A0A061I1V0_CRIGR Loading...

Replication factor C subunit 3

Subunit of the replication factor C (RFC) complex which acts during elongation of primed DNA templates by DNA polymerases delta and epsilon, and is necessary for ATP-dependent loading of proliferating cell nuclear antigen (PCNA) onto primed DNA.

AlphaFold DB , UniProt , Accession A0A061I1V0, Species CRIGR (Cricetulus griseus, Chinese hamster), Gene Rfc3, Length 356 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
1M51Low85.8Confident248 Ų24877.5 Ų77.5100%1.22240%0.395SS*.  0126.60-78.8176.2-129.700107.7
2S76.8Confident86.3Confident75 Ų7573.3 Ų73.352%0.52438%0.378SS..  trans-77.7136.4175.7550000110.1
3L89.3Confident86.6Confident91 Ų9167.9 Ų67.948%0.47635%0.35SS..  trans-55.3149.3172.3-65.4170.4000111.1V5 D6 K7 L228L3-V5 PolarHBondContact O-N 3.4Å; L3-D6 PolarHBondContact O-N 3.36Å; L3-D6 VanDerWaalsContact O-N 3.14Å; L3-K7 PolarHBondContact O-N 3.36Å; L3-L228 HydrophobicContact CD1-CD2 4.4Å
4W90Very high86.8Confident17 Ų1768.6 Ų68.66%0.06437%0.371CS..Hα-helixtrans-63.4-29.5-178.8-64.42.2000112.5D6 K7 Y8 V199 E203 L205 E231 R234W4-D6 PolarHBondContact O-N 3.29Å; W4-K7 PolarHBondContact O-N 3.14Å; W4-Y8 HydrophobicContact CB-CD2 3.99Å; W4-Y8 HydrophobicContact CB-CE2 4.4Å; W4-Y8 HydrophobicContact CG-CD2 4.38Å; W4-Y8 HydrophobicContact CG-CE2 4.31Å; W4-Y8 PolarHBondContact O-N 3.46Å; W4-V199 HydrophobicContact CE3-CG1 4Å; W4-E203 HydrophobicContact CD2-CG 4.48Å; W4-L205 HydrophobicContact CH2-CD1 3.83Å; W4-L205 HydrophobicContact CZ2-CD1 4.37Å; W4-L205 HydrophobicContact CZ3-CD1 4.37Å; W4-E231 HydrophobicContact CD2-CB 4.12Å; W4-E231 HydrophobicContact CD2-CG 3.96Å; W4-E231 HydrophobicContact CE3-CB 3.98Å; W4-E231 HydrophobicContact CE3-CG 4.31Å; W4-E231 HydrophobicContact CG-CG 4.29Å; W4-E231 HydrophobicContact CH2-CB 4.3Å; W4-E231 HydrophobicContact CH2-CG 4.34Å; W4-E231 HydrophobicContact CZ2-CB 4.42Å; W4-E231 HydrophobicContact CZ2-CG 3.97Å; W4-E231 HydrophobicContact CZ3-CB 4.11Å; W4-E231 PolarHBondContact N-OE2 3.15Å; W4-R234 HydrophobicContact CH2-CB 4.01Å; W4-R234 HydrophobicContact CH2-CG 4.29Å
5V90.6Very high87.1Confident27 Ų2774.2 Ų74.216%0.16439%0.385CS..Hα-helixtrans-53.2-42.1175.5178.90000111.8L3 R224 L227 L228L3-V5 PolarHBondContact O-N 3.4Å; V5-R224 HydrophobicContact CG1-CG 4.08Å; V5-L227 HydrophobicContact CG2-CB 3.81Å; V5-L228 HydrophobicContact CG2-CD2 3.69Å; V5-L228 HydrophobicContact CG2-CG 3.81Å
6D89.1Confident87.4Confident101 Ų10170.1 Ų70.154%0.5436%0.364SS..Hα-helixtrans-91-37.1-180-72.7-33.4000111.8L3 W4 Y8 R9L3-D6 PolarHBondContact O-N 3.36Å; L3-D6 VanDerWaalsContact O-N 3.14Å; W4-D6 PolarHBondContact O-N 3.29Å; D6-Y8 VanDerWaalsContact C-N 3.35Å; D6-Y8 PolarHBondContact O-N 2.99Å; D6-R9 WeakPolarHBondContact O-CB 3.33Å; D6-R9 PolarHBondContact O-N 3.21Å
7K91.1Very high87.5Confident111 Ų11169.7 Ų69.748%0.48336%0.362SS..Hα-helixtrans-61-40.7-179.7-174.5-177.3175.7-168.90113L3 W4 E203L3-K7 PolarHBondContact O-N 3.36Å; W4-K7 PolarHBondContact O-N 3.14Å; K7-E203 IonicContact NZ-OE1 3.43Å; K7-E203 PolarHBondContact NZ-OE1 3.47Å
8Y91.8Very high87.7Confident44 Ų4466.4 Ų66.417%0.17334%0.344CS..THydrogen-bonded Turntrans-100.66.1-176-68.4-68.7000113.9W4 D6 V199 K202 E203W4-Y8 HydrophobicContact CB-CD2 3.99Å; W4-Y8 HydrophobicContact CB-CE2 4.4Å; W4-Y8 HydrophobicContact CG-CD2 4.38Å; W4-Y8 HydrophobicContact CG-CE2 4.31Å; W4-Y8 PolarHBondContact O-N 3.46Å; D6-Y8 VanDerWaalsContact C-N 3.35Å; D6-Y8 PolarHBondContact O-N 2.99Å; Y8-V199 HydrophobicContact CD2-CG1 3.62Å; Y8-V199 HydrophobicContact CD2-CG2 4.39Å; Y8-V199 HydrophobicContact CE2-CG1 3.95Å; Y8-V199 HydrophobicContact CG-CG1 4.16Å; Y8-V199 HydrophobicContact CG-CG2 4.13Å; Y8-K202 HydrophobicContact CD1-CB 4.38Å; Y8-K202 HydrophobicContact CD1-CD 3.77Å; Y8-K202 HydrophobicContact CE1-CB 3.59Å; Y8-K202 HydrophobicContact CE1-CD 3.73Å; Y8-K202 HydrophobicContact CE1-CG 4.29Å; Y8-E203 HydrophobicContact CE2-CG 3.75Å; Y8-E203 WeakPolarHBondContact CE2-OE1 3.3Å; Y8-E203 VanDerWaalsContact OH-CD 3.29Å; Y8-E203 VanDerWaalsContact OH-CG 3.31Å; Y8-E203 WeakPolarHBondContact OH-CG 3.3Å; Y8-E203 PolarHBondContact OH-OE1 3.41Å
9R91.5Very high88Confident77 Ų7765.6 Ų65.629%0.29134%0.339SS..  trans-60.4126.6176.2-175.3174174.6-174.1-6.9109.8D6 K49 T50D6-R9 WeakPolarHBondContact O-CB 3.33Å; D6-R9 PolarHBondContact O-N 3.21Å; R9-K49 PolarHBondContact NH2-O 3.21Å; R9-T50 HydrophobicContact CG-CG2 3.73Å; R9-T50 PolarHBondContact NE-OG1 3.49Å
10P92.1Very high88.2Confident21 Ų2170.1 Ų70.114%0.13636%0.355CS..  trans-68.7138.8177.826.5-32.8000110.5R15 L16 T50 C54P10-R15 HydrophobicContact CB-CB 4.29Å; P10-R15 WeakPolarHBondContact CB-O 3.41Å; P10-L16 HydrophobicContact CB-CD1 4.45Å; P10-L16 HydrophobicContact CG-CD1 4.39Å; P10-T50 HydrophobicContact CG-CG2 3.62Å; P10-T50 WeakPolarHBondContact O-CG2 3.24Å; P10-C54 PolarHBondContact O-SG 2.93Å; P10-C54 VanDerWaalsContact O-SG 3.38Å
11C90.4Very high88.5Confident41 Ų4173.8 Ų73.828%0.27737%0.371SS..  trans-101.1-14.9-178.6-52.20000113.9R57C11-R57 WeakPolarHBondContact O-CD 3.34Å
12S91.6Very high90.5Very high26 Ų2663.7 Ų63.718%0.18232%0.321CS..SBendtrans-124.2147.7-175.7-55.50000110.9A14 R15 L16S12-A14 PolarHBondContact O-N 3.01Å; S12-R15 PolarHBondContact O-N 3.19Å; S12-L16 WeakPolarHBondContact O-CD1 3.36Å
13L89.9Confident91.3Very high4 Ų460.5 Ų60.52%0.02130%0.299CS..G310 helixtrans-60.1-34.2-179.4-74178.4000112.6R15 L26 R27 C54 I55 E58L13-R15 VanDerWaalsContact C-N 3.26Å; L13-R15 PolarHBondContact O-N 3Å; L13-L26 HydrophobicContact CD1-CB 4.06Å; L13-L26 HydrophobicContact CD2-CB 4.37Å; L13-L26 HydrophobicContact CD2-CD1 4.49Å; L13-R27 HydrophobicContact CD1-CB 4.07Å; L13-C54 HydrophobicContact CD2-CB 3.57Å; L13-C54 HydrophobicContact CG-CB 3.85Å; L13-I55 HydrophobicContact CD1-CG1 4.49Å; L13-I55 HydrophobicContact CD2-CG1 4.39Å; L13-E58 HydrophobicContact CB-CG 4.44Å; L13-E58 HydrophobicContact CD1-CG 3.99Å; L13-E58 HydrophobicContact CG-CG 4.07Å
14A89.6Confident91.5Very high78 Ų7858.5 Ų58.565%0.64530%0.296SS*.G310 helixtrans-70.1-19.2176.800000114.1S12S12-A14 PolarHBondContact O-N 3.01Å
