 4.28Å; M87-Y115 HydrophobicContact CB-CE1 3.85Å; M87-Y115 HydrophobicContact CG-CD1 4.36Å; M87-Y115 HydrophobicContact CG-CE1 4.42Å; I90-Y115 HydrophobicContact CD1-CD1 4.39Å; I90-Y115 HydrophobicContact CD1-CD2 4.1Å; I90-Y115 HydrophobicContact CD1-CE1 4.01Å; I90-Y115 HydrophobicContact CD1-CE2 3.67Å; I90-Y115 HydrophobicContact CD1-CG 4.42Å; Y91-Y115 HydrophobicContact CE2-CD1 4.28Å; C111-Y115 WeakPolarHBondContact O-CB 3.31Å; C111-Y115 PolarHBondContact O-N 3.22Å; R112-Y115 WeakPolarHBondContact O-CB 3.15Å; R112-Y115 PolarHBondContact O-N 3.32Å; R112-Y115 VanDerWaalsContact O-N 3.15Å; E113-Y115 VanDerWaalsContact C-N 3.3Å; Y115-A117 VanDerWaalsContact C-N 3.3Å; Y115-A117 PolarHBondContact O-N 2.95Å; Y115-Y118 HydrophobicContact CD2-CD1 4.25Å; Y115-Y118 AromaticContact CE2-CD1 3.92Å; Y115-Y118 HydrophobicContact CE2-CD1 3.92Å; Y115-Y118 HydrophobicContact CE2-CE1 4.35Å; Y115-Y118 WeakPolarHBondContact O-CB 3.18Å; Y115-Y118 PolarHBondContact O-N 3.22Å; Y115-V119 HydrophobicContact CD1-CG2 3.51Å; Y115-V119 HydrophobicContact CE1-CG2 3.32Å; Y115-V119 HydrophobicContact CG-CG2 4.48Å; Y115-V119 VanDerWaalsContact O-CG2 3.28Å; Y115-V119 WeakPolarHBondContact O-CG2 3.38Å; Y115-V119 PolarHBondContact O-N 2.98Å
116E87Confident87.1Confident15 Ų1530.9 Ų30.97%0.0716%0.156CC..Hα-helixtrans-54-49.5172.1-174.1-172.1160.500111.2Y91 R112 E113 C114 Y118 V119 I120 Q219 K250 V253Y91-E116 WeakPolarHBondContact OH-CB 2.89Å; R112-E116 PolarHBondContact O-N 3.24Å; E113-E116 WeakPolarHBondContact O-CB 3.19Å; E113-E116 PolarHBondContact O-N 3.45Å; C114-E116 VanDerWaalsContact C-N 3.35Å; E116-Y118 VanDerWaalsContact C-N 3.29Å; E116-Y118 PolarHBondContact O-N 3.41Å; E116-V119 PolarHBondContact O-N 3.07Å; E116-V119 VanDerWaalsContact O-N 3.14Å; E116-I120 HydrophobicContact CG-CD1 4.18Å; E116-I120 WeakPolarHBondContact O-CG1 3.38Å; E116-I120 PolarHBondContact O-N 3.29Å; E116-Q219 PolarHBondContact OE1-NE2 3.07Å; E116-K250 IonicContact OE1-NZ 3.34Å; E116-K250 PolarHBondContact OE1-NZ 3.23Å; E116-V253 VanDerWaalsContact CD-CG1 3.4Å; E116-V253 HydrophobicContact CG-CG2 3.78Å; E116-V253 WeakPolarHBondContact OE1-CG1 2.89Å; E116-V253 WeakPolarHBondContact OE2-CG1 3.01Å
117A90Very high87.6Confident0 Ų028.1 Ų28.10%014%0.141CC..Hα-helixtrans-60.6-42.7-179.400000111.4E113 C114 Y115 V119 I120 Y121 Y177 T178 R181E113-A117 PolarHBondContact O-N 2.81Å; C114-A117 PolarHBondContact O-N 3.44Å; Y115-A117 VanDerWaalsContact C-N 3.3Å; Y115-A117 PolarHBondContact O-N 2.95Å; A117-V119 PolarHBondContact O-N 2.86Å; A117-I120 PolarHBondContact O-N 2.95Å; A117-Y121 PolarHBondContact O-N 3.27Å; A117-Y121 VanDerWaalsContact O-N 3.16Å; A117-Y177 VanDerWaalsContact CA-CE1 3.41Å; A117-Y177 HydrophobicContact CB-CD1 3.55Å; A117-Y177 HydrophobicContact CB-CE1 3.36Å; A117-Y177 HydrophobicContact CB-CG 4.26Å; A117-T178 PolarHBondContact O-OG1 3.34Å; A117-T178 VanDerWaalsContact O-OG1 3.11Å; A117-R181 HydrophobicContact CB-CB 4.04Å; A117-R181 HydrophobicContact CB-CG 4.49Å
118Y90.4Very high87.9Confident36 Ų3621.8 Ų21.814%0.14112%0.117CC..Hα-helixtrans-60.1-42.6174-178.4-113.1000112.9R83 C114 Y115 E116 Y121 N122 V337R83-Y118 HydrophobicContact CB-CE1 4.06Å; R83-Y118 WeakPolarHBondContact CD-OH 3.41Å; R83-Y118 HydrophobicContact CG-CE1 4.16Å; R83-Y118 PolarHBondContact NE-OH 3.32Å; R83-Y118 VanDerWaalsContact NE-OH 3.09Å; C114-Y118 PolarHBondContact O-N 2.91Å; Y115-Y118 HydrophobicContact CD2-CD1 4.25Å; Y115-Y118 AromaticContact CE2-CD1 3.92Å; Y115-Y118 HydrophobicContact CE2-CD1 3.92Å; Y115-Y118 HydrophobicContact CE2-CE1 4.35Å; Y115-Y118 WeakPolarHBondContact O-CB 3.18Å; Y115-Y118 PolarHBondContact O-N 3.22Å; E116-Y118 VanDerWaalsContact C-N 3.29Å; E116-Y118 PolarHBondContact O-N 3.41Å; Y118-Y121 PolarHBondContact O-N 3.31Å; Y118-N122 WeakPolarHBondContact CD1-ND2 3.35Å; Y118-N122 WeakPolarHBondContact CE1-ND2 2.89Å; Y118-N122 VanDerWaalsContact CE2-ND2 3.35Å; Y118-N122 WeakPolarHBondContact CE2-ND2 3.48Å; Y118-N122 PolarHBondContact O-N 2.85Å; Y118-N122 PolarHBondContact O-ND2 3.13Å; Y118-V337 HydrophobicContact CE2-CG1 4.48Å; Y118-V337 HydrophobicContact CE2-CG2 3.91Å
119V89.8Confident88Confident1 Ų121.5 Ų21.51%0.00611%0.114CC..Hα-helixtrans-64.8-41.6179.2168.40000111.3I84 M87 Y115 E116 A117 Y121 N122 F123 V249I84-V119 HydrophobicContact CB-CG1 4.45Å; I84-V119 HydrophobicContact CG1-CG1 4.09Å; I84-V119 HydrophobicContact CG2-CG1 4.22Å; M87-V119 HydrophobicContact CB-CG2 4.15Å; M87-V119 HydrophobicContact CG-CG2 4.34Å; M87-V119 HydrophobicContact SD-CG1 4.04Å; M87-V119 HydrophobicContact SD-CG2 4.41Å; Y115-V119 HydrophobicContact CD1-CG2 3.51Å; Y115-V119 HydrophobicContact CE1-CG2 3.32Å; Y115-V119 HydrophobicContact CG-CG2 4.48Å; Y115-V119 VanDerWaalsContact O-CG2 3.28Å; Y115-V119 WeakPolarHBondContact O-CG2 3.38Å; Y115-V119 PolarHBondContact O-N 2.98Å; E116-V119 PolarHBondContact O-N 3.07Å; E116-V119 VanDerWaalsContact O-N 3.14Å; A117-V119 PolarHBondContact O-N 2.86Å; V119-Y121 VanDerWaalsContact C-N 3.34Å; V119-Y121 PolarHBondContact O-N 2.83Å; V119-N122 PolarHBondContact O-N 3.39Å; V119-F123 WeakPolarHBondContact O-CB 3.29Å; V119-F123 PolarHBondContact O-N 3.31Å; V119-V249 HydrophobicContact CG1-CG1 3.46Å; V119-V249 VanDerWaalsContact CG1-CG1 3.46Å
120I89.8Confident88.3Confident6 Ų621.1 Ų21.13%0.03111%0.11CC..Hα-helixtrans-62.9-42.5177.3-64.9173.4000110.7E116 A117 F123 M124 V174 Y177 M223 L226E116-I120 HydrophobicContact CG-CD1 4.18Å; E116-I120 WeakPolarHBondContact O-CG1 3.38Å; E116-I120 PolarHBondContact O-N 3.29Å; A117-I120 PolarHBondContact O-N 2.95Å; I120-F123 PolarHBondContact O-N 2.83Å; I120-M124 PolarHBondContact O-N 3.13Å; I120-V174 HydrophobicContact CG2-CG1 3.74Å; I120-Y177 HydrophobicContact CD1-CD1 4.27Å; I120-Y177 HydrophobicContact CD1-CE1 3.9Å; I120-M223 HydrophobicContact CD1-SD 3.98Å; I120-L226 HydrophobicContact CG2-CD1 3.78Å
121Y91.3Very high88.4Confident0 Ų019.4 Ų19.40%010%0.099CC..Hα-helixtrans-62.2-46174.2163.3-93.3000112.2A117 Y118 V119 F123 M124 T125 L175 T178 V337 D340A117-Y121 PolarHBondContact O-N 3.27Å; A117-Y121 VanDerWaalsContact O-N 3.16Å; Y118-Y121 PolarHBondContact O-N 3.31Å; V119-Y121 VanDerWaalsContact C-N 3.34Å; V119-Y121 PolarHBondContact O-N 2.83Å; Y121-F123 PolarHBondContact O-N 3.08Å; Y121-M124 WeakPolarHBondContact O-CB 3.48Å; Y121-M124 PolarHBondContact O-N 3.13Å; Y121-M124 VanDerWaalsContact O-N 3.09Å; Y121-T125 PolarHBondContact O-N 2.85Å; Y121-T125 PolarHBondContact O-OG1 2.81Å; Y121-L175 HydrophobicContact CD2-CB 4.4Å; Y121-L175 HydrophobicContact CD2-CD1 3.67Å; Y121-L175 HydrophobicContact CE2-CD1 3.68Å; Y121-L175 HydrophobicContact CG-CD1 4.4Å; Y121-T178 VanDerWaalsContact CB-OG1 3.27Å; Y121-T178 WeakPolarHBondContact CB-OG1 3.34Å; Y121-V337 HydrophobicContact CD1-CG1 4.3Å; Y121-V337 HydrophobicContact CD1-CG2 4.31Å; Y121-V337 HydrophobicContact CE1-CB 4.07Å; Y121-V337 HydrophobicContact CE1-CG1 3.84Å; Y121-V337 HydrophobicContact CE1-CG2 3.5Å; Y121-V337 VanDerWaalsContact CE1-CG2 3.5Å; Y121-D340 PolarHBondContact OH-OD2 3.32Å
122N90.8Very high88.4Confident0 Ų020.4 Ų20.40%010%0.096CC..Hα-helixtrans-61.1-35.9176-80-76.2000112P80 R83 I84 Y118 V119 T125 F126P80-N122 HydrophobicContact CB-CB 4.25Å; P80-N122 WeakPolarHBondContact CB-O 3.49Å; R83-N122 HydrophobicContact CB-CB 4.5Å; R83-N122 WeakPolarHBondContact CD-OD1 3.45Å; R83-N122 PolarHBondContact NH1-OD1 2.76Å; I84-N122 HydrophobicContact CG1-CB 4.25Å; Y118-N122 WeakPolarHBondContact CD1-ND2 3.35Å; Y118-N122 WeakPolarHBondContact CE1-ND2 2.89Å; Y118-N122 VanDerWaalsContact CE2-ND2 3.35Å; Y118-N122 WeakPolarHBondContact CE2-ND2 3.48Å; Y118-N122 PolarHBondContact O-N 2.85Å; Y118-N122 PolarHBondContact O-ND2 3.13Å; V119-N122 PolarHBondContact O-N 3.39Å; N122-T125 PolarHBondContact O-N 3.04Å; N122-F126 VanDerWaalsContact O-CB 3.28Å; N122-F126 WeakPolarHBondContact O-CB 3.19Å; N122-F126 PolarHBondContact O-N 3.47Å
123F89.6Confident88.2Confident4 Ų425.6 Ų25.62%0.01812%0.115CC..Hα-helixtrans-64.4-42.1174.1-172.1-107.3000112I84 V119 I120 Y121 F126 L127 L226 K245 F246I84-F123 HydrophobicContact CD1-CB 4.07Å; I84-F123 HydrophobicContact CD1-CD2 4.03Å; V119-F123 WeakPolarHBondContact O-CB 3.29Å; V119-F123 PolarHBondContact O-N 3.31Å; I120-F123 PolarHBondContact O-N 2.83Å; Y121-F123 PolarHBondContact O-N 3.08Å; F123-F126 HydrophobicContact CD2-CD1 4.43Å; F123-F126 HydrophobicContact CE2-CD1 4.39Å; F123-F126 WeakPolarHBondContact O-CB 3.43Å; F123-F126 PolarHBondContact O-N 3.18Å; F123-L127 HydrophobicContact CD1-CD1 4.17Å; F123-L127 HydrophobicContact CE1-CD1 3.63Å; F123-L127 HydrophobicContact CE1-CD2 4.39Å; F123-L127 HydrophobicContact CE1-CG 4.14Å; F123-L127 HydrophobicContact CE2-CD2 4.29Å; F123-L127 HydrophobicContact CZ-CD1 4.03Å; F123-L127 HydrophobicContact CZ-CD2 3.95Å; F123-L127 HydrophobicContact CZ-CG 4.18Å; F123-L127 WeakPolarHBondContact O-CG 3.4Å; F123-L127 PolarHBondContact O-N 3.26Å; F123-L127 VanDerWaalsContact O-N 3.1Å; F123-L226 HydrophobicContact CD1-CD1 3.96Å; F123-L226 HydrophobicContact CD1-CD2 4.15Å; F123-L226 HydrophobicContact CE1-CD2 4.02Å; F123-K245 HydrophobicContact CE2-CB 3.91Å; F123-K245 HydrophobicContact CZ-CB 4.35Å; F123-F246 AromaticContact CD1-CD2 3.95Å; F123-F246 HydrophobicContact CD1-CD2 3.95Å; F123-F246 HydrophobicContact CE1-CB 3.7Å; F123-F246 AromaticContact CE1-CD2 3.56Å; F123-F246 HydrophobicContact CE1-CD2 3.56Å; F123-F246 HydrophobicContact CE1-CG 4.09Å; F123-F246 HydrophobicContact CZ-CB 3.63Å; F123-F246 HydrophobicContact CZ-CD2 4.35Å; F123-F246 HydrophobicContact CZ-CG 4.5Å
124M89.1Confident88.1Confident0 Ų027.3 Ų27.30%012%0.123CC..Hα-helixtrans-60.7-49.1173.7-178.769.3-167.800111.7I120 Y121 F126 L127 L128 C170 K171 V174 F229I120-M124 PolarHBondContact O-N 3.13Å; Y121-M124 WeakPolarHBondContact O-CB 3.48Å; Y121-M124 PolarHBondContact O-N 3.13Å; Y121-M124 VanDerWaalsContact O-N 3.09Å; M124-F126 VanDerWaalsContact C-N 3.29Å; M124-F126 PolarHBondContact O-N 3.43Å; M124-L127 PolarHBondContact O-N 3.1Å; M124-L128 HydrophobicContact CE-CD1 4.49Å; M124-L128 WeakPolarHBondContact O-CB 3.25Å; M124-L128 PolarHBondContact O-N 3.26Å; M124-C170 HydrophobicContact CE-CB 3.73Å; M124-K171 HydrophobicContact CE-CB 4.36Å; M124-V174 HydrophobicContact CB-CB 4.31Å; M124-V174 HydrophobicContact CB-CG1 4.09Å; M124-V174 HydrophobicContact CB-CG2 4.25Å; M124-V174 HydrophobicContact CG-CB 4.35Å; M124-V174 HydrophobicContact CG-CG2 4.17Å; M124-V174 HydrophobicContact SD-CG2 4.32Å; M124-F229 HydrophobicContact CE-CB 4.3Å; M124-F229 HydrophobicContact CE-CD1 4.2Å; M124-F229 HydrophobicContact CE-CD2 3.42Å; M124-F229 VanDerWaalsContact CE-CD2 3.42Å; M124-F229 HydrophobicContact CE-CE1 4.39Å; M124-F229 HydrophobicContact CE-CE2 3.57Å; M124-F229 HydrophobicContact CE-CG 3.72Å; M124-F229 HydrophobicContact CE-CZ 4.08Å; M124-F229 HydrophobicContact SD-CB 4.43Å; M124-F229 HydrophobicContact SD-CD1 4.11Å; M124-F229 HydrophobicContact SD-CD2 4.34Å; M124-F229 HydrophobicContact SD-CE1 4.45Å; M124-F229 HydrophobicContact SD-CG 4.05Å
125T89.4Confident87.8Confident9 Ų928.6 Ų28.66%0.05512%0.124CC..Hα-helixtrans-60.7-38.7177.5-61.40000111.6P80 Y121 N122 L128 N129P80-T125 HydrophobicContact CG-CG2 4.31Å; Y121-T125 PolarHBondContact O-N 2.85Å; Y121-T125 PolarHBondContact O-OG1 2.81Å; N122-T125 PolarHBondContact O-N 3.04Å; T125-L128 PolarHBondContact O-N 3.11Å; T125-N129 WeakPolarHBondContact O-CB 3.38Å; T125-N129 PolarHBondContact O-N 3.24Å; T125-N129 PolarHBondContact O-OD1 3.32Å
126F89.1Confident87.2Confident1 Ų132.4 Ų32.40%0.00415%0.154CC..Hα-helixtrans-58.3-49.6174.4171.1-111.9000112.3L77 P80 I81 N122 F123 M124 L128 Y130 I240 K245L77-F126 HydrophobicContact CB-CE2 4.27Å; L77-F126 HydrophobicContact CD2-CD2 4.41Å; L77-F126 HydrophobicContact CD2-CE2 4.38Å; P80-F126 HydrophobicContact CB-CB 3.82Å; P80-F126 HydrophobicContact CG-CB 4.48Å; I81-F126 HydrophobicContact CD1-CD2 4Å; I81-F126 HydrophobicContact CD1-CE2 3.46Å; I81-F126 VanDerWaalsContact CD1-CE2 3.46Å; I81-F126 HydrophobicContact CD1-CZ 4.03Å; I81-F126 HydrophobicContact CG1-CD2 3.72Å; I81-F126 HydrophobicContact CG1-CE2 3.69Å; I81-F126 HydrophobicContact CG1-CG 4.37Å; I81-F126 HydrophobicContact CG1-CZ 4.27Å; N122-F126 VanDerWaalsContact O-CB 3.28Å; N122-F126 WeakPolarHBondContact O-CB 3.19Å; N122-F126 PolarHBondContact O-N 3.47Å; F123-F126 HydrophobicContact CD2-CD1 4.43Å; F123-F126 HydrophobicContact CE2-CD1 4.39Å; F123-F126 WeakPolarHBondContact O-CB 3.43Å; F123-F126 PolarHBondContact O-N 3.18Å; M124-F126 VanDerWaalsContact C-N 3.29Å; M124-F126 PolarHBondContact O-N 3.43Å; F126-L128 VanDerWaalsContact C-N 3.33Å; F126-Y130 WeakPolarHBondContact O-CB 3.38Å; F126-Y130 PolarHBondContact O-N 3.36Å; F126-I240 HydrophobicContact CE1-CD1 4.2Å; F126-K245 HydrophobicContact CE1-CD 4.26Å
127L87.8Confident86.8Confident1 Ų134.5 Ų34.51%0.00517%0.17CC..Hα-helixtrans-65.8-39.2-179.5-59.8179.6000111.7F123 M124 Y130 L131 F229 L237 I240 P242F123-L127 HydrophobicContact CD1-CD1 4.17Å; F123-L127 HydrophobicContact CE1-CD1 3.63Å; F123-L127 HydrophobicContact CE1-CD2 4.39Å; F123-L127 HydrophobicContact CE1-CG 4.14Å; F123-L127 HydrophobicContact CE2-CD2 4.29Å; F123-L127 HydrophobicContact CZ-CD1 4.03Å; F123-L127 HydrophobicContact CZ-CD2 3.95Å; F123-L127 HydrophobicContact CZ-CG 4.18Å; F123-L127 WeakPolarHBondContact O-CG 3.4Å; F123-L127 PolarHBondContact O-N 3.26Å; F123-L127 VanDerWaalsContact O-N 3.1Å; M124-L127 PolarHBondContact O-N 3.1Å; L127-Y130 PolarHBondContact O-N 3.26Å; L127-L131 WeakPolarHBondContact O-CG 3.48Å; L127-L131 PolarHBondContact O-N 3.1Å; L127-L131 VanDerWaalsContact O-N 3.1Å; L127-F229 HydrophobicContact CB-CE1 3.68Å; L127-F229 HydrophobicContact CB-CZ 4.31Å; L127-F229 HydrophobicContact CD1-CD1 4.23Å; L127-F229 HydrophobicContact CD1-CE1 4.02Å; L127-L237 HydrophobicContact CB-CD2 4.28Å; L127-L237 HydrophobicContact CD2-CD2 4.03Å; L127-I240 HydrophobicContact CD2-CD1 3.77Å; L127-P242 HydrophobicContact CD2-CB 3.99Å
128L88.2Confident86.4Confident11 Ų1134.8 Ų34.86%0.05817%0.172CC..Hα-helixtrans-66.5-49.2179.4-173.5146.8000111.3M124 T125 F126 Y130 L131 E132 K171 F229M124-L128 HydrophobicContact CE-CD1 4.49Å; M124-L128 WeakPolarHBondContact O-CB 3.25Å; M124-L128 PolarHBondContact O-N 3.26Å; T125-L128 PolarHBondContact O-N 3.11Å; F126-L128 VanDerWaalsContact C-N 3.33Å; L128-Y130 VanDerWaalsContact C-N 3.26Å; L128-Y130 PolarHBondContact O-N 2.94Å; L128-L131 PolarHBondContact O-N 3.35Å; L128-L131 VanDerWaalsContact O-N 3.12Å; L128-E132 HydrophobicContact CD2-CG 4.16Å; L128-E132 WeakPolarHBondContact CD2-OE1 3.48Å; L128-E132 WeakPolarHBondContact O-CG 3.45Å; L128-E132 PolarHBondContact O-N 3.13Å; L128-K171 HydrophobicContact CD1-CD 4.3Å; L128-F229 HydrophobicContact CB-CZ 4.48Å
129N88.1Confident85.7Confident33 Ų3335.4 Ų35.418%0.17618%0.179CC..Hα-helixtrans-61-36.2176.6-68.2-4.2000112E76 L77 T125 R133E76-N129 PolarHBondContact O-ND2 2.92Å; L77-N129 HydrophobicContact CD2-CB 3.69Å; T125-N129 WeakPolarHBondContact O-CB 3.38Å; T125-N129 PolarHBondContact O-N 3.24Å; T125-N129 PolarHBondContact O-OD1 3.32Å; N129-R133 WeakPolarHBondContact O-CB 3.21Å; N129-R133 PolarHBondContact O-N 2.77Å
130Y85.8Confident84.9Confident36 Ų3641.2 Ų41.214%0.14121%0.208CC..Hα-helixtrans-63-44.9175.8177.3-99.1000111.4L77 F126 L127 L128 Q134 L237 P239 I240L77-Y130 HydrophobicContact CD1-CD2 4.19Å; F126-Y130 WeakPolarHBondContact O-CB 3.38Å; F126-Y130 PolarHBondContact O-N 3.36Å; L127-Y130 PolarHBondContact O-N 3.26Å; L128-Y130 VanDerWaalsContact C-N 3.26Å; L128-Y130 PolarHBondContact O-N 2.94Å; Y130-Q134 WeakPolarHBondContact O-CB 3.29Å; Y130-Q134 PolarHBondContact O-N 3.36Å; Y130-Q134 VanDerWaalsContact O-N 3.1Å; Y130-L237 HydrophobicContact CD1-CD2 4.21Å; Y130-P239 HydrophobicContact CE1-CG 4.49Å; Y130-P239 WeakPolarHBondContact OH-CG 3.22Å; Y130-I240 HydrophobicContact CD1-CD1 3.8Å; Y130-I240 HydrophobicContact CD1-CG1 4.34Å; Y130-I240 HydrophobicContact CD1-CG2 4.05Å; Y130-I240 HydrophobicContact CD2-CG2 3.98Å; Y130-I240 HydrophobicContact CE1-CB 4.47Å; Y130-I240 HydrophobicContact CE1-CD1 4.15Å; Y130-I240 HydrophobicContact CE1-CG1 4.19Å; Y130-I240 HydrophobicContact CE1-CG2 3.5Å; Y130-I240 VanDerWaalsContact CE1-CG2 3.5Å; Y130-I240 HydrophobicContact CE2-CG2 3.45Å; Y130-I240 VanDerWaalsContact CE2-CG2 3.45Å; Y130-I240 HydrophobicContact CG-CD1 4.16Å; Y130-I240 HydrophobicContact CG-CG2 4.26Å; Y130-I240 WeakPolarHBondContact OH-CG2 3.21Å
131L85.6Confident84.2Confident0 Ų043.1 Ų43.10%022%0.217CC..Hα-helixtrans-70.6-42.8-179.3-75.3167.1000112.9L127 L128 R133 Q134 Y135 L138 F229 L233 E236 L237L127-L131 WeakPolarHBondContact O-CG 3.48Å; L127-L131 PolarHBondContact O-N 3.1Å; L127-L131 VanDerWaalsContact O-N 3.1Å; L128-L131 PolarHBondContact O-N 3.35Å; L128-L131 VanDerWaalsContact O-N 3.12Å; L131-R133 PolarHBondContact O-N 3.38Å; L131-Q134 PolarHBondContact O-N 3.31Å; L131-Y135 HydrophobicContact CD2-CD2 4.08Å; L131-Y135 HydrophobicContact CD2-CE2 4.24Å; L131-Y135 WeakPolarHBondContact O-CA 3.3Å; L131-Y135 WeakPolarHBondContact O-CB 3.37Å; L131-Y135 PolarHBondContact O-N 3.29Å; L131-L138 HydrophobicContact CB-CD1 4.15Å; L131-L138 HydrophobicContact CB-CD2 3.77Å; L131-L138 HydrophobicContact CD2-CD1 4.4Å; L131-F229 HydrophobicContact CD1-CE1 4.11Å; L131-F229 HydrophobicContact CD1-CZ 3.67Å; L131-L233 HydrophobicContact CD1-CB 4.06Å; L131-L233 HydrophobicContact CD1-CD1 3.69Å; L131-L233 HydrophobicContact CD1-CD2 4.15Å; L131-L233 HydrophobicContact CD1-CG 4.17Å; L131-E236 HydrophobicContact CD2-CB 3.64Å; L131-L237 HydrophobicContact CD1-CD1 4.14Å; L131-L237 HydrophobicContact CD1-CD2 3.95Å; L131-L237 HydrophobicContact CD1-CG 4.03Å; L131-L237 HydrophobicContact CD2-CD2 4.16Å; L131-L237 HydrophobicContact CD2-CG 4.08Å; L131-L237 HydrophobicContact CG-CD2 3.91Å; L131-L237 HydrophobicContact CG-CG 4.23Å
132E85.4Confident83.5Confident103 Ų10343.3 Ų43.348%0.48122%0.218SC..Hα-helixtrans-61.1-36.4177.3-73.2-178.8165.700111.8L128 Y135 L138L128-E132 HydrophobicContact CD2-CG 4.16Å; L128-E132 WeakPolarHBondContact CD2-OE1 3.48Å; L128-E132 WeakPolarHBondContact O-CG 3.45Å; L128-E132 PolarHBondContact O-N 3.13Å; E132-Y135 CarbonylContact O-C 3.58Å; E132-L138 HydrophobicContact CG-CD2 4.31Å
133R83.1Confident82.7Confident130 Ų13049.1 Ų49.149%0.49125%0.245SC..Hα-helixtrans-72.4-41.2178-168.4177.8-174.491.55112.7E76 N129 L131E76-R133 IonicContact OE2-NH1 3.39Å; E76-R133 PolarHBondContact OE2-NH1 2.9Å; N129-R133 WeakPolarHBondContact O-CB 3.21Å; N129-R133 PolarHBondContact O-N 2.77Å; L131-R133 PolarHBondContact O-N 3.38Å
134Q81.9Confident81.9Confident111 Ų11155.1 Ų55.152%0.51928%0.282SS..Hα-helixtrans-77.9-31.7-178.9-16767.522.700111.9Y130 L131Y130-Q134 WeakPolarHBondContact O-CB 3.29Å; Y130-Q134 PolarHBondContact O-N 3.36Å; Y130-Q134 VanDerWaalsContact O-N 3.1Å; L131-Q134 PolarHBondContact O-N 3.31Å
135Y82.8Confident80.9Confident60 Ų6059.9 Ų59.924%0.23530%0.304CS..  trans-131.386.8-176.3-55.2-81.7000110.4L131 E132 S137 L138 M141 E236L131-Y135 HydrophobicContact CD2-CD2 4.08Å; L131-Y135 HydrophobicContact CD2-CE2 4.24Å; L131-Y135 WeakPolarHBondContact O-CA 3.3Å; L131-Y135 WeakPolarHBondContact O-CB 3.37Å; L131-Y135 PolarHBondContact O-N 3.29Å; E132-Y135 CarbonylContact O-C 3.58Å; Y135-S137 PolarHBondContact O-N 3.38Å; Y135-S137 VanDerWaalsContact O-N 3.11Å; Y135-L138 WeakPolarHBondContact O-CB 3.24Å; Y135-L138 PolarHBondContact O-N 3.48Å; Y135-M141 HydrophobicContact CD1-CE 4.04Å; Y135-M141 HydrophobicContact CD1-SD 4.3Å; Y135-M141 HydrophobicContact CD2-CE 4.47Å; Y135-M141 HydrophobicContact CG-CE 4Å; Y135-E236 HydrophobicContact CD2-CB 4.48Å; Y135-E236 VanDerWaalsContact CE1-OE2 3.26Å; Y135-E236 WeakPolarHBondContact CE1-OE2 3.28Å; Y135-E236 HydrophobicContact CE2-CB 3.87Å; Y135-E236 HydrophobicContact CE2-CG 4.42Å; Y135-E236 WeakPolarHBondContact CE2-OE2 3.43Å; Y135-E236 PolarHBondContact OH-OE2 3.01Å
136P76.9Confident79.6Confident124 Ų12467.2 Ų67.281%0.80534%0.338SS*.THydrogen-bonded Turntrans-60.1-24.5177.7-24.634.5000113.5
137S78.4Confident78.4Confident59 Ų5972.7 Ų72.741%0.41336%0.364SS..THydrogen-bonded Turntrans-99.227.3174.355.40000113.1Y135 V139 M140 M141Y135-S137 PolarHBondContact O-N 3.38Å; Y135-S137 VanDerWaalsContact O-N 3.11Å; S137-V139 PolarHBondContact O-N 3.14Å; S137-V139 VanDerWaalsContact O-N 3.16Å; S137-M140 PolarHBondContact O-N 2.87Å; S137-M141 PolarHBondContact O-N 3.28Å
138L80.3Confident77.2Confident6 Ų675 Ų753%0.03137%0.374CS..Hα-helixtrans-47.6-45.4-179.6-179.366.5000112.3L131 E132 Y135 M141 L142 L167 L233L131-L138 HydrophobicContact CB-CD1 4.15Å; L131-L138 HydrophobicContact CB-CD2 3.77Å; L131-L138 HydrophobicContact CD2-CD1 4.4Å; E132-L138 HydrophobicContact CG-CD2 4.31Å; Y135-L138 WeakPolarHBondContact O-CB 3.24Å; Y135-L138 PolarHBondContact O-N 3.48Å; L138-M141 HydrophobicContact CD1-CE 3.87Å; L138-M141 PolarHBondContact O-N 2.85Å; L138-L142 HydrophobicContact CD1-CD1 3.7Å; L138-L142 HydrophobicContact CD2-CD1 4.42Å; L138-L142 HydrophobicContact CG-CD1 3.6Å; L138-L142 WeakPolarHBondContact O-CB 3.2Å; L138-L142 VanDerWaalsContact O-CD1 3.23Å; L138-L142 WeakPolarHBondContact O-CD1 3.05Å; L138-L142 PolarHBondContact O-N 3.01Å; L138-L167 HydrophobicContact CD2-CD1 3.82Å; L138-L167 HydrophobicContact CD2-CD2 4.38Å; L138-L167 HydrophobicContact CG-CD1 4.23Å; L138-L233 HydrophobicContact CD1-CD2 3.81Å
139V77Confident75.9Confident48 Ų4883 Ų8329%0.29141%0.409SS..Hα-helixtrans-61-48.7-179.7175.90000111.6S137 M141 L142 E143 E164 L167S137-V139 PolarHBondContact O-N 3.14Å; S137-V139 VanDerWaalsContact O-N 3.16Å; V139-M141 VanDerWaalsContact C-N 3.32Å; V139-M141 PolarHBondContact O-N 2.96Å; V139-L142 PolarHBondContact O-N 3.31Å; V139-E143 WeakPolarHBondContact O-CG 3.42Å; V139-E143 PolarHBondContact O-N 3.31Å; V139-E164 HydrophobicContact CG1-CB 3.9Å; V139-E164 HydrophobicContact CG2-CB 4.38Å; V139-L167 HydrophobicContact CG2-CD1 4.25Å
140M72.2Confident74.9Confident124 Ų12482.2 Ų82.261%0.61140%0.404SS*.Hα-helixtrans-64.2-38.5178.8-71.4-179.9-101.400111.6S137 E143 V144S137-M140 PolarHBondContact O-N 2.87Å; M140-E143 PolarHBondContact O-N 3.47Å; M140-V144 WeakPolarHBondContact O-CG2 3.09Å; M140-V144 PolarHBondContact O-N 3.16Å
141M74.6Confident73.7Confident46 Ų4682.7 Ų82.723%0.22741%0.409CS..Hα-helixtrans-64-43175.7-176.5174.464.900111.5Y135 S137 L138 V139 E143 V144 Q145 E236Y135-M141 HydrophobicContact CD1-CE 4.04Å; Y135-M141 HydrophobicContact CD1-SD 4.3Å; Y135-M141 HydrophobicContact CD2-CE 4.47Å; Y135-M141 HydrophobicContact CG-CE 4Å; S137-M141 PolarHBondContact O-N 3.28Å; L138-M141 HydrophobicContact CD1-CE 3.87Å; L138-M141 PolarHBondContact O-N 2.85Å; V139-M141 VanDerWaalsContact C-N 3.32Å; V139-M141 PolarHBondContact O-N 2.96Å; M141-E143 VanDerWaalsContact C-N 3.35Å; M141-V144 PolarHBondContact O-N 3.37Å; M141-Q145 WeakPolarHBondContact O-CG 3.33Å; M141-Q145 PolarHBondContact O-N 3.09Å; M141-E236 HydrophobicContact CE-CG 3.62Å; M141-E236 HydrophobicContact SD-CG 4.45Å
142L77.1Confident71.8Confident4 Ų487.7 Ų87.72%0.02144%0.441CS..Hα-helixtrans-66.6-32.9175.1-92.1129.6000113L138 V139 V144 Q145 M162 L166 L167 L233L138-L142 HydrophobicContact CD1-CD1 3.7Å; L138-L142 HydrophobicContact CD2-CD1 4.42Å; L138-L142 HydrophobicContact CG-CD1 3.6Å; L138-L142 WeakPolarHBondContact O-CB 3.2Å; L138-L142 VanDerWaalsContact O-CD1 3.23Å; L138-L142 WeakPolarHBondContact O-CD1 3.05Å; L138-L142 PolarHBondContact O-N 3.01Å; V139-L142 PolarHBondContact O-N 3.31Å; L142-V144 VanDerWaalsContact C-N 3.25Å; L142-V144 PolarHBondContact O-N 3.27Å; L142-Q145 PolarHBondContact O-N 3.28Å; L142-M162 WeakPolarHBondContact O-CB 3.47Å; L142-L166 HydrophobicContact CD2-CD2 3.83Å; L142-L167 HydrophobicContact CD1-CD1 4.08Å; L142-L167 HydrophobicContact CD1-CD2 4.08Å; L142-L167 HydrophobicContact CD1-CG 4.22Å; L142-L233 HydrophobicContact CD1-CD2 3.83Å; L142-L233 HydrophobicContact CD2-CD2 4.35Å; L142-L233 HydrophobicContact CG-CD2 4.15Å
143E74.6Confident70.4Confident121 Ų12188 Ų8857%0.56545%0.452SS*.Hα-helixtrans-65.3-30177.4-78.2174.9176.600112.8V139 M140 M141V139-E143 WeakPolarHBondContact O-CG 3.42Å; V139-E143 PolarHBondContact O-N 3.31Å; M140-E143 PolarHBondContact O-N 3.47Å; M141-E143 VanDerWaalsContact C-N 3.35Å
144V71.9Confident69.2Low131 Ų13184.6 Ų84.679%0.79444%0.443SS*.Hα-helixtrans-84.6-19177.5-179.60000112.1M140 M141 L142M140-V144 WeakPolarHBondContact O-CG2 3.09Å; M140-V144 PolarHBondContact O-N 3.16Å; M141-V144 PolarHBondContact O-N 3.37Å; L142-V144 VanDerWaalsContact C-N 3.25Å; L142-V144 PolarHBondContact O-N 3.27Å
145Q68.5Low68Low99 Ų9983.1 Ų83.146%0.46344%0.444SS..SBendtrans-70.6147.4178.6-75.1-72.7-32.600112.2M141 L142 Q147M141-Q145 WeakPolarHBondContact O-CG 3.33Å; M141-Q145 PolarHBondContact O-N 3.09Å; L142-Q145 PolarHBondContact O-N 3.28Å; Q145-Q147 PolarHBondContact O-N 3.49Å
146E62Low66.6Low163 Ų16386.1 Ų86.176%0.76247%0.473SS*.  trans-61.9138.3176.7-73.1-168.3167.500111.4Q148E146-Q148 PolarHBondContact O-N 3.18Å; E146-Q148 PolarHBondContact O-NE2 3.43Å
147Q64.2Low65.7Low117 Ų11782.9 Ų82.955%0.54745%0.452SS..  trans-55.6112.2177.1-74.9-170.2-16.100111.2Q145 K149 M162Q145-Q147 PolarHBondContact O-N 3.49Å; Q147-K149 PolarHBondContact O-N 3.11Å; Q147-M162 HydrophobicContact CB-CG 4.39Å; Q147-M162 HydrophobicContact CG-CG 4.05Å
148Q63.4Low64.7Low50 Ų5085 Ų8523%0.23447%0.465CS..PPolyproline II helixtrans-67.6124173.6-63-58.9-61.200110.3E146 M162 A232E146-Q148 PolarHBondContact O-N 3.18Å; E146-Q148 PolarHBondContact O-NE2 3.43Å; Q148-M162 HydrophobicContact CB-CE 3.86Å; Q148-M162 HydrophobicContact CB-SD 4.32Å; Q148-M162 HydrophobicContact CG-CE 4.37Å; Q148-M162 HydrophobicContact CG-SD 4.18Å; Q148-M162 VanDerWaalsContact N-CE 3.28Å; Q148-A232 HydrophobicContact CG-CB 4.04Å
149K60.7Low63.9Low178 Ų17887.3 Ų87.377%0.77448%0.48SS*.PPolyproline II helixtrans-68.8141.8171.9-65.6-179.8-178176.50109.8Q147Q147-K149 PolarHBondContact O-N 3.11Å
150H67.1Low63.4Low17 Ų1787.7 Ų87.78%0.07948%0.476CS..PPolyproline II helixtrans-58.1140.2173.1-76-64.3000111.3L154 C157 P158 P159 W160 Y224H150-L154 HydrophobicContact CB-CB 4.49Å; H150-L154 VanDerWaalsContact CB-O 3.3Å; H150-L154 WeakPolarHBondContact CB-O 3.38Å; H150-C157 PolarHBondContact CD2-O 2.92Å; H150-P158 PolarHBondContact CD2-O 3.36Å; H150-P158 PolarHBondContact NE2-O 3.46Å; H150-P159 WeakPolarHBondContact NE2-CA 3.33Å; H150-W160 AromaticContact CE1-CD1 3.74Å; H150-W160 AromaticContact CE1-CG 3.94Å; H150-W160 AromaticContact CE1-NE1 3.8Å; H150-W160 AromaticContact NE2-CD1 3.66Å; H150-W160 AromaticContact NE2-NE1 3.96Å; H150-Y224 VanDerWaalsContact CA-OH 3.26Å; H150-Y224 WeakPolarHBondContact CA-OH 3.5Å; H150-Y224 WeakPolarHBondContact CB-OH 3.46Å; H150-Y224 VanDerWaalsContact CG-OH 3.28Å; H150-Y224 AromaticContact ND1-CZ 3.83Å; H150-Y224 PolarHBondContact ND1-OH 3.43Å
151L59.9Low63.1Low46 Ų4684.9 Ų84.924%0.24147%0.467CS..PPolyproline II helixtrans-75150175.3-93.970.9000110L154 Y224 V227L151-L154 PolarHBondContact O-N 2.93Å; L151-Y224 HydrophobicContact CB-CE2 3.86Å; L151-Y224 PolarHBondContact N-OH 3.39Å; L151-Y224 VanDerWaalsContact N-OH 3.11Å; L151-V227 HydrophobicContact CD2-CG1 4.1Å
152P46.5Very low62.7Low105 Ų10583.9 Ų83.968%0.68246%0.462SS*.THydrogen-bonded Turntrans-57.6133168.923.6-30.4000109.1
153P54.5Low62.7Low108 Ų10883.7 Ų83.770%0.70146%0.461SS*.THydrogen-bonded Turncis-95.6220.635.6-35.2000117.1
154L58.4Low62.8Low59 Ų5981 Ų8131%0.30945%0.449SS..SBendtrans-95.820.3-177.4-77.9155.5000113.4H150 L151 C156 C157 Y224H150-L154 HydrophobicContact CB-CB 4.49Å; H150-L154 VanDerWaalsContact CB-O 3.3Å; H150-L154 WeakPolarHBondContact CB-O 3.38Å; L151-L154 PolarHBondContact O-N 2.93Å; L154-C156 PolarHBondContact O-N 2.87Å; L154-C157 VanDerWaalsContact CD2-SG 3.6Å; L154-C157 WeakPolarHBondContact O-CB 3.27Å; L154-C157 PolarHBondContact O-N 3.45Å; L154-Y224 HydrophobicContact CB-CE2 4.44Å; L154-Y224 HydrophobicContact CD1-CD1 3.9Å; L154-Y224 HydrophobicContact CD1-CD2 4.45Å; L154-Y224 HydrophobicContact CD1-CE1 3.76Å; L154-Y224 HydrophobicContact CD1-CE2 4.31Å; L154-Y224 HydrophobicContact CD1-CG 4.26Å
155C56.7Low63Low81 Ų8177.2 Ų77.255%0.54743%0.426SS..THydrogen-bonded Turntrans-60.8-17-177.853.20000114.5
156C53.8Low63.8Low123 Ų12372.5 Ų72.583%0.83140%0.404SS*.THydrogen-bonded Turntrans-88.1-8.8177.4-53.80000113.7L154L154-C156 PolarHBondContact O-N 2.87Å
157C57.7Low64.8Low55 Ų5565.3 Ų65.337%0.37237%0.37SS..SBendtrans-82.6148.8177.9-69.90000111.1H150 L154H150-C157 PolarHBondContact CD2-O 2.92Å; L154-C157 VanDerWaalsContact CD2-SG 3.6Å; L154-C157 WeakPolarHBondContact O-CB 3.27Å; L154-C157 PolarHBondContact O-N 3.45Å
158P57.5Low65.7Low104 Ų10461 Ų6168%0.67535%0.351SS*.PPolyproline II helixtrans-60.9134.2176.223.9-32.1000110.3H150 W160H150-P158 PolarHBondContact CD2-O 3.36Å; H150-P158 PolarHBondContact NE2-O 3.46Å; P158-W160 PolarHBondContact O-N 3.44Å
159P63.6Low66.7Low54 Ų5465.3 Ų65.335%0.35137%0.365SS..PPolyproline II helixtrans-56.5140.2176.623.8-31.9000109.9H150H150-P159 WeakPolarHBondContact NE2-CA 3.33Å
160W66.7Low67.9Low56 Ų5656.8 Ų56.821%0.21233%0.328CS..PPolyproline II helixtrans-71.7139.3175.8-69-4.7000109.3H150 P158 M162 L166 R169 L228H150-W160 AromaticContact CE1-CD1 3.74Å; H150-W160 AromaticContact CE1-CG 3.94Å; H150-W160 AromaticContact CE1-NE1 3.8Å; H150-W160 AromaticContact NE2-CD1 3.66Å; H150-W160 AromaticContact NE2-NE1 3.96Å; P158-W160 PolarHBondContact O-N 3.44Å; W160-M162 WeakPolarHBondContact O-CE 3.28Å; W160-M162 PolarHBondContact O-N 2.95Å; W160-L166 HydrophobicContact CB-CD1 4.31Å; W160-L166 HydrophobicContact CE3-CD1 3.94Å; W160-R169 HydrophobicContact CD2-CB 4.03Å; W160-R169 HydrophobicContact CD2-CG 4.38Å; W160-R169 HydrophobicContact CE3-CB 3.36Å; W160-R169 HydrophobicContact CE3-CG 4.16Å; W160-R169 HydrophobicContact CH2-CB 3.76Å; W160-R169 HydrophobicContact CZ2-CB 4.35Å; W160-R169 HydrophobicContact CZ3-CB 3.23Å; W160-R169 HydrophobicContact CZ3-CG 4.35Å; W160-L228 HydrophobicContact CE3-CD2 4.27Å; W160-L228 HydrophobicContact CZ3-CD2 4.45Å
161P65.3Low68.9Low66 Ų6658 Ų5843%0.42933%0.333SS..PPolyproline II helixtrans-60.5129.7176.823.2-29.4000109V165 L166P161-V165 HydrophobicContact CG-CB 3.89Å; P161-V165 HydrophobicContact CG-CG1 3.73Å; P161-V165 HydrophobicContact CG-CG2 4.26Å; P161-L166 PolarHBondContact O-N 3.27Å
162M67.8Low70.3Confident24 Ų2457.9 Ų57.912%0.11833%0.332CS..THydrogen-bonded Turntrans-66.7159.5178.1-60.2-72.6116.300110.1L142 Q147 Q148 W160 L166L142-M162 WeakPolarHBondContact O-CB 3.47Å; Q147-M162 HydrophobicContact CB-CG 4.39Å; Q147-M162 HydrophobicContact CG-CG 4.05Å; Q148-M162 HydrophobicContact CB-CE 3.86Å; Q148-M162 HydrophobicContact CB-SD 4.32Å; Q148-M162 HydrophobicContact CG-CE 4.37Å; Q148-M162 HydrophobicContact CG-SD 4.18Å; Q148-M162 VanDerWaalsContact N-CE 3.28Å; W160-M162 WeakPolarHBondContact O-CE 3.28Å; W160-M162 PolarHBondContact O-N 2.95Å; M162-L166 HydrophobicContact CE-CD1 4.47Å; M162-L166 HydrophobicContact CE-CD2 3.9Å; M162-L166 HydrophobicContact SD-CD2 3.75Å
163G75.9Confident72.2Confident0 Ų053 Ų530%030%0.302CS..THydrogen-bonded Turntrans101.1-142-174.600000112.3V165 L166 L167G163-V165 VanDerWaalsContact C-N 3.29Å; G163-V165 PolarHBondContact O-N 3.44Å; G163-L166 PolarHBondContact O-N 3.45Å; G163-L167 PolarHBondContact O-N 3.4Å
164E75.8Confident73.9Confident66 Ų6647.9 Ų47.931%0.30827%0.268SS..Hα-helixtrans-61.6-37.7-173.7-162.3-157128.900112.6V139 L166 L167 L168 Y360V139-E164 HydrophobicContact CG1-CB 3.9Å; V139-E164 HydrophobicContact CG2-CB 4.38Å; E164-L166 VanDerWaalsContact C-N 3.34Å; E164-L166 PolarHBondContact O-N 3.34Å; E164-L167 PolarHBondContact O-N 3.32Å; E164-L168 WeakPolarHBondContact O-CB 3.43Å; E164-L168 PolarHBondContact O-N 3.28Å; E164-Y360 WeakPolarHBondContact OE1-CB 3.48Å
165V78.1Confident75.4Confident50 Ų5045.2 Ų45.230%0.30325%0.254SS..Hα-helixtrans-66.3-38.3-176.3-178.40000111.2P161 G163 R169P161-V165 HydrophobicContact CG-CB 3.89Å; P161-V165 HydrophobicContact CG-CG1 3.73Å; P161-V165 HydrophobicContact CG-CG2 4.26Å; G163-V165 VanDerWaalsContact C-N 3.29Å; G163-V165 PolarHBondContact O-N 3.44Å; V165-R169 HydrophobicContact CG1-CG 4.01Å; V165-R169 WeakPolarHBondContact O-CB 3.34Å; V165-R169 WeakPolarHBondContact O-CG 3.2Å; V165-R169 PolarHBondContact O-N 2.92Å
166L83.7Confident77.1Confident1 Ų143.6 Ų43.61%0.00524%0.239CC..Hα-helixtrans-63.1-50.3175.7177.965.6000110.9L142 W160 P161 M162 G163 E164 L168 R169 C170 L228 A232L142-L166 HydrophobicContact CD2-CD2 3.83Å; W160-L166 HydrophobicContact CB-CD1 4.31Å; W160-L166 HydrophobicContact CE3-CD1 3.94Å; P161-L166 PolarHBondContact O-N 3.27Å; M162-L166 HydrophobicContact CE-CD1 4.47Å; M162-L166 HydrophobicContact CE-CD2 3.9Å; M162-L166 HydrophobicContact SD-CD2 3.75Å; G163-L166 PolarHBondContact O-N 3.45Å; E164-L166 VanDerWaalsContact C-N 3.34Å; E164-L166 PolarHBondContact O-N 3.34Å; L166-L168 PolarHBondContact O-N 2.86Å; L166-R169 PolarHBondContact O-N 3.33Å; L166-C170 WeakPolarHBondContact O-CB 3.27Å; L166-C170 PolarHBondContact O-N 2.87Å; L166-C170 PolarHBondContact O-SG 3.43Å; L166-L228 HydrophobicContact CD1-CD2 4.2Å; L166-A232 HydrophobicContact CD2-CB 3.81Å
167L83.8Confident78.8Confident12 Ų1237.7 Ų37.76%0.06320%0.199CC..Hα-helixtrans-57.7-49.1-179.9-63.3177.2000111L138 V139 L142 G163 E164 C170 K171 F229 L233L138-L167 HydrophobicContact CD2-CD1 3.82Å; L138-L167 HydrophobicContact CD2-CD2 4.38Å; L138-L167 HydrophobicContact CG-CD1 4.23Å; V139-L167 HydrophobicContact CG2-CD1 4.25Å; L142-L167 HydrophobicContact CD1-CD1 4.08Å; L142-L167 HydrophobicContact CD1-CD2 4.08Å; L142-L167 HydrophobicContact CD1-CG 4.22Å; G163-L167 PolarHBondContact O-N 3.4Å; E164-L167 PolarHBondContact O-N 3.32Å; L167-C170 PolarHBondContact O-N 3.17Å; L167-K171 WeakPolarHBondContact O-CB 3.45Å; L167-K171 PolarHBondContact O-N 2.92Å; L167-F229 HydrophobicContact CD2-CD2 4.04Å; L167-F229 HydrophobicContact CD2-CE2 3.47Å; L167-F229 VanDerWaalsContact CD2-CE2 3.47Å; L167-F229 HydrophobicContact CD2-CZ 4.5Å; L167-L233 HydrophobicContact CD2-CD1 3.91Å
168L82.9Confident80.4Confident27 Ų2735.8 Ų35.814%0.14119%0.186CC..Hα-helixtrans-62.8-45.2178.9-176.765.8000111.5E164 L166 K171 L172 Y360E164-L168 WeakPolarHBondContact O-CB 3.43Å; E164-L168 PolarHBondContact O-N 3.28Å; L166-L168 PolarHBondContact O-N 2.86Å; L168-K171 PolarHBondContact O-N 3.39Å; L168-L172 HydrophobicContact CD1-CD1 4.19Å; L168-L172 HydrophobicContact CD1-CG 4.29Å; L168-L172 HydrophobicContact CD2-CD1 4.48Å; L168-L172 HydrophobicContact CG-CD1 3.87Å; L168-L172 HydrophobicContact CG-CG 4.37Å; L168-L172 VanDerWaalsContact O-CB 3.31Å; L168-L172 WeakPolarHBondContact O-CB 3.35Å; L168-L172 WeakPolarHBondContact O-CG 3.39Å; L168-L172 PolarHBondContact O-N 3.1Å; L168-Y360 HydrophobicContact CD1-CE1 4.48Å; L168-Y360 HydrophobicContact CD2-CE2 4.08Å
169R84.4Confident81.9Confident139 Ų13933.5 Ų33.553%0.52517%0.169SC..Hα-helixtrans-67.5-38.7-179.1-70.5-78.6-171.8179.72.8112.2W160 V165 L166 G173W160-R169 HydrophobicContact CD2-CB 4.03Å; W160-R169 HydrophobicContact CD2-CG 4.38Å; W160-R169 HydrophobicContact CE3-CB 3.36Å; W160-R169 HydrophobicContact CE3-CG 4.16Å; W160-R169 HydrophobicContact CH2-CB 3.76Å; W160-R169 HydrophobicContact CZ2-CB 4.35Å; W160-R169 HydrophobicContact CZ3-CB 3.23Å; W160-R169 HydrophobicContact CZ3-CG 4.35Å; V165-R169 HydrophobicContact CG1-CG 4.01Å; V165-R169 WeakPolarHBondContact O-CB 3.34Å; V165-R169 WeakPolarHBondContact O-CG 3.2Å; V165-R169 PolarHBondContact O-N 2.92Å; L166-R169 PolarHBondContact O-N 3.33Å; R169-G173 PolarHBondContact O-N 2.9Å
170C86.8Confident83.2Confident0 Ų032 Ų320%016%0.159CC..Hα-helixtrans-64.8-45.7174-75.40000111.2M124 L166 L167 L172 G173 V174 C225 F229M124-C170 HydrophobicContact CE-CB 3.73Å; L166-C170 WeakPolarHBondContact O-CB 3.27Å; L166-C170 PolarHBondContact O-N 2.87Å; L166-C170 PolarHBondContact O-SG 3.43Å; L167-C170 PolarHBondContact O-N 3.17Å; C170-L172 PolarHBondContact O-N 3.4Å; C170-G173 PolarHBondContact O-N 2.84Å; C170-V174 WeakPolarHBondContact O-CG2 3.16Å; C170-V174 PolarHBondContact O-N 3.41Å; C170-V174 VanDerWaalsContact O-N 3.07Å; C170-C225 PolarHBondContact SG-O 3.17Å; C170-F229 HydrophobicContact CB-CB 4.06Å; C170-F229 HydrophobicContact CB-CD2 4.22Å
171K87.9Confident84.3Confident43 Ų4330.2 Ų30.219%0.18715%0.153CC..Hα-helixtrans-59-47.8175.9-174.3178.5178.6-177.80111.2M124 L128 L167 L168 G173 V174 L175 D340M124-K171 HydrophobicContact CE-CB 4.36Å; L128-K171 HydrophobicContact CD1-CD 4.3Å; L167-K171 WeakPolarHBondContact O-CB 3.45Å; L167-K171 PolarHBondContact O-N 2.92Å; L168-K171 PolarHBondContact O-N 3.39Å; K171-G173 VanDerWaalsContact C-N 3.34Å; K171-G173 PolarHBondContact O-N 3.2Å; K171-V174 PolarHBondContact O-N 3.27Å; K171-L175 VanDerWaalsContact O-CB 3.31Å; K171-L175 WeakPolarHBondContact O-CB 3.31Å; K171-L175 PolarHBondContact O-N 3.22Å; K171-D340 VanDerWaalsContact CE-CG 3.44Å; K171-D340 WeakPolarHBondContact CE-OD2 2.97Å; K171-D340 IonicContact NZ-OD1 2.76Å; K171-D340 PolarHBondContact NZ-OD1 3Å; K171-D340 IonicContact NZ-OD2 3.91Å; K171-D340 PolarHBondContact NZ-OD2 3.44Å
172L87.8Confident85.5Confident42 Ų4229.8 Ų29.822%0.2215%0.15CC..Hα-helixtrans-64.1-36.7177-71.1173.1000112.9L168 C170 L175 Q176 Q344L168-L172 HydrophobicContact CD1-CD1 4.19Å; L168-L172 HydrophobicContact CD1-CG 4.29Å; L168-L172 HydrophobicContact CD2-CD1 4.48Å; L168-L172 HydrophobicContact CG-CD1 3.87Å; L168-L172 HydrophobicContact CG-CG 4.37Å; L168-L172 VanDerWaalsContact O-CB 3.31Å; L168-L172 WeakPolarHBondContact O-CB 3.35Å; L168-L172 WeakPolarHBondContact O-CG 3.39Å; L168-L172 PolarHBondContact O-N 3.1Å; C170-L172 PolarHBondContact O-N 3.4Å; L172-L175 PolarHBondContact O-N 3.14Å; L172-Q176 WeakPolarHBondContact O-CB 3.31Å; L172-Q176 PolarHBondContact O-N 3.42Å; L172-Q344 HydrophobicContact CD2-CB 3.82Å; L172-Q344 HydrophobicContact CD2-CG 3.74Å
173G87.9Confident86.6Confident4 Ų432.2 Ų32.24%0.04117%0.166CC..Hα-helixtrans-65.1-39.4177.500000112.6R169 C170 K171R169-G173 PolarHBondContact O-N 2.9Å; C170-G173 PolarHBondContact O-N 2.84Å; K171-G173 VanDerWaalsContact C-N 3.34Å; K171-G173 PolarHBondContact O-N 3.2Å
174V90.1Very high87.2Confident0 Ų032.5 Ų32.50%017%0.167CC..Hα-helixtrans-72.7-41.7174.1178.60000111.5I120 M124 C170 K171 Q176 Y177 C225 L226I120-V174 HydrophobicContact CG2-CG1 3.74Å; M124-V174 HydrophobicContact CB-CB 4.31Å; M124-V174 HydrophobicContact CB-CG1 4.09Å; M124-V174 HydrophobicContact CB-CG2 4.25Å; M124-V174 HydrophobicContact CG-CB 4.35Å; M124-V174 HydrophobicContact CG-CG2 4.17Å; M124-V174 HydrophobicContact SD-CG2 4.32Å; C170-V174 WeakPolarHBondContact O-CG2 3.16Å; C170-V174 PolarHBondContact O-N 3.41Å; C170-V174 VanDerWaalsContact O-N 3.07Å; K171-V174 PolarHBondContact O-N 3.27Å; V174-Q176 PolarHBondContact O-N 3.45Å; V174-Y177 PolarHBondContact O-N 3.17Å; V174-C225 HydrophobicContact CG2-CB 4.42Å; V174-L226 HydrophobicContact CG2-CB 4.18Å; V174-L226 HydrophobicContact CG2-CD1 4.46Å