15R91Very high91.7Very high152 Ų15262.8 Ų62.857%0.57432%0.317SS*.G310 helixtrans-98.610.6-177.1-65.8-179.365.1-162.5-0.4112.9P10 S12 L13P10-R15 HydrophobicContact CB-CB 4.29Å; P10-R15 WeakPolarHBondContact CB-O 3.41Å; S12-R15 PolarHBondContact O-N 3.19Å; L13-R15 VanDerWaalsContact C-N 3.26Å; L13-R15 PolarHBondContact O-N 3Å
16L92.1Very high91.9Very high9 Ų962 Ų625%0.04731%0.311CS..  trans-68134175.4-93.462.5000110.7P10 S12 A23 R51 C54P10-L16 HydrophobicContact CB-CD1 4.45Å; P10-L16 HydrophobicContact CG-CD1 4.39Å; S12-L16 WeakPolarHBondContact O-CD1 3.36Å; L16-A23 HydrophobicContact CB-CB 4.41Å; L16-A23 HydrophobicContact CD2-CB 3.91Å; L16-R51 HydrophobicContact CD2-CG 3.92Å; L16-C54 HydrophobicContact CD1-CB 4.46Å
17D89.4Confident92.1Very high63 Ų6362.3 Ų62.334%0.33731%0.305SS..SBendtrans-74.2-31.4-177.1-55.6-60.3000112.6V195D17-V195 HydrophobicContact CB-CG2 3.52Å
18Y92.1Very high92.1Very high10 Ų1062 Ų624%0.03931%0.308CS..SBendtrans-140.2162.1-176.660-83.3000112.8A46 R51 P187 V195 L223Y18-A46 VanDerWaalsContact OH-C 3.31Å; Y18-A46 PolarHBondContact OH-O 3.44Å; Y18-R51 PolarHBondContact O-NH2 3.35Å; Y18-R51 PolarHBondContact OH-NH1 3.49Å; Y18-P187 HydrophobicContact CD1-CB 4.44Å; Y18-P187 HydrophobicContact CD2-CB 3.83Å; Y18-P187 HydrophobicContact CE1-CB 4.42Å; Y18-P187 HydrophobicContact CE2-CB 3.75Å; Y18-P187 HydrophobicContact CE2-CG 4.04Å; Y18-P187 HydrophobicContact CG-CB 4.19Å; Y18-V195 HydrophobicContact CD1-CG2 4.34Å; Y18-L223 HydrophobicContact CE1-CD2 3.52Å
19H92Very high92.1Very high52 Ų5261.5 Ų61.524%0.24131%0.309CS..  trans57.550.5-172.6-55.6-31.7000112.8E21 Q22 A23 P185H19-E21 VanDerWaalsContact C-N 3.31Å; H19-E21 PolarHBondContact O-N 3.15Å; H19-Q22 HydrophobicContact CB-CB 4.29Å; H19-Q22 PolarHBondContact O-N 3.03Å; H19-A23 PolarHBondContact O-N 3.14Å; H19-P185 PolarHBondContact NE2-O 3.03Å
20K92.9Very high92Very high154 Ų15458.2 Ų58.267%0.6730%0.297SS*.Hα-helixtrans-61.6-35.1-175.4-66-176.8180175.90113.5A23 A24K20-A23 WeakPolarHBondContact O-CB 3.47Å; K20-A23 PolarHBondContact O-N 2.89Å; K20-A24 PolarHBondContact O-N 3.22Å
21E94.3Very high91.8Very high148 Ų14862.8 Ų62.869%0.69232%0.317SS*.Hα-helixtrans-63.2-48.6176.3-170.2-169.6162.200111.3H19 A23 A24 Q25H19-E21 VanDerWaalsContact C-N 3.31Å; H19-E21 PolarHBondContact O-N 3.15Å; E21-A23 VanDerWaalsContact C-N 3.27Å; E21-A23 PolarHBondContact O-N 3.21Å; E21-A24 WeakPolarHBondContact O-CB 2.85Å; E21-A24 PolarHBondContact O-N 3.01Å; E21-A24 VanDerWaalsContact O-N 3.12Å; E21-Q25 WeakPolarHBondContact O-CG 3.25Å; E21-Q25 PolarHBondContact O-N 2.99Å; E21-Q25 PolarHBondContact OE1-NE2 3.02Å
22Q93.8Very high91.4Very high37 Ų3764.3 Ų64.317%0.17333%0.327CS..Hα-helixtrans-60.7-38.2174.7177.2172.46800111.5H19 A24 Q25 L26 R183H19-Q22 HydrophobicContact CB-CB 4.29Å; H19-Q22 PolarHBondContact O-N 3.03Å; Q22-A24 VanDerWaalsContact C-N 3.33Å; Q22-A24 PolarHBondContact O-N 3.38Å; Q22-Q25 PolarHBondContact O-N 2.95Å; Q22-L26 HydrophobicContact CG-CD1 4.17Å; Q22-L26 HydrophobicContact CG-CG 4.41Å; Q22-L26 WeakPolarHBondContact O-CB 3.47Å; Q22-L26 WeakPolarHBondContact O-CG 3.39Å; Q22-L26 PolarHBondContact O-N 3.21Å; Q22-R183 PolarHBondContact NE2-O 3.49Å
23A93.3Very high90.6Very high7 Ų765.7 Ų65.76%0.05835%0.345CS..Hα-helixtrans-62.5-39.5175.900000112.1L16 H19 K20 E21 L26 R27L16-A23 HydrophobicContact CB-CB 4.41Å; L16-A23 HydrophobicContact CD2-CB 3.91Å; H19-A23 PolarHBondContact O-N 3.14Å; K20-A23 WeakPolarHBondContact O-CB 3.47Å; K20-A23 PolarHBondContact O-N 2.89Å; E21-A23 VanDerWaalsContact C-N 3.27Å; E21-A23 PolarHBondContact O-N 3.21Å; A23-L26 PolarHBondContact O-N 3.48Å; A23-R27 WeakPolarHBondContact O-CB 3.36Å; A23-R27 PolarHBondContact O-N 2.71Å
24A94Very high90.4Very high49 Ų4970.5 Ų70.541%0.40537%0.371SS..Hα-helixtrans-66.5-41.8174.600000112K20 E21 Q22 L26 R27 N28K20-A24 PolarHBondContact O-N 3.22Å; E21-A24 WeakPolarHBondContact O-CB 2.85Å; E21-A24 PolarHBondContact O-N 3.01Å; E21-A24 VanDerWaalsContact O-N 3.12Å; Q22-A24 VanDerWaalsContact C-N 3.33Å; Q22-A24 PolarHBondContact O-N 3.38Å; A24-L26 PolarHBondContact O-N 2.95Å; A24-R27 WeakPolarHBondContact O-CB 3.11Å; A24-R27 PolarHBondContact O-N 3.38Å; A24-N28 VanDerWaalsContact O-CG 3.27Å; A24-N28 PolarHBondContact O-N 3.24Å; A24-N28 PolarHBondContact O-OD1 3.36Å
25Q93.7Very high90.4Very high108 Ų10866.9 Ų66.951%0.50534%0.341SS..Hα-helixtrans-61.2-43.9174.6-68172.31.800111.8E21 Q22 R27 N28 L29E21-Q25 WeakPolarHBondContact O-CG 3.25Å; E21-Q25 PolarHBondContact O-N 2.99Å; E21-Q25 PolarHBondContact OE1-NE2 3.02Å; Q22-Q25 PolarHBondContact O-N 2.95Å; Q25-R27 VanDerWaalsContact C-N 3.29Å; Q25-R27 PolarHBondContact O-N 3.32Å; Q25-N28 PolarHBondContact O-N 3.42Å; Q25-L29 WeakPolarHBondContact O-CB 3.37Å; Q25-L29 PolarHBondContact O-N 3.21Å
26L93.7Very high90.5Very high10 Ų1061.2 Ų61.25%0.05232%0.324CS..Hα-helixtrans-63.9-35.2174.9-71.1173000112L13 Q22 A23 A24 L29 V30 R51 I55 V182L13-L26 HydrophobicContact CD1-CB 4.06Å; L13-L26 HydrophobicContact CD2-CB 4.37Å; L13-L26 HydrophobicContact CD2-CD1 4.49Å; Q22-L26 HydrophobicContact CG-CD1 4.17Å; Q22-L26 HydrophobicContact CG-CG 4.41Å; Q22-L26 WeakPolarHBondContact O-CB 3.47Å; Q22-L26 WeakPolarHBondContact O-CG 3.39Å; Q22-L26 PolarHBondContact O-N 3.21Å; A23-L26 PolarHBondContact O-N 3.48Å; A24-L26 PolarHBondContact O-N 2.95Å; L26-L29 HydrophobicContact CD2-CD2 4.43Å; L26-L29 WeakPolarHBondContact O-CB 3.35Å; L26-L29 PolarHBondContact O-N 3.33Å; L26-V30 PolarHBondContact O-N 3.21Å; L26-V30 VanDerWaalsContact O-N 3.1Å; L26-R51 HydrophobicContact CD1-CG 4.42Å; L26-I55 HydrophobicContact CD1-CD1 4.18Å; L26-I55 HydrophobicContact CD2-CD1 3.98Å; L26-V182 HydrophobicContact CD2-CG1 4.17Å; L26-V182 HydrophobicContact CD2-CG2 4.1Å
27R92.8Very high90.7Very high108 Ų10861 Ų6141%0.40832%0.322SS..Hα-helixtrans-65.4-44.5174.9-171.7180-177.5-176.4-0.9111.6L13 A23 A24 Q25 L29 V30 Q31L13-R27 HydrophobicContact CD1-CB 4.07Å; A23-R27 WeakPolarHBondContact O-CB 3.36Å; A23-R27 PolarHBondContact O-N 2.71Å; A24-R27 WeakPolarHBondContact O-CB 3.11Å; A24-R27 PolarHBondContact O-N 3.38Å; Q25-R27 VanDerWaalsContact C-N 3.29Å; Q25-R27 PolarHBondContact O-N 3.32Å; R27-L29 VanDerWaalsContact C-N 3.26Å; R27-L29 PolarHBondContact O-N 3.42Å; R27-V30 WeakPolarHBondContact O-CG2 3.32Å; R27-V30 PolarHBondContact O-N 3.01Å; R27-Q31 VanDerWaalsContact O-CG 3.31Å; R27-Q31 WeakPolarHBondContact O-CG 3.44Å; R27-Q31 PolarHBondContact O-N 2.9Å; R27-Q31 VanDerWaalsContact O-N 3.11Å