175L89.3Confident87.8Confident2 Ų230.3 Ų30.31%0.0116%0.159CC..Hα-helixtrans-62-34179-171.458.9000112.2Y121 K171 L172 Y177 T178 V179 D340 I341 Q344Y121-L175 HydrophobicContact CD2-CB 4.4Å; Y121-L175 HydrophobicContact CD2-CD1 3.67Å; Y121-L175 HydrophobicContact CE2-CD1 3.68Å; Y121-L175 HydrophobicContact CG-CD1 4.4Å; K171-L175 VanDerWaalsContact O-CB 3.31Å; K171-L175 WeakPolarHBondContact O-CB 3.31Å; K171-L175 PolarHBondContact O-N 3.22Å; L172-L175 PolarHBondContact O-N 3.14Å; L175-Y177 VanDerWaalsContact C-N 3.31Å; L175-Y177 PolarHBondContact O-N 3.44Å; L175-T178 WeakPolarHBondContact O-CB 3.36Å; L175-T178 PolarHBondContact O-N 3.49Å; L175-T178 VanDerWaalsContact O-N 3.12Å; L175-V179 PolarHBondContact O-N 2.88Å; L175-V179 VanDerWaalsContact O-N 3.17Å; L175-D340 HydrophobicContact CD2-CB 4.07Å; L175-I341 HydrophobicContact CD1-CG1 3.8Å; L175-I341 HydrophobicContact CD2-CG1 4.47Å; L175-I341 HydrophobicContact CG-CG1 4.38Å; L175-Q344 HydrophobicContact CD2-CB 4.12Å
176Q91.4Very high88.3Confident47 Ų4731.8 Ų31.822%0.2217%0.168CC..Hα-helixtrans-54.1-44.2174.7178.1-84.2-31.900112.4L172 V174 V179 V180 S218L172-Q176 WeakPolarHBondContact O-CB 3.31Å; L172-Q176 PolarHBondContact O-N 3.42Å; V174-Q176 PolarHBondContact O-N 3.45Å; Q176-V179 PolarHBondContact O-N 3.27Å; Q176-V180 HydrophobicContact CG-CG2 4.46Å; Q176-V180 WeakPolarHBondContact O-CB 3.01Å; Q176-V180 WeakPolarHBondContact O-CG2 3.21Å; Q176-V180 PolarHBondContact O-N 3.4Å; Q176-S218 VanDerWaalsContact CD-OG 3.24Å; Q176-S218 PolarHBondContact NE2-OG 3.12Å; Q176-S218 PolarHBondContact OE1-OG 3.01Å
177Y91.1Very high88.6Confident0 Ų035.2 Ų35.20%019%0.185CC..Hα-helixtrans-66.9-37.3178.5175.3-121000112.5A117 I120 V174 L175 V179 V180 R181 Q219 A222A117-Y177 VanDerWaalsContact CA-CE1 3.41Å; A117-Y177 HydrophobicContact CB-CD1 3.55Å; A117-Y177 HydrophobicContact CB-CE1 3.36Å; A117-Y177 HydrophobicContact CB-CG 4.26Å; I120-Y177 HydrophobicContact CD1-CD1 4.27Å; I120-Y177 HydrophobicContact CD1-CE1 3.9Å; V174-Y177 PolarHBondContact O-N 3.17Å; L175-Y177 VanDerWaalsContact C-N 3.31Å; L175-Y177 PolarHBondContact O-N 3.44Å; Y177-V179 VanDerWaalsContact C-N 3.26Å; Y177-V179 PolarHBondContact O-N 3.06Å; Y177-V180 PolarHBondContact O-N 3.36Å; Y177-R181 HydrophobicContact CE2-CB 4.35Å; Y177-R181 PolarHBondContact O-N 3.4Å; Y177-Q219 HydrophobicContact CD2-CB 4.04Å; Y177-Q219 HydrophobicContact CE1-CB 4.43Å; Y177-Q219 HydrophobicContact CE1-CG 4.04Å; Y177-Q219 HydrophobicContact CE2-CB 3.55Å; Y177-Q219 HydrophobicContact CE2-CG 4.01Å; Y177-A222 HydrophobicContact CD1-CB 4.39Å; Y177-A222 HydrophobicContact CG-CB 4.17Å
178T90Very high88.7Confident15 Ų1535.2 Ų35.29%0.09219%0.187CC..Hα-helixtrans-63.5-31.8177.9-53.20000112.5A117 Y121 L175 P182A117-T178 PolarHBondContact O-OG1 3.34Å; A117-T178 VanDerWaalsContact O-OG1 3.11Å; Y121-T178 VanDerWaalsContact CB-OG1 3.27Å; Y121-T178 WeakPolarHBondContact CB-OG1 3.34Å; L175-T178 WeakPolarHBondContact O-CB 3.36Å; L175-T178 PolarHBondContact O-N 3.49Å; L175-T178 VanDerWaalsContact O-N 3.12Å; T178-P182 WeakPolarHBondContact O-CD 3.3Å; T178-P182 WeakPolarHBondContact O-CG 3.47Å
179V90.3Very high88.8Confident55 Ų5537.4 Ų37.433%0.33320%0.199SC..Hα-helixtrans-85.6-40.6175.8178.30000111.5L175 Q176 Y177 R181 P182 V183 I341L175-V179 PolarHBondContact O-N 2.88Å; L175-V179 VanDerWaalsContact O-N 3.17Å; Q176-V179 PolarHBondContact O-N 3.27Å; Y177-V179 VanDerWaalsContact C-N 3.26Å; Y177-V179 PolarHBondContact O-N 3.06Å; V179-R181 VanDerWaalsContact C-N 3.34Å; V179-R181 PolarHBondContact O-N 2.9Å; V179-P182 WeakPolarHBondContact O-CD 3.48Å; V179-V183 HydrophobicContact CG1-CG2 4.45Å; V179-V183 VanDerWaalsContact O-CG2 3.28Å; V179-V183 WeakPolarHBondContact O-CG2 3.13Å; V179-V183 PolarHBondContact O-N 3.31Å; V179-I341 HydrophobicContact CG2-CD1 4.26Å; V179-I341 HydrophobicContact CG2-CG1 4.14Å; V179-I341 HydrophobicContact CG2-CG2 4.39Å
180V90.6Very high88.9Confident23 Ų2335.3 Ų35.314%0.13920%0.197CC..Hα-helixtrans-63.8-38.8-178.1156.50000112Q176 Y177 V183 T184 F214Q176-V180 HydrophobicContact CG-CG2 4.46Å; Q176-V180 WeakPolarHBondContact O-CB 3.01Å; Q176-V180 WeakPolarHBondContact O-CG2 3.21Å; Q176-V180 PolarHBondContact O-N 3.4Å; Y177-V180 PolarHBondContact O-N 3.36Å; V180-V183 PolarHBondContact O-N 3.17Å; V180-T184 HydrophobicContact CG1-CG2 3.92Å; V180-T184 WeakPolarHBondContact O-CG2 3.49Å; V180-T184 PolarHBondContact O-N 2.91Å; V180-T184 PolarHBondContact O-OG1 3.35Å; V180-F214 HydrophobicContact CG1-CD1 3.98Å; V180-F214 HydrophobicContact CG1-CE1 3.44Å; V180-F214 VanDerWaalsContact CG1-CE1 3.44Å; V180-F214 HydrophobicContact CG1-CZ 4.35Å; V180-F214 HydrophobicContact CG2-CE1 4.29Å
181R89.4Confident88.8Confident19 Ų1936.6 Ų36.67%0.07221%0.205CC..Hα-helixtrans-63.7-50.2-175.6-171.352.9163.6-117.512.6113.4E113 A117 Y177 V179 V183 T184 T185E113-R181 IonicContact OE1-NH2 2.99Å; E113-R181 PolarHBondContact OE1-NH2 3.21Å; E113-R181 IonicContact OE2-CZ 2.83Å; E113-R181 IonicContact OE2-NE 2.76Å; E113-R181 PolarHBondContact OE2-NE 3.29Å; E113-R181 IonicContact OE2-NH2 3.22Å; E113-R181 PolarHBondContact OE2-NH2 2.96Å; A117-R181 HydrophobicContact CB-CB 4.04Å; A117-R181 HydrophobicContact CB-CG 4.49Å; Y177-R181 HydrophobicContact CE2-CB 4.35Å; Y177-R181 PolarHBondContact O-N 3.4Å; V179-R181 VanDerWaalsContact C-N 3.34Å; V179-R181 PolarHBondContact O-N 2.9Å; R181-V183 VanDerWaalsContact C-N 3.29Å; R181-V183 PolarHBondContact O-N 3.23Å; R181-T184 PolarHBondContact O-N 2.98Å; R181-T184 PolarHBondContact O-OG1 3.28Å; R181-T185 PolarHBondContact O-N 3.48Å; R181-T185 PolarHBondContact O-OG1 3.35Å
182P90.5Very high88.5Confident56 Ų5638 Ų3836%0.36421%0.213SC..Hα-helixtrans-60.5-36172.8-25.234.7000113.6T178 V179 T185 V186T178-P182 WeakPolarHBondContact O-CD 3.3Å; T178-P182 WeakPolarHBondContact O-CG 3.47Å; V179-P182 WeakPolarHBondContact O-CD 3.48Å; P182-T185 WeakPolarHBondContact O-CB 3.2Å; P182-T185 PolarHBondContact O-N 2.97Å; P182-V186 WeakPolarHBondContact O-CG2 3.45Å; P182-V186 PolarHBondContact O-N 3.13Å
183V90.9Very high88.3Confident76 Ų7643.5 Ų43.546%0.46124%0.241SC..Hα-helixtrans-65.8-44.5178171.10000110.9V179 V180 R181 T185 V186 I187V179-V183 HydrophobicContact CG1-CG2 4.45Å; V179-V183 VanDerWaalsContact O-CG2 3.28Å; V179-V183 WeakPolarHBondContact O-CG2 3.13Å; V179-V183 PolarHBondContact O-N 3.31Å; V180-V183 PolarHBondContact O-N 3.17Å; R181-V183 VanDerWaalsContact C-N 3.29Å; R181-V183 PolarHBondContact O-N 3.23Å; V183-T185 VanDerWaalsContact C-N 3.31Å; V183-T185 PolarHBondContact O-N 2.86Å; V183-V186 PolarHBondContact O-N 3.1Å; V183-I187 HydrophobicContact CG1-CD1 3.92Å; V183-I187 VanDerWaalsContact O-CG1 3.29Å; V183-I187 WeakPolarHBondContact O-CG1 3.4Å; V183-I187 PolarHBondContact O-N 3.19Å
184T89.1Confident88.2Confident5 Ų547.3 Ų47.33%0.03127%0.267CS..Hα-helixtrans-68.6-32.1178.156.60000111.9V180 R181 I187 A188 L211 F214 N215V180-T184 HydrophobicContact CG1-CG2 3.92Å; V180-T184 WeakPolarHBondContact O-CG2 3.49Å; V180-T184 PolarHBondContact O-N 2.91Å; V180-T184 PolarHBondContact O-OG1 3.35Å; R181-T184 PolarHBondContact O-N 2.98Å; R181-T184 PolarHBondContact O-OG1 3.28Å; T184-I187 PolarHBondContact O-N 2.67Å; T184-A188 WeakPolarHBondContact O-CB 3.3Å; T184-A188 PolarHBondContact O-N 3.5Å; T184-L211 HydrophobicContact CG2-CD2 4.35Å; T184-F214 HydrophobicContact CG2-CD1 3.63Å; T184-F214 HydrophobicContact CG2-CE1 3.87Å; T184-N215 WeakPolarHBondContact CB-OD1 3.37Å; T184-N215 WeakPolarHBondContact CG2-OD1 3.48Å; T184-N215 PolarHBondContact OG1-ND2 3.31Å; T184-N215 PolarHBondContact OG1-OD1 3.42Å
185T88Confident87.7Confident21 Ų2154.7 Ų54.713%0.12931%0.306CS..Hα-helixtrans-60.1-48.1168.1-69.80000112.3T110 R181 P182 V183 I187 A188 L189T110-T185 HydrophobicContact CG2-CG2 3.13Å; R181-T185 PolarHBondContact O-N 3.48Å; R181-T185 PolarHBondContact O-OG1 3.35Å; P182-T185 WeakPolarHBondContact O-CB 3.2Å; P182-T185 PolarHBondContact O-N 2.97Å; V183-T185 VanDerWaalsContact C-N 3.31Å; V183-T185 PolarHBondContact O-N 2.86Å; T185-I187 VanDerWaalsContact C-N 3.3Å; T185-I187 PolarHBondContact O-N 3.45Å; T185-A188 WeakPolarHBondContact O-CB 3.41Å; T185-A188 PolarHBondContact O-N 2.77Å; T185-A188 VanDerWaalsContact O-N 3.16Å; T185-L189 HydrophobicContact CG2-CD1 4.47Å; T185-L189 WeakPolarHBondContact O-CG 3.15Å; T185-L189 PolarHBondContact O-N 3.13Å
186V89.3Confident87.1Confident81 Ų8158.2 Ų58.249%0.49133%0.328SS..Hα-helixtrans-63-40.5177.7171.40000110.9P182 V183 A188 L189 I190P182-V186 WeakPolarHBondContact O-CG2 3.45Å; P182-V186 PolarHBondContact O-N 3.13Å; V183-V186 PolarHBondContact O-N 3.1Å; V186-A188 VanDerWaalsContact C-N 3.33Å; V186-A188 PolarHBondContact O-N 2.96Å; V186-L189 PolarHBondContact O-N 3.44Å; V186-I190 HydrophobicContact CG1-CD1 4Å; V186-I190 WeakPolarHBondContact O-CG1 3.32Å; V186-I190 PolarHBondContact O-N 3.48Å
187I88.9Confident86Confident72 Ų7258.3 Ų58.337%0.36933%0.326SS..Hα-helixtrans-62.2-42.4174.4-64.8165000110.5V183 T184 T185 L189 I190 C191 L211V183-I187 HydrophobicContact CG1-CD1 3.92Å; V183-I187 VanDerWaalsContact O-CG1 3.29Å; V183-I187 WeakPolarHBondContact O-CG1 3.4Å; V183-I187 PolarHBondContact O-N 3.19Å; T184-I187 PolarHBondContact O-N 2.67Å; T185-I187 VanDerWaalsContact C-N 3.3Å; T185-I187 PolarHBondContact O-N 3.45Å; I187-L189 PolarHBondContact O-N 3.48Å; I187-I190 PolarHBondContact O-N 3.41Å; I187-C191 WeakPolarHBondContact O-CB 3.19Å; I187-C191 PolarHBondContact O-N 3.31Å; I187-C191 PolarHBondContact O-SG 2.78Å; I187-L211 HydrophobicContact CB-CD2 4.25Å; I187-L211 HydrophobicContact CG2-CD1 4.37Å; I187-L211 HydrophobicContact CG2-CD2 3.89Å
188A85.6Confident84.8Confident13 Ų1362.2 Ų62.211%0.10735%0.347CS..Hα-helixtrans-57.7-47.3175.900000111.5T184 T185 V186 I190 C191 Q192 Y197 L211T184-A188 WeakPolarHBondContact O-CB 3.3Å; T184-A188 PolarHBondContact O-N 3.5Å; T185-A188 WeakPolarHBondContact O-CB 3.41Å; T185-A188 PolarHBondContact O-N 2.77Å; T185-A188 VanDerWaalsContact O-N 3.16Å; V186-A188 VanDerWaalsContact C-N 3.33Å; V186-A188 PolarHBondContact O-N 2.96Å; A188-I190 PolarHBondContact O-N 2.81Å; A188-C191 PolarHBondContact O-N 3.2Å; A188-Q192 WeakPolarHBondContact O-CB 3.32Å; A188-Q192 PolarHBondContact O-N 2.8Å; A188-Y197 HydrophobicContact CB-CD2 4.44Å; A188-Y197 HydrophobicContact CB-CE2 3.72Å; A188-L211 HydrophobicContact CB-CD1 3.84Å
189L85.1Confident83.5Confident73 Ų7365.9 Ų65.938%0.38236%0.363SS..Hα-helixtrans-61.2-41.8177.1-68.2174.4000112.2T185 V186 I187 Q192 L193T185-L189 HydrophobicContact CG2-CD1 4.47Å; T185-L189 WeakPolarHBondContact O-CG 3.15Å; T185-L189 PolarHBondContact O-N 3.13Å; V186-L189 PolarHBondContact O-N 3.44Å; I187-L189 PolarHBondContact O-N 3.48Å; L189-Q192 PolarHBondContact O-N 2.98Å; L189-L193 WeakPolarHBondContact O-CG 3.45Å; L189-L193 PolarHBondContact O-N 2.97Å
190I87.2Confident82.2Confident94 Ų9465.7 Ų65.748%0.48237%0.373SS..Hα-helixtrans-63.9-44.8175.7-66.3165.6000110.5V186 I187 A188 Q192 L193 C194V186-I190 HydrophobicContact CG1-CD1 4Å; V186-I190 WeakPolarHBondContact O-CG1 3.32Å; V186-I190 PolarHBondContact O-N 3.48Å; I187-I190 PolarHBondContact O-N 3.41Å; A188-I190 PolarHBondContact O-N 2.81Å; I190-Q192 VanDerWaalsContact C-N 3.25Å; I190-Q192 PolarHBondContact O-N 2.99Å; I190-L193 PolarHBondContact O-N 3.18Å; I190-C194 PolarHBondContact O-N 3.02Å; I190-C194 PolarHBondContact O-SG 3.18Å; I190-C194 VanDerWaalsContact O-SG 3.37Å
191C84.1Confident81Confident27 Ų2768.9 Ų68.918%0.18239%0.389CS..Hα-helixtrans-61.9-34.7176.8-70.60000112.3I187 A188 C194 D195 V196 Y197 A207I187-C191 WeakPolarHBondContact O-CB 3.19Å; I187-C191 PolarHBondContact O-N 3.31Å; I187-C191 PolarHBondContact O-SG 2.78Å; A188-C191 PolarHBondContact O-N 3.2Å; C191-C194 CarbonylContact O-C 3.44Å; C191-C194 PolarHBondContact O-N 3.49Å; C191-D195 PolarHBondContact O-N 2.89Å; C191-V196 PolarHBondContact O-N 3.32Å; C191-V196 VanDerWaalsContact O-N 3.09Å; C191-Y197 HydrophobicContact CB-CD2 4.17Å; C191-Y197 PolarHBondContact O-N 2.89Å; C191-A207 HydrophobicContact CB-CB 4.09Å
192Q82.1Confident79.6Confident73 Ų7375 Ų7534%0.34142%0.416SS..Hα-helixtrans-68.2-41.4175.5-168.9176.315.200111.8A188 L189 I190 C194 D195 Y197A188-Q192 WeakPolarHBondContact O-CB 3.32Å; A188-Q192 PolarHBondContact O-N 2.8Å; L189-Q192 PolarHBondContact O-N 2.98Å; I190-Q192 VanDerWaalsContact C-N 3.25Å; I190-Q192 PolarHBondContact O-N 2.99Å; Q192-C194 PolarHBondContact O-N 2.73Å; Q192-D195 PolarHBondContact O-N 2.69Å; Q192-D195 VanDerWaalsContact O-N 3.14Å; Q192-Y197 HydrophobicContact CB-CD1 4.13Å; Q192-Y197 HydrophobicContact CB-CG 4.27Å; Q192-Y197 HydrophobicContact CG-CD1 4.31Å
193L83.8Confident78.5Confident157 Ų15774.2 Ų74.282%0.82241%0.412SS*.Hα-helixtrans-65-26.8173.1-67.9174.6000113L189 I190 D195L189-L193 WeakPolarHBondContact O-CG 3.45Å; L189-L193 PolarHBondContact O-N 2.97Å; I190-L193 PolarHBondContact O-N 3.18Å; L193-D195 VanDerWaalsContact C-N 3.34Å
194C84.9Confident77.2Confident85 Ų8579 Ų7957%0.57443%0.427SS*.THydrogen-bonded Turntrans-87.11.7175.8-65.50000114.1I190 C191 Q192 V196I190-C194 PolarHBondContact O-N 3.02Å; I190-C194 PolarHBondContact O-SG 3.18Å; I190-C194 VanDerWaalsContact O-SG 3.37Å; C191-C194 CarbonylContact O-C 3.44Å; C191-C194 PolarHBondContact O-N 3.49Å; Q192-C194 PolarHBondContact O-N 2.73Å; C194-V196 HydrophobicContact CB-CG2 4.25Å; C194-V196 WeakPolarHBondContact O-CG2 3.42Å; C194-V196 PolarHBondContact O-N 3.35Å
195D79.4Confident76.2Confident154 Ų15487.5 Ų87.582%0.82446%0.463SS*.THydrogen-bonded Turntrans6125.6-179.5-145.450.9000114.1C191 Q192 L193C191-D195 PolarHBondContact O-N 2.89Å; Q192-D195 PolarHBondContact O-N 2.69Å; Q192-D195 VanDerWaalsContact O-N 3.14Å; L193-D195 VanDerWaalsContact C-N 3.34Å
196V77.9Confident75.6Confident77 Ų7787.2 Ų87.247%0.46746%0.461SS..  trans-105.91.8177.3-1680000111.5C191 C194C191-V196 PolarHBondContact O-N 3.32Å; C191-V196 VanDerWaalsContact O-N 3.09Å; C194-V196 HydrophobicContact CB-CG2 4.25Å; C194-V196 WeakPolarHBondContact O-CG2 3.42Å; C194-V196 PolarHBondContact O-N 3.35Å
197Y68.2Low75.2Confident49 Ų4984.3 Ų84.319%0.19245%0.445CS..  trans-102.687.7-177.4-167.6-103.1000110.8A188 C191 Q192 E199 W208 L211A188-Y197 HydrophobicContact CB-CD2 4.44Å; A188-Y197 HydrophobicContact CB-CE2 3.72Å; C191-Y197 HydrophobicContact CB-CD2 4.17Å; C191-Y197 PolarHBondContact O-N 2.89Å; Q192-Y197 HydrophobicContact CB-CD1 4.13Å; Q192-Y197 HydrophobicContact CB-CG 4.27Å; Q192-Y197 HydrophobicContact CG-CD1 4.31Å; Y197-E199 HydrophobicContact CD1-CG 3.73Å; Y197-E199 HydrophobicContact CE1-CG 3.27Å; Y197-E199 WeakPolarHBondContact CE1-OE1 3.31Å; Y197-E199 PolarHBondContact O-N 3.01Å; Y197-W208 HydrophobicContact CD2-CB 4.08Å; Y197-W208 AromaticContact CE1-CD1 3.95Å; Y197-W208 HydrophobicContact CE2-CB 3.91Å; Y197-W208 AromaticContact CE2-CD1 3.66Å; Y197-W208 HydrophobicContact CE2-CG 4.18Å; Y197-W208 AromaticContact CZ-CD1 3.37Å; Y197-W208 VanDerWaalsContact OH-CD1 3.25Å; Y197-L211 HydrophobicContact CD2-CD1 4.42Å; Y197-L211 HydrophobicContact CE2-CD1 4Å
198D66.6Low74.8Confident81 Ų8183 Ų8343%0.43344%0.436SS..  trans-87.4102.4170.2-70.1-47.2000110N201 N206 W208D198-N201 HydrophobicContact CB-CB 4.2Å; D198-N206 WeakPolarHBondContact CB-ND2 3.31Å; D198-W208 WeakPolarHBondContact O-CB 3.41Å
199E62.5Low74.6Confident92 Ų9283.1 Ų83.143%0.4344%0.435SS..THydrogen-bonded Turntrans-64.1137.9174.4-72.3-177.7-172.900111.7Y197 N201Y197-E199 HydrophobicContact CD1-CG 3.73Å; Y197-E199 HydrophobicContact CE1-CG 3.27Å; Y197-E199 WeakPolarHBondContact CE1-OE1 3.31Å; Y197-E199 PolarHBondContact O-N 3.01Å; E199-N201 PolarHBondContact O-N 3.23Å; E199-N201 VanDerWaalsContact O-N 3.1Å
200G61.6Low74.6Confident52 Ų5286 Ų8654%0.53644%0.442SS..THydrogen-bonded Turntrans75.9-9173.100000116.1
201N65.5Low74.5Confident89 Ų8982.6 Ų82.648%0.47643%0.425SS..  trans-93106.1177.6-167.6-13.4000111.6D198 E199 S203 N206D198-N201 HydrophobicContact CB-CB 4.2Å; E199-N201 PolarHBondContact O-N 3.23Å; E199-N201 VanDerWaalsContact O-N 3.1Å; N201-S203 PolarHBondContact O-N 2.83Å; N201-N206 PolarHBondContact O-ND2 3.41Å
202F59.6Low74.4Confident148 Ų14883.4 Ų83.465%0.64943%0.429SS*.  trans-73.374.5175.2-70.9-83.2000111.5W208F202-W208 HydrophobicContact CD1-CZ3 4.11Å; F202-W208 HydrophobicContact CE1-CH2 4.24Å; F202-W208 AromaticContact CE1-CZ3 3.85Å; F202-W208 HydrophobicContact CE1-CZ3 3.85Å; F202-W208 HydrophobicContact CE2-CH2 4.36Å; F202-W208 HydrophobicContact CE2-CZ3 4.3Å; F202-W208 HydrophobicContact CG-CZ3 4.45Å; F202-W208 AromaticContact CZ-CH2 3.95Å; F202-W208 HydrophobicContact CZ-CH2 3.95Å; F202-W208 AromaticContact CZ-CZ3 3.96Å; F202-W208 HydrophobicContact CZ-CZ3 3.96Å
203S67.8Low74.6Confident39 Ų3984.3 Ų84.327%0.27344%0.435SS..  trans-114.7141.8169.7178.60000110.4N201 K205 N206 T209N201-S203 PolarHBondContact O-N 2.83Å; S203-K205 PolarHBondContact O-N 3.14Å; S203-K205 VanDerWaalsContact O-N 3.16Å; S203-K205 PolarHBondContact OG-N 3.29Å; S203-N206 PolarHBondContact O-N 3.48Å; S203-T209 PolarHBondContact O-OG1 3.21Å
204F65.2Low74.9Confident176 Ų17682.1 Ų82.177%0.77242%0.419SS*.THydrogen-bonded Turntrans-66.4-7.1173-72.4-78.1000113.1Y210F204-Y210 WeakPolarHBondContact O-CE2 3.41Å; F204-Y210 PolarHBondContact O-OH 2.91Å
205K67.3Low75.1Confident184 Ų18478.7 Ų78.780%0.840%0.395SS*.THydrogen-bonded Turntrans-94.8-9.4175.7-64.2-173.8178.9-1770113.3S203S203-K205 PolarHBondContact O-N 3.14Å; S203-K205 VanDerWaalsContact O-N 3.16Å; S203-K205 PolarHBondContact OG-N 3.29Å
206N75.6Confident75.5Confident16 Ų1674.8 Ų74.89%0.08637%0.374CS..  trans-97.1134.1-168.6-645.5000111D198 N201 S203 W208 T209 Y210D198-N206 WeakPolarHBondContact CB-ND2 3.31Å; N201-N206 PolarHBondContact O-ND2 3.41Å; S203-N206 PolarHBondContact O-N 3.48Å; N206-W208 PolarHBondContact O-N 3.09Å; N206-T209 PolarHBondContact O-N 2.93Å; N206-Y210 WeakPolarHBondContact O-CD2 2.87Å
207A79.9Confident76Confident19 Ų1976.8 Ų76.816%0.15738%0.38CS..Hα-helixtrans-61.2-34179.600000112.3C191 T209 Y210 L211C191-A207 HydrophobicContact CB-CB 4.09Å; A207-T209 PolarHBondContact O-N 3.41Å; A207-Y210 PolarHBondContact O-N 3.38Å; A207-L211 WeakPolarHBondContact O-CG 3.06Å; A207-L211 PolarHBondContact O-N 3.49Å
208W80.8Confident77.1Confident45 Ų4574.8 Ų74.817%0.1737%0.373CS..Hα-helixtrans-54.2-50.6177.7-177.193.1000112.6Y197 D198 F202 N206 Y210 L211 V212Y197-W208 HydrophobicContact CD2-CB 4.08Å; Y197-W208 AromaticContact CE1-CD1 3.95Å; Y197-W208 HydrophobicContact CE2-CB 3.91Å; Y197-W208 AromaticContact CE2-CD1 3.66Å; Y197-W208 HydrophobicContact CE2-CG 4.18Å; Y197-W208 AromaticContact CZ-CD1 3.37Å; Y197-W208 VanDerWaalsContact OH-CD1 3.25Å; D198-W208 WeakPolarHBondContact O-CB 3.41Å; F202-W208 HydrophobicContact CD1-CZ3 4.11Å; F202-W208 HydrophobicContact CE1-CH2 4.24Å; F202-W208 AromaticContact CE1-CZ3 3.85Å; F202-W208 HydrophobicContact CE1-CZ3 3.85Å; F202-W208 HydrophobicContact CE2-CH2 4.36Å; F202-W208 HydrophobicContact CE2-CZ3 4.3Å; F202-W208 HydrophobicContact CG-CZ3 4.45Å; F202-W208 AromaticContact CZ-CH2 3.95Å; F202-W208 HydrophobicContact CZ-CH2 3.95Å; F202-W208 AromaticContact CZ-CZ3 3.96Å; F202-W208 HydrophobicContact CZ-CZ3 3.96Å; N206-W208 PolarHBondContact O-N 3.09Å; W208-Y210 VanDerWaalsContact C-N 3.33Å; W208-Y210 PolarHBondContact O-N 3.15Å; W208-L211 PolarHBondContact O-N 3.31Å; W208-V212 HydrophobicContact CD2-CG2 3.94Å; W208-V212 HydrophobicContact CE3-CG2 4.28Å; W208-V212 HydrophobicContact CH2-CG2 4.21Å; W208-V212 HydrophobicContact CZ2-CG2 3.86Å; W208-V212 HydrophobicContact CZ3-CG2 4.41Å; W208-V212 WeakPolarHBondContact O-CG2 3.47Å; W208-V212 PolarHBondContact O-N 3.39Å
209T80.7Confident78.2Confident15 Ų1572.3 Ų72.39%0.09236%0.359CS..Hα-helixtrans-58.6-43.8-178.7-50.70000111.9S203 N206 A207 V212 I213S203-T209 PolarHBondContact O-OG1 3.21Å; N206-T209 PolarHBondContact O-N 2.93Å; A207-T209 PolarHBondContact O-N 3.41Å; T209-V212 PolarHBondContact O-N 2.91Å; T209-I213 HydrophobicContact CG2-CD1 4.01Å; T209-I213 VanDerWaalsContact O-CG1 3.3Å; T209-I213 WeakPolarHBondContact O-CG1 3.06Å; T209-I213 PolarHBondContact O-N 3.35Å
210Y85.4Confident79.3Confident134 Ų13473.1 Ų73.153%0.52537%0.365SS..Hα-helixtrans-66.3-42.2178.9-71.8-73.2000112.3F204 N206 A207 W208 V212 I213 F214F204-Y210 WeakPolarHBondContact O-CE2 3.41Å; F204-Y210 PolarHBondContact O-OH 2.91Å; N206-Y210 WeakPolarHBondContact O-CD2 2.87Å; A207-Y210 PolarHBondContact O-N 3.38Å; W208-Y210 VanDerWaalsContact C-N 3.33Å; W208-Y210 PolarHBondContact O-N 3.15Å; Y210-V212 VanDerWaalsContact C-N 3.35Å; Y210-I213 PolarHBondContact O-N 3.33Å; Y210-F214 VanDerWaalsContact O-CB 3.3Å; Y210-F214 WeakPolarHBondContact O-CB 3.13Å; Y210-F214 PolarHBondContact O-N 3.46Å
211L85.1Confident80.7Confident22 Ų2274.4 Ų74.412%0.11536%0.357CS..Hα-helixtrans-63.2-42.3176.9-70.1171.2000111.3T184 I187 A188 Y197 A207 W208 F214 N215T184-L211 HydrophobicContact CG2-CD2 4.35Å; I187-L211 HydrophobicContact CB-CD2 4.25Å; I187-L211 HydrophobicContact CG2-CD1 4.37Å; I187-L211 HydrophobicContact CG2-CD2 3.89Å; A188-L211 HydrophobicContact CB-CD1 3.84Å; Y197-L211 HydrophobicContact CD2-CD1 4.42Å; Y197-L211 HydrophobicContact CE2-CD1 4Å; A207-L211 WeakPolarHBondContact O-CG 3.06Å; A207-L211 PolarHBondContact O-N 3.49Å; W208-L211 PolarHBondContact O-N 3.31Å; L211-F214 PolarHBondContact O-N 3.45Å; L211-N215 WeakPolarHBondContact O-CB 3.5Å; L211-N215 VanDerWaalsContact O-CG 3.23Å; L211-N215 PolarHBondContact O-N 3.38Å; L211-N215 PolarHBondContact O-ND2 2.85Å
212V82.8Confident81.8Confident44 Ų4470.2 Ų70.227%0.26733%0.334SS..Hα-helixtrans-61.6-48.6175.2171.70000111.1W208 T209 Y210 F214 N215 N216W208-V212 HydrophobicContact CD2-CG2 3.94Å; W208-V212 HydrophobicContact CE3-CG2 4.28Å; W208-V212 HydrophobicContact CH2-CG2 4.21Å; W208-V212 HydrophobicContact CZ2-CG2 3.86Å; W208-V212 HydrophobicContact CZ3-CG2 4.41Å; W208-V212 WeakPolarHBondContact O-CG2 3.47Å; W208-V212 PolarHBondContact O-N 3.39Å; T209-V212 PolarHBondContact O-N 2.91Å; Y210-V212 VanDerWaalsContact C-N 3.35Å; V212-F214 PolarHBondContact O-N 3.25Å; V212-N215 PolarHBondContact O-N 3.04Å; V212-N216 WeakPolarHBondContact CG1-ND2 3.5Å; V212-N216 WeakPolarHBondContact O-CB 3.42Å; V212-N216 PolarHBondContact O-N 3.3Å; V212-N216 PolarHBondContact O-ND2 3.32Å
213I85.9Confident83Confident93 Ų9364.3 Ų64.348%0.47731%0.309SS..Hα-helixtrans-60.6-47.5178.6-69.9167.9000110.6T209 Y210 N215 N216 M217T209-I213 HydrophobicContact CG2-CD1 4.01Å; T209-I213 VanDerWaalsContact O-CG1 3.3Å; T209-I213 WeakPolarHBondContact O-CG1 3.06Å; T209-I213 PolarHBondContact O-N 3.35Å; Y210-I213 PolarHBondContact O-N 3.33Å; I213-N215 VanDerWaalsContact C-N 3.35Å; I213-N215 PolarHBondContact O-N 3.3Å; I213-N216 PolarHBondContact O-N 3Å; I213-M217 HydrophobicContact CG2-CG 4.38Å; I213-M217 WeakPolarHBondContact O-CB 3.29Å; I213-M217 WeakPolarHBondContact O-CG 3.48Å; I213-M217 PolarHBondContact O-N 3.38Å
214F90Very high83.9Confident110 Ų11063.7 Ų63.748%0.48230%0.301SS..Hα-helixtrans-62.5-42.4-179.4-175.7-101.5000112V180 T184 Y210 L211 V212 M217 S218V180-F214 HydrophobicContact CG1-CD1 3.98Å; V180-F214 HydrophobicContact CG1-CE1 3.44Å; V180-F214 VanDerWaalsContact CG1-CE1 3.44Å; V180-F214 HydrophobicContact CG1-CZ 4.35Å; V180-F214 HydrophobicContact CG2-CE1 4.29Å; T184-F214 HydrophobicContact CG2-CD1 3.63Å; T184-F214 HydrophobicContact CG2-CE1 3.87Å; Y210-F214 VanDerWaalsContact O-CB 3.3Å; Y210-F214 WeakPolarHBondContact O-CB 3.13Å; Y210-F214 PolarHBondContact O-N 3.46Å; L211-F214 PolarHBondContact O-N 3.45Å; V212-F214 PolarHBondContact O-N 3.25Å; F214-M217 PolarHBondContact O-N 3.41Å; F214-S218 WeakPolarHBondContact O-CB 3.28Å; F214-S218 PolarHBondContact O-N 3.06Å
215N88.4Confident84.9Confident14 Ų1455.3 Ų55.38%0.07526%0.264CS..Hα-helixtrans-61.8-45.2175.3-82.9-23.3000112.4T184 L211 V212 I213 S218 Q219T184-N215 WeakPolarHBondContact CB-OD1 3.37Å; T184-N215 WeakPolarHBondContact CG2-OD1 3.48Å; T184-N215 PolarHBondContact OG1-ND2 3.31Å; T184-N215 PolarHBondContact OG1-OD1 3.42Å; L211-N215 WeakPolarHBondContact O-CB 3.5Å; L211-N215 VanDerWaalsContact O-CG 3.23Å; L211-N215 PolarHBondContact O-N 3.38Å; L211-N215 PolarHBondContact O-ND2 2.85Å; V212-N215 PolarHBondContact O-N 3.04Å; I213-N215 VanDerWaalsContact C-N 3.35Å; I213-N215 PolarHBondContact O-N 3.3Å; N215-S218 PolarHBondContact O-N 2.95Å; N215-Q219 WeakPolarHBondContact O-CB 3.46Å; N215-Q219 PolarHBondContact O-N 3.34Å
216N88.1Confident85.8Confident71 Ų7146.7 Ų46.738%0.3823%0.227SC..Hα-helixtrans-65.1-40.4177.5-82.8-81.7000111.9V212 I213 Q219 L220V212-N216 WeakPolarHBondContact CG1-ND2 3.5Å; V212-N216 WeakPolarHBondContact O-CB 3.42Å; V212-N216 PolarHBondContact O-N 3.3Å; V212-N216 PolarHBondContact O-ND2 3.32Å; I213-N216 PolarHBondContact O-N 3Å; N216-Q219 PolarHBondContact O-N 3.33Å; N216-L220 VanDerWaalsContact O-CB 3.29Å; N216-L220 WeakPolarHBondContact O-CB 3.48Å; N216-L220 PolarHBondContact O-N 3.24Å
217M88.8Confident86.2Confident120 Ų12048.5 Ų48.559%0.59124%0.238SC*.Hα-helixtrans-63.7-43.5175.9-73.6-60.8-62.900112I213 F214 L220 F221I213-M217 HydrophobicContact CG2-CG 4.38Å; I213-M217 WeakPolarHBondContact O-CB 3.29Å; I213-M217 WeakPolarHBondContact O-CG 3.48Å; I213-M217 PolarHBondContact O-N 3.38Å; F214-M217 PolarHBondContact O-N 3.41Å; M217-L220 PolarHBondContact O-N 3.48Å; M217-F221 WeakPolarHBondContact O-CB 3.47Å; M217-F221 PolarHBondContact O-N 3.49Å
218S90.9Very high86.4Confident7 Ų747.8 Ų47.85%0.04923%0.232CC..Hα-helixtrans-64.9-42.4176.2-179.50000112Q176 F214 N215 F221 A222Q176-S218 VanDerWaalsContact CD-OG 3.24Å; Q176-S218 PolarHBondContact NE2-OG 3.12Å; Q176-S218 PolarHBondContact OE1-OG 3.01Å; F214-S218 WeakPolarHBondContact O-CB 3.28Å; F214-S218 PolarHBondContact O-N 3.06Å; N215-S218 PolarHBondContact O-N 2.95Å; S218-F221 PolarHBondContact O-N 3.29Å; S218-A222 PolarHBondContact O-N 3.12Å
219Q89.4Confident86.6Confident28 Ų2845.7 Ų45.713%0.13122%0.224CC..Hα-helixtrans-63.3-43.8175.7-169.6-176.15.200111.3E116 Y177 N215 N216 F221 A222 M223E116-Q219 PolarHBondContact OE1-NE2 3.07Å; Y177-Q219 HydrophobicContact CD2-CB 4.04Å; Y177-Q219 HydrophobicContact CE1-CB 4.43Å; Y177-Q219 HydrophobicContact CE1-CG 4.04Å; Y177-Q219 HydrophobicContact CE2-CB 3.55Å; Y177-Q219 HydrophobicContact CE2-CG 4.01Å; N215-Q219 WeakPolarHBondContact O-CB 3.46Å; N215-Q219 PolarHBondContact O-N 3.34Å; N216-Q219 PolarHBondContact O-N 3.33Å; Q219-F221 VanDerWaalsContact C-N 3.32Å; Q219-F221 PolarHBondContact O-N 3.21Å; Q219-A222 PolarHBondContact O-N 3.33Å; Q219-M223 WeakPolarHBondContact O-CB 3.37Å; Q219-M223 WeakPolarHBondContact O-CG 3.4Å; Q219-M223 PolarHBondContact O-N 3.46Å
220L87.4Confident86.7Confident109 Ų10947.6 Ų47.657%0.57123%0.23SC*.Hα-helixtrans-61.7-41.3177.5-176.264.4000111.3N216 M217 M223 Y224N216-L220 VanDerWaalsContact O-CB 3.29Å; N216-L220 WeakPolarHBondContact O-CB 3.48Å; N216-L220 PolarHBondContact O-N 3.24Å; M217-L220 PolarHBondContact O-N 3.48Å; L220-M223 PolarHBondContact O-N 3.38Å; L220-Y224 VanDerWaalsContact O-CB 3.26Å; L220-Y224 WeakPolarHBondContact O-CB 3.39Å; L220-Y224 PolarHBondContact O-N 2.98Å
221F89.3Confident86.5Confident80 Ų8047.7 Ų47.735%0.35123%0.229SC..Hα-helixtrans-64.8-45.7176.2-177.5-104.3000112.4M217 S218 Q219 M223 Y224 C225M217-F221 WeakPolarHBondContact O-CB 3.47Å; M217-F221 PolarHBondContact O-N 3.49Å; S218-F221 PolarHBondContact O-N 3.29Å; Q219-F221 VanDerWaalsContact C-N 3.32Å; Q219-F221 PolarHBondContact O-N 3.21Å; F221-M223 PolarHBondContact O-N 3.41Å; F221-Y224 WeakPolarHBondContact O-CB 3.42Å; F221-Y224 PolarHBondContact O-N 2.89Å; F221-C225 PolarHBondContact O-N 3.36Å; F221-C225 PolarHBondContact O-SG 3.33Å
222A89.7Confident86.4Confident0 Ų047.6 Ų47.60%023%0.231CC..Hα-helixtrans-61-44.5176.200000112Y177 S218 Q219 Y224 C225 L226Y177-A222 HydrophobicContact CD1-CB 4.39Å; Y177-A222 HydrophobicContact CG-CB 4.17Å; S218-A222 PolarHBondContact O-N 3.12Å; Q219-A222 PolarHBondContact O-N 3.33Å; A222-Y224 VanDerWaalsContact C-N 3.32Å; A222-Y224 PolarHBondContact O-N 3.35Å; A222-C225 PolarHBondContact O-N 3.23Å; A222-L226 WeakPolarHBondContact O-CB 3.36Å; A222-L226 PolarHBondContact O-N 2.94Å
223M84.9Confident86.3Confident25 Ų2545.8 Ų45.812%0.12322%0.22CC..Hα-helixtrans-63.1-39.2175.8-70.5-65.7-65.600111.8I120 Q219 L220 F221 L226 V227 F246 K250I120-M223 HydrophobicContact CD1-SD 3.98Å; Q219-M223 WeakPolarHBondContact O-CB 3.37Å; Q219-M223 WeakPolarHBondContact O-CG 3.4Å; Q219-M223 PolarHBondContact O-N 3.46Å; L220-M223 PolarHBondContact O-N 3.38Å; F221-M223 PolarHBondContact O-N 3.41Å; M223-L226 PolarHBondContact O-N 2.85Å; M223-V227 VanDerWaalsContact O-CG2 3.29Å; M223-V227 WeakPolarHBondContact O-CG2 3.4Å; M223-V227 PolarHBondContact O-N 3.38Å; M223-F246 HydrophobicContact CE-CE1 4.13Å; M223-F246 HydrophobicContact CE-CE2 3.68Å; M223-F246 HydrophobicContact CE-CZ 3.19Å; M223-F246 HydrophobicContact SD-CE2 4.2Å; M223-F246 HydrophobicContact SD-CZ 4.25Å; M223-K250 HydrophobicContact CE-CB 4.39Å; M223-K250 HydrophobicContact CE-CD 3.36Å; M223-K250 VanDerWaalsContact CE-CE 3.45Å; M223-K250 HydrophobicContact CE-CG 3.57Å; M223-K250 HydrophobicContact SD-CD 3.81Å
224Y85.6Confident86.1Confident25 Ų2548.6 Ų48.610%0.09823%0.225CC..Hα-helixtrans-60.8-48.4174173.8-93.3000111.8H150 L151 L154 L220 F221 A222 L226 V227 L228H150-Y224 VanDerWaalsContact CA-OH 3.26Å; H150-Y224 WeakPolarHBondContact CA-OH 3.5Å; H150-Y224 WeakPolarHBondContact CB-OH 3.46Å; H150-Y224 VanDerWaalsContact CG-OH 3.28Å; H150-Y224 AromaticContact ND1-CZ 3.83Å; H150-Y224 PolarHBondContact ND1-OH 3.43Å; L151-Y224 HydrophobicContact CB-CE2 3.86Å; L151-Y224 PolarHBondContact N-OH 3.39Å; L151-Y224 VanDerWaalsContact N-OH 3.11Å; L154-Y224 HydrophobicContact CB-CE2 4.44Å; L154-Y224 HydrophobicContact CD1-CD1 3.9Å; L154-Y224 HydrophobicContact CD1-CD2 4.45Å; L154-Y224 HydrophobicContact CD1-CE1 3.76Å; L154-Y224 HydrophobicContact CD1-CE2 4.31Å; L154-Y224 HydrophobicContact CD1-CG 4.26Å; L220-Y224 VanDerWaalsContact O-CB 3.26Å; L220-Y224 WeakPolarHBondContact O-CB 3.39Å; L220-Y224 PolarHBondContact O-N 2.98Å; F221-Y224 WeakPolarHBondContact O-CB 3.42Å; F221-Y224 PolarHBondContact O-N 2.89Å; A222-Y224 VanDerWaalsContact C-N 3.32Å; A222-Y224 PolarHBondContact O-N 3.35Å; Y224-L226 VanDerWaalsContact C-N 3.26Å; Y224-L226 PolarHBondContact O-N 3.15Å; Y224-V227 PolarHBondContact O-N 2.91Å; Y224-L228 HydrophobicContact CE1-CD2 4.27Å; Y224-L228 WeakPolarHBondContact O-CB 3.5Å; Y224-L228 PolarHBondContact O-N 3.27Å
225C86.8Confident85.6Confident0 Ų049 Ų490%023%0.232CC..Hα-helixtrans-58.6-39176.9-73.60000112.4C170 V174 F221 A222 F229C170-C225 PolarHBondContact SG-O 3.17Å; V174-C225 HydrophobicContact CG2-CB 4.42Å; F221-C225 PolarHBondContact O-N 3.36Å; F221-C225 PolarHBondContact O-SG 3.33Å; A222-C225 PolarHBondContact O-N 3.23Å; C225-F229 WeakPolarHBondContact O-CB 3.32Å; C225-F229 PolarHBondContact O-N 3.38Å
226L86.2Confident85.3Confident4 Ų450.4 Ų50.42%0.02124%0.238CC..Hα-helixtrans-70-42.2178.5-161.8158.5000112I120 F123 V174 A222 M223 Y224 F229 Y230 F246I120-L226 HydrophobicContact CG2-CD1 3.78Å; F123-L226 HydrophobicContact CD1-CD1 3.96Å; F123-L226 HydrophobicContact CD1-CD2 4.15Å; F123-L226 HydrophobicContact CE1-CD2 4.02Å; V174-L226 HydrophobicContact CG2-CB 4.18Å; V174-L226 HydrophobicContact CG2-CD1 4.46Å; A222-L226 WeakPolarHBondContact O-CB 3.36Å; A222-L226 PolarHBondContact O-N 2.94Å; M223-L226 PolarHBondContact O-N 2.85Å; Y224-L226 VanDerWaalsContact C-N 3.26Å; Y224-L226 PolarHBondContact O-N 3.15Å; L226-F229 WeakPolarHBondContact O-CB 3.43Å; L226-F229 PolarHBondContact O-N 3.08Å; L226-Y230 WeakPolarHBondContact O-CB 2.98Å; L226-Y230 PolarHBondContact O-N 2.99Å; L226-F246 HydrophobicContact CD1-CE2 4.16Å; L226-F246 HydrophobicContact CD2-CD2 3.71Å; L226-F246 HydrophobicContact CD2-CE2 3.44Å; L226-F246 VanDerWaalsContact CD2-CE2 3.44Å; L226-F246 HydrophobicContact CD2-CZ 4.19Å; L226-F246 HydrophobicContact CG-CE2 4.34Å
227V83.8Confident84.9Confident54 Ų5447 Ų4733%0.32722%0.22SC..Hα-helixtrans-64.7-41.2174.3169.90000111.2L151 M223 Y224 Y230 R231 F246L151-V227 HydrophobicContact CD2-CG1 4.1Å; M223-V227 VanDerWaalsContact O-CG2 3.29Å; M223-V227 WeakPolarHBondContact O-CG2 3.4Å; M223-V227 PolarHBondContact O-N 3.38Å; Y224-V227 PolarHBondContact O-N 2.91Å; V227-Y230 PolarHBondContact O-N 2.87Å; V227-R231 WeakPolarHBondContact O-CB 3.5Å; V227-R231 PolarHBondContact O-N 3.33Å; V227-F246 HydrophobicContact CG2-CZ 4.39Å
228L83.9Confident84.2Confident4 Ų444.7 Ų44.72%0.02122%0.216CC..Hα-helixtrans-61.6-45.6175.9-176.466.1000111W160 L166 Y224 R231 A232W160-L228 HydrophobicContact CE3-CD2 4.27Å; W160-L228 HydrophobicContact CZ3-CD2 4.45Å; L166-L228 HydrophobicContact CD1-CD2 4.2Å; Y224-L228 HydrophobicContact CE1-CD2 4.27Å; Y224-L228 WeakPolarHBondContact O-CB 3.5Å; Y224-L228 PolarHBondContact O-N 3.27Å; L228-R231 PolarHBondContact O-N 3.17Å; L228-A232 WeakPolarHBondContact O-CB 3.4Å; L228-A232 PolarHBondContact O-N 2.94Å
229F86.3Confident83.4Confident0 Ų048.3 Ų48.30%024%0.239CC..Hα-helixtrans-58.4-49.4174.4175-91.7000111.6M124 L127 L128 L131 L167 C170 C225 L226 R231 A232 L233 L237M124-F229 HydrophobicContact CE-CB 4.3Å; M124-F229 HydrophobicContact CE-CD1 4.2Å; M124-F229 HydrophobicContact CE-CD2 3.42Å; M124-F229 VanDerWaalsContact CE-CD2 3.42Å; M124-F229 HydrophobicContact CE-CE1 4.39Å; M124-F229 HydrophobicContact CE-CE2 3.57Å; M124-F229 HydrophobicContact CE-CG 3.72Å; M124-F229 HydrophobicContact CE-CZ 4.08Å; M124-F229 HydrophobicContact SD-CB 4.43Å; M124-F229 HydrophobicContact SD-CD1 4.11Å; M124-F229 HydrophobicContact SD-CD2 4.34Å; M124-F229 HydrophobicContact SD-CE1 4.45Å; M124-F229 HydrophobicContact SD-CG 4.05Å; L127-F229 HydrophobicContact CB-CE1 3.68Å; L127-F229 HydrophobicContact CB-CZ 4.31Å; L127-F229 HydrophobicContact CD1-CD1 4.23Å; L127-F229 HydrophobicContact CD1-CE1 4.02Å; L128-F229 HydrophobicContact CB-CZ 4.48Å; L131-F229 HydrophobicContact CD1-CE1 4.11Å; L131-F229 HydrophobicContact CD1-CZ 3.67Å; L167-F229 HydrophobicContact CD2-CD2 4.04Å; L167-F229 HydrophobicContact CD2-CE2 3.47Å; L167-F229 VanDerWaalsContact CD2-CE2 3.47Å; L167-F229 HydrophobicContact CD2-CZ 4.5Å; C170-F229 HydrophobicContact CB-CB 4.06Å; C170-F229 HydrophobicContact CB-CD2 4.22Å; C225-F229 WeakPolarHBondContact O-CB 3.32Å; C225-F229 PolarHBondContact O-N 3.38Å; L226-F229 WeakPolarHBondContact O-CB 3.43Å; L226-F229 PolarHBondContact O-N 3.08Å; F229-R231 VanDerWaalsContact C-N 3.31Å; F229-R231 PolarHBondContact O-N 3.32Å; F229-A232 PolarHBondContact O-N 2.94Å; F229-L233 HydrophobicContact CD1-CD1 4.35Å; F229-L233 HydrophobicContact CD2-CD1 3.67Å; F229-L233 HydrophobicContact CE1-CD1 4.05Å; F229-L233 HydrophobicContact CE2-CD1 3.37Å; F229-L233 HydrophobicContact CG-CD1 4.18Å; F229-L233 HydrophobicContact CZ-CD1 3.58Å; F229-L233 PolarHBondContact O-N 3.46Å; F229-L233 VanDerWaalsContact O-N 3.13Å; F229-L237 HydrophobicContact CE1-CD1 4.23Å
230Y82.7Confident82.5Confident55 Ų5548 Ų4822%0.21624%0.238CC..Hα-helixtrans-60.6-41.4178.6170.5-112.1000112.1L226 V227 L233 R234 L237 P242 V243L226-Y230 WeakPolarHBondContact O-CB 2.98Å; L226-Y230 PolarHBondContact O-N 2.99Å; V227-Y230 PolarHBondContact O-N 2.87Å; Y230-L233 CarbonylContact O-C 3.45Å; Y230-L233 PolarHBondContact O-N 3.34Å; Y230-R234 HydrophobicContact CE2-CB 4.44Å; Y230-R234 HydrophobicContact CE2-CG 4.37Å; Y230-R234 VanDerWaalsContact O-CA 3.24Å; Y230-R234 WeakPolarHBondContact O-CA 3.4Å; Y230-R234 WeakPolarHBondContact O-CB 3.4Å; Y230-R234 PolarHBondContact O-N 2.95Å; Y230-L237 HydrophobicContact CD2-CD1 4.03Å; Y230-P242 HydrophobicContact CD2-CB 4.32Å; Y230-P242 HydrophobicContact CD2-CG 3.59Å; Y230-P242 HydrophobicContact CE2-CB 4.26Å; Y230-P242 HydrophobicContact CE2-CG 3.13Å; Y230-V243 HydrophobicContact CD1-CG2 4.37Å; Y230-V243 HydrophobicContact CE1-CG2 3.43Å; Y230-V243 VanDerWaalsContact CE1-CG2 3.43Å; Y230-V243 HydrophobicContact CE2-CG2 4.1Å; Y230-V243 WeakPolarHBondContact OH-CG2 3.41Å
231R81.1Confident81.6Confident137 Ų13750.8 Ų50.852%0.51725%0.246SC..Hα-helixtrans-65.5-42179.2-174.6179.6174.6117.21.4111.9V227 L228 F229 L233V227-R231 WeakPolarHBondContact O-CB 3.5Å; V227-R231 PolarHBondContact O-N 3.33Å; L228-R231 PolarHBondContact O-N 3.17Å; F229-R231 VanDerWaalsContact C-N 3.31Å; F229-R231 PolarHBondContact O-N 3.32Å; R231-L233 PolarHBondContact O-N 3.47Å
232A82.1Confident80.5Confident20 Ų2047.2 Ų47.217%0.16523%0.23CC..Hα-helixtrans-64.9-27.6178.300000112.8Q148 L166 L228 F229Q148-A232 HydrophobicContact CG-CB 4.04Å; L166-A232 HydrophobicContact CD2-CB 3.81Å; L228-A232 WeakPolarHBondContact O-CB 3.4Å; L228-A232 PolarHBondContact O-N 2.94Å; F229-A232 PolarHBondContact O-N 2.94Å
233L81.2Confident79.3Confident5 Ų550.6 Ų50.63%0.02625%0.251CS..THydrogen-bonded Turntrans-118.920.9-173.1-69154.5000112.5L131 L138 L142 L167 F229 Y230 R231 D235 E236 L237L131-L233 HydrophobicContact CD1-CB 4.06Å; L131-L233 HydrophobicContact CD1-CD1 3.69Å; L131-L233 HydrophobicContact CD1-CD2 4.15Å; L131-L233 HydrophobicContact CD1-CG 4.17Å; L138-L233 HydrophobicContact CD1-CD2 3.81Å; L142-L233 HydrophobicContact CD1-CD2 3.83Å; L142-L233 HydrophobicContact CD2-CD2 4.35Å; L142-L233 HydrophobicContact CG-CD2 4.15Å; L167-L233 HydrophobicContact CD2-CD1 3.91Å; F229-L233 HydrophobicContact CD1-CD1 4.35Å; F229-L233 HydrophobicContact CD2-CD1 3.67Å; F229-L233 HydrophobicContact CE1-CD1 4.05Å; F229-L233 HydrophobicContact CE2-CD1 3.37Å; F229-L233 HydrophobicContact CG-CD1 4.18Å; F229-L233 HydrophobicContact CZ-CD1 3.58Å; F229-L233 PolarHBondContact O-N 3.46Å; F229-L233 VanDerWaalsContact O-N 3.13Å; Y230-L233 CarbonylContact O-C 3.45Å; Y230-L233 PolarHBondContact O-N 3.34Å; R231-L233 PolarHBondContact O-N 3.47Å; L233-D235 VanDerWaalsContact C-N 3.31Å; L233-D235 PolarHBondContact O-N 3.17Å; L233-E236 PolarHBondContact O-N 3.32Å; L233-L237 HydrophobicContact CB-CD1 3.64Å; L233-L237 HydrophobicContact CB-CG 4.27Å; L233-L237 VanDerWaalsContact O-CB 3.29Å; L233-L237 WeakPolarHBondContact O-CB 3.34Å; L233-L237 WeakPolarHBondContact O-CD1 3.27Å; L233-L237 VanDerWaalsContact O-CG 3.27Å; L233-L237 WeakPolarHBondContact O-CG 3.41Å; L233-L237 PolarHBondContact O-N 3.23Å
234R81.8Confident78.3Confident153 Ų15351 Ų5158%0.57726%0.261SS*.Hα-helixtrans-58.4-44.4-172174.2-178.6176.9-165-2.1112Y230 L237 S238Y230-R234 HydrophobicContact CE2-CB 4.44Å; Y230-R234 HydrophobicContact CE2-CG 4.37Å; Y230-R234 VanDerWaalsContact O-CA 3.24Å; Y230-R234 WeakPolarHBondContact O-CA 3.4Å; Y230-R234 WeakPolarHBondContact O-CB 3.4Å; Y230-R234 PolarHBondContact O-N 2.95Å; R234-L237 CarbonylContact O-C 3.58Å; R234-L237 PolarHBondContact O-N 2.83Å; R234-S238 PolarHBondContact O-N 3.06Å
235D79.5Confident77.9Confident119 Ų11951.2 Ų51.264%0.63626%0.263SS*.Hα-helixtrans-69.7-42-173.9-60.7-38.5000110.4L233 L237 S238L233-D235 VanDerWaalsContact C-N 3.31Å; L233-D235 PolarHBondContact O-N 3.17Å; D235-L237 VanDerWaalsContact C-N 3.34Å; D235-L237 PolarHBondContact O-N 3.35Å; D235-S238 VanDerWaalsContact O-CB 3.25Å; D235-S238 WeakPolarHBondContact O-CB 3.3Å; D235-S238 PolarHBondContact O-N 2.94Å; D235-S238 PolarHBondContact O-OG 3.06Å