28N92.1Very high91Very high103 Ų10358 Ų5855%0.55131%0.306SS*.Hα-helixtrans-63.6-36.6175.8-64.3-12.7000111.1A24 Q25 Q31 C32A24-N28 VanDerWaalsContact O-CG 3.27Å; A24-N28 PolarHBondContact O-N 3.24Å; A24-N28 PolarHBondContact O-OD1 3.36Å; Q25-N28 PolarHBondContact O-N 3.42Å; N28-Q31 PolarHBondContact O-N 3.1Å; N28-C32 PolarHBondContact O-N 3.25Å
29L92Very high91.2Very high34 Ų3457.6 Ų57.618%0.17831%0.305CS..Hα-helixtrans-63.4-43.3177.2-176.766.1000112.7Q25 L26 R27 Q31 C32 P36 L38 L180Q25-L29 WeakPolarHBondContact O-CB 3.37Å; Q25-L29 PolarHBondContact O-N 3.21Å; L26-L29 HydrophobicContact CD2-CD2 4.43Å; L26-L29 WeakPolarHBondContact O-CB 3.35Å; L26-L29 PolarHBondContact O-N 3.33Å; R27-L29 VanDerWaalsContact C-N 3.26Å; R27-L29 PolarHBondContact O-N 3.42Å; L29-Q31 VanDerWaalsContact C-N 3.34Å; L29-C32 WeakPolarHBondContact O-CB 3.42Å; L29-C32 PolarHBondContact O-N 3.05Å; L29-P36 HydrophobicContact CD1-CG 4.08Å; L29-L38 HydrophobicContact CD2-CD2 3.92Å; L29-L180 HydrophobicContact CD1-CD1 4.04Å; L29-L180 HydrophobicContact CD2-CD1 4.08Å
30V89.9Confident91.5Very high8 Ų855.1 Ų55.15%0.04829%0.294CS..Hα-helixtrans-74.2-25.5178.3-62.50000113.2L26 R27 C32 F35 I55 E58 L59 R127L26-V30 PolarHBondContact O-N 3.21Å; L26-V30 VanDerWaalsContact O-N 3.1Å; R27-V30 WeakPolarHBondContact O-CG2 3.32Å; R27-V30 PolarHBondContact O-N 3.01Å; V30-C32 VanDerWaalsContact C-N 3.35Å; V30-F35 HydrophobicContact CG1-CD2 4.38Å; V30-F35 HydrophobicContact CG1-CE2 4.11Å; V30-I55 HydrophobicContact CG1-CG2 3.83Å; V30-E58 HydrophobicContact CG2-CB 3.93Å; V30-L59 HydrophobicContact CB-CD2 3.97Å; V30-L59 HydrophobicContact CB-CG 4.26Å; V30-L59 HydrophobicContact CG1-CD1 4.48Å; V30-L59 HydrophobicContact CG1-CD2 4.09Å; V30-L59 HydrophobicContact CG1-CG 3.98Å; V30-R127 PolarHBondContact O-NH2 3.45Å
31Q87.5Confident91.7Very high118 Ų11850.4 Ų50.455%0.55127%0.272SS*.Hα-helixtrans-73.4-29.3173.5-74.8177.7-10.900112R27 N28 L29R27-Q31 VanDerWaalsContact O-CG 3.31Å; R27-Q31 WeakPolarHBondContact O-CG 3.44Å; R27-Q31 PolarHBondContact O-N 2.9Å; R27-Q31 VanDerWaalsContact O-N 3.11Å; N28-Q31 PolarHBondContact O-N 3.1Å; L29-Q31 VanDerWaalsContact C-N 3.34Å
32C81.8Confident91.7Very high73 Ų7343.7 Ų43.749%0.49324%0.242SC..SBendtrans-60.4140171.6-162.60000110.2N28 L29 V30 D34 R127N28-C32 PolarHBondContact O-N 3.25Å; L29-C32 WeakPolarHBondContact O-CB 3.42Å; L29-C32 PolarHBondContact O-N 3.05Å; V30-C32 VanDerWaalsContact C-N 3.35Å; C32-D34 PolarHBondContact O-N 2.79Å; C32-R127 PolarHBondContact O-NH2 3.48Å
33G75.1Confident91.7Very high55 Ų5545 Ų4557%0.56725%0.254SS*.SBendtrans-59.9-34.4-175.200000113.3R127G33-R127 PolarHBondContact O-NH1 2.75Å
34D84.8Confident91.6Very high104 Ų10447.5 Ų47.556%0.55627%0.271SS*.SBendtrans-106.9108.1-175.9-17025.6000111.9C32 P36 R160C32-D34 PolarHBondContact O-N 2.79Å; D34-P36 WeakPolarHBondContact O-CD 3.41Å; D34-R160 IonicContact OD1-CZ 3.07Å; D34-R160 IonicContact OD1-NH2 2.6Å; D34-R160 PolarHBondContact OD1-NH2 3.23Å
35F90.6Very high91.5Very high2 Ų245.7 Ų45.71%0.00926%0.257CS..  trans-88.8115.9179.4-176.1-100.4000110.8V30 L38 I55 L59 F129 R160 I162V30-F35 HydrophobicContact CG1-CD2 4.38Å; V30-F35 HydrophobicContact CG1-CE2 4.11Å; F35-L38 HydrophobicContact CE1-CD1 4.41Å; F35-L38 HydrophobicContact CE1-CG 4.25Å; F35-L38 HydrophobicContact CE2-CD1 3.91Å; F35-L38 HydrophobicContact CE2-CG 4.29Å; F35-L38 HydrophobicContact CZ-CD1 3.44Å; F35-L38 VanDerWaalsContact CZ-CD1 3.44Å; F35-L38 HydrophobicContact CZ-CD2 4.48Å; F35-L38 HydrophobicContact CZ-CG 3.69Å; F35-I55 HydrophobicContact CE2-CG2 3.92Å; F35-I55 HydrophobicContact CZ-CG2 3.93Å; F35-L59 HydrophobicContact CD1-CD1 4.46Å; F35-L59 HydrophobicContact CD2-CD1 4.15Å; F35-L59 HydrophobicContact CD2-CD2 4.21Å; F35-L59 HydrophobicContact CE1-CD1 4.25Å; F35-L59 HydrophobicContact CE2-CD1 3.93Å; F35-L59 HydrophobicContact CG-CD1 4.4Å; F35-L59 HydrophobicContact CG-CD2 4.49Å; F35-L59 HydrophobicContact CZ-CD1 3.96Å; F35-F129 HydrophobicContact CB-CE1 4.13Å; F35-F129 HydrophobicContact CB-CE2 4.4Å; F35-F129 HydrophobicContact CB-CZ 3.58Å; F35-F129 HydrophobicContact CD1-CE2 4.08Å; F35-F129 HydrophobicContact CD1-CZ 4.09Å; F35-F129 HydrophobicContact CG-CZ 4.1Å; F35-R160 HydrophobicContact CD1-CB 4.03Å; F35-R160 HydrophobicContact CD1-CG 4.15Å; F35-R160 HydrophobicContact CE1-CB 4.37Å; F35-R160 VanDerWaalsContact O-CD 3.29Å; F35-R160 WeakPolarHBondContact O-CD 3.45Å; F35-R160 PolarHBondContact O-NE 3.02Å; F35-I162 HydrophobicContact CE1-CD1 4.35Å; F35-I162 HydrophobicContact CE1-CG1 4.34Å; F35-I162 HydrophobicContact CZ-CD1 4.12Å; F35-I162 HydrophobicContact CZ-CG1 4.43Å
36P93.6Very high91.5Very high33 Ų3340.6 Ų40.621%0.21423%0.233CC..  trans-76.9169.1179.532.5-35.9000112L29 D34 L38 L180L29-P36 HydrophobicContact CD1-CG 4.08Å; D34-P36 WeakPolarHBondContact O-CD 3.41Å; P36-L38 HydrophobicContact CG-CD2 4.29Å; P36-L180 HydrophobicContact CG-CB 4.13Å; P36-L180 HydrophobicContact CG-CD1 4.02Å
37H95Very high91.4Very high5 Ų540.8 Ų40.82%0.02324%0.238CC..  trans-64.3138.9165.2-61.8-34.2000110.7M152 M156 L161 C179 L180H37-M152 WeakPolarHBondContact CD2-CG 2.82Å; H37-M152 PolarHBondContact CD2-SD 3.45Å; H37-M152 WeakPolarHBondContact NE2-CG 3.4Å; H37-M156 PolarHBondContact CE1-SD 3.3Å; H37-M156 PolarHBondContact NE2-SD 3.17Å; H37-L161 WeakPolarHBondContact CA-O 3.22Å; H37-L161 PolarHBondContact ND1-N 3.41Å; H37-C179 HydrophobicContact CB-CB 4.31Å; H37-C179 CarbonylContact O-C 3.59Å; H37-C179 VanDerWaalsContact O-CA 3.29Å; H37-C179 WeakPolarHBondContact O-CA 3.44Å; H37-L180 PolarHBondContact O-N 3.06Å