236E81.5Confident77Confident42 Ų4253.3 Ų53.320%0.19627%0.272CS..Hα-helixtrans-69.3-30.5176.2-50.9-51.4152.100113.2L131 Y135 M141 L233 P239L131-E236 HydrophobicContact CD2-CB 3.64Å; Y135-E236 HydrophobicContact CD2-CB 4.48Å; Y135-E236 VanDerWaalsContact CE1-OE2 3.26Å; Y135-E236 WeakPolarHBondContact CE1-OE2 3.28Å; Y135-E236 HydrophobicContact CE2-CB 3.87Å; Y135-E236 HydrophobicContact CE2-CG 4.42Å; Y135-E236 WeakPolarHBondContact CE2-OE2 3.43Å; Y135-E236 PolarHBondContact OH-OE2 3.01Å; M141-E236 HydrophobicContact CE-CG 3.62Å; M141-E236 HydrophobicContact SD-CG 4.45Å; L233-E236 PolarHBondContact O-N 3.32Å; E236-P239 WeakPolarHBondContact O-CD 3.37Å
237L80Confident76.2Confident0 Ų058.2 Ų58.20%030%0.298CS..Hα-helixtrans-87.9-9.4176.4-68.8158.8000113L127 Y130 L131 F229 Y230 L233 R234 D235 P239 I240 P242L127-L237 HydrophobicContact CB-CD2 4.28Å; L127-L237 HydrophobicContact CD2-CD2 4.03Å; Y130-L237 HydrophobicContact CD1-CD2 4.21Å; L131-L237 HydrophobicContact CD1-CD1 4.14Å; L131-L237 HydrophobicContact CD1-CD2 3.95Å; L131-L237 HydrophobicContact CD1-CG 4.03Å; L131-L237 HydrophobicContact CD2-CD2 4.16Å; L131-L237 HydrophobicContact CD2-CG 4.08Å; L131-L237 HydrophobicContact CG-CD2 3.91Å; L131-L237 HydrophobicContact CG-CG 4.23Å; F229-L237 HydrophobicContact CE1-CD1 4.23Å; Y230-L237 HydrophobicContact CD2-CD1 4.03Å; L233-L237 HydrophobicContact CB-CD1 3.64Å; L233-L237 HydrophobicContact CB-CG 4.27Å; L233-L237 VanDerWaalsContact O-CB 3.29Å; L233-L237 WeakPolarHBondContact O-CB 3.34Å; L233-L237 WeakPolarHBondContact O-CD1 3.27Å; L233-L237 VanDerWaalsContact O-CG 3.27Å; L233-L237 WeakPolarHBondContact O-CG 3.41Å; L233-L237 PolarHBondContact O-N 3.23Å; R234-L237 CarbonylContact O-C 3.58Å; R234-L237 PolarHBondContact O-N 2.83Å; D235-L237 VanDerWaalsContact C-N 3.34Å; D235-L237 PolarHBondContact O-N 3.35Å; L237-P239 VanDerWaalsContact C-N 3.31Å; L237-I240 HydrophobicContact CB-CG1 4.41Å; L237-I240 HydrophobicContact CD2-CD1 3.61Å; L237-I240 HydrophobicContact CD2-CG1 4.16Å; L237-I240 WeakPolarHBondContact O-CG1 3.37Å; L237-I240 PolarHBondContact O-N 3.39Å; L237-P242 HydrophobicContact CB-CG 3.86Å; L237-P242 WeakPolarHBondContact O-CD 3.39Å
238S74.5Confident75.4Confident72 Ų7257 Ų5750%0.50329%0.291SS..G310 helixtrans-49.4-39.1179.371.80000115R234 D235 I240 K241R234-S238 PolarHBondContact O-N 3.06Å; D235-S238 VanDerWaalsContact O-CB 3.25Å; D235-S238 WeakPolarHBondContact O-CB 3.3Å; D235-S238 PolarHBondContact O-N 2.94Å; D235-S238 PolarHBondContact O-OG 3.06Å; S238-I240 VanDerWaalsContact C-N 3.26Å; S238-I240 PolarHBondContact O-N 3.15Å; S238-K241 PolarHBondContact O-N 3.2Å
239P73Confident74.8Confident83 Ų8357.1 Ų57.154%0.53929%0.292SS..G310 helixtrans-62-27.4178.221.7-35000114.3Y130 E236 L237Y130-P239 HydrophobicContact CE1-CG 4.49Å; Y130-P239 WeakPolarHBondContact OH-CG 3.22Å; E236-P239 WeakPolarHBondContact O-CD 3.37Å; L237-P239 VanDerWaalsContact C-N 3.31Å
240I71.1Confident74.2Confident22 Ų2258.7 Ų58.711%0.11330%0.299CS..G310 helixtrans-94.91.2-177.862.9164.7000114.2F126 L127 Y130 L237 S238 P242 K245F126-I240 HydrophobicContact CE1-CD1 4.2Å; L127-I240 HydrophobicContact CD2-CD1 3.77Å; Y130-I240 HydrophobicContact CD1-CD1 3.8Å; Y130-I240 HydrophobicContact CD1-CG1 4.34Å; Y130-I240 HydrophobicContact CD1-CG2 4.05Å; Y130-I240 HydrophobicContact CD2-CG2 3.98Å; Y130-I240 HydrophobicContact CE1-CB 4.47Å; Y130-I240 HydrophobicContact CE1-CD1 4.15Å; Y130-I240 HydrophobicContact CE1-CG1 4.19Å; Y130-I240 HydrophobicContact CE1-CG2 3.5Å; Y130-I240 VanDerWaalsContact CE1-CG2 3.5Å; Y130-I240 HydrophobicContact CE2-CG2 3.45Å; Y130-I240 VanDerWaalsContact CE2-CG2 3.45Å; Y130-I240 HydrophobicContact CG-CD1 4.16Å; Y130-I240 HydrophobicContact CG-CG2 4.26Å; Y130-I240 WeakPolarHBondContact OH-CG2 3.21Å; L237-I240 HydrophobicContact CB-CG1 4.41Å; L237-I240 HydrophobicContact CD2-CD1 3.61Å; L237-I240 HydrophobicContact CD2-CG1 4.16Å; L237-I240 WeakPolarHBondContact O-CG1 3.37Å; L237-I240 PolarHBondContact O-N 3.39Å; S238-I240 VanDerWaalsContact C-N 3.26Å; S238-I240 PolarHBondContact O-N 3.15Å; I240-P242 HydrophobicContact CD1-CB 4.3Å; I240-P242 HydrophobicContact CG1-CB 4.25Å; I240-K245 WeakPolarHBondContact O-CE 3.31Å
241K68.1Low73.8Confident167 Ų16761 Ų6173%0.72631%0.313SS*.  trans41.658.7-176.5-64.9-179.6-178.7174.90111.9S238 V243 G244S238-K241 PolarHBondContact O-N 3.2Å; K241-V243 PolarHBondContact O-N 3.35Å; K241-G244 PolarHBondContact O-N 3.03Å; K241-G244 VanDerWaalsContact O-N 3.08Å
242P65.6Low73.4Confident4 Ų454.9 Ų54.93%0.02629%0.291CS..Hα-helixtrans-67.3-24.7-16732.4-40.9000112.2L127 Y230 L237 I240 G244 K245 F246L127-P242 HydrophobicContact CD2-CB 3.99Å; Y230-P242 HydrophobicContact CD2-CB 4.32Å; Y230-P242 HydrophobicContact CD2-CG 3.59Å; Y230-P242 HydrophobicContact CE2-CB 4.26Å; Y230-P242 HydrophobicContact CE2-CG 3.13Å; L237-P242 HydrophobicContact CB-CG 3.86Å; L237-P242 WeakPolarHBondContact O-CD 3.39Å; I240-P242 HydrophobicContact CD1-CB 4.3Å; I240-P242 HydrophobicContact CG1-CB 4.25Å; P242-G244 VanDerWaalsContact C-N 3.3Å; P242-G244 PolarHBondContact O-N 3.27Å; P242-K245 PolarHBondContact O-N 2.68Å; P242-F246 WeakPolarHBondContact O-CB 3.45Å; P242-F246 PolarHBondContact O-N 2.89Å
243V66.4Low72.9Confident71 Ų7154.7 Ų54.743%0.4329%0.288SS..Hα-helixtrans-62.4-39.4175.5-177.80000110.9Y230 K241 L247Y230-V243 HydrophobicContact CD1-CG2 4.37Å; Y230-V243 HydrophobicContact CE1-CG2 3.43Å; Y230-V243 VanDerWaalsContact CE1-CG2 3.43Å; Y230-V243 HydrophobicContact CE2-CG2 4.1Å; Y230-V243 WeakPolarHBondContact OH-CG2 3.41Å; K241-V243 PolarHBondContact O-N 3.35Å; V243-L247 WeakPolarHBondContact O-CB 3.28Å; V243-L247 PolarHBondContact O-N 3.34Å
244G63.3Low72.7Confident34 Ų3460 Ų6035%0.35131%0.311SS..Hα-helixtrans-65.7-40.2176.300000112K241 P242 C248K241-G244 PolarHBondContact O-N 3.03Å; K241-G244 VanDerWaalsContact O-N 3.08Å; P242-G244 VanDerWaalsContact C-N 3.3Å; P242-G244 PolarHBondContact O-N 3.27Å; G244-C248 WeakPolarHBondContact O-CB 3.47Å; G244-C248 PolarHBondContact O-N 3.36Å; G244-C248 PolarHBondContact O-SG 3.15Å
245K76.1Confident72.6Confident29 Ų2954.5 Ų54.513%0.12629%0.294CS..Hα-helixtrans-68.8-45.9176.9-64.2-179179.2-172.30112.1F123 F126 I240 P242 C248 V249 S309 F310F123-K245 HydrophobicContact CE2-CB 3.91Å; F123-K245 HydrophobicContact CZ-CB 4.35Å; F126-K245 HydrophobicContact CE1-CD 4.26Å; I240-K245 WeakPolarHBondContact O-CE 3.31Å; P242-K245 PolarHBondContact O-N 2.68Å; K245-C248 WeakPolarHBondContact O-CB 3.36Å; K245-C248 PolarHBondContact O-N 3.34Å; K245-V249 WeakPolarHBondContact O-CG2 3.17Å; K245-V249 PolarHBondContact O-N 2.86Å; K245-V249 VanDerWaalsContact O-N 3.11Å; K245-S309 WeakPolarHBondContact CA-OG 3.36Å; K245-S309 VanDerWaalsContact CE-O 3.25Å; K245-S309 WeakPolarHBondContact CE-O 3.48Å; K245-S309 WeakPolarHBondContact CG-OG 3.3Å; K245-F310 HydrophobicContact CB-CE1 4.03Å; K245-F310 HydrophobicContact CB-CZ 3.84Å; K245-F310 HydrophobicContact CD-CD1 4.26Å; K245-F310 HydrophobicContact CD-CE1 3.95Å; K245-F310 HydrophobicContact CG-CE1 4.1Å; K245-F310 HydrophobicContact CG-CZ 4.26Å
246F69.7Low72.4Confident45 Ų4549.7 Ų49.720%0.19727%0.27CS..Hα-helixtrans-62.4-44.1175.4177-106.4000111.9F123 M223 L226 V227 P242 C248 V249 K250F123-F246 AromaticContact CD1-CD2 3.95Å; F123-F246 HydrophobicContact CD1-CD2 3.95Å; F123-F246 HydrophobicContact CE1-CB 3.7Å; F123-F246 AromaticContact CE1-CD2 3.56Å; F123-F246 HydrophobicContact CE1-CD2 3.56Å; F123-F246 HydrophobicContact CE1-CG 4.09Å; F123-F246 HydrophobicContact CZ-CB 3.63Å; F123-F246 HydrophobicContact CZ-CD2 4.35Å; F123-F246 HydrophobicContact CZ-CG 4.5Å; M223-F246 HydrophobicContact CE-CE1 4.13Å; M223-F246 HydrophobicContact CE-CE2 3.68Å; M223-F246 HydrophobicContact CE-CZ 3.19Å; M223-F246 HydrophobicContact SD-CE2 4.2Å; M223-F246 HydrophobicContact SD-CZ 4.25Å; L226-F246 HydrophobicContact CD1-CE2 4.16Å; L226-F246 HydrophobicContact CD2-CD2 3.71Å; L226-F246 HydrophobicContact CD2-CE2 3.44Å; L226-F246 VanDerWaalsContact CD2-CE2 3.44Å; L226-F246 HydrophobicContact CD2-CZ 4.19Å; L226-F246 HydrophobicContact CG-CE2 4.34Å; V227-F246 HydrophobicContact CG2-CZ 4.39Å; P242-F246 WeakPolarHBondContact O-CB 3.45Å; P242-F246 PolarHBondContact O-N 2.89Å; F246-C248 VanDerWaalsContact C-N 3.32Å; F246-C248 PolarHBondContact O-N 2.84Å; F246-V249 PolarHBondContact O-N 3.41Å; F246-K250 WeakPolarHBondContact O-CB 3.15Å; F246-K250 PolarHBondContact O-N 3.29Å
247L68.6Low72.2Confident106 Ų10652.8 Ų52.856%0.55528%0.283SS*.Hα-helixtrans-63.4-40.9176-170.267.1000110V243 V249 K250 M251V243-L247 WeakPolarHBondContact O-CB 3.28Å; V243-L247 PolarHBondContact O-N 3.34Å; L247-V249 VanDerWaalsContact C-N 3.27Å; L247-V249 PolarHBondContact O-N 2.89Å; L247-K250 PolarHBondContact O-N 3.03Å; L247-M251 HydrophobicContact CD1-CB 4.35Å; L247-M251 HydrophobicContact CG-CB 4.38Å; L247-M251 WeakPolarHBondContact O-CA 3.18Å; L247-M251 WeakPolarHBondContact O-CB 3.31Å; L247-M251 PolarHBondContact O-N 3.38Å
248C67.9Low72.2Confident28 Ų2859.4 Ų59.419%0.18931%0.308CS..Hα-helixtrans-61-34.2175.1-72.60000113.5G244 K245 F246 H306G244-C248 WeakPolarHBondContact O-CB 3.47Å; G244-C248 PolarHBondContact O-N 3.36Å; G244-C248 PolarHBondContact O-SG 3.15Å; K245-C248 WeakPolarHBondContact O-CB 3.36Å; K245-C248 PolarHBondContact O-N 3.34Å; F246-C248 VanDerWaalsContact C-N 3.32Å; F246-C248 PolarHBondContact O-N 2.84Å; C248-H306 PolarHBondContact O-NE2 3.3Å; C248-H306 VanDerWaalsContact O-NE2 3.1Å
249V69.6Low72.5Confident8 Ų857.4 Ų57.45%0.04829%0.29CS..Hα-helixtrans-77.9-47.2177.2173.50000111.2I84 V119 K245 F246 L247 F310I84-V249 HydrophobicContact CG2-CG2 3.47Å; I84-V249 VanDerWaalsContact CG2-CG2 3.47Å; V119-V249 HydrophobicContact CG1-CG1 3.46Å; V119-V249 VanDerWaalsContact CG1-CG1 3.46Å; K245-V249 WeakPolarHBondContact O-CG2 3.17Å; K245-V249 PolarHBondContact O-N 2.86Å; K245-V249 VanDerWaalsContact O-N 3.11Å; F246-V249 PolarHBondContact O-N 3.41Å; L247-V249 VanDerWaalsContact C-N 3.27Å; L247-V249 PolarHBondContact O-N 2.89Å; V249-F310 HydrophobicContact CG2-CE2 4.28Å; V249-F310 HydrophobicContact CG2-CZ 4.1Å
250K74.4Confident72.8Confident32 Ų3254.8 Ų54.814%0.13928%0.276CS..Hα-helixtrans-80.8-32-173-167.564.6-176.2-178.80113.4E116 M223 F246 L247 V252 V253 F254E116-K250 IonicContact OE1-NZ 3.34Å; E116-K250 PolarHBondContact OE1-NZ 3.23Å; M223-K250 HydrophobicContact CE-CB 4.39Å; M223-K250 HydrophobicContact CE-CD 3.36Å; M223-K250 VanDerWaalsContact CE-CE 3.45Å; M223-K250 HydrophobicContact CE-CG 3.57Å; M223-K250 HydrophobicContact SD-CD 3.81Å; F246-K250 WeakPolarHBondContact O-CB 3.15Å; F246-K250 PolarHBondContact O-N 3.29Å; L247-K250 PolarHBondContact O-N 3.03Å; K250-V252 PolarHBondContact O-N 3.34Å; K250-V253 PolarHBondContact O-N 3.32Å; K250-V253 VanDerWaalsContact O-N 3.15Å; K250-F254 VanDerWaalsContact O-CB 3.3Å; K250-F254 WeakPolarHBondContact O-CB 3.32Å; K250-F254 PolarHBondContact O-N 2.81Å
251M74.1Confident73.2Confident105 Ų10556.8 Ų56.852%0.51729%0.289SS..Hα-helixtrans-61.7-35.3-179.4-172.7-102.9-15800111L247 V253 F254 V255L247-M251 HydrophobicContact CD1-CB 4.35Å; L247-M251 HydrophobicContact CG-CB 4.38Å; L247-M251 WeakPolarHBondContact O-CA 3.18Å; L247-M251 WeakPolarHBondContact O-CB 3.31Å; L247-M251 PolarHBondContact O-N 3.38Å; M251-V253 VanDerWaalsContact C-N 3.35Å; M251-V253 PolarHBondContact O-N 3.24Å; M251-F254 PolarHBondContact O-N 3.22Å; M251-V255 HydrophobicContact CE-CG2 4.1Å; M251-V255 HydrophobicContact CG-CG2 3.78Å; M251-V255 VanDerWaalsContact O-CB 3.32Å; M251-V255 WeakPolarHBondContact O-CB 3.3Å; M251-V255 WeakPolarHBondContact O-CG2 3.4Å; M251-V255 PolarHBondContact O-N 2.76Å; M251-V255 HydrophobicContact SD-CG2 3.89Å
252V72Confident73.9Confident7 Ų753.7 Ų53.74%0.04228%0.28CS..Hα-helixtrans-54.7-49.1173.3166.50000112M87 Y91 K250 S256 M299 A302M87-V252 HydrophobicContact CE-CB 4.12Å; M87-V252 HydrophobicContact CE-CG1 3.67Å; Y91-V252 HydrophobicContact CD1-CG1 4.16Å; Y91-V252 HydrophobicContact CE1-CG1 4.25Å; K250-V252 PolarHBondContact O-N 3.34Å; V252-S256 PolarHBondContact O-N 3.02Å; V252-S256 PolarHBondContact O-OG 3.21Å; V252-M299 HydrophobicContact CB-CE 4.32Å; V252-M299 HydrophobicContact CG1-CE 3.36Å; V252-M299 HydrophobicContact CG1-SD 3.92Å; V252-M299 HydrophobicContact CG2-CE 4.26Å; V252-A302 HydrophobicContact CG2-CB 3.68Å
253V72.4Confident74.7Confident17 Ų1753.8 Ų53.810%0.10328%0.28CS..Hα-helixtrans-75.6-40.3-179.3-176.40000111.3M87 E116 K250 M251 S256 F257M87-V253 HydrophobicContact CE-CG2 3.68Å; E116-V253 VanDerWaalsContact CD-CG1 3.4Å; E116-V253 HydrophobicContact CG-CG2 3.78Å; E116-V253 WeakPolarHBondContact OE1-CG1 2.89Å; E116-V253 WeakPolarHBondContact OE2-CG1 3.01Å; K250-V253 PolarHBondContact O-N 3.32Å; K250-V253 VanDerWaalsContact O-N 3.15Å; M251-V253 VanDerWaalsContact C-N 3.35Å; M251-V253 PolarHBondContact O-N 3.24Å; V253-S256 WeakPolarHBondContact CA-OG 3.34Å; V253-S256 PolarHBondContact O-OG 3.45Å; V253-F257 WeakPolarHBondContact O-CB 3.12Å; V253-F257 PolarHBondContact O-N 3.13Å
254F76.2Confident75.2Confident117 Ų11752.8 Ų52.851%0.51328%0.279SS..Hα-helixtrans-65.3-44.3-176.5-175.4-98.4000111.1K250 M251 F257 W258K250-F254 VanDerWaalsContact O-CB 3.3Å; K250-F254 WeakPolarHBondContact O-CB 3.32Å; K250-F254 PolarHBondContact O-N 2.81Å; M251-F254 PolarHBondContact O-N 3.22Å; F254-F257 PolarHBondContact O-N 3.37Å; F254-W258 AromaticContact CD1-CD1 3.64Å; F254-W258 AromaticContact CD2-NE1 3.89Å; F254-W258 AromaticContact CE1-CD1 3.35Å; F254-W258 HydrophobicContact CE1-CG 4.49Å; F254-W258 AromaticContact CE1-NE1 3.39Å; F254-W258 AromaticContact CE2-CD1 3.76Å; F254-W258 AromaticContact CE2-NE1 3.21Å; F254-W258 AromaticContact CG-CD1 3.99Å; F254-W258 AromaticContact CZ-CD1 3.45Å; F254-W258 VanDerWaalsContact CZ-CD1 3.45Å; F254-W258 AromaticContact CZ-NE1 2.94Å; F254-W258 PolarHBondContact O-N 3.04Å
255V79.6Confident76.1Confident36 Ų3656.2 Ų56.222%0.21829%0.289CS..Hα-helixtrans-67.8-44.7180-178.10000110.3M251 F257 W258 Q259 E298M251-V255 HydrophobicContact CE-CG2 4.1Å; M251-V255 HydrophobicContact CG-CG2 3.78Å; M251-V255 VanDerWaalsContact O-CB 3.32Å; M251-V255 WeakPolarHBondContact O-CB 3.3Å; M251-V255 WeakPolarHBondContact O-CG2 3.4Å; M251-V255 PolarHBondContact O-N 2.76Å; M251-V255 HydrophobicContact SD-CG2 3.89Å; V255-F257 VanDerWaalsContact C-N 3.31Å; V255-F257 PolarHBondContact O-N 3.21Å; V255-W258 PolarHBondContact O-N 3.2Å; V255-Q259 HydrophobicContact CG1-CG 4.28Å; V255-Q259 WeakPolarHBondContact O-CB 3.29Å; V255-Q259 WeakPolarHBondContact O-CG 3.28Å; V255-Q259 PolarHBondContact O-N 2.99Å; V255-E298 WeakPolarHBondContact CG1-OE1 3.33Å
256S76.3Confident76.2Confident18 Ų1857.4 Ų57.413%0.12630%0.296CS..Hα-helixtrans-61.2-35.7175.547.20000113.5V252 V253 Q259 A260V252-S256 PolarHBondContact O-N 3.02Å; V252-S256 PolarHBondContact O-OG 3.21Å; V253-S256 WeakPolarHBondContact CA-OG 3.34Å; V253-S256 PolarHBondContact O-OG 3.45Å; S256-Q259 WeakPolarHBondContact O-CB 3.28Å; S256-Q259 PolarHBondContact O-N 3.21Å; S256-A260 PolarHBondContact O-N 3.02Å
257F77.1Confident76.6Confident107 Ų10757.1 Ų57.147%0.46930%0.298SS..Hα-helixtrans-63.4-49.9171.2173.4-95.9000112.6V253 F254 V255 Q259 A260 V261V253-F257 WeakPolarHBondContact O-CB 3.12Å; V253-F257 PolarHBondContact O-N 3.13Å; F254-F257 PolarHBondContact O-N 3.37Å; V255-F257 VanDerWaalsContact C-N 3.31Å; V255-F257 PolarHBondContact O-N 3.21Å; F257-Q259 PolarHBondContact O-N 3.38Å; F257-A260 WeakPolarHBondContact O-CB 3.17Å; F257-A260 PolarHBondContact O-N 3.35Å; F257-V261 HydrophobicContact CD1-CG2 4.41Å; F257-V261 HydrophobicContact CE1-CG2 3.92Å; F257-V261 HydrophobicContact CE2-CG2 4.31Å; F257-V261 HydrophobicContact CZ-CG2 3.87Å; F257-V261 WeakPolarHBondContact O-CG2 3.26Å; F257-V261 PolarHBondContact O-N 2.93Å
258W79.6Confident76.9Confident139 Ų13960.3 Ų60.353%0.52731%0.308SS..Hα-helixtrans-66.3-29.6179.5-81.5102.8000112.5F254 V255 V261 L262F254-W258 AromaticContact CD1-CD1 3.64Å; F254-W258 AromaticContact CD2-NE1 3.89Å; F254-W258 AromaticContact CE1-CD1 3.35Å; F254-W258 HydrophobicContact CE1-CG 4.49Å; F254-W258 AromaticContact CE1-NE1 3.39Å; F254-W258 AromaticContact CE2-CD1 3.76Å; F254-W258 AromaticContact CE2-NE1 3.21Å; F254-W258 AromaticContact CG-CD1 3.99Å; F254-W258 AromaticContact CZ-CD1 3.45Å; F254-W258 VanDerWaalsContact CZ-CD1 3.45Å; F254-W258 AromaticContact CZ-NE1 2.94Å; F254-W258 PolarHBondContact O-N 3.04Å; V255-W258 PolarHBondContact O-N 3.2Å; W258-V261 PolarHBondContact O-N 2.8Å; W258-L262 VanDerWaalsContact O-CB 3.23Å; W258-L262 WeakPolarHBondContact O-CB 3.37Å; W258-L262 PolarHBondContact O-N 3.12Å
259Q80.9Confident77.6Confident30 Ų3063.6 Ų63.614%0.1433%0.326CS..Hα-helixtrans-63.8-47.4170.4-74.8168.9-1100111.9V255 S256 F257 V261 L262 I263 I294 E298V255-Q259 HydrophobicContact CG1-CG 4.28Å; V255-Q259 WeakPolarHBondContact O-CB 3.29Å; V255-Q259 WeakPolarHBondContact O-CG 3.28Å; V255-Q259 PolarHBondContact O-N 2.99Å; S256-Q259 WeakPolarHBondContact O-CB 3.28Å; S256-Q259 PolarHBondContact O-N 3.21Å; F257-Q259 PolarHBondContact O-N 3.38Å; Q259-V261 VanDerWaalsContact C-N 3.28Å; Q259-V261 PolarHBondContact O-N 2.95Å; Q259-L262 PolarHBondContact O-N 3.49Å; Q259-I263 WeakPolarHBondContact O-CB 3.26Å; Q259-I263 VanDerWaalsContact O-CG1 3.22Å; Q259-I263 WeakPolarHBondContact O-CG1 3.33Å; Q259-I263 PolarHBondContact O-N 2.71Å; Q259-I294 VanDerWaalsContact CD-CG2 3.5Å; Q259-E298 PolarHBondContact NE2-OE1 3.02Å; Q259-E298 PolarHBondContact OE1-OE2 3.39Å
260A79.7Confident77.5Confident29 Ų2965 Ų6524%0.2434%0.343CS..Hα-helixtrans-56.2-45.6175.800000111.2S256 F257 A264 Q291S256-A260 PolarHBondContact O-N 3.02Å; F257-A260 WeakPolarHBondContact O-CB 3.17Å; F257-A260 PolarHBondContact O-N 3.35Å; A260-A264 VanDerWaalsContact O-CB 3.26Å; A260-A264 WeakPolarHBondContact O-CB 3.36Å; A260-A264 PolarHBondContact O-N 3.45Å; A260-Q291 VanDerWaalsContact CA-OE1 3.24Å
261V79.3Confident77.2Confident63 Ų6369.2 Ų69.238%0.38237%0.366SS..Hα-helixtrans-63.5-45.1176.9175.10000111.7F257 W258 Q259 A264 L265F257-V261 HydrophobicContact CD1-CG2 4.41Å; F257-V261 HydrophobicContact CE1-CG2 3.92Å; F257-V261 HydrophobicContact CE2-CG2 4.31Å; F257-V261 HydrophobicContact CZ-CG2 3.87Å; F257-V261 WeakPolarHBondContact O-CG2 3.26Å; F257-V261 PolarHBondContact O-N 2.93Å; W258-V261 PolarHBondContact O-N 2.8Å; Q259-V261 VanDerWaalsContact C-N 3.28Å; Q259-V261 PolarHBondContact O-N 2.95Å; V261-A264 PolarHBondContact O-N 3.12Å; V261-L265 WeakPolarHBondContact O-CB 3.48Å; V261-L265 PolarHBondContact O-N 2.68Å
262L83.1Confident76.6Confident102 Ų10265.4 Ų65.453%0.53435%0.347SS..Hα-helixtrans-64.1-46.1179.7-178139.5000110.8W258 Q259 A264 L265 L266W258-L262 VanDerWaalsContact O-CB 3.23Å; W258-L262 WeakPolarHBondContact O-CB 3.37Å; W258-L262 PolarHBondContact O-N 3.12Å; Q259-L262 PolarHBondContact O-N 3.49Å; L262-A264 PolarHBondContact O-N 2.93Å; L262-L265 WeakPolarHBondContact O-CB 3.39Å; L262-L265 PolarHBondContact O-N 2.85Å; L262-L266 HydrophobicContact CD2-CD1 3.41Å; L262-L266 VanDerWaalsContact CD2-CD1 3.41Å; L262-L266 HydrophobicContact CG-CD1 3.71Å; L262-L266 WeakPolarHBondContact O-CD1 3.3Å; L262-L266 PolarHBondContact O-N 3.22Å
263I83.3Confident75.7Confident7 Ų768.1 Ų68.14%0.03637%0.366CS..Hα-helixtrans-62.4-44.6177.1-65.3166.6000110.3Q259 L265 L266 V267 A287 L290 Q291 I294Q259-I263 WeakPolarHBondContact O-CB 3.26Å; Q259-I263 VanDerWaalsContact O-CG1 3.22Å; Q259-I263 WeakPolarHBondContact O-CG1 3.33Å; Q259-I263 PolarHBondContact O-N 2.71Å; I263-L265 VanDerWaalsContact C-N 3.28Å; I263-L265 PolarHBondContact O-N 3.5Å; I263-L266 PolarHBondContact O-N 3.46Å; I263-L266 VanDerWaalsContact O-N 3.13Å; I263-V267 WeakPolarHBondContact O-CG2 3.35Å; I263-V267 PolarHBondContact O-N 2.74Å; I263-A287 HydrophobicContact CG2-CB 3.48Å; I263-A287 VanDerWaalsContact CG2-CB 3.48Å; I263-L290 HydrophobicContact CD1-CD2 4.46Å; I263-L290 HydrophobicContact CD1-CG 4.32Å; I263-L290 HydrophobicContact CG1-CD2 4.4Å; I263-Q291 HydrophobicContact CD1-CB 3.74Å; I263-Q291 HydrophobicContact CD1-CG 4.33Å; I263-I294 HydrophobicContact CD1-CD1 4.29Å