38L96.6Very high91.5Very high0 Ų036.3 Ų36.30%022%0.221CC..EExtended strand (participates in β ladder)trans-109.6139.6-179.8-61.2-170.9000111.3L29 F35 P36 V40 I55 L161 I162 L163 L180 V182L29-L38 HydrophobicContact CD2-CD2 3.92Å; F35-L38 HydrophobicContact CE1-CD1 4.41Å; F35-L38 HydrophobicContact CE1-CG 4.25Å; F35-L38 HydrophobicContact CE2-CD1 3.91Å; F35-L38 HydrophobicContact CE2-CG 4.29Å; F35-L38 HydrophobicContact CZ-CD1 3.44Å; F35-L38 VanDerWaalsContact CZ-CD1 3.44Å; F35-L38 HydrophobicContact CZ-CD2 4.48Å; F35-L38 HydrophobicContact CZ-CG 3.69Å; P36-L38 HydrophobicContact CG-CD2 4.29Å; L38-V40 HydrophobicContact CB-CG2 4.31Å; L38-I55 HydrophobicContact CD1-CD1 3.95Å; L38-L161 PolarHBondContact N-O 3.28Å; L38-I162 HydrophobicContact CB-CG1 4.21Å; L38-I162 HydrophobicContact CB-CG2 4.24Å; L38-I162 HydrophobicContact CD1-CD1 4.41Å; L38-I162 HydrophobicContact CD1-CG1 4.46Å; L38-I162 HydrophobicContact CG-CG1 4.48Å; L38-I162 WeakPolarHBondContact O-CA 3.38Å; L38-L163 PolarHBondContact O-N 2.87Å; L38-L180 HydrophobicContact CD2-CB 3.89Å; L38-L180 HydrophobicContact CD2-CD2 4.11Å; L38-L180 HydrophobicContact CD2-CG 4.45Å; L38-V182 HydrophobicContact CD2-CG2 4.37Å
39L96.9Very high91.6Very high1 Ų135.3 Ų35.31%0.00521%0.212CC..EExtended strand (participates in β ladder)trans-115.298.3165.617663.4000108.3L163 T168 R176 C179 L180 A181 V182L39-L163 CarbonylContact C-O 3.51Å; L39-L163 HydrophobicContact CD1-CB 3.69Å; L39-L163 HydrophobicContact CD1-CD1 4.4Å; L39-T168 HydrophobicContact CD2-CG2 4.16Å; L39-R176 HydrophobicContact CD2-CG 4.01Å; L39-C179 HydrophobicContact CB-CB 3.75Å; L39-L180 PolarHBondContact N-O 3.31Å; L39-A181 CarbonylContact O-C 3.57Å; L39-A181 WeakPolarHBondContact O-CA 3.47Å; L39-V182 PolarHBondContact O-N 2.95Å
40V97Very high91.7Very high1 Ų134.8 Ų34.81%0.00621%0.21CC..EExtended strand (participates in β ladder)trans-93.3118.7179.7-173.40000109.3L38 K48 I52 I162 L163 C164 C165 V182 V184L38-V40 HydrophobicContact CB-CG2 4.31Å; V40-K48 HydrophobicContact CG1-CB 4.09Å; V40-K48 HydrophobicContact CG1-CG 4.26Å; V40-I52 HydrophobicContact CB-CD1 4.17Å; V40-I52 HydrophobicContact CB-CG1 4.41Å; V40-I52 HydrophobicContact CG1-CD1 4.39Å; V40-I52 HydrophobicContact CG1-CG1 4.45Å; V40-I52 HydrophobicContact CG2-CD1 4.24Å; V40-I52 HydrophobicContact CG2-CG1 4.03Å; V40-I162 HydrophobicContact CG2-CG2 4.1Å; V40-L163 PolarHBondContact N-O 3.41Å; V40-C164 WeakPolarHBondContact O-CA 3.33Å; V40-C165 PolarHBondContact O-N 3.39Å; V40-C165 VanDerWaalsContact O-N 3.09Å; V40-V182 WeakPolarHBondContact CA-O 3.4Å; V40-V182 HydrophobicContact CG2-CB 4.23Å; V40-V184 HydrophobicContact CG1-CG2 3.77Å
41Y96.4Very high92Very high55 Ų5534.7 Ų34.722%0.21621%0.209CC..EExtended strand (participates in β ladder)trans-138.4160.4-175.671.3-83.2000113.3C165 T168 A181 V182 R183 V184Y41-C165 VanDerWaalsContact CA-O 3.31Å; Y41-C165 WeakPolarHBondContact CA-O 3.49Å; Y41-C165 VanDerWaalsContact CB-SG 3.56Å; Y41-T168 HydrophobicContact CD1-CG2 3.65Å; Y41-T168 HydrophobicContact CD2-CG2 3.59Å; Y41-T168 HydrophobicContact CE1-CG2 4.08Å; Y41-T168 HydrophobicContact CE2-CG2 3.99Å; Y41-T168 HydrophobicContact CG-CG2 3.37Å; Y41-A181 HydrophobicContact CE1-CB 4.03Å; Y41-V182 WeakPolarHBondContact CD1-O 3.44Å; Y41-V182 PolarHBondContact N-O 3.17Å; Y41-R183 HydrophobicContact CD2-CG 4.38Å; Y41-R183 HydrophobicContact CE1-CB 3.94Å; Y41-R183 HydrophobicContact CE2-CB 3.94Å; Y41-R183 HydrophobicContact CE2-CG 3.72Å; Y41-V184 PolarHBondContact O-N 2.95Å
42G94.8Very high92.3Very high7 Ų729.1 Ų29.17%0.07218%0.183CC..  trans148.3175.3-176.200000112.8K48 N166 V184G42-K48 PolarHBondContact O-NZ 3.07Å; G42-N166 CarbonylContact C-O 3.57Å; G42-N166 PolarHBondContact N-O 2.92Å; G42-N166 VanDerWaalsContact O-CA 3.26Å; G42-N166 WeakPolarHBondContact O-CA 3.4Å; G42-N166 VanDerWaalsContact O-O 3.11Å; G42-V184 WeakPolarHBondContact CA-O 3.47Å
43P94.1Very high92.9Very high63 Ų6327.2 Ų27.241%0.40917%0.167SC..  trans-61.9158-177.922.1-29.1000113.1A46 K48 A186P43-A46 HydrophobicContact CG-CB 4.09Å; P43-A46 WeakPolarHBondContact O-CB 3.49Å; P43-A46 PolarHBondContact O-N 3.47Å; P43-K48 PolarHBondContact O-NZ 3.47Å; P43-A186 HydrophobicContact CG-CB 3.67Å
44S91.9Very high93.8Very high61 Ų6124.6 Ų24.643%0.42714%0.14SC..THydrogen-bonded Turntrans-64.2144.3174.3-169.40000110.2A46S44-A46 PolarHBondContact O-N 2.8Å
45G91.3Very high94.2Very high11 Ų1119.8 Ų19.811%0.11311%0.114CC..THydrogen-bonded Turntrans76.5-3-179.100000116.1G47 N222 L223G45-G47 PolarHBondContact O-N 3.2Å; G45-N222 WeakPolarHBondContact CA-OD1 3.37Å; G45-L223 WeakPolarHBondContact O-CB 3.36Å; G45-L223 PolarHBondContact O-N 2.97Å
46A93.2Very high94.3Very high0 Ų019.7 Ų19.70%011%0.114CC..SBendtrans-74.43.3173.900000114.2Y18 P43 S44 R51 V184Y18-A46 VanDerWaalsContact OH-C 3.31Å; Y18-A46 PolarHBondContact OH-O 3.44Å; P43-A46 HydrophobicContact CG-CB 4.09Å; P43-A46 WeakPolarHBondContact O-CB 3.49Å; P43-A46 PolarHBondContact O-N 3.47Å; S44-A46 PolarHBondContact O-N 2.8Å; A46-R51 PolarHBondContact O-NH1 2.9Å; A46-V184 HydrophobicContact CB-CG1 4.27Å; A46-V184 WeakPolarHBondContact O-CG1 3.46Å
47G93.1Very high94.2Very high14 Ų1421.1 Ų21.114%0.14412%0.115CC..  trans78.529.4176.700000115.9G45 T50 R51G45-G47 PolarHBondContact O-N 3.2Å; G47-T50 WeakPolarHBondContact O-CB 3.47Å; G47-T50 PolarHBondContact O-N 3.36Å; G47-T50 VanDerWaalsContact O-N 3.15Å; G47-R51 VanDerWaalsContact CA-NH1 3.3Å; G47-R51 WeakPolarHBondContact O-CD 3.4Å; G47-R51 PolarHBondContact O-N 2.89Å; G47-R51 VanDerWaalsContact O-N 3.14Å; G47-R51 PolarHBondContact O-NH1 3.03Å
48K94.6Very high94Very high15 Ų1524.3 Ų24.37%0.06513%0.13CC..Hα-helixtrans-51.7-53.9172.8-61.9-172.6-64.4-85.80112.7V40 G42 P43 T50 R51 I52 C165 N166 V184V40-K48 HydrophobicContact CG1-CB 4.09Å; V40-K48 HydrophobicContact CG1-CG 4.26Å; G42-K48 PolarHBondContact O-NZ 3.07Å; P43-K48 PolarHBondContact O-NZ 3.47Å; K48-T50 PolarHBondContact O-N 3.35Å; K48-R51 PolarHBondContact O-N 3.27Å; K48-R51 VanDerWaalsContact O-N 3.11Å; K48-I52 WeakPolarHBondContact O-CG1 3.22Å; K48-I52 PolarHBondContact O-N 3.34Å; K48-C165 WeakPolarHBondContact CD-O 3.46Å; K48-C165 WeakPolarHBondContact CE-O 3.44Å; K48-N166 PolarHBondContact NZ-OD1 3.06Å; K48-V184 HydrophobicContact CG-CB 4.08Å; K48-V184 HydrophobicContact CG-CG1 4.45Å; K48-V184 HydrophobicContact CG-CG2 4.36Å
49K93.4Very high93.6Very high81 Ų8124.5 Ų24.535%0.35213%0.131SC..Hα-helixtrans-57.8-36.5177.1-71.9-157.5176.9-162.40112R9 I52 M53 E94R9-K49 PolarHBondContact NH2-O 3.21Å; K49-I52 PolarHBondContact O-N 2.89Å; K49-M53 WeakPolarHBondContact O-CG 3.34Å; K49-M53 PolarHBondContact O-N 3.27Å; K49-E94 IonicContact NZ-OE1 3.77Å; K49-E94 PolarHBondContact NZ-OE1 3.38Å