264A77Confident74.7Confident49 Ų4975.1 Ų75.141%0.40540%0.398SS..Hα-helixtrans-61-37175.400000112.3A260 V261 L262 K268A260-A264 VanDerWaalsContact O-CB 3.26Å; A260-A264 WeakPolarHBondContact O-CB 3.36Å; A260-A264 PolarHBondContact O-N 3.45Å; V261-A264 PolarHBondContact O-N 3.12Å; L262-A264 PolarHBondContact O-N 2.93Å; A264-K268 WeakPolarHBondContact O-CG 3.45Å; A264-K268 PolarHBondContact O-N 2.99Å
265L80.4Confident73.4Confident106 Ų10679 Ų7956%0.55542%0.415SS*.Hα-helixtrans-65.5-44.8172.9-173.675.4000111.2V261 L262 I263 V267 K268 V269V261-L265 WeakPolarHBondContact O-CB 3.48Å; V261-L265 PolarHBondContact O-N 2.68Å; L262-L265 WeakPolarHBondContact O-CB 3.39Å; L262-L265 PolarHBondContact O-N 2.85Å; I263-L265 VanDerWaalsContact C-N 3.28Å; I263-L265 PolarHBondContact O-N 3.5Å; L265-V267 VanDerWaalsContact C-N 3.29Å; L265-V267 PolarHBondContact O-N 2.9Å; L265-K268 PolarHBondContact O-N 3.34Å; L265-K268 VanDerWaalsContact O-N 3.13Å; L265-V269 HydrophobicContact CD1-CG2 4.47Å; L265-V269 HydrophobicContact CG-CG2 4.25Å; L265-V269 WeakPolarHBondContact O-CB 3.08Å; L265-V269 VanDerWaalsContact O-CG2 3.26Å; L265-V269 WeakPolarHBondContact O-CG2 3.48Å; L265-V269 PolarHBondContact O-N 2.83Å
266L80Confident71.9Confident55 Ų5588.5 Ų88.529%0.28845%0.446SS..Hα-helixtrans-61.6-36.5177.2-89.392.1000112.7L262 I263 G270 I271 I272L262-L266 HydrophobicContact CD2-CD1 3.41Å; L262-L266 VanDerWaalsContact CD2-CD1 3.41Å; L262-L266 HydrophobicContact CG-CD1 3.71Å; L262-L266 WeakPolarHBondContact O-CD1 3.3Å; L262-L266 PolarHBondContact O-N 3.22Å; I263-L266 PolarHBondContact O-N 3.46Å; I263-L266 VanDerWaalsContact O-N 3.13Å; L266-G270 PolarHBondContact O-N 3.41Å; L266-I271 HydrophobicContact CD2-CB 4.44Å; L266-I271 HydrophobicContact CD2-CD1 4.4Å; L266-I271 HydrophobicContact CD2-CG2 4.08Å; L266-I271 HydrophobicContact CG-CD1 4.24Å; L266-I271 PolarHBondContact O-N 3.32Å; L266-I271 VanDerWaalsContact O-N 3.15Å; L266-I272 HydrophobicContact CB-CD1 4Å; L266-I272 HydrophobicContact CB-CG1 4.42Å
267V77.4Confident70.5Confident39 Ų3989.9 Ų89.924%0.23645%0.454CS..Hα-helixtrans-62.3-48.8171.41680000110.4I263 L265 V269 G270 I272 V283 A287I263-V267 WeakPolarHBondContact O-CG2 3.35Å; I263-V267 PolarHBondContact O-N 2.74Å; L265-V267 VanDerWaalsContact C-N 3.29Å; L265-V267 PolarHBondContact O-N 2.9Å; V267-V269 PolarHBondContact O-N 2.99Å; V267-G270 PolarHBondContact O-N 3.36Å; V267-G270 VanDerWaalsContact O-N 3.07Å; V267-I272 HydrophobicContact CG2-CB 4.29Å; V267-I272 HydrophobicContact CG2-CD1 4Å; V267-V283 HydrophobicContact CB-CG1 4.3Å; V267-V283 HydrophobicContact CG1-CG1 3.54Å; V267-V283 HydrophobicContact CG2-CG1 3.91Å; V267-A287 HydrophobicContact CG2-CB 3.97Å
268K75.4Confident69.3Low173 Ų17392 Ų9275%0.75246%0.459SS*.Hα-helixtrans-64.9-36.1179.3-76.4-175.2177.8-1790113.9A264 L265 G270A264-K268 WeakPolarHBondContact O-CG 3.45Å; A264-K268 PolarHBondContact O-N 2.99Å; L265-K268 PolarHBondContact O-N 3.34Å; L265-K268 VanDerWaalsContact O-N 3.13Å; K268-G270 PolarHBondContact O-N 2.84Å
269V81.3Confident67.9Low96 Ų9692.4 Ų92.458%0.58247%0.472SS*.THydrogen-bonded Turntrans-73.2-10.2176.61770000111.3L265 V267 I271L265-V269 HydrophobicContact CD1-CG2 4.47Å; L265-V269 HydrophobicContact CG-CG2 4.25Å; L265-V269 WeakPolarHBondContact O-CB 3.08Å; L265-V269 VanDerWaalsContact O-CG2 3.26Å; L265-V269 WeakPolarHBondContact O-CG2 3.48Å; L265-V269 PolarHBondContact O-N 2.83Å; V267-V269 PolarHBondContact O-N 2.99Å; V269-I271 VanDerWaalsContact C-N 3.3Å; V269-I271 HydrophobicContact CB-CD1 4.49Å; V269-I271 HydrophobicContact CG1-CD1 4Å; V269-I271 HydrophobicContact CG1-CG1 4.03Å; V269-I271 PolarHBondContact O-N 3.32Å
270G68.2Low66.4Low39 Ų3993.9 Ų93.940%0.40248%0.476SS..THydrogen-bonded Turntrans7616.8177.300000113.6L266 V267 K268 I272 S273L266-G270 PolarHBondContact O-N 3.41Å; V267-G270 PolarHBondContact O-N 3.36Å; V267-G270 VanDerWaalsContact O-N 3.07Å; K268-G270 PolarHBondContact O-N 2.84Å; G270-I272 VanDerWaalsContact C-N 3.25Å; G270-S273 WeakPolarHBondContact O-CB 3.35Å
271I69.1Low65Low119 Ų119102.4 Ų102.461%0.6151%0.511SS*.SBendtrans-66.9-36.1171.1-67.2169000109.4L266 V269L266-I271 HydrophobicContact CD2-CB 4.44Å; L266-I271 HydrophobicContact CD2-CD1 4.4Å; L266-I271 HydrophobicContact CD2-CG2 4.08Å; L266-I271 HydrophobicContact CG-CD1 4.24Å; L266-I271 PolarHBondContact O-N 3.32Å; L266-I271 VanDerWaalsContact O-N 3.15Å; V269-I271 VanDerWaalsContact C-N 3.3Å; V269-I271 HydrophobicContact CB-CD1 4.49Å; V269-I271 HydrophobicContact CG1-CD1 4Å; V269-I271 HydrophobicContact CG1-CG1 4.03Å; V269-I271 PolarHBondContact O-N 3.32Å
272I61.3Low64.2Low26 Ų26101.7 Ų101.713%0.13351%0.509CS..SBendtrans-98.188.2170.5-56168.7000106.5L266 V267 G270 V283 V286L266-I272 HydrophobicContact CB-CD1 4Å; L266-I272 HydrophobicContact CB-CG1 4.42Å; V267-I272 HydrophobicContact CG2-CB 4.29Å; V267-I272 HydrophobicContact CG2-CD1 4Å; G270-I272 VanDerWaalsContact C-N 3.25Å; I272-V283 HydrophobicContact CG2-CG1 4.18Å; I272-V286 HydrophobicContact CG2-CG1 4.34Å
273S52.1Low63.5Low63 Ų6398.6 Ų98.644%0.44149%0.494SS..  trans-110.2140.6-176.4-167.80000111.7G270 K275 R276 T277G270-S273 WeakPolarHBondContact O-CB 3.35Å; S273-K275 PolarHBondContact O-N 3.15Å; S273-R276 PolarHBondContact O-N 2.97Å; S273-T277 PolarHBondContact O-OG1 3.43Å
274E52.1Low62.8Low164 Ų164105.3 Ų105.377%0.76653%0.525SS*.THydrogen-bonded Turntrans-46.2-26.7-178.4-75.3-177.7150.500115R276 V283E274-R276 VanDerWaalsContact C-N 3.34Å; E274-R276 PolarHBondContact O-N 3.16Å; E274-V283 HydrophobicContact CG-CG2 3.65Å
275K47.4Very low62.5Low199 Ų199104.2 Ų104.287%0.86552%0.516SS*.THydrogen-bonded Turntrans-79.6-4-169.4-70.2-175.3177.8-179.80115.6S273S273-K275 PolarHBondContact O-N 3.15Å
276R50Low62.2Low235 Ų235100.2 Ų100.289%0.88750%0.496SS*.SBendtrans-142.90.8-173.4-139.7177.3-151.2159.87.2117.7S273 E274S273-R276 PolarHBondContact O-N 2.97Å; E274-R276 VanDerWaalsContact C-N 3.34Å; E274-R276 PolarHBondContact O-N 3.16Å
277T46.6Very low62.1Low47 Ų4798.2 Ų98.229%0.28849%0.488SS..  trans-136.896.2-16042.40000113.4S273S273-T277 PolarHBondContact O-OG1 3.43Å
278W51.6Low62.2Low153 Ų15399.4 Ų99.458%0.5850%0.495SS*.  trans72.1157.8148.9-38.3105.8000116.1T42 W280T42-W278 VanDerWaalsContact CB-CZ3 3.42Å; T42-W278 HydrophobicContact CG2-CD2 4.03Å; T42-W278 HydrophobicContact CG2-CE3 3.34Å; T42-W278 HydrophobicContact CG2-CH2 3.62Å; T42-W278 HydrophobicContact CG2-CZ2 4.3Å; T42-W278 HydrophobicContact CG2-CZ3 3.12Å; T42-W278 WeakPolarHBondContact OG1-CZ3 3.4Å; W278-W280 PolarHBondContact O-N 2.98Å
279D49.2Very low62.5Low146 Ų14691.5 Ų91.578%0.78146%0.462SS*.SBendtrans-60.819.6-173.3-125.3-13.1000116
280W49.8Very low62.6Low62 Ų6290.4 Ų90.424%0.23545%0.453CS..  trans-101130.6-174.1-67.388.4000111.1H43 P102 W278 S282 A285 V286H43-W280 AromaticContact CE1-CH2 3.33Å; H43-W280 WeakPolarHBondContact CE1-CH2 3.35Å; H43-W280 AromaticContact CE1-CZ2 3.32Å; H43-W280 WeakPolarHBondContact CE1-CZ2 3.18Å; H43-W280 AromaticContact ND1-CE2 3.39Å; H43-W280 AromaticContact ND1-CH2 3.39Å; H43-W280 WeakPolarHBondContact ND1-CH2 3.24Å; H43-W280 AromaticContact ND1-CZ2 2.84Å; H43-W280 WeakPolarHBondContact ND1-CZ2 3.35Å; H43-W280 AromaticContact ND1-NE1 3.85Å; P102-W280 HydrophobicContact CG-CZ3 4.38Å; W278-W280 PolarHBondContact O-N 2.98Å; W280-S282 VanDerWaalsContact C-N 3.27Å; W280-S282 PolarHBondContact O-N 3.47Å; W280-A285 HydrophobicContact CD2-CB 4.42Å; W280-A285 HydrophobicContact CE3-CB 3.47Å; W280-A285 VanDerWaalsContact CE3-CB 3.47Å; W280-A285 HydrophobicContact CZ3-CB 3.74Å; W280-V286 HydrophobicContact CB-CG2 3.4Å; W280-V286 VanDerWaalsContact CB-CG2 3.4Å; W280-V286 HydrophobicContact CD2-CG2 4.3Å; W280-V286 HydrophobicContact CG-CG2 3.57Å
281Q50.9Low63.5Low207 Ų20790.8 Ų90.897%0.96744%0.444SS*.SBendtrans-73.2-11.5-177.4-72.8177.5-35.500114.2
282S62.7Low64.4Low49 Ų4985.2 Ų85.234%0.34342%0.416SS..  trans-144.2145.717773.10000113W280 E284 A285 V286W280-S282 VanDerWaalsContact C-N 3.27Å; W280-S282 PolarHBondContact O-N 3.47Å; S282-E284 PolarHBondContact O-N 2.9Å; S282-A285 PolarHBondContact O-N 3.21Å; S282-A285 WeakPolarHBondContact OG-CB 3.34Å; S282-A285 PolarHBondContact OG-N 2.65Å; S282-V286 PolarHBondContact O-N 2.83Å
283V68.9Low65.7Low36 Ų3686.5 Ų86.522%0.21842%0.421CS..Hα-helixtrans-62.9-32177.6-178.40000111.6V267 I272 E274 V286 A287V267-V283 HydrophobicContact CB-CG1 4.3Å; V267-V283 HydrophobicContact CG1-CG1 3.54Å; V267-V283 HydrophobicContact CG2-CG1 3.91Å; I272-V283 HydrophobicContact CG2-CG1 4.18Å; E274-V283 HydrophobicContact CG-CG2 3.65Å; V283-V286 PolarHBondContact O-N 3.42Å; V283-A287 PolarHBondContact O-N 2.86Å; V283-A287 VanDerWaalsContact O-N 3.13Å
284E67.8Low67.5Low149 Ų14985.8 Ų85.870%0.69641%0.411SS*.Hα-helixtrans-65.9-42.6177.7-67.7156176.700111.6S282 V286 A287 T288S282-E284 PolarHBondContact O-N 2.9Å; E284-V286 VanDerWaalsContact C-N 3.3Å; E284-V286 PolarHBondContact O-N 3.31Å; E284-A287 WeakPolarHBondContact O-CB 3.34Å; E284-A287 PolarHBondContact O-N 2.86Å; E284-A287 VanDerWaalsContact O-N 3.16Å; E284-T288 PolarHBondContact O-N 2.87Å; E284-T288 PolarHBondContact O-OG1 2.97Å; E284-T288 VanDerWaalsContact O-OG1 3.12Å
285A70.8Confident69.3Low25 Ų2578.1 Ų78.121%0.20738%0.376CS..Hα-helixtrans-66-34178.500000112.3W280 S282 G289W280-A285 HydrophobicContact CD2-CB 4.42Å; W280-A285 HydrophobicContact CE3-CB 3.47Å; W280-A285 VanDerWaalsContact CE3-CB 3.47Å; W280-A285 HydrophobicContact CZ3-CB 3.74Å; S282-A285 PolarHBondContact O-N 3.21Å; S282-A285 WeakPolarHBondContact OG-CB 3.34Å; S282-A285 PolarHBondContact OG-N 2.65Å; A285-G289 PolarHBondContact O-N 3.15Å
286V74.8Confident71.3Confident22 Ų2268.7 Ų68.713%0.13333%0.334CS..Hα-helixtrans-65.5-42.3173179.30000111.1I272 W280 S282 V283 E284 L290I272-V286 HydrophobicContact CG2-CG1 4.34Å; W280-V286 HydrophobicContact CB-CG2 3.4Å; W280-V286 VanDerWaalsContact CB-CG2 3.4Å; W280-V286 HydrophobicContact CD2-CG2 4.3Å; W280-V286 HydrophobicContact CG-CG2 3.57Å; S282-V286 PolarHBondContact O-N 2.83Å; V283-V286 PolarHBondContact O-N 3.42Å; E284-V286 VanDerWaalsContact C-N 3.3Å; E284-V286 PolarHBondContact O-N 3.31Å; V286-L290 VanDerWaalsContact O-CB 3.3Å; V286-L290 WeakPolarHBondContact O-CB 3.32Å; V286-L290 PolarHBondContact O-N 3.33Å
287A77.7Confident73.2Confident14 Ų1459.5 Ų59.512%0.11630%0.304CS..Hα-helixtrans-62.3-48.7177.700000111.6I263 V267 V283 E284 L290 Q291I263-A287 HydrophobicContact CG2-CB 3.48Å; I263-A287 VanDerWaalsContact CG2-CB 3.48Å; V267-A287 HydrophobicContact CG2-CB 3.97Å; V283-A287 PolarHBondContact O-N 2.86Å; V283-A287 VanDerWaalsContact O-N 3.13Å; E284-A287 WeakPolarHBondContact O-CB 3.34Å; E284-A287 PolarHBondContact O-N 2.86Å; E284-A287 VanDerWaalsContact O-N 3.16Å; A287-L290 PolarHBondContact O-N 3.5Å; A287-Q291 PolarHBondContact O-N 3.23Å
288T78.6Confident75.3Confident63 Ų6359 Ų5939%0.38730%0.298SS..Hα-helixtrans-62.4-47177.3-53.20000111.4E284 L290 Q291 D292E284-T288 PolarHBondContact O-N 2.87Å; E284-T288 PolarHBondContact O-OG1 2.97Å; E284-T288 VanDerWaalsContact O-OG1 3.12Å; T288-L290 VanDerWaalsContact C-N 3.31Å; T288-L290 PolarHBondContact O-N 3.01Å; T288-Q291 WeakPolarHBondContact O-CB 3.44Å; T288-Q291 PolarHBondContact O-N 3.33Å; T288-Q291 VanDerWaalsContact O-N 3.1Å; T288-D292 PolarHBondContact O-N 3.21Å
289G81.6Confident77.2Confident7 Ų751.7 Ų51.77%0.07227%0.271CS..Hα-helixtrans-63.3-34.8177.800000113.5L99 A285 F293L99-G289 WeakPolarHBondContact CD1-O 3.5Å; A285-G289 PolarHBondContact O-N 3.15Å; G289-F293 WeakPolarHBondContact O-CB 3.33Å; G289-F293 PolarHBondContact O-N 2.78Å
290L84.1Confident79.2Confident73 Ų7346.8 Ų46.838%0.38224%0.243SC..Hα-helixtrans-67.3-40.4173.4-178.861.9000111.5I263 V286 A287 T288 F293 I294I263-L290 HydrophobicContact CD1-CD2 4.46Å; I263-L290 HydrophobicContact CD1-CG 4.32Å; I263-L290 HydrophobicContact CG1-CD2 4.4Å; V286-L290 VanDerWaalsContact O-CB 3.3Å; V286-L290 WeakPolarHBondContact O-CB 3.32Å; V286-L290 PolarHBondContact O-N 3.33Å; A287-L290 PolarHBondContact O-N 3.5Å; T288-L290 VanDerWaalsContact C-N 3.31Å; T288-L290 PolarHBondContact O-N 3.01Å; L290-F293 PolarHBondContact O-N 3.23Å; L290-I294 HydrophobicContact CD1-CD1 4.27Å; L290-I294 HydrophobicContact CG-CD1 4.08Å; L290-I294 VanDerWaalsContact O-CG1 3.28Å; L290-I294 WeakPolarHBondContact O-CG1 3.44Å; L290-I294 PolarHBondContact O-N 3.21Å
291Q86.8Confident81.1Confident47 Ų4749 Ų4922%0.2226%0.258CS..Hα-helixtrans-61.6-49.4175.6-173.6-180-48.800111A260 I263 A287 T288 F293 I294 I295A260-Q291 VanDerWaalsContact CA-OE1 3.24Å; I263-Q291 HydrophobicContact CD1-CB 3.74Å; I263-Q291 HydrophobicContact CD1-CG 4.33Å; A287-Q291 PolarHBondContact O-N 3.23Å; T288-Q291 WeakPolarHBondContact O-CB 3.44Å; T288-Q291 PolarHBondContact O-N 3.33Å; T288-Q291 VanDerWaalsContact O-N 3.1Å; Q291-F293 VanDerWaalsContact C-N 3.32Å; Q291-F293 PolarHBondContact O-N 3.19Å; Q291-I294 PolarHBondContact O-N 3.49Å; Q291-I294 VanDerWaalsContact O-N 3.14Å; Q291-I295 HydrophobicContact CG-CD1 4.01Å; Q291-I295 VanDerWaalsContact O-CG1 3.31Å; Q291-I295 WeakPolarHBondContact O-CG1 3.5Å; Q291-I295 PolarHBondContact O-N 3.14Å
292D87.8Confident82.9Confident3 Ų339.6 Ų39.62%0.01622%0.216CC..Hα-helixtrans-61.8-38.8178.5-72.7-32.5000112.6L99 T288 I295 C296L99-D292 HydrophobicContact CB-CB 4.41Å; L99-D292 HydrophobicContact CD1-CB 4.45Å; T288-D292 PolarHBondContact O-N 3.21Å; D292-I295 PolarHBondContact O-N 3.28Å; D292-C296 PolarHBondContact O-N 3.11Å; D292-C296 PolarHBondContact O-SG 2.61Å
293F88.9Confident84.1Confident53 Ų5337.3 Ų37.323%0.23220%0.201CC..Hα-helixtrans-60.3-46.2173.4175.6-95.2000111.8A46 I49 A50 L99 G289 L290 Q291 C296 V297A46-F293 HydrophobicContact CB-CD2 4.26Å; I49-F293 HydrophobicContact CB-CE2 4.06Å; I49-F293 HydrophobicContact CG2-CE2 3.81Å; I49-F293 HydrophobicContact CG2-CZ 3.99Å; A50-F293 HydrophobicContact CB-CD2 3.92Å; A50-F293 HydrophobicContact CB-CE2 4.33Å; L99-F293 HydrophobicContact CD2-CB 4.48Å; G289-F293 WeakPolarHBondContact O-CB 3.33Å; G289-F293 PolarHBondContact O-N 2.78Å; L290-F293 PolarHBondContact O-N 3.23Å; Q291-F293 VanDerWaalsContact C-N 3.32Å; Q291-F293 PolarHBondContact O-N 3.19Å; F293-C296 WeakPolarHBondContact O-CB 3.28Å; F293-C296 PolarHBondContact O-N 2.94Å; F293-V297 HydrophobicContact CE1-CG2 4.46Å; F293-V297 PolarHBondContact O-N 3.33Å
294I89.7Confident85Confident48 Ų4838.4 Ų38.425%0.24621%0.205CC..Hα-helixtrans-64-45.3178.5-67.3166.1000109.9Q259 I263 L290 Q291 C296 V297 E298Q259-I294 VanDerWaalsContact CD-CG2 3.5Å; I263-I294 HydrophobicContact CD1-CD1 4.29Å; L290-I294 HydrophobicContact CD1-CD1 4.27Å; L290-I294 HydrophobicContact CG-CD1 4.08Å; L290-I294 VanDerWaalsContact O-CG1 3.28Å; L290-I294 WeakPolarHBondContact O-CG1 3.44Å; L290-I294 PolarHBondContact O-N 3.21Å; Q291-I294 PolarHBondContact O-N 3.49Å; Q291-I294 VanDerWaalsContact O-N 3.14Å; I294-C296 PolarHBondContact O-N 3.03Å; I294-V297 WeakPolarHBondContact O-CA 2.92Å; I294-V297 WeakPolarHBondContact O-CB 3.32Å; I294-V297 PolarHBondContact O-N 3.5Å; I294-E298 HydrophobicContact CG2-CG 4.09Å; I294-E298 WeakPolarHBondContact O-CG 3.29Å; I294-E298 PolarHBondContact O-N 2.87Å
295I89.8Confident85.9Confident3 Ų333.2 Ų33.22%0.01519%0.187CC..Hα-helixtrans-55.4-40.4177.7-67.9167.6000111.2S95 Q291 D292 V297 E298 M299S95-I295 WeakPolarHBondContact OG-CG2 3.37Å; Q291-I295 HydrophobicContact CG-CD1 4.01Å; Q291-I295 VanDerWaalsContact O-CG1 3.31Å; Q291-I295 WeakPolarHBondContact O-CG1 3.5Å; Q291-I295 PolarHBondContact O-N 3.14Å; D292-I295 PolarHBondContact O-N 3.28Å; I295-V297 VanDerWaalsContact C-N 3.28Å; I295-V297 PolarHBondContact O-N 3.23Å; I295-E298 PolarHBondContact O-N 3.46Å; I295-M299 HydrophobicContact CG2-CE 4.17Å; I295-M299 HydrophobicContact CG2-CG 4.06Å; I295-M299 VanDerWaalsContact O-CG 3.31Å; I295-M299 WeakPolarHBondContact O-CG 3.39Å; I295-M299 PolarHBondContact O-N 2.91Å
296C89.9Confident86.6Confident0 Ų032.1 Ų32.10%018%0.178CC..Hα-helixtrans-57.7-40.5175.8-670000112.6A50 V54 D292 F293 I294 F300A50-C296 HydrophobicContact CB-CB 3.98Å; V54-C296 HydrophobicContact CG2-CB 4.21Å; D292-C296 PolarHBondContact O-N 3.11Å; D292-C296 PolarHBondContact O-SG 2.61Å; F293-C296 WeakPolarHBondContact O-CB 3.28Å; F293-C296 PolarHBondContact O-N 2.94Å; I294-C296 PolarHBondContact O-N 3.03Å; C296-F300 PolarHBondContact O-N 3.18Å
297V89.8Confident87Confident42 Ų4233.8 Ų33.826%0.25518%0.184SC..Hα-helixtrans-71.1-40.3176.7-179.30000111F53 F293 I294 I295 M299 F300 L301F53-V297 HydrophobicContact CD2-CG2 3.83Å; F53-V297 HydrophobicContact CE2-CG2 3.87Å; F53-V297 HydrophobicContact CG-CG2 4.21Å; F53-V297 HydrophobicContact CZ-CG2 4.28Å; F293-V297 HydrophobicContact CE1-CG2 4.46Å; F293-V297 PolarHBondContact O-N 3.33Å; I294-V297 WeakPolarHBondContact O-CA 2.92Å; I294-V297 WeakPolarHBondContact O-CB 3.32Å; I294-V297 PolarHBondContact O-N 3.5Å; I295-V297 VanDerWaalsContact C-N 3.28Å; I295-V297 PolarHBondContact O-N 3.23Å; V297-M299 VanDerWaalsContact C-N 3.34Å; V297-M299 PolarHBondContact O-N 2.98Å; V297-F300 WeakPolarHBondContact O-CB 3.18Å; V297-F300 PolarHBondContact O-N 3.35Å; V297-L301 PolarHBondContact O-N 3.41Å
298E90.6Very high87.2Confident36 Ų3640 Ų4017%0.16821%0.208CC..Hα-helixtrans-64.4-39.7177.8-62.2-157.213400112.7V255 Q259 I294 I295 F300 L301 A302V255-E298 WeakPolarHBondContact CG1-OE1 3.33Å; Q259-E298 PolarHBondContact NE2-OE1 3.02Å; Q259-E298 PolarHBondContact OE1-OE2 3.39Å; I294-E298 HydrophobicContact CG2-CG 4.09Å; I294-E298 WeakPolarHBondContact O-CG 3.29Å; I294-E298 PolarHBondContact O-N 2.87Å; I295-E298 PolarHBondContact O-N 3.46Å; E298-F300 PolarHBondContact O-N 3.05Å; E298-L301 PolarHBondContact O-N 2.94Å; E298-L301 VanDerWaalsContact O-N 3.13Å; E298-A302 WeakPolarHBondContact O-CB 3.43Å; E298-A302 PolarHBondContact O-N 2.99Å
299M91.4Very high87.3Confident1 Ų138.2 Ų38.21%0.00520%0.199CC..Hα-helixtrans-63.7-31.6179.2-71.5-45.197.700111.3T57 V88 Y91 V252 I295 V297 A302 A303T57-M299 HydrophobicContact CG2-CB 4.17Å; T57-M299 WeakPolarHBondContact CG2-O 3.46Å; V88-M299 HydrophobicContact CG1-CB 4.16Å; V88-M299 WeakPolarHBondContact CG1-O 2.84Å; Y91-M299 VanDerWaalsContact CB-SD 3.54Å; Y91-M299 HydrophobicContact CD1-SD 4.19Å; Y91-M299 HydrophobicContact CG-SD 4.21Å; V252-M299 HydrophobicContact CB-CE 4.32Å; V252-M299 HydrophobicContact CG1-CE 3.36Å; V252-M299 HydrophobicContact CG1-SD 3.92Å; V252-M299 HydrophobicContact CG2-CE 4.26Å; I295-M299 HydrophobicContact CG2-CE 4.17Å; I295-M299 HydrophobicContact CG2-CG 4.06Å; I295-M299 VanDerWaalsContact O-CG 3.31Å; I295-M299 WeakPolarHBondContact O-CG 3.39Å; I295-M299 PolarHBondContact O-N 2.91Å; V297-M299 VanDerWaalsContact C-N 3.34Å; V297-M299 PolarHBondContact O-N 2.98Å; M299-A302 PolarHBondContact O-N 3.1Å; M299-A303 WeakPolarHBondContact O-CB 3.41Å; M299-A303 PolarHBondContact O-N 2.95Å