50T94.4Very high93.2Very high23 Ų2324.9 Ų24.914%0.14113%0.133CC..Hα-helixtrans-61.8-45.1176.7-52.50000111.7R9 P10 G47 K48 M53 C54R9-T50 HydrophobicContact CG-CG2 3.73Å; R9-T50 PolarHBondContact NE-OG1 3.49Å; P10-T50 HydrophobicContact CG-CG2 3.62Å; P10-T50 WeakPolarHBondContact O-CG2 3.24Å; G47-T50 WeakPolarHBondContact O-CB 3.47Å; G47-T50 PolarHBondContact O-N 3.36Å; G47-T50 VanDerWaalsContact O-N 3.15Å; K48-T50 PolarHBondContact O-N 3.35Å; T50-M53 PolarHBondContact O-N 3.03Å; T50-C54 PolarHBondContact O-N 3.43Å; T50-C54 PolarHBondContact O-SG 3.25Å
51R95Very high92.8Very high7 Ų726 Ų263%0.02614%0.144CC..Hα-helixtrans-63.2-43.8176.4-81.471.2-177.9-173.22.1111.2L16 Y18 L26 A46 G47 K48 M53 C54 I55L16-R51 HydrophobicContact CD2-CG 3.92Å; Y18-R51 PolarHBondContact O-NH2 3.35Å; Y18-R51 PolarHBondContact OH-NH1 3.49Å; L26-R51 HydrophobicContact CD1-CG 4.42Å; A46-R51 PolarHBondContact O-NH1 2.9Å; G47-R51 VanDerWaalsContact CA-NH1 3.3Å; G47-R51 WeakPolarHBondContact O-CD 3.4Å; G47-R51 PolarHBondContact O-N 2.89Å; G47-R51 VanDerWaalsContact O-N 3.14Å; G47-R51 PolarHBondContact O-NH1 3.03Å; K48-R51 PolarHBondContact O-N 3.27Å; K48-R51 VanDerWaalsContact O-N 3.11Å; R51-M53 PolarHBondContact O-N 3.4Å; R51-C54 WeakPolarHBondContact O-CB 3.46Å; R51-C54 PolarHBondContact O-N 3.29Å; R51-I55 VanDerWaalsContact O-CG1 3.31Å; R51-I55 WeakPolarHBondContact O-CG1 3.47Å; R51-I55 PolarHBondContact O-N 3.12Å
52I95.1Very high92.3Very high0 Ų027.8 Ų27.80%016%0.16CC..Hα-helixtrans-59.9-46.8178.8-64.6168.1000110.7V40 K48 K49 C54 I55 L56 L133 I162 C164V40-I52 HydrophobicContact CB-CD1 4.17Å; V40-I52 HydrophobicContact CB-CG1 4.41Å; V40-I52 HydrophobicContact CG1-CD1 4.39Å; V40-I52 HydrophobicContact CG1-CG1 4.45Å; V40-I52 HydrophobicContact CG2-CD1 4.24Å; V40-I52 HydrophobicContact CG2-CG1 4.03Å; K48-I52 WeakPolarHBondContact O-CG1 3.22Å; K48-I52 PolarHBondContact O-N 3.34Å; K49-I52 PolarHBondContact O-N 2.89Å; I52-C54 VanDerWaalsContact C-N 3.33Å; I52-C54 PolarHBondContact O-N 3.46Å; I52-I55 WeakPolarHBondContact O-CB 3.17Å; I52-I55 PolarHBondContact O-N 2.89Å; I52-L56 HydrophobicContact CG2-CD1 4.19Å; I52-L56 HydrophobicContact CG2-CG 4.49Å; I52-L56 WeakPolarHBondContact O-CB 3.36Å; I52-L56 WeakPolarHBondContact O-CG 3.44Å; I52-L56 PolarHBondContact O-N 3.37Å; I52-L133 HydrophobicContact CD1-CD1 3.9Å; I52-L133 HydrophobicContact CG2-CD1 4.03Å; I52-L133 HydrophobicContact CG2-CD2 3.9Å; I52-I162 HydrophobicContact CD1-CG2 3.93Å; I52-I162 HydrophobicContact CG1-CG2 3.96Å; I52-I162 HydrophobicContact CG2-CD1 4.2Å; I52-I162 HydrophobicContact CG2-CG2 4.08Å; I52-C164 HydrophobicContact CD1-CB 3.86Å
53M93.9Very high91.8Very high34 Ų3428.3 Ų28.317%0.16717%0.166CC..Hα-helixtrans-64.6-36.4176.7-68.5-55.2-69.300112.7K49 T50 R51 L56 R57K49-M53 WeakPolarHBondContact O-CG 3.34Å; K49-M53 PolarHBondContact O-N 3.27Å; T50-M53 PolarHBondContact O-N 3.03Å; R51-M53 PolarHBondContact O-N 3.4Å; M53-L56 PolarHBondContact O-N 3.3Å; M53-L56 HydrophobicContact SD-CD1 3.93Å; M53-R57 WeakPolarHBondContact O-CB 3.39Å; M53-R57 PolarHBondContact O-N 3.32Å
54C93.8Very high91.5Very high0 Ų025.3 Ų25.30%015%0.147CC..Hα-helixtrans-64.9-41.8173.9-65.70000111.7P10 L13 L16 T50 R51 I52 L56 R57 E58P10-C54 PolarHBondContact O-SG 2.93Å; P10-C54 VanDerWaalsContact O-SG 3.38Å; L13-C54 HydrophobicContact CD2-CB 3.57Å; L13-C54 HydrophobicContact CG-CB 3.85Å; L16-C54 HydrophobicContact CD1-CB 4.46Å; T50-C54 PolarHBondContact O-N 3.43Å; T50-C54 PolarHBondContact O-SG 3.25Å; R51-C54 WeakPolarHBondContact O-CB 3.46Å; R51-C54 PolarHBondContact O-N 3.29Å; I52-C54 VanDerWaalsContact C-N 3.33Å; I52-C54 PolarHBondContact O-N 3.46Å; C54-L56 VanDerWaalsContact C-N 3.34Å; C54-R57 PolarHBondContact O-N 2.94Å; C54-E58 VanDerWaalsContact O-CG 3.29Å; C54-E58 WeakPolarHBondContact O-CG 3.22Å; C54-E58 PolarHBondContact O-N 2.96Å
55I93.6Very high91.1Very high2 Ų226.6 Ų26.61%0.0115%0.146CC..Hα-helixtrans-59-47.6174.1-71.3165.7000110L13 L26 V30 F35 L38 R51 I52 R57 E58 L59 I162L13-I55 HydrophobicContact CD1-CG1 4.49Å; L13-I55 HydrophobicContact CD2-CG1 4.39Å; L26-I55 HydrophobicContact CD1-CD1 4.18Å; L26-I55 HydrophobicContact CD2-CD1 3.98Å; V30-I55 HydrophobicContact CG1-CG2 3.83Å; F35-I55 HydrophobicContact CE2-CG2 3.92Å; F35-I55 HydrophobicContact CZ-CG2 3.93Å; L38-I55 HydrophobicContact CD1-CD1 3.95Å; R51-I55 VanDerWaalsContact O-CG1 3.31Å; R51-I55 WeakPolarHBondContact O-CG1 3.47Å; R51-I55 PolarHBondContact O-N 3.12Å; I52-I55 WeakPolarHBondContact O-CB 3.17Å; I52-I55 PolarHBondContact O-N 2.89Å; I55-R57 VanDerWaalsContact C-N 3.32Å; I55-R57 PolarHBondContact O-N 3.43Å; I55-E58 PolarHBondContact O-N 3.48Å; I55-L59 HydrophobicContact CG2-CD1 3.81Å; I55-L59 HydrophobicContact CG2-CG 4.43Å; I55-L59 WeakPolarHBondContact O-CB 3.43Å; I55-L59 WeakPolarHBondContact O-CG 3.49Å; I55-L59 PolarHBondContact O-N 3.41Å; I55-I162 HydrophobicContact CG2-CD1 4.48Å
56L92.4Very high90.9Very high0 Ų033.7 Ų33.70%017%0.173CC..Hα-helixtrans-61.6-39178.6-74.7177.6000112.6I52 M53 C54 L59 Y60 V64 H92 V131I52-L56 HydrophobicContact CG2-CD1 4.19Å; I52-L56 HydrophobicContact CG2-CG 4.49Å; I52-L56 WeakPolarHBondContact O-CB 3.36Å; I52-L56 WeakPolarHBondContact O-CG 3.44Å; I52-L56 PolarHBondContact O-N 3.37Å; M53-L56 PolarHBondContact O-N 3.3Å; M53-L56 HydrophobicContact SD-CD1 3.93Å; C54-L56 VanDerWaalsContact C-N 3.34Å; L56-L59 PolarHBondContact O-N 2.68Å; L56-Y60 HydrophobicContact CD2-CD2 4.2Å; L56-Y60 HydrophobicContact CD2-CE2 4.02Å; L56-Y60 PolarHBondContact O-N 3.45Å; L56-V64 HydrophobicContact CB-CG1 4.48Å; L56-V64 HydrophobicContact CB-CG2 3.89Å; L56-H92 HydrophobicContact CD1-CB 4.42Å; L56-H92 HydrophobicContact CD2-CB 4.19Å; L56-V131 HydrophobicContact CD2-CB 3.81Å; L56-V131 HydrophobicContact CD2-CG1 3.78Å; L56-V131 HydrophobicContact CD2-CG2 4.01Å