300F90.7Very high87.1Confident42 Ų4238.1 Ų38.118%0.18420%0.197CC..Hα-helixtrans-63.5-48.5171.9174.2-108.7000112.1F53 M56 T57 I60 C296 V297 E298 A302 A303 I304F53-F300 HydrophobicContact CD1-CB 4.3Å; F53-F300 HydrophobicContact CD1-CD1 4.28Å; F53-F300 HydrophobicContact CD1-CG 4.29Å; M56-F300 HydrophobicContact CB-CD2 3.82Å; M56-F300 HydrophobicContact CB-CE2 3.68Å; M56-F300 HydrophobicContact SD-CE2 4.38Å; T57-F300 WeakPolarHBondContact OG1-CA 3.21Å; T57-F300 VanDerWaalsContact OG1-CB 3.32Å; T57-F300 WeakPolarHBondContact OG1-CB 3.37Å; T57-F300 PolarHBondContact OG1-N 2.84Å; I60-F300 HydrophobicContact CD1-CD2 4.17Å; I60-F300 HydrophobicContact CD1-CE2 3.62Å; C296-F300 PolarHBondContact O-N 3.18Å; V297-F300 WeakPolarHBondContact O-CB 3.18Å; V297-F300 PolarHBondContact O-N 3.35Å; E298-F300 PolarHBondContact O-N 3.05Å; F300-A302 VanDerWaalsContact C-N 3.3Å; F300-A302 PolarHBondContact O-N 3.02Å; F300-A303 WeakPolarHBondContact O-CB 3.35Å; F300-A303 PolarHBondContact O-N 3.3Å; F300-I304 HydrophobicContact CD1-CD1 4.42Å; F300-I304 HydrophobicContact CE1-CD1 3.85Å; F300-I304 HydrophobicContact CE2-CD1 4.25Å; F300-I304 HydrophobicContact CZ-CD1 3.77Å; F300-I304 PolarHBondContact O-N 3.48Å
301L89.8Confident86.7Confident108 Ų10837 Ų3757%0.56519%0.193SC*.Hα-helixtrans-63.9-39176-62.2178.6000111.4V297 E298 I304 A305V297-L301 PolarHBondContact O-N 3.41Å; E298-L301 PolarHBondContact O-N 2.94Å; E298-L301 VanDerWaalsContact O-N 3.13Å; L301-I304 PolarHBondContact O-N 3.39Å; L301-A305 PolarHBondContact O-N 2.92Å
302A87.9Confident85.8Confident10 Ų1037.3 Ų37.38%0.08319%0.192CC..Hα-helixtrans-64.7-38.717600000111.6V88 V252 E298 M299 F300 I304 A305 H306V88-A302 HydrophobicContact CG2-CB 4.3Å; V252-A302 HydrophobicContact CG2-CB 3.68Å; E298-A302 WeakPolarHBondContact O-CB 3.43Å; E298-A302 PolarHBondContact O-N 2.99Å; M299-A302 PolarHBondContact O-N 3.1Å; F300-A302 VanDerWaalsContact C-N 3.3Å; F300-A302 PolarHBondContact O-N 3.02Å; A302-I304 VanDerWaalsContact C-N 3.3Å; A302-I304 PolarHBondContact O-N 3.42Å; A302-A305 PolarHBondContact O-N 3.39Å; A302-H306 VanDerWaalsContact O-CB 3.29Å; A302-H306 WeakPolarHBondContact O-CB 3.48Å; A302-H306 PolarHBondContact O-CD2 2.8Å; A302-H306 PolarHBondContact O-N 3.11Å
303A88.6Confident84.9Confident2 Ų244.1 Ų44.12%0.01722%0.222CC..Hα-helixtrans-59-43.3175.200000111.5T57 I60 V88 M299 F300 H307T57-A303 HydrophobicContact CG2-CB 3.98Å; I60-A303 HydrophobicContact CB-CB 4.2Å; I60-A303 HydrophobicContact CG2-CB 3.89Å; V88-A303 HydrophobicContact CG1-CB 3.83Å; M299-A303 WeakPolarHBondContact O-CB 3.41Å; M299-A303 PolarHBondContact O-N 2.95Å; F300-A303 WeakPolarHBondContact O-CB 3.35Å; F300-A303 PolarHBondContact O-N 3.3Å; A303-H307 WeakPolarHBondContact O-CB 3.47Å; A303-H307 PolarHBondContact O-N 3.4Å
304I87.9Confident83.9Confident59 Ų5946 Ų4630%0.30324%0.24SC..Hα-helixtrans-64.3-48.3175.9-61.8170.5000110I60 F300 L301 A302 H306 H307 F308I60-I304 HydrophobicContact CD1-CG1 4.29Å; F300-I304 HydrophobicContact CD1-CD1 4.42Å; F300-I304 HydrophobicContact CE1-CD1 3.85Å; F300-I304 HydrophobicContact CE2-CD1 4.25Å; F300-I304 HydrophobicContact CZ-CD1 3.77Å; F300-I304 PolarHBondContact O-N 3.48Å; L301-I304 PolarHBondContact O-N 3.39Å; A302-I304 VanDerWaalsContact C-N 3.3Å; A302-I304 PolarHBondContact O-N 3.42Å; I304-H306 PolarHBondContact O-N 2.85Å; I304-H307 WeakPolarHBondContact O-CB 3.2Å; I304-H307 PolarHBondContact O-N 2.95Å; I304-F308 HydrophobicContact CG2-CD2 3.87Å; I304-F308 HydrophobicContact CG2-CE2 3.57Å; I304-F308 WeakPolarHBondContact O-CD2 3.29Å; I304-F308 PolarHBondContact O-N 2.9Å; I304-F308 VanDerWaalsContact O-N 3.17Å
305A86.9Confident82.7Confident39 Ų3944.6 Ų44.632%0.32223%0.231SC..Hα-helixtrans-61.1-43.117900000112.5L301 A302 F308 S309L301-A305 PolarHBondContact O-N 2.92Å; A302-A305 PolarHBondContact O-N 3.39Å; A305-F308 PolarHBondContact O-N 3.46Å; A305-S309 WeakPolarHBondContact O-CB 3.36Å; A305-S309 PolarHBondContact O-N 3.23Å
306H84.9Confident81.4Confident3 Ų348.9 Ų48.91%0.01425%0.253CS..Hα-helixtrans-64.7-39.1176.4-85.7-114.8000111.6L85 C248 A302 I304 F308 S309 F310L85-H306 HydrophobicContact CD2-CB 4.17Å; C248-H306 PolarHBondContact O-NE2 3.3Å; C248-H306 VanDerWaalsContact O-NE2 3.1Å; A302-H306 VanDerWaalsContact O-CB 3.29Å; A302-H306 WeakPolarHBondContact O-CB 3.48Å; A302-H306 PolarHBondContact O-CD2 2.8Å; A302-H306 PolarHBondContact O-N 3.11Å; I304-H306 PolarHBondContact O-N 2.85Å; H306-F308 VanDerWaalsContact C-N 3.3Å; H306-F308 PolarHBondContact O-N 3Å; H306-S309 PolarHBondContact O-N 3.05Å; H306-F310 HydrophobicContact CB-CD2 4.4Å; H306-F310 AromaticContact ND1-CD2 3.84Å; H306-F310 AromaticContact ND1-CE2 3.77Å; H306-F310 WeakPolarHBondContact O-CB 3.46Å; H306-F310 PolarHBondContact O-N 3.02Å
307H83.4Confident80.1Confident56 Ų5655.1 Ų55.126%0.25928%0.282SS..Hα-helixtrans-59-41.9175.1-174.178.6000112.1A303 I304A303-H307 WeakPolarHBondContact O-CB 3.47Å; A303-H307 PolarHBondContact O-N 3.4Å; I304-H307 WeakPolarHBondContact O-CB 3.2Å; I304-H307 PolarHBondContact O-N 2.95Å
308F82.6Confident78.3Confident144 Ų14462.9 Ų62.963%0.63232%0.316SS*.Hα-helixtrans-76.2-43.3177.3-72-65000112.9I304 A305 H306 T311I304-F308 HydrophobicContact CG2-CD2 3.87Å; I304-F308 HydrophobicContact CG2-CE2 3.57Å; I304-F308 WeakPolarHBondContact O-CD2 3.29Å; I304-F308 PolarHBondContact O-N 2.9Å; I304-F308 VanDerWaalsContact O-N 3.17Å; A305-F308 PolarHBondContact O-N 3.46Å; H306-F308 VanDerWaalsContact C-N 3.3Å; H306-F308 PolarHBondContact O-N 3Å; F308-T311 PolarHBondContact O-OG1 3.3Å
309S80.8Confident76.5Confident27 Ų2762.5 Ų62.519%0.18932%0.319CS..Hα-helixtrans-70.7-38.8-175.5-1640000112.7K245 A305 H306K245-S309 WeakPolarHBondContact CA-OG 3.36Å; K245-S309 VanDerWaalsContact CE-O 3.25Å; K245-S309 WeakPolarHBondContact CE-O 3.48Å; K245-S309 WeakPolarHBondContact CG-OG 3.3Å; A305-S309 WeakPolarHBondContact O-CB 3.36Å; A305-S309 PolarHBondContact O-N 3.23Å; H306-S309 PolarHBondContact O-N 3.05Å
310F76.6Confident74.9Confident5 Ų570.8 Ų70.82%0.02236%0.358CS..THydrogen-bonded Turntrans-105.258.1177.4-62.7-80.2000111.2H68 I81 I84 L85 K245 V249 H306H68-F310 PolarHBondContact CE1-O 3.14Å; H68-F310 PolarHBondContact NE2-O 3.33Å; I81-F310 HydrophobicContact CG1-CD1 4.2Å; I81-F310 HydrophobicContact CG2-CB 4.08Å; I81-F310 HydrophobicContact CG2-CD1 3.96Å; I81-F310 HydrophobicContact CG2-CG 4.28Å; I84-F310 HydrophobicContact CG2-CE2 4.06Å; I84-F310 HydrophobicContact CG2-CZ 3.95Å; L85-F310 HydrophobicContact CD2-CB 4.46Å; K245-F310 HydrophobicContact CB-CE1 4.03Å; K245-F310 HydrophobicContact CB-CZ 3.84Å; K245-F310 HydrophobicContact CD-CD1 4.26Å; K245-F310 HydrophobicContact CD-CE1 3.95Å; K245-F310 HydrophobicContact CG-CE1 4.1Å; K245-F310 HydrophobicContact CG-CZ 4.26Å; V249-F310 HydrophobicContact CG2-CE2 4.28Å; V249-F310 HydrophobicContact CG2-CZ 4.1Å; H306-F310 HydrophobicContact CB-CD2 4.4Å; H306-F310 AromaticContact ND1-CD2 3.84Å; H306-F310 AromaticContact ND1-CE2 3.77Å; H306-F310 WeakPolarHBondContact O-CB 3.46Å; H306-F310 PolarHBondContact O-N 3.02Å
311T76.6Confident73.1Confident49 Ų4976.6 Ų76.630%0.30139%0.385SS..  trans-65.1136.7179-74.20000111.9F308 K313 P314F308-T311 PolarHBondContact O-OG1 3.3Å; T311-K313 HydrophobicContact CG2-CB 3.53Å; T311-K313 HydrophobicContact CG2-CD 3.74Å; T311-K313 HydrophobicContact CG2-CG 3.43Å; T311-K313 VanDerWaalsContact CG2-CG 3.43Å; T311-P314 WeakPolarHBondContact O-CD 3.44Å
312Y67.3Low71.8Confident54 Ų5474.4 Ų74.421%0.21238%0.376CS..SBendtrans-83.3-13.7178.564.4-88.7000114.4Q67 H71 Y315 I316Q67-Y312 HydrophobicContact CB-CD1 3.49Å; Q67-Y312 VanDerWaalsContact CB-CD1 3.49Å; Q67-Y312 HydrophobicContact CB-CD2 4.05Å; Q67-Y312 HydrophobicContact CB-CE1 3.9Å; Q67-Y312 HydrophobicContact CB-CE2 4.4Å; Q67-Y312 HydrophobicContact CB-CG 3.58Å; Q67-Y312 HydrophobicContact CG-CD1 3.95Å; Q67-Y312 HydrophobicContact CG-CE1 3.81Å; Q67-Y312 HydrophobicContact CG-CE2 4.48Å; Q67-Y312 HydrophobicContact CG-CG 4.36Å; H71-Y312 AromaticContact ND1-CD2 3.88Å; Y312-Y315 WeakPolarHBondContact O-CB 3.39Å; Y312-Y315 PolarHBondContact O-N 3.36Å; Y312-I316 HydrophobicContact CD2-CD1 4.14Å; Y312-I316 HydrophobicContact CD2-CG1 4.23Å; Y312-I316 HydrophobicContact CE2-CD1 4Å
313K69.6Low70.9Confident145 Ų14576.4 Ų76.463%0.6339%0.39SS*.G310 helixtrans-48.5-41.5-178.3-64178-174.9-178.50115.8T311 Y315 I316T311-K313 HydrophobicContact CG2-CB 3.53Å; T311-K313 HydrophobicContact CG2-CD 3.74Å; T311-K313 HydrophobicContact CG2-CG 3.43Å; T311-K313 VanDerWaalsContact CG2-CG 3.43Å; K313-Y315 PolarHBondContact O-N 2.87Å; K313-I316 HydrophobicContact CB-CD1 4.43Å; K313-I316 WeakPolarHBondContact O-CG1 3.22Å; K313-I316 PolarHBondContact O-N 3.25Å
314P66.5Low69.8Low94 Ų9477.9 Ų77.961%0.6140%0.4SS*.G310 helixtrans-68.5-13.4178.926.3-34000113.8T311T311-P314 WeakPolarHBondContact O-CD 3.44Å
315Y65.3Low68.8Low18 Ų1881.2 Ų81.27%0.07141%0.412CS..G310 helixtrans-98.44.8-179.5-55.6-70.4000113.4T73 Q74 L77 Q78 I81 Y312 K313 Q317T73-Y315 VanDerWaalsContact CG2-O 3.29Å; T73-Y315 WeakPolarHBondContact CG2-O 3.47Å; T73-Y315 PolarHBondContact OG1-O 3.44Å; T73-Y315 VanDerWaalsContact OG1-O 3.09Å; Q74-Y315 HydrophobicContact CB-CD1 4.25Å; Q74-Y315 HydrophobicContact CB-CE1 4.31Å; L77-Y315 HydrophobicContact CB-CE1 4.31Å; L77-Y315 HydrophobicContact CD1-CE1 4.35Å; Q78-Y315 HydrophobicContact CG-CD1 4.04Å; Q78-Y315 HydrophobicContact CG-CD2 4.3Å; Q78-Y315 HydrophobicContact CG-CE1 4.09Å; Q78-Y315 HydrophobicContact CG-CE2 4.35Å; Q78-Y315 HydrophobicContact CG-CG 4.16Å; I81-Y315 HydrophobicContact CD1-CE2 4.16Å; I81-Y315 WeakPolarHBondContact CD1-OH 3.3Å; Y312-Y315 WeakPolarHBondContact O-CB 3.39Å; Y312-Y315 PolarHBondContact O-N 3.36Å; K313-Y315 PolarHBondContact O-N 2.87Å; Y315-Q317 PolarHBondContact O-N 3.29Å
316I63.1Low68.2Low93 Ų9383.9 Ų83.948%0.47742%0.421SS..  trans-77.175.4174.7-52.6172.5000108.1Y312 K313Y312-I316 HydrophobicContact CD2-CD1 4.14Å; Y312-I316 HydrophobicContact CD2-CG1 4.23Å; Y312-I316 HydrophobicContact CE2-CD1 4Å; K313-I316 HydrophobicContact CB-CD1 4.43Å; K313-I316 WeakPolarHBondContact O-CG1 3.22Å; K313-I316 PolarHBondContact O-N 3.25Å
317Q61.5Low67.6Low131 Ų13183.8 Ų83.861%0.61242%0.421SS*.SBendtrans-117.9153.6161.8-90.4164-9.600107.5T73 Y315 A319T73-Q317 HydrophobicContact CG2-CB 4.17Å; T73-Q317 VanDerWaalsContact CG2-O 3.23Å; T73-Q317 WeakPolarHBondContact CG2-O 3.42Å; Y315-Q317 PolarHBondContact O-N 3.29Å; Q317-A319 VanDerWaalsContact C-N 3.31Å; Q317-A319 PolarHBondContact O-N 3.21Å
318E51.3Low67.2Low204 Ų20485.3 Ų85.395%0.95343%0.427SS*.  trans-60.196.5177.2-71.5-174.8158.900108.7
319A54.7Low66.9Low29 Ų2983.1 Ų83.124%0.2442%0.42CS..  trans-68.9133.6178.700000108.6T73 Q317T73-A319 HydrophobicContact CG2-CB 3.64Å; Q317-A319 VanDerWaalsContact C-N 3.31Å; Q317-A319 PolarHBondContact O-N 3.21Å
320E56.3Low66.6Low175 Ų17583.1 Ų83.182%0.81842%0.421SS*.  trans-52.3143.1163.6-78.3-179.1153.200109.7R9 V322R9-E320 PolarHBondContact NH2-O 2.88Å; E320-V322 VanDerWaalsContact C-N 3.29Å; E320-V322 PolarHBondContact O-N 3.46Å
321E53.8Low66.4Low164 Ų16483.2 Ų83.277%0.76642%0.422SS*.  trans-69.882.9-175.4-69.2-170.2174.600111.1
322V61.5Low66.3Low61 Ų6187.6 Ų87.637%0.3743%0.433SS..  trans-80.1137.6167.1-171.30000109.1W8 E320 D326W8-V322 PolarHBondContact NE1-O 3.11Å; E320-V322 VanDerWaalsContact C-N 3.29Å; E320-V322 PolarHBondContact O-N 3.46Å; V322-D326 HydrophobicContact CG1-CB 4.2Å
323S69.3Low66.9Low52 Ų5287.9 Ų87.936%0.36444%0.438SS..  trans-56.8144.3176.5-178.10000112F325 D326 S327S323-F325 VanDerWaalsContact C-N 3.3Å; S323-F325 PolarHBondContact O-N 3.34Å; S323-D326 WeakPolarHBondContact CB-OD2 3.23Å; S323-D326 PolarHBondContact O-N 3.37Å; S323-S327 PolarHBondContact O-N 3.05Å; S323-S327 PolarHBondContact O-OG 2.81Å
324C65.7Low67.5Low34 Ų3484.3 Ų84.323%0.2343%0.425CS..Hα-helixtrans-54.7-45.4178.9-177.20000112.5W8 S327 F328W8-C324 HydrophobicContact CB-CB 3.96Å; W8-C324 HydrophobicContact CD2-CB 3.37Å; W8-C324 HydrophobicContact CE3-CB 3.48Å; W8-C324 VanDerWaalsContact CE3-CB 3.48Å; W8-C324 HydrophobicContact CG-CB 3.61Å; W8-C324 HydrophobicContact CZ2-CB 4.45Å; W8-C324 HydrophobicContact CZ3-CB 4.08Å; C324-S327 PolarHBondContact O-N 3.33Å; C324-F328 WeakPolarHBondContact O-CB 3.36Å; C324-F328 PolarHBondContact O-N 2.92Å
325F67.8Low68.3Low128 Ų12883.1 Ų83.156%0.56142%0.419SS*.Hα-helixtrans-71.4-37.7-174.4-166.5-100000111.1S323 F328 M329S323-F325 VanDerWaalsContact C-N 3.3Å; S323-F325 PolarHBondContact O-N 3.34Å; F325-F328 PolarHBondContact O-N 3.36Å; F325-M329 HydrophobicContact CD1-CG 4.06Å; F325-M329 HydrophobicContact CE1-CE 3.9Å; F325-M329 HydrophobicContact CE1-CG 3.72Å; F325-M329 HydrophobicContact CE2-CE 4.28Å; F325-M329 HydrophobicContact CZ-CE 3.48Å; F325-M329 VanDerWaalsContact CZ-CE 3.48Å; F325-M329 HydrophobicContact CZ-CG 4.11Å; F325-M329 WeakPolarHBondContact O-CB 3.42Å; F325-M329 PolarHBondContact O-N 3.18Å
326D73Confident69.2Low95 Ų9584.7 Ų84.751%0.50843%0.429SS..Hα-helixtrans-68.3-39.7176.7-62.9-28.1000111.1V322 S323 F328 M329 A330V322-D326 HydrophobicContact CG1-CB 4.2Å; S323-D326 WeakPolarHBondContact CB-OD2 3.23Å; S323-D326 PolarHBondContact O-N 3.37Å; D326-F328 PolarHBondContact O-N 3.48Å; D326-M329 PolarHBondContact O-N 3.02Å; D326-A330 WeakPolarHBondContact O-CB 3.26Å; D326-A330 PolarHBondContact O-N 3.18Å
327S74Confident70.1Confident1 Ų180.6 Ų80.61%0.00741%0.408CS..Hα-helixtrans-64.2-40.1174.4-57.30000111.8S323 C324 M331S323-S327 PolarHBondContact O-N 3.05Å; S323-S327 PolarHBondContact O-OG 2.81Å; C324-S327 PolarHBondContact O-N 3.33Å; S327-M331 PolarHBondContact O-N 3.36Å
328F73.4Confident71.2Confident88 Ų8883 Ų8339%0.38641%0.411SS..Hα-helixtrans-71.2-39.7177.4-175.3-95.7000112.6C324 F325 D326 M331 W332C324-F328 WeakPolarHBondContact O-CB 3.36Å; C324-F328 PolarHBondContact O-N 2.92Å; F325-F328 PolarHBondContact O-N 3.36Å; D326-F328 PolarHBondContact O-N 3.48Å; F328-M331 HydrophobicContact CD2-CE 3.8Å; F328-M331 HydrophobicContact CE2-CE 3.63Å; F328-M331 HydrophobicContact CZ-CE 4.26Å; F328-M331 WeakPolarHBondContact O-CB 3.46Å; F328-M331 PolarHBondContact O-N 2.86Å; F328-W332 AromaticContact CE1-CD1 3.97Å; F328-W332 AromaticContact CZ-CD1 3.95Å; F328-W332 AromaticContact CZ-NE1 3.63Å; F328-W332 PolarHBondContact O-N 3.48Å
329M76.9Confident72.8Confident99 Ų9975.7 Ų75.749%0.48839%0.386SS..Hα-helixtrans-70.5-41.2175.5-81.4-63.6-176.600111.7F325 D326 M331 W332 D333F325-M329 HydrophobicContact CD1-CG 4.06Å; F325-M329 HydrophobicContact CE1-CE 3.9Å; F325-M329 HydrophobicContact CE1-CG 3.72Å; F325-M329 HydrophobicContact CE2-CE 4.28Å; F325-M329 HydrophobicContact CZ-CE 3.48Å; F325-M329 VanDerWaalsContact CZ-CE 3.48Å; F325-M329 HydrophobicContact CZ-CG 4.11Å; F325-M329 WeakPolarHBondContact O-CB 3.42Å; F325-M329 PolarHBondContact O-N 3.18Å; D326-M329 PolarHBondContact O-N 3.02Å; M329-M331 PolarHBondContact O-N 3.38Å; M329-W332 CarbonylContact O-C 3.43Å; M329-W332 PolarHBondContact O-N 3.44Å; M329-W332 VanDerWaalsContact O-N 3.07Å; M329-D333 PolarHBondContact O-N 3.42Å
330A74.3Confident74.2Confident26 Ų2675.6 Ų75.622%0.21538%0.381CS..Hα-helixtrans-62.5-24.1175.300000112.8K79 D326K79-A330 WeakPolarHBondContact CD-O 3.4Å; K79-A330 WeakPolarHBondContact CE-O 3.34Å; D326-A330 WeakPolarHBondContact O-CB 3.26Å; D326-A330 PolarHBondContact O-N 3.18Å
331M72.5Confident75.6Confident7 Ų769.8 Ų69.83%0.03436%0.355CS..Hα-helixtrans-69.5-41172.5179.7-171.577.200112.4I65 I82 S327 F328 M329I65-M331 HydrophobicContact CG2-SD 4.45Å; I82-M331 HydrophobicContact CB-CG 4.39Å; I82-M331 HydrophobicContact CD1-CG 4.39Å; I82-M331 HydrophobicContact CG2-CG 3.6Å; I82-M331 HydrophobicContact CG2-SD 3.5Å; I82-M331 VanDerWaalsContact CG2-SD 3.5Å; S327-M331 PolarHBondContact O-N 3.36Å; F328-M331 HydrophobicContact CD2-CE 3.8Å; F328-M331 HydrophobicContact CE2-CE 3.63Å; F328-M331 HydrophobicContact CZ-CE 4.26Å; F328-M331 WeakPolarHBondContact O-CB 3.46Å; F328-M331 PolarHBondContact O-N 2.86Å; M329-M331 PolarHBondContact O-N 3.38Å
332W74.8Confident77Confident141 Ų14165.4 Ų65.453%0.53434%0.343SS..Hα-helixtrans-89.5-3.8179.8-7995.2000113.9F328 M329 I334F328-W332 AromaticContact CE1-CD1 3.97Å; F328-W332 AromaticContact CZ-CD1 3.95Å; F328-W332 AromaticContact CZ-NE1 3.63Å; F328-W332 PolarHBondContact O-N 3.48Å; M329-W332 CarbonylContact O-C 3.43Å; M329-W332 PolarHBondContact O-N 3.44Å; M329-W332 VanDerWaalsContact O-N 3.07Å; W332-I334 WeakPolarHBondContact O-CG1 3.32Å; W332-I334 PolarHBondContact O-N 3.12Å
333D80.8Confident78Confident61 Ų6164.9 Ų64.933%0.32634%0.336SS..  trans-62.1123.8175-179.420.2000109.9R83 M329 S335R83-D333 PolarHBondContact NH2-O 2.92Å; M329-D333 PolarHBondContact O-N 3.42Å; D333-S335 WeakPolarHBondContact OD1-CB 3.49Å; D333-S335 PolarHBondContact OD1-N 3.3Å; D333-S335 PolarHBondContact OD1-OG 3.28Å
334I82.2Confident78.5Confident70 Ų7064 Ų6436%0.35933%0.327SS..  trans-109.211.4179.4-61.8167.4000109.8W332 D336 V337 R338W332-I334 WeakPolarHBondContact O-CG1 3.32Å; W332-I334 PolarHBondContact O-N 3.12Å; I334-D336 PolarHBondContact O-N 3.13Å; I334-V337 HydrophobicContact CG2-CB 3.76Å; I334-V337 HydrophobicContact CG2-CG1 4.47Å; I334-V337 HydrophobicContact CG2-CG2 4Å; I334-V337 PolarHBondContact O-N 2.98Å; I334-V337 VanDerWaalsContact O-N 3.11Å; I334-R338 PolarHBondContact O-N 2.96Å
335S82.8Confident79.3Confident68 Ų6867.1 Ų67.148%0.47634%0.344SS..Hα-helixtrans-61.1-33.2-175.7-60.30000112.8D333 R338 A339D333-S335 WeakPolarHBondContact OD1-CB 3.49Å; D333-S335 PolarHBondContact OD1-N 3.3Å; D333-S335 PolarHBondContact OD1-OG 3.28Å; S335-R338 PolarHBondContact O-N 3.16Å; S335-A339 VanDerWaalsContact O-CB 3.29Å; S335-A339 WeakPolarHBondContact O-CB 3.4Å; S335-A339 PolarHBondContact O-N 2.93Å
336D82.8Confident79.9Confident52 Ų5266.5 Ų66.528%0.27834%0.338SS..Hα-helixtrans-59-48.4172.760.7-34.6000111.8R83 I334 R338 A339 D340R83-D336 IonicContact CZ-OD1 3.6Å; R83-D336 IonicContact CZ-OD2 3.43Å; R83-D336 IonicContact NH1-OD1 2.82Å; R83-D336 PolarHBondContact NH1-OD1 2.82Å; R83-D336 IonicContact NH1-OD2 2.77Å; R83-D336 PolarHBondContact NH1-OD2 3.44Å; R83-D336 VanDerWaalsContact NH2-CG 3.32Å; R83-D336 IonicContact NH2-OD1 3.34Å; R83-D336 PolarHBondContact NH2-OD1 3.45Å; R83-D336 IonicContact NH2-OD2 3.14Å; R83-D336 PolarHBondContact NH2-OD2 3.38Å; R83-D336 VanDerWaalsContact NH2-OD2 3.16Å; I334-D336 PolarHBondContact O-N 3.13Å; D336-R338 PolarHBondContact O-N 2.92Å; D336-A339 PolarHBondContact O-N 3.2Å; D336-D340 PolarHBondContact O-N 3.06Å
337V83.3Confident80.1Confident6 Ų663.6 Ų63.64%0.03632%0.322CS..Hα-helixtrans-67-40.9-179.8-171.70000110.4Y118 Y121 I334 D340 I341Y118-V337 HydrophobicContact CE2-CG1 4.48Å; Y118-V337 HydrophobicContact CE2-CG2 3.91Å; Y121-V337 HydrophobicContact CD1-CG1 4.3Å; Y121-V337 HydrophobicContact CD1-CG2 4.31Å; Y121-V337 HydrophobicContact CE1-CB 4.07Å; Y121-V337 HydrophobicContact CE1-CG1 3.84Å; Y121-V337 HydrophobicContact CE1-CG2 3.5Å; Y121-V337 VanDerWaalsContact CE1-CG2 3.5Å; I334-V337 HydrophobicContact CG2-CB 3.76Å; I334-V337 HydrophobicContact CG2-CG1 4.47Å; I334-V337 HydrophobicContact CG2-CG2 4Å; I334-V337 PolarHBondContact O-N 2.98Å; I334-V337 VanDerWaalsContact O-N 3.11Å; V337-D340 PolarHBondContact O-N 3.5Å; V337-I341 HydrophobicContact CG1-CD1 3.93Å; V337-I341 HydrophobicContact CG1-CG1 4.48Å; V337-I341 WeakPolarHBondContact O-CB 3.43Å; V337-I341 VanDerWaalsContact O-CG1 3.23Å; V337-I341 WeakPolarHBondContact O-CG1 3.3Å; V337-I341 PolarHBondContact O-N 3.31Å
338R83.6Confident80.1Confident182 Ų18267.4 Ų67.469%0.68735%0.345SS*.Hα-helixtrans-64.6-41.2176.3-71.7-177.6-179-173.11.5111.9I334 S335 D336 I341 S342I334-R338 PolarHBondContact O-N 2.96Å; S335-R338 PolarHBondContact O-N 3.16Å; D336-R338 PolarHBondContact O-N 2.92Å; R338-I341 PolarHBondContact O-N 3.37Å; R338-S342 VanDerWaalsContact O-CB 3.28Å; R338-S342 WeakPolarHBondContact O-CB 3.43Å; R338-S342 PolarHBondContact O-N 3.44Å; R338-S342 PolarHBondContact O-OG 3.32Å