57R91.9Very high90.7Very high63 Ų6337.6 Ų37.624%0.23819%0.194CC..Hα-helixtrans-68.1-36.3176.4-168-176176.1133.5-3112.4C11 M53 C54 I55 G61 V64 E65C11-R57 WeakPolarHBondContact O-CD 3.34Å; M53-R57 WeakPolarHBondContact O-CB 3.39Å; M53-R57 PolarHBondContact O-N 3.32Å; C54-R57 PolarHBondContact O-N 2.94Å; I55-R57 VanDerWaalsContact C-N 3.32Å; I55-R57 PolarHBondContact O-N 3.43Å; R57-G61 CarbonylContact O-C 3.48Å; R57-G61 WeakPolarHBondContact O-CA 3.42Å; R57-G61 PolarHBondContact O-N 3.01Å; R57-V64 HydrophobicContact CB-CG1 4.14Å; R57-E65 IonicContact CZ-OE1 3.24Å; R57-E65 IonicContact CZ-OE2 3.81Å; R57-E65 IonicContact NH1-OE1 3.44Å; R57-E65 PolarHBondContact NH1-OE1 3.31Å; R57-E65 IonicContact NH1-OE2 2.73Å; R57-E65 PolarHBondContact NH1-OE2 3.27Å; R57-E65 VanDerWaalsContact NH1-OE2 3.07Å
58E90.3Very high90.6Very high73 Ų7345 Ų4534%0.34122%0.217SC..Hα-helixtrans-73.5-29.1175.3-63.8-78.5164.200112L13 V30 C54 I55L13-E58 HydrophobicContact CB-CG 4.44Å; L13-E58 HydrophobicContact CD1-CG 3.99Å; L13-E58 HydrophobicContact CG-CG 4.07Å; V30-E58 HydrophobicContact CG2-CB 3.93Å; C54-E58 VanDerWaalsContact O-CG 3.29Å; C54-E58 WeakPolarHBondContact O-CG 3.22Å; C54-E58 PolarHBondContact O-N 2.96Å; I55-E58 PolarHBondContact O-N 3.48Å
59L88.9Confident90.4Very high4 Ų450 Ų502%0.02124%0.244CC..Hα-helixtrans-76.7-47.6177.2-76.4170.8000113.4V30 F35 I55 L56V30-L59 HydrophobicContact CB-CD2 3.97Å; V30-L59 HydrophobicContact CB-CG 4.26Å; V30-L59 HydrophobicContact CG1-CD1 4.48Å; V30-L59 HydrophobicContact CG1-CD2 4.09Å; V30-L59 HydrophobicContact CG1-CG 3.98Å; F35-L59 HydrophobicContact CD1-CD1 4.46Å; F35-L59 HydrophobicContact CD2-CD1 4.15Å; F35-L59 HydrophobicContact CD2-CD2 4.21Å; F35-L59 HydrophobicContact CE1-CD1 4.25Å; F35-L59 HydrophobicContact CE2-CD1 3.93Å; F35-L59 HydrophobicContact CG-CD1 4.4Å; F35-L59 HydrophobicContact CG-CD2 4.49Å; F35-L59 HydrophobicContact CZ-CD1 3.96Å; I55-L59 HydrophobicContact CG2-CD1 3.81Å; I55-L59 HydrophobicContact CG2-CG 4.43Å; I55-L59 WeakPolarHBondContact O-CB 3.43Å; I55-L59 WeakPolarHBondContact O-CG 3.49Å; I55-L59 PolarHBondContact O-N 3.41Å; L56-L59 PolarHBondContact O-N 2.68Å
60Y87.8Confident90.2Very high9 Ų950 Ų504%0.03525%0.245CC..Hα-helixtrans-116.30.7-169.8-59-69.1000114L56 Y91 R127 F129 V131L56-Y60 HydrophobicContact CD2-CD2 4.2Å; L56-Y60 HydrophobicContact CD2-CE2 4.02Å; L56-Y60 PolarHBondContact O-N 3.45Å; Y60-Y91 AromaticContact CD1-CD1 3.89Å; Y60-Y91 HydrophobicContact CD1-CD1 3.89Å; Y60-Y91 AromaticContact CD1-CG 3.98Å; Y60-Y91 HydrophobicContact CD1-CG 3.98Å; Y60-Y91 HydrophobicContact CG-CD1 4.26Å; Y60-Y91 AromaticContact CG-CG 3.9Å; Y60-Y91 HydrophobicContact CG-CG 3.9Å; Y60-R127 HydrophobicContact CE1-CB 4.09Å; Y60-F129 VanDerWaalsContact OH-CD2 3.28Å; Y60-F129 WeakPolarHBondContact OH-CD2 3.45Å; Y60-F129 VanDerWaalsContact OH-CE2 3.3Å; Y60-F129 WeakPolarHBondContact OH-CE2 3.44Å; Y60-F129 PolarHBondContact OH-O 3.36Å; Y60-V131 HydrophobicContact CE2-CB 4.27Å; Y60-V131 HydrophobicContact CE2-CG2 3.82Å; Y60-V131 WeakPolarHBondContact OH-CG2 3.46Å; Y60-V131 PolarHBondContact OH-N 2.68Å
61G88.1Confident89.9Confident24 Ų2454.5 Ų54.525%0.24726%0.264CS..G310 helixtrans75.5-163.1-176.400000113.9R57 G63 V64R57-G61 CarbonylContact O-C 3.48Å; R57-G61 WeakPolarHBondContact O-CA 3.42Å; R57-G61 PolarHBondContact O-N 3.01Å; G61-G63 VanDerWaalsContact C-N 3.27Å; G61-G63 PolarHBondContact O-N 3.18Å; G61-V64 WeakPolarHBondContact O-CG1 3.37Å
62V87.4Confident89.2Confident92 Ų9256 Ų5656%0.55827%0.272SS*.G310 helixtrans-72.1-17.1-173.4-58.60000114V64 E65V62-V64 PolarHBondContact O-N 2.68Å; V62-V64 VanDerWaalsContact O-N 3.12Å; V62-E65 PolarHBondContact O-N 3.31Å
63G83.9Confident88.8Confident18 Ų1860.7 Ų60.719%0.18630%0.3CS..G310 helixtrans-62.6-19.4179.500000113.4G61 E65 K66G61-G63 VanDerWaalsContact C-N 3.27Å; G61-G63 PolarHBondContact O-N 3.18Å; G63-E65 PolarHBondContact O-N 3.01Å; G63-K66 PolarHBondContact O-N 2.96Å
64V86.9Confident88.1Confident1 Ų159.8 Ų59.81%0.00630%0.296CS..G310 helixtrans-67.5-20.1179.983.70000114L56 R57 G61 V62 K66 S89 H92L56-V64 HydrophobicContact CB-CG1 4.48Å; L56-V64 HydrophobicContact CB-CG2 3.89Å; R57-V64 HydrophobicContact CB-CG1 4.14Å; G61-V64 WeakPolarHBondContact O-CG1 3.37Å; V62-V64 PolarHBondContact O-N 2.68Å; V62-V64 VanDerWaalsContact O-N 3.12Å; V64-K66 VanDerWaalsContact C-N 3.29Å; V64-S89 PolarHBondContact O-OG 3.42Å; V64-H92 VanDerWaalsContact CG2-CE1 3.43Å; V64-H92 WeakPolarHBondContact CG2-CE1 3.19Å; V64-H92 WeakPolarHBondContact CG2-ND1 3.4Å; V64-H92 PolarHBondContact O-CE1 3.03Å
65E85.1Confident87.6Confident88 Ų8863.5 Ų63.541%0.41132%0.319SS..G310 helixtrans-81-13-179.3-58.1-174.8148.700112.2R57 V62 G63 L67R57-E65 IonicContact CZ-OE1 3.24Å; R57-E65 IonicContact CZ-OE2 3.81Å; R57-E65 IonicContact NH1-OE1 3.44Å; R57-E65 PolarHBondContact NH1-OE1 3.31Å; R57-E65 IonicContact NH1-OE2 2.73Å; R57-E65 PolarHBondContact NH1-OE2 3.27Å; R57-E65 VanDerWaalsContact NH1-OE2 3.07Å; V62-E65 PolarHBondContact O-N 3.31Å; G63-E65 PolarHBondContact O-N 3.01Å; E65-L67 PolarHBondContact O-N 3.22Å; E65-L67 VanDerWaalsContact O-N 3.07Å
66K86.5Confident86.9Confident159 Ų15963.9 Ų63.969%0.69132%0.321SS*.  trans-78.992.5172.2-62.1-177.4-178178.80108.4G63 V64 S89G63-K66 PolarHBondContact O-N 2.96Å; V64-K66 VanDerWaalsContact C-N 3.29Å; K66-S89 PolarHBondContact O-OG 3.11Å; K66-S89 VanDerWaalsContact O-OG 3.08Å
67L88.4Confident86.2Confident82 Ų8269.2 Ų69.243%0.42936%0.356SS..  trans-98.5144-179.3-56.7169.9000110.3E65 I87 A88E65-L67 PolarHBondContact O-N 3.22Å; E65-L67 VanDerWaalsContact O-N 3.07Å; L67-I87 HydrophobicContact CB-CG2 3.99Å; L67-I87 HydrophobicContact CD1-CG2 4.21Å; L67-I87 HydrophobicContact CD2-CG2 4Å; L67-I87 HydrophobicContact CG-CG2 4.28Å; L67-A88 CarbonylContact C-O 3.58Å
68R91.3Very high85.6Confident169 Ų16971.2 Ų71.264%0.63838%0.379SS*.EExtended strand (participates in β ladder)trans-126.3141.5172.1-63.5178.8-177.9169.40.7108.2A88R68-A88 PolarHBondContact N-O 3.46Å; R68-A88 PolarHBondContact O-N 3.15Å
69I90.8Very high85.2Confident120 Ų12076.5 Ų76.562%0.61540%0.401SS*.EExtended strand (participates in β ladder)trans-92.3120173.4-58.4175.6000107
70E88.4Confident85Confident82 Ų8283.3 Ų83.338%0.38343%0.431SS..EExtended strand (participates in β ladder)trans-112.2128.7177.3-68-177.1-179.200109.6T86 A88E70-T86 PolarHBondContact N-O 3.45Å; E70-T86 PolarHBondContact O-N 3.26Å; E70-T86 PolarHBondContact O-OG1 2.9Å; E70-A88 HydrophobicContact CG-CB 4.15Å
71H87.6Confident84.8Confident118 Ų11890.3 Ų90.355%0.54646%0.461SS..EExtended strand (participates in β ladder)trans-96.9114.8176.8-70.8-102.3000108.9E83H71-E83 HydrophobicContact CB-CG 4.49Å; H71-E83 WeakPolarHBondContact CB-OE1 3.4Å; H71-E83 IonicContact CE1-OE1 2.94Å; H71-E83 IonicContact CG-OE1 3.91Å; H71-E83 IonicContact ND1-OE1 3.97Å; H71-E83 PolarHBondContact ND1-OE1 3.31Å
72Q82Confident84.6Confident39 Ų3990.6 Ų90.618%0.18246%0.457CS..EExtended strand (participates in β ladder)trans-110.5125.7-179.6-59.8-16421.300109.9I84 M111Q72-I84 PolarHBondContact N-O 2.9Å; Q72-I84 PolarHBondContact O-N 2.92Å; Q72-M111 HydrophobicContact CB-CE 4.48Å; Q72-M111 PolarHBondContact OE1-SD 3.09Å
73T85.4Confident84.5Confident98 Ų9892 Ų9260%0.60146%0.457SS*.EExtended strand (participates in β ladder)trans-96.311817764.50000109.7E83T73-E83 HydrophobicContact CG2-CG 4.33Å
74I80.3Confident84.6Confident15 Ų1591.4 Ų91.48%0.07745%0.45CS..EExtended strand (participates in β ladder)trans-112.6131.2-178.2-60.8161.3000108.4I82 I84 V106 I107 M111I74-I82 PolarHBondContact N-O 3.34Å; I74-I82 PolarHBondContact O-N 3.39Å; I74-I84 HydrophobicContact CD1-CD1 3.91Å; I74-V106 HydrophobicContact CG2-CG1 3.96Å; I74-I107 HydrophobicContact CD1-CB 4.1Å; I74-I107 HydrophobicContact CD1-CG1 3.52Å; I74-I107 HydrophobicContact CD1-CG2 3.99Å; I74-I107 HydrophobicContact CG2-CG1 4.31Å; I74-M111 HydrophobicContact CD1-CE 3.57Å; I74-M111 HydrophobicContact CG1-CE 4.2Å
75T82.5Confident84.7Confident78 Ų7894.4 Ų94.448%0.47947%0.471SS..EExtended strand (participates in β ladder)trans-93.2121.5177.6-54.20000108.9
76T79.6Confident84.8Confident10 Ų1090.2 Ų90.26%0.06145%0.451CS..  trans-69.5160.9173.759.80000111.5S78 K79 K80 I82 S103T76-S78 PolarHBondContact O-N 2.97Å; T76-K79 PolarHBondContact O-N 3.45Å; T76-K80 WeakPolarHBondContact CB-O 3.22Å; T76-K80 WeakPolarHBondContact CG2-O 3.2Å; T76-K80 PolarHBondContact N-O 2.88Å; T76-K80 WeakPolarHBondContact OG1-CA 3.43Å; T76-K80 WeakPolarHBondContact OG1-CB 3.49Å; T76-K80 PolarHBondContact OG1-N 3.47Å; T76-K80 PolarHBondContact OG1-O 2.92Å; T76-I82 HydrophobicContact CG2-CD1 3.52Å; T76-I82 HydrophobicContact CG2-CG1 4.03Å; T76-S103 VanDerWaalsContact CG2-OG 3.25Å; T76-S103 WeakPolarHBondContact CG2-OG 3.47Å
77P77.8Confident85.1Confident111 Ų11185.4 Ų85.472%0.72143%0.432SS*.THydrogen-bonded Turntrans-56.1-24.4171.722.7-34.8000113K79P77-K79 VanDerWaalsContact C-N 3.27Å; P77-K79 PolarHBondContact O-N 3.35Å
78S79.4Confident85.1Confident105 Ų10581.9 Ų81.973%0.73442%0.415SS*.THydrogen-bonded Turntrans-85.613.7176.2-49.20000114T76 K80T76-S78 PolarHBondContact O-N 2.97Å; S78-K80 PolarHBondContact O-N 3.34Å
79K81.5Confident85Confident184 Ų18474.6 Ų74.680%0.839%0.39SS*.SBendtrans60.56.4-175.8-62-179.3179.4177.40115.8T76 P77 K81T76-K79 PolarHBondContact O-N 3.45Å; P77-K79 VanDerWaalsContact C-N 3.27Å; P77-K79 PolarHBondContact O-N 3.35Å; K79-K81 PolarHBondContact O-N 3.26Å
80K83.4Confident84.7Confident147 Ų14773 Ų7364%0.63938%0.383SS*.  trans-71.7127169.1-174.4-176.9179.9-177.60108.8T76 S78T76-K80 WeakPolarHBondContact CB-O 3.22Å; T76-K80 WeakPolarHBondContact CG2-O 3.2Å; T76-K80 PolarHBondContact N-O 2.88Å; T76-K80 WeakPolarHBondContact OG1-CA 3.43Å; T76-K80 WeakPolarHBondContact OG1-CB 3.49Å; T76-K80 PolarHBondContact OG1-N 3.47Å; T76-K80 PolarHBondContact OG1-O 2.92Å; S78-K80 PolarHBondContact O-N 3.34Å
81K84.7Confident84.7Confident156 Ų15671 Ų7168%0.67837%0.372SS*.EExtended strand (participates in β ladder)trans-85128.8171.8-64-175.9179.8-177.20109K79K79-K81 PolarHBondContact O-N 3.26Å
82I84.4Confident84.8Confident30 Ų3065.5 Ų65.515%0.15435%0.347CS..EExtended strand (participates in β ladder)trans-116.7129.7173.8-59.7175000106.5I74 T76 I84 A100I74-I82 PolarHBondContact N-O 3.34Å; I74-I82 PolarHBondContact O-N 3.39Å; T76-I82 HydrophobicContact CG2-CD1 3.52Å; T76-I82 HydrophobicContact CG2-CG1 4.03Å; I82-I84 HydrophobicContact CG2-CG1 4.13Å; I82-A100 HydrophobicContact CD1-CB 4.39Å; I82-A100 HydrophobicContact CG2-CB 4.1Å
83E85.6Confident85.3Confident123 Ų12364.3 Ų64.358%0.57534%0.341SS*.EExtended strand (participates in β ladder)trans-97.6134174.7-168.2-178.115700109.1H71 T73H71-E83 HydrophobicContact CB-CG 4.49Å; H71-E83 WeakPolarHBondContact CB-OE1 3.4Å; H71-E83 IonicContact CE1-OE1 2.94Å; H71-E83 IonicContact CG-OE1 3.91Å; H71-E83 IonicContact ND1-OE1 3.97Å; H71-E83 PolarHBondContact ND1-OE1 3.31Å; T73-E83 HydrophobicContact CG2-CG 4.33Å
84I85.7Confident85.7Confident4 Ų460.8 Ų60.82%0.02132%0.318CS..EExtended strand (participates in β ladder)trans-128132.1179.4-54.9-179.3000108.3Q72 I74 I82 T86 V95 A100 I107Q72-I84 PolarHBondContact N-O 2.9Å; Q72-I84 PolarHBondContact O-N 2.92Å; I74-I84 HydrophobicContact CD1-CD1 3.91Å; I82-I84 HydrophobicContact CG2-CG1 4.13Å; I84-T86 HydrophobicContact CG2-CG2 4.39Å; I84-V95 HydrophobicContact CG2-CG2 4.32Å; I84-A100 HydrophobicContact CD1-CB 3.96Å; I84-I107 HydrophobicContact CD1-CB 4.17Å; I84-I107 HydrophobicContact CD1-CD1 3.27Å; I84-I107 HydrophobicContact CD1-CG1 3.46Å; I84-I107 VanDerWaalsContact CD1-CG1 3.46Å; I84-I107 HydrophobicContact CD1-CG2 3.64Å
85S87.9Confident86.2Confident64 Ų6460.2 Ų60.245%0.44832%0.315SS..EExtended strand (participates in β ladder)trans-82.7125.1169.750.90000109.4
86T88.6Confident86.6Confident0 Ų057.8 Ų57.80%030%0.3CS..EExtended strand (participates in β ladder)trans-117.4139.5173.957.80000108.5E70 I84 V95 M111E70-T86 PolarHBondContact N-O 3.45Å; E70-T86 PolarHBondContact O-N 3.26Å; E70-T86 PolarHBondContact O-OG1 2.9Å; I84-T86 HydrophobicContact CG2-CG2 4.39Å; T86-V95 HydrophobicContact CG2-CB 4.01Å; T86-V95 HydrophobicContact CG2-CG2 3.81Å; T86-M111 HydrophobicContact CG2-SD 4.14Å
87I91.5Very high86.8Confident58 Ų5857.4 Ų57.430%0.29730%0.297SS..EExtended strand (participates in β ladder)trans-99.9107.5175.6-59.3173.6000106.1L67 E94L67-I87 HydrophobicContact CB-CG2 3.99Å; L67-I87 HydrophobicContact CD1-CG2 4.21Å; L67-I87 HydrophobicContact CD2-CG2 4Å; L67-I87 HydrophobicContact CG-CG2 4.28Å; I87-E94 HydrophobicContact CB-CB 4.2Å; I87-E94 PolarHBondContact N-O 3.1Å; I87-E94 PolarHBondContact O-N 2.97Å