339A85.1Confident80.1Confident51 Ų5164.9 Ų64.942%0.42135%0.345SS..Hα-helixtrans-60.9-48.9176.700000110.4S335 D336 I341 S342 E343S335-A339 VanDerWaalsContact O-CB 3.29Å; S335-A339 WeakPolarHBondContact O-CB 3.4Å; S335-A339 PolarHBondContact O-N 2.93Å; D336-A339 PolarHBondContact O-N 3.2Å; A339-I341 PolarHBondContact O-N 2.91Å; A339-S342 PolarHBondContact O-N 3.09Å; A339-S342 PolarHBondContact O-OG 2.75Å; A339-E343 WeakPolarHBondContact O-CB 2.89Å; A339-E343 PolarHBondContact O-N 2.93Å
340D84.9Confident79.9Confident27 Ų2764.6 Ų64.614%0.14434%0.338CS..Hα-helixtrans-60.5-44.9177.6-81.5-12.8000112.6Y121 K171 L175 D336 V337 E343 Q344Y121-D340 PolarHBondContact OH-OD2 3.32Å; K171-D340 VanDerWaalsContact CE-CG 3.44Å; K171-D340 WeakPolarHBondContact CE-OD2 2.97Å; K171-D340 IonicContact NZ-OD1 2.76Å; K171-D340 PolarHBondContact NZ-OD1 3Å; K171-D340 IonicContact NZ-OD2 3.91Å; K171-D340 PolarHBondContact NZ-OD2 3.44Å; L175-D340 HydrophobicContact CD2-CB 4.07Å; D336-D340 PolarHBondContact O-N 3.06Å; V337-D340 PolarHBondContact O-N 3.5Å; D340-E343 PolarHBondContact O-N 3.07Å; D340-Q344 PolarHBondContact O-N 3.33Å
341I84.4Confident79.8Confident53 Ų5368.9 Ų68.927%0.27236%0.362SS..Hα-helixtrans-62.3-45.8175.7-68.6170.1000110.4L175 V179 V337 R338 A339 E343 Q344 V345L175-I341 HydrophobicContact CD1-CG1 3.8Å; L175-I341 HydrophobicContact CD2-CG1 4.47Å; L175-I341 HydrophobicContact CG-CG1 4.38Å; V179-I341 HydrophobicContact CG2-CD1 4.26Å; V179-I341 HydrophobicContact CG2-CG1 4.14Å; V179-I341 HydrophobicContact CG2-CG2 4.39Å; V337-I341 HydrophobicContact CG1-CD1 3.93Å; V337-I341 HydrophobicContact CG1-CG1 4.48Å; V337-I341 WeakPolarHBondContact O-CB 3.43Å; V337-I341 VanDerWaalsContact O-CG1 3.23Å; V337-I341 WeakPolarHBondContact O-CG1 3.3Å; V337-I341 PolarHBondContact O-N 3.31Å; R338-I341 PolarHBondContact O-N 3.37Å; A339-I341 PolarHBondContact O-N 2.91Å; I341-E343 VanDerWaalsContact C-N 3.26Å; I341-E343 PolarHBondContact O-N 3.13Å; I341-Q344 PolarHBondContact O-N 3.36Å; I341-V345 HydrophobicContact CG2-CG2 4.41Å; I341-V345 WeakPolarHBondContact O-CG2 3.39Å; I341-V345 PolarHBondContact O-N 3.45Å
342S84Confident79.8Confident71 Ų7174.5 Ų74.550%0.49740%0.396SS..Hα-helixtrans-62.5-36.8-179.978.30000111.8R338 A339 V345 R346R338-S342 VanDerWaalsContact O-CB 3.28Å; R338-S342 WeakPolarHBondContact O-CB 3.43Å; R338-S342 PolarHBondContact O-N 3.44Å; R338-S342 PolarHBondContact O-OG 3.32Å; A339-S342 PolarHBondContact O-N 3.09Å; A339-S342 PolarHBondContact O-OG 2.75Å; S342-V345 PolarHBondContact O-N 3.28Å; S342-R346 VanDerWaalsContact O-CB 3.26Å; S342-R346 WeakPolarHBondContact O-CB 3.49Å; S342-R346 PolarHBondContact O-N 3.26Å
343E82.9Confident79.6Confident50 Ų5074.4 Ų74.423%0.23440%0.403CS..Hα-helixtrans-68.2-43.1176.1176.4155.6-115.500111.6A339 D340 I341 V345 R346 N347 Y360A339-E343 WeakPolarHBondContact O-CB 2.89Å; A339-E343 PolarHBondContact O-N 2.93Å; D340-E343 PolarHBondContact O-N 3.07Å; I341-E343 VanDerWaalsContact C-N 3.26Å; I341-E343 PolarHBondContact O-N 3.13Å; E343-V345 PolarHBondContact O-N 3.36Å; E343-R346 WeakPolarHBondContact O-CB 3.35Å; E343-R346 PolarHBondContact O-N 2.88Å; E343-R346 IonicContact OE1-NH2 3.16Å; E343-R346 PolarHBondContact OE1-NH2 3.03Å; E343-N347 WeakPolarHBondContact O-CB 3.2Å; E343-N347 VanDerWaalsContact O-CG 3.23Å; E343-N347 PolarHBondContact O-N 3.17Å; E343-Y360 PolarHBondContact OE1-OH 3.48Å; E343-Y360 PolarHBondContact OE2-OH 3.34Å
344Q80.5Confident78.5Confident35 Ų3574.7 Ų74.716%0.16442%0.421CS..Hα-helixtrans-58.8-48.6173.9176.8174.66.100111.4L172 L175 D340 I341 R346 N347 V348L172-Q344 HydrophobicContact CD2-CB 3.82Å; L172-Q344 HydrophobicContact CD2-CG 3.74Å; L175-Q344 HydrophobicContact CD2-CB 4.12Å; D340-Q344 PolarHBondContact O-N 3.33Å; I341-Q344 PolarHBondContact O-N 3.36Å; Q344-R346 VanDerWaalsContact C-N 3.29Å; Q344-R346 PolarHBondContact O-N 2.88Å; Q344-N347 PolarHBondContact O-N 3.41Å; Q344-N347 VanDerWaalsContact O-N 3.17Å; Q344-V348 HydrophobicContact CG-CG2 4.34Å; Q344-V348 WeakPolarHBondContact O-CG2 3.49Å; Q344-V348 PolarHBondContact O-N 3.1Å
345V81.8Confident77.3Confident99 Ų9979.5 Ų79.560%0.644%0.435SS*.Hα-helixtrans-60.2-42.6178.7172.20000110.5I341 S342 E343 N347 G349I341-V345 HydrophobicContact CG2-CG2 4.41Å; I341-V345 WeakPolarHBondContact O-CG2 3.39Å; I341-V345 PolarHBondContact O-N 3.45Å; S342-V345 PolarHBondContact O-N 3.28Å; E343-V345 PolarHBondContact O-N 3.36Å; V345-N347 PolarHBondContact O-N 3.16Å; V345-G349 PolarHBondContact O-N 3.26Å
346R80.9Confident75.8Confident115 Ų11582.2 Ų82.243%0.43445%0.451SS..Hα-helixtrans-62.5-42175.6-177.717968.3141.7-0.3112.2S342 E343 Q344 R350S342-R346 VanDerWaalsContact O-CB 3.26Å; S342-R346 WeakPolarHBondContact O-CB 3.49Å; S342-R346 PolarHBondContact O-N 3.26Å; E343-R346 WeakPolarHBondContact O-CB 3.35Å; E343-R346 PolarHBondContact O-N 2.88Å; E343-R346 IonicContact OE1-NH2 3.16Å; E343-R346 PolarHBondContact OE1-NH2 3.03Å; Q344-R346 VanDerWaalsContact C-N 3.29Å; Q344-R346 PolarHBondContact O-N 2.88Å; R346-R350 WeakPolarHBondContact O-CB 3.26Å; R346-R350 VanDerWaalsContact O-CG 3.31Å; R346-R350 WeakPolarHBondContact O-CG 3.41Å; R346-R350 PolarHBondContact O-N 2.87Å
347N75.6Confident74.2Confident33 Ų3387 Ų8718%0.17647%0.469CS..Hα-helixtrans-70.2-45.3-179.1-74.3-13.8000111.6E343 Q344 V345 G349 R350 T351 Y360E343-N347 WeakPolarHBondContact O-CB 3.2Å; E343-N347 VanDerWaalsContact O-CG 3.23Å; E343-N347 PolarHBondContact O-N 3.17Å; Q344-N347 PolarHBondContact O-N 3.41Å; Q344-N347 VanDerWaalsContact O-N 3.17Å; V345-N347 PolarHBondContact O-N 3.16Å; N347-G349 VanDerWaalsContact C-N 3.34Å; N347-R350 PolarHBondContact O-N 3.19Å; N347-T351 PolarHBondContact O-N 2.98Å; N347-T351 PolarHBondContact O-OG1 3.33Å; N347-T351 VanDerWaalsContact O-OG1 3.1Å; N347-Y360 PolarHBondContact ND2-OH 3.4Å
348V74.9Confident72.3Confident81 Ų8195.4 Ų95.449%0.49151%0.505SS..Hα-helixtrans-61.6-44.9173.5174.30000110.4Q344 R350 T351 V352Q344-V348 HydrophobicContact CG-CG2 4.34Å; Q344-V348 WeakPolarHBondContact O-CG2 3.49Å; Q344-V348 PolarHBondContact O-N 3.1Å; V348-R350 VanDerWaalsContact C-N 3.33Å; V348-R350 PolarHBondContact O-N 3.15Å; V348-T351 PolarHBondContact O-N 2.88Å; V348-V352 HydrophobicContact CG1-CG2 4.33Å; V348-V352 WeakPolarHBondContact O-CG2 3.44Å; V348-V352 PolarHBondContact O-N 3.48Å
349G73.6Confident70.1Confident36 Ų3691.8 Ų91.837%0.37151%0.507SS..Hα-helixtrans-57.1-43.8175.300000112.4V345 N347 V352 M353V345-G349 PolarHBondContact O-N 3.26Å; N347-G349 VanDerWaalsContact C-N 3.34Å; G349-V352 PolarHBondContact O-N 3.15Å; G349-M353 WeakPolarHBondContact O-CB 3.49Å; G349-M353 PolarHBondContact O-N 3.07Å
350R73.3Confident68.4Low92 Ų9291.8 Ų91.835%0.34750%0.497SS..Hα-helixtrans-65.4-39.7176.1-77.2174.9-179.8156.5-3.8113.3R346 N347 V348 M353 G354 R355R346-R350 WeakPolarHBondContact O-CB 3.26Å; R346-R350 VanDerWaalsContact O-CG 3.31Å; R346-R350 WeakPolarHBondContact O-CG 3.41Å; R346-R350 PolarHBondContact O-N 2.87Å; N347-R350 PolarHBondContact O-N 3.19Å; V348-R350 VanDerWaalsContact C-N 3.33Å; V348-R350 PolarHBondContact O-N 3.15Å; R350-M353 CarbonylContact O-C 3.5Å; R350-M353 PolarHBondContact O-N 3.44Å; R350-G354 PolarHBondContact O-N 2.84Å; R350-G354 VanDerWaalsContact O-N 3.14Å; R350-R355 PolarHBondContact O-N 3.13Å; R350-R355 VanDerWaalsContact O-N 3.17Å
351T72.1Confident66.4Low116 Ų116100.2 Ų100.271%0.71253%0.533SS*.Hα-helixtrans-65.1-43.4176.4-57.80000111.4N347 V348 M353 G354N347-T351 PolarHBondContact O-N 2.98Å; N347-T351 PolarHBondContact O-OG1 3.33Å; N347-T351 VanDerWaalsContact O-OG1 3.1Å; V348-T351 PolarHBondContact O-N 2.88Å; T351-M353 VanDerWaalsContact C-N 3.33Å; T351-G354 PolarHBondContact O-N 3.39Å
352V71.6Confident64Low125 Ų125101.4 Ų101.476%0.75856%0.558SS**Hα-helixtrans-67.7-35.3176.8174.10000111.4V348 G349 G354V348-V352 HydrophobicContact CG1-CG2 4.33Å; V348-V352 WeakPolarHBondContact O-CG2 3.44Å; V348-V352 PolarHBondContact O-N 3.48Å; G349-V352 PolarHBondContact O-N 3.15Å; V352-G354 VanDerWaalsContact C-N 3.3Å; V352-G354 PolarHBondContact O-N 3.29Å
353M70.9Confident61.7Low139 Ų139107.6 Ų107.669%0.68558%0.579SS**THydrogen-bonded Turntrans-86.97.3-178.8-152.6171.1-176.300113.7G349 R350 T351 R355G349-M353 WeakPolarHBondContact O-CB 3.49Å; G349-M353 PolarHBondContact O-N 3.07Å; R350-M353 CarbonylContact O-C 3.5Å; R350-M353 PolarHBondContact O-N 3.44Å; T351-M353 VanDerWaalsContact C-N 3.33Å; M353-R355 VanDerWaalsContact C-N 3.29Å; M353-R355 PolarHBondContact O-N 3.04Å
354G57.6Low59.3Low68 Ų68109.5 Ų109.570%0.70160%0.604SS**THydrogen-bonded Turntrans6618.8172.100000116R350 T351 V352R350-G354 PolarHBondContact O-N 2.84Å; R350-G354 VanDerWaalsContact O-N 3.14Å; T351-G354 PolarHBondContact O-N 3.39Å; V352-G354 VanDerWaalsContact C-N 3.3Å; V352-G354 PolarHBondContact O-N 3.29Å
355R56.6Low57.4Low171 Ų171116.4 Ų116.465%0.64564%0.636SS**PPolyproline II helixtrans-88.5138179.6-70.9-171.6179.6-171.50.9111.3R350 M353R350-R355 PolarHBondContact O-N 3.13Å; R350-R355 VanDerWaalsContact O-N 3.17Å; M353-R355 VanDerWaalsContact C-N 3.29Å; M353-R355 PolarHBondContact O-N 3.04Å
356P52.2Low54.9Low125 Ų125118.7 Ų118.781%0.81265%0.645SS**PPolyproline II helixtrans-63.6145.4-177.624-31.4000112.3
357K48.5Very low52.7Low152 Ų152120.3 Ų120.366%0.66166%0.662SS**PPolyproline II helixtrans-68.4127.9-176.9-153.4-177.3-176.5-1650109.4
358K43.4Very low51Low182 Ų182121.4 Ų121.479%0.79168%0.681SS**PPolyproline II helixtrans-78.9127165-144.3179.3-175.6-171.50106.7
359S37.8Very low48.9Very low106 Ų106126.4 Ų126.474%0.74170%0.699SS**PPolyproline II helixtrans-53.5138.2173.4-166.20000109.8
360Y48.8Very low47.2Very low52 Ų52136.3 Ų136.320%0.20473%0.725CS.*SBendtrans-67.4136.1175.9-104.8-108.1000108.6E164 L168 E343 N347E164-Y360 WeakPolarHBondContact OE1-CB 3.48Å; L168-Y360 HydrophobicContact CD1-CE1 4.48Å; L168-Y360 HydrophobicContact CD2-CE2 4.08Å; E343-Y360 PolarHBondContact OE1-OH 3.48Å; E343-Y360 PolarHBondContact OE2-OH 3.34Å; N347-Y360 PolarHBondContact ND2-OH 3.4Å
361F43.6Very low45.3Very low203 Ų203138.3 Ų138.389%0.8975%0.753SS**  trans54.494.1178.7-75.6-86.6000117.3
362G33.7Very low43.5Very low78 Ų78135.7 Ų135.780%0.80475%0.749SS**  trans-135.981.516300000109.7
363E34.7Very low41.7Very low201 Ų201137.7 Ų137.794%0.93976%0.755SS**  trans-142.457.3158.7-135.2161.6-171.700108.4
364A33Very low39.9Very low91 Ų91139.1 Ų139.175%0.75276%0.764SS**SBendtrans-105.2114.7150.600000106.2N366A364-N366 PolarHBondContact O-N 3.32Å; A364-N366 VanDerWaalsContact O-N 3.16Å
365Q40.4Very low38.5Very low180 Ų180141.6 Ų141.684%0.84177%0.771SS**  trans-41.3113.2169.3-171.4174.52.300110.4
366N28.8Very low37.2Very low147 Ų147138.9 Ų138.979%0.78678%0.778SS**  trans-131.176166.7-156.726.2000108.3A364 G368A364-N366 PolarHBondContact O-N 3.32Å; A364-N366 VanDerWaalsContact O-N 3.16Å; N366-G368 PolarHBondContact O-N 3.34Å
367D35.4Very low36.1Very low148 Ų148137.4 Ų137.479%0.79178%0.776SS**  trans-72.7117.4160-89.9-38.6000108.1
368G39.4Very low35.2Very low56 Ų56135.7 Ų135.758%0.57778%0.784SS**  trans81.3100.3161.300000115N366N366-G368 PolarHBondContact O-N 3.34Å
369E31.6Very low34.5Very low186 Ų186135.2 Ų135.287%0.86978%0.784SS**  -168.8113.4120.5-101.5168.4168.900112.1
370R37.1Very low33.9Very low245 Ų245136.4 Ų136.493%0.92578%0.782SS**  trans7.6115.5155.6-71.7171.1158.5166.6-6.1117.9
371S33.6Very low32.9Very low134 Ų134140.2 Ų140.294%0.93781%0.811SS**  trans-114.992.6143-84.10000109.3
372G34.5Very low32.1Very low61 Ų61137.6 Ų137.663%0.62981%0.805SS**  trans-106.9125.7152.700000106.7
373L33.3Very low31.8Very low167 Ų167140.4 Ų140.487%0.87481%0.807SS**  trans173.2137.2135.1-91161.2000110.2
374L33Very low31.3Very low168 Ų168139.2 Ų139.288%0.8880%0.801SS**  trans88.678.2167.7-47.7-178.8000117.8
375S29.5Very low31Very low121 Ų121139.1 Ų139.185%0.84680%0.801SS**  trans-138.4117.2133.7157.70000107.9
376S29.6Very low30.4Very low114 Ų114135.5 Ų135.580%0.79780%0.802SS**  trans-68.6141.5-179.545.20000112.3
377A28.6Very low30.2Very low93 Ų93133 Ų13377%0.76980%0.795SS**  trans-35.7138.9173.700000117
378S30Very low29.8Very low116 Ų116133 Ų13381%0.81180%0.796SS**  -163111.9124.1-18.10000112
379Q28.7Very low29.2Very low172 Ų172139 Ų13980%0.80481%0.808SS**  trans37.3130.3141.1-81164.5-3600124.9
380D25.3Very low29Very low132 Ų132134 Ų13471%0.70681%0.807SS**  trans61.3125.9136.4-51.1-25.3000118.4
381T27Very low28.5Very low132 Ų132129.9 Ų129.981%0.8180%0.798SS**  -173.8152.364.9-41.30000110.7
382I26.5Very low28.2Very low148 Ų148135.1 Ų135.176%0.75980%0.799SS**  trans-45.4138174.6-60.5152.1000115.3
383T27.7Very low28Very low137 Ų137141.4 Ų141.484%0.8481%0.812SS**  trans-161.4139.1130.8-31.20000112.7
384E25.1Very low27.9Very low175 Ų175137 Ų13782%0.81881%0.807SS**  trans-63.2156179.2-62165.1123.300115.3
385A26.1Very low27.8Very low90 Ų90138 Ų13874%0.74481%0.812SS**  148130104.900000113.6
386A27.3Very low27.9Very low104 Ų104135.8 Ų135.886%0.8681%0.809SS**  trans60.2149.3142.800000118.5
387S24.6Very low27.8Very low93 Ų93141.9 Ų141.965%0.6581%0.814SS**  cis176.3134.3-7.3173.20000102.8
388N27.5Very low27.8Very low150 Ų150143 Ų14380%0.80281%0.812SS**  166.4135.9122.8-86-13000112.6
389Q25.9Very low27.7Very low181 Ų181144.8 Ų144.885%0.84681%0.812SS**  trans-62.6152.5179.2-69.2159.1-6200113.8
390G29Very low27.8Very low81 Ų81142 Ų14284%0.83581%0.806SS**  trans-157.390.215900000109.7
391Q25.6Very low28Very low158 Ų158141.9 Ų141.974%0.73881%0.813SS**  trans-57.2142.3173.6-111.3156-51.400112.7
392Y28.6Very low28Very low244 Ų244143.9 Ų143.996%0.95781%0.812SS**  trans-161.6124.8131.1-88.1-69.2000110.2
393E30.4Very low28Very low194 Ų194141.8 Ų141.891%0.90781%0.811SS**  trans-82.9150.8172.7-73.3-176.6111.500111.8
394G30.5Very low28.1Very low75 Ų75142.4 Ų142.477%0.77381%0.808SS**  trans-170.778.5173.900000114.9
395L30.4Very low28.3Very low187 Ų187139 Ų13998%0.97980%0.804SS**  trans24.5124145.6-131.181000121.2
396G31.3Very low28.4Very low76 Ų76139 Ų13978%0.78480%0.804SS**  trans160.388.5154.300000117.1
397R28.1Very low29.1Very low241 Ų241139.7 Ų139.791%0.90980%0.8SS**  trans-60.1150.2159.1-74.5175.1163.6166.5-3.6109.1
398T28.7Very low29.3Very low116 Ų116140.4 Ų140.471%0.71281%0.811SS**  179.6150.860.9180000111.1
399L27.3Very low29.3Very low155 Ų155136.6 Ų136.681%0.81281%0.807SS**  trans67.6106.3146.4-88.3100.2000122
400T30.8Very low29.3Very low113 Ų113135.3 Ų135.369%0.69381%0.805SS**  trans-63.5154.1140.845.40000111.7
401P29.9Very low29.2Very low129 Ų129138.2 Ų138.284%0.83880%0.802SS**  trans-109.6126.1145.318.8-1.6000110.2
402H26.4Very low29.3Very low174 Ų174135.6 Ų135.681%0.80680%0.801SS**  trans-80167.4164.9-97-74.3000111.3
403S27.9Very low29.2Very low105 Ų105128.3 Ų128.373%0.73479%0.792SS**  trans109.6139.6149.986.40000114.5
404L29.2Very low29Very low149 Ų149125.9 Ų125.978%0.7879%0.789SS**  cis-166.5141.211.6-124.4153.9000109.2
405S30Very low28.8Very low104 Ų104133.8 Ų133.873%0.72780%0.796SS**  trans63124.2142.346.90000124.2
406A27.9Very low28.6Very low91 Ų91133.3 Ų133.375%0.75279%0.789SS**  trans-71.4-168.2160.600000112.2
407P41.5Very low28.5Very low118 Ų118138.2 Ų138.277%0.76679%0.791SS**  cis-149.4165.11941.2-18000120.6
408A29.4Very low28.4Very low107 Ų107129.8 Ų129.888%0.88478%0.779SS**  trans41.2144.2131.300000125.5
409G26.6Very low28.4Very low70 Ų70133 Ų13372%0.72279%0.786SS**  trans117.2135.9150.900000113.7
410L26.5Very low28.5Very low154 Ų154134.1 Ų134.181%0.80679%0.787SS**  cis-164150.515.1-114.2101.8000107.8
411D26Very low28.5Very low142 Ų142133.6 Ų133.676%0.75979%0.794SS**  trans35.3154.3135.2-68.9-15.8000121.8
412S27.3Very low28.3Very low104 Ų104138.1 Ų138.173%0.72779%0.794SS**  cis174.9174.9-1457.20000105.8
413A28.3Very low28.4Very low91 Ų91137 Ų13775%0.75280%0.8SS**  trans85121.4171.900000116.4
414V24.7Very low28.4Very low142 Ų142138.4 Ų138.486%0.86180%0.799SS**  cis117.113533.2161.40000108.8
415W26Very low28.4Very low242 Ų242136.4 Ų136.492%0.91780%0.798SS**  trans-89.1176.5-174.1-76.886.3000114
416E27.6Very low28.4Very low176 Ų176137.5 Ų137.582%0.82280%0.8SS**  trans102.2143.4167.9-67.4-177.7158.300116
417E27.9Very low28.5Very low180 Ų180140.9 Ų140.984%0.84180%0.801SS**  cis-174156.4-12.2-118.4-170.5169.100107.4
418G26.6Very low28Very low63 Ų63141.2 Ų141.265%0.64980%0.796SS**  trans100.2114.5138.600000122.9
419H29.6Very low28Very low184 Ų184143.8 Ų143.885%0.85280%0.795SS**  trans53.7146.8135.5-77.4-84.6000121.3
420E29.4Very low28.3Very low179 Ų179144.6 Ų144.684%0.83680%0.795SS**  cis-167.415427.1-117.7169.7157.600106.3
421A29Very low28.5Very low102 Ų102148 Ų14884%0.84380%0.797SS**  170.4162.879.400000111.2
422R26.3Very low28.7Very low223 Ų223149 Ų14984%0.84280%0.799SS**  trans-109.7154.3-164.7-168.5-177.2-168.4170.82.8111.2
423T28.7Very low28.7Very low150 Ų150150.8 Ų150.892%0.9280%0.8SS**  trans-165.4136.3143.313.30000112.9
424D28.7Very low28.9Very low135 Ų135155.3 Ų155.372%0.72281%0.805SS**  trans-73.9156.9-179.9-93.9-45.2000114.8
425S28.2Very low29.2Very low108 Ų108153.9 Ų153.976%0.75580%0.797SS**  173.3114.2113.240.40000114.2
426T30Very low29.4Very low126 Ų126152 Ų15277%0.77380%0.796SS**  30.4128.8124-19.70000120.7
427Q30Very low29.6Very low163 Ų163152.4 Ų152.476%0.76280%0.797SS**  157.9129.697.7-160.9163.31700115.7
428D30.6Very low30.8Very low125 Ų125149.1 Ų149.167%0.66879%0.792SS**  trans33.4129148.9-57.4-36.5000123.3
429N30Very low31.1Very low161 Ų161155.5 Ų155.586%0.86181%0.805SS**  -174.8143.494.8-116.5-31.7000115.3
430A33.5Very low31.2Very low87 Ų87155.4 Ų155.472%0.71980%0.804SS**  trans-67.3179.8170.300000112.1
431R30.5Very low31.4Very low224 Ų224150.9 Ų150.985%0.84580%0.798SS**  cis-174.3152.119.4-152.4172.7-174.9174.31.9103.1
432M29.3Very low31.5Very low163 Ų163153.8 Ų153.880%0.80380%0.799SS**  163.9145.480.7-162.1125.3149.400110.4
433N28.7Very low31.9Very low143 Ų143150.1 Ų150.177%0.76580%0.796SS**  trans-52.8155.2179.5-60-26.8000117.5
434H30.9Very low32.2Very low185 Ų185150.1 Ų150.186%0.85679%0.789SS**  -166145.6108.9-115.4-67.4000115.3
435T32.2Very low32.4Very low113 Ų113149.8 Ų149.869%0.69379%0.791SS**  trans-62.1148.1179.7-20.70000116.3
436K28.9Very low32.9Very low202 Ų202151.6 Ų151.688%0.87879%0.791SS**  159124.2122.6-88.8177.2178.6-176.10113.3
437E33.1Very low33.5Very low184 Ų184155.1 Ų155.186%0.8681%0.812SS**  trans-88.5178.9145.7-99.2-173.5148.200108.8
438P53.7Low33.7Very low111 Ų111154.7 Ų154.772%0.72182%0.815SS**  cis-131.8174.8-15.630.3-9.9000112.8
439E30.9Very low33.9Very low197 Ų197156.3 Ų156.392%0.92182%0.822SS**  trans-171.2156.2139.8-118.1-179.3175.400115.2
440E32.5Very low34.1Very low182 Ų182156 Ų15685%0.8582%0.82SS**  trans-69.7163.6-171.8-103.2173.4139.200117.2
441A33.2Very low34.1Very low85 Ų85160.1 Ų160.170%0.70283%0.826SS**  trans61.6119.2146.600000119.6
442D31.5Very low34.4Very low163 Ų163156.1 Ų156.187%0.87283%0.825SS**  -160.5147.1112-115.8-23.1000115.4
443L35.8Very low34.7Very low146 Ų146155.6 Ų155.676%0.76483%0.827SS**  trans-85.3124.8-177.5-176.398.6000109.7
444I33.6Very low35.1Very low150 Ų150156.5 Ų156.577%0.76983%0.831SS**  trans-136.7110.7161.8-58.7-176.6000111.4I446I444-I446 HydrophobicContact CG2-CD1 3.99Å; I444-I446 HydrophobicContact CG2-CG1 3.84Å
445V34.1Very low35.4Very low127 Ų127154.3 Ų154.377%0.7783%0.829SS**  trans-92.2122.5164.5169.30000108.1
446I38Very low35.7Very low146 Ų146157.8 Ų157.875%0.74984%0.84SS**  trans-161.4124.8164.4-58.3-174.6000105.5I444I444-I446 HydrophobicContact CG2-CD1 3.99Å; I444-I446 HydrophobicContact CG2-CG1 3.84Å
447T43.4Very low36.3Very low200 Ų200153.7 Ų153.7100%1.22784%0.837SS**  cis-150.80-7.6-46.40000106.2

Retrieved 447 of 447 residues in 132.3 ms (Link to these results)

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