88A89.5Confident87Confident8 Ų853.2 Ų53.27%0.06627%0.271CS..EExtended strand (participates in β ladder)trans-105.8142.2-177.400000110.9L67 R68 E70 L93L67-A88 CarbonylContact C-O 3.58Å; R68-A88 PolarHBondContact N-O 3.46Å; R68-A88 PolarHBondContact O-N 3.15Å; E70-A88 HydrophobicContact CG-CB 4.15Å; A88-L93 HydrophobicContact CB-CD1 4.39Å
89S88.8Confident87.2Confident17 Ų1753.2 Ų53.212%0.11926%0.262CS..  trans-119.5172.5161.9-170.50000108.2V64 K66 Y91 H92V64-S89 PolarHBondContact O-OG 3.42Å; K66-S89 PolarHBondContact O-OG 3.11Å; K66-S89 VanDerWaalsContact O-OG 3.08Å; S89-Y91 PolarHBondContact O-N 2.73Å; S89-Y91 VanDerWaalsContact O-N 3.12Å; S89-H92 WeakPolarHBondContact CB-CE1 3.41Å; S89-H92 VanDerWaalsContact CB-ND1 3.32Å; S89-H92 WeakPolarHBondContact CB-ND1 3.37Å; S89-H92 PolarHBondContact N-O 3.36Å
90N84.6Confident87Confident87 Ų8745 Ų4547%0.46523%0.229SC..SBendtrans-58.7-27.9175.9-65.3-13.8000112.3
91Y87.3Confident86.9Confident38 Ų3839.8 Ų39.815%0.14922%0.217CC..SBendtrans-111.7-22.6-171.5-49.2-74.9000114.8Y60 S89 K130 V131Y60-Y91 AromaticContact CD1-CD1 3.89Å; Y60-Y91 HydrophobicContact CD1-CD1 3.89Å; Y60-Y91 AromaticContact CD1-CG 3.98Å; Y60-Y91 HydrophobicContact CD1-CG 3.98Å; Y60-Y91 HydrophobicContact CG-CD1 4.26Å; Y60-Y91 AromaticContact CG-CG 3.9Å; Y60-Y91 HydrophobicContact CG-CG 3.9Å; S89-Y91 PolarHBondContact O-N 2.73Å; S89-Y91 VanDerWaalsContact O-N 3.12Å; Y91-K130 WeakPolarHBondContact O-CA 3.36Å; Y91-V131 PolarHBondContact O-N 3.43Å; Y91-V131 VanDerWaalsContact O-N 3.15Å
92H90.6Very high86.9Confident4 Ų439.7 Ų39.72%0.01922%0.224CC..EExtended strand (participates in β ladder)trans-143.2158.2-177.677.7-77.9000112.5L56 V64 S89 V131L56-H92 HydrophobicContact CD1-CB 4.42Å; L56-H92 HydrophobicContact CD2-CB 4.19Å; V64-H92 VanDerWaalsContact CG2-CE1 3.43Å; V64-H92 WeakPolarHBondContact CG2-CE1 3.19Å; V64-H92 WeakPolarHBondContact CG2-ND1 3.4Å; V64-H92 PolarHBondContact O-CE1 3.03Å; S89-H92 WeakPolarHBondContact CB-CE1 3.41Å; S89-H92 VanDerWaalsContact CB-ND1 3.32Å; S89-H92 WeakPolarHBondContact CB-ND1 3.37Å; S89-H92 PolarHBondContact N-O 3.36Å; H92-V131 CarbonylContact C-O 3.47Å; H92-V131 WeakPolarHBondContact CA-O 3.48Å; H92-V131 HydrophobicContact CB-CB 4.04Å; H92-V131 HydrophobicContact CB-CG1 4.49Å; H92-V131 VanDerWaalsContact CB-O 3.27Å; H92-V131 WeakPolarHBondContact CB-O 3Å
93L91.9Very high86.9Confident13 Ų1339.6 Ų39.67%0.06823%0.226CC..EExtended strand (participates in β ladder)trans-127.8120.3175.6-179131.1000109.3A88 V95 V115 V131 V132 L133A88-L93 HydrophobicContact CB-CD1 4.39Å; L93-V95 HydrophobicContact CD2-CB 4.02Å; L93-V95 HydrophobicContact CD2-CG1 3.85Å; L93-V115 HydrophobicContact CB-CG2 4.09Å; L93-V115 HydrophobicContact CD1-CG2 4.09Å; L93-V115 HydrophobicContact CD2-CG2 4.28Å; L93-V115 HydrophobicContact CG-CG2 4.39Å; L93-V131 PolarHBondContact N-O 2.97Å; L93-V132 HydrophobicContact CD2-CG1 4.3Å; L93-V132 CarbonylContact O-C 3.51Å; L93-V132 WeakPolarHBondContact O-CA 3.34Å; L93-L133 PolarHBondContact O-N 2.79Å
94E93.4Very high86.9Confident24 Ų2433.9 Ų33.911%0.11220%0.199CC..EExtended strand (participates in β ladder)trans-96.4125170.5175.8176.4-176.900109.5K49 I87 L133 T135K49-E94 IonicContact NZ-OE1 3.77Å; K49-E94 PolarHBondContact NZ-OE1 3.38Å; I87-E94 HydrophobicContact CB-CB 4.2Å; I87-E94 PolarHBondContact N-O 3.1Å; I87-E94 PolarHBondContact O-N 2.97Å; E94-L133 WeakPolarHBondContact CA-O 3.37Å; E94-L133 HydrophobicContact CB-CB 4.23Å; E94-L133 HydrophobicContact CB-CD2 4.08Å; E94-L133 HydrophobicContact CB-CG 4.31Å; E94-L133 HydrophobicContact CG-CD2 3.89Å; E94-L133 HydrophobicContact CG-CG 4.11Å; E94-T135 HydrophobicContact CG-CG2 4.28Å
95V91.5Very high87.1Confident3 Ų338.1 Ų38.12%0.01822%0.215CC..EExtended strand (participates in β ladder)trans-137.6141.5177.458.10000110.3I84 T86 L93 P97 L133 L134 T135I84-V95 HydrophobicContact CG2-CG2 4.32Å; T86-V95 HydrophobicContact CG2-CB 4.01Å; T86-V95 HydrophobicContact CG2-CG2 3.81Å; L93-V95 HydrophobicContact CD2-CB 4.02Å; L93-V95 HydrophobicContact CD2-CG1 3.85Å; V95-P97 WeakPolarHBondContact O-CD 3.43Å; V95-L133 PolarHBondContact N-O 3.43Å; V95-L134 HydrophobicContact CG1-CD2 3.26Å; V95-T135 PolarHBondContact O-N 2.79Å; V95-T135 VanDerWaalsContact O-N 3.17Å
96N91Very high87.2Confident28 Ų2836.5 Ų36.515%0.1520%0.203CC..  trans-103.690.9169.8-165.128.4000110.4S98 D99 T135N96-S98 VanDerWaalsContact CG-OG 3.32Å; N96-S98 PolarHBondContact ND2-OG 3.37Å; N96-S98 VanDerWaalsContact ND2-OG 3.14Å; N96-S98 PolarHBondContact O-N 2.83Å; N96-S98 PolarHBondContact OD1-OG 3.46Å; N96-S98 VanDerWaalsContact OD1-OG 3.05Å; N96-D99 PolarHBondContact ND2-OD1 2.89Å; N96-D99 PolarHBondContact ND2-OD2 3.46Å; N96-D99 PolarHBondContact O-N 3.39Å; N96-T135 WeakPolarHBondContact CB-OG1 3.45Å; N96-T135 PolarHBondContact OD1-O 3.23Å; N96-T135 PolarHBondContact OD1-OG1 2.93Å; N96-T135 VanDerWaalsContact OD1-OG1 3.08Å
97P84.4Confident87.1Confident1 Ų136.6 Ų36.61%0.00620%0.203CC..G310 helixtrans-69.1-13.8-175.228.5-36.5000113.8V95 D99 I108 L140V95-P97 WeakPolarHBondContact O-CD 3.43Å; P97-D99 VanDerWaalsContact C-N 3.26Å; P97-D99 PolarHBondContact O-N 2.89Å; P97-I108 HydrophobicContact CB-CD1 4.5Å; P97-I108 HydrophobicContact CB-CG1 4.05Å; P97-L140 HydrophobicContact CB-CD2 3.87Å; P97-L140 HydrophobicContact CG-CD1 4.22Å; P97-L140 HydrophobicContact CG-CD2 3.66Å; P97-L140 HydrophobicContact CG-CG 4.25Å
98S82.1Confident87Confident24 Ų2434 Ų3417%0.16819%0.19CC..G310 helixtrans-68.3-22.9179.1590000113.8N96 A100 G101N96-S98 VanDerWaalsContact CG-OG 3.32Å; N96-S98 PolarHBondContact ND2-OG 3.37Å; N96-S98 VanDerWaalsContact ND2-OG 3.14Å; N96-S98 PolarHBondContact O-N 2.83Å; N96-S98 PolarHBondContact OD1-OG 3.46Å; N96-S98 VanDerWaalsContact OD1-OG 3.05Å; S98-A100 PolarHBondContact O-N 3.48Å; S98-A100 VanDerWaalsContact O-N 3.13Å; S98-G101 PolarHBondContact O-N 3.22Å
99D82.1Confident86.9Confident104 Ų10436.7 Ų36.756%0.55620%0.201SC*.G310 helixtrans-67.3-17.6-174-64.3-15.8000112.5N96 P97N96-D99 PolarHBondContact ND2-OD1 2.89Å; N96-D99 PolarHBondContact ND2-OD2 3.46Å; N96-D99 PolarHBondContact O-N 3.39Å; P97-D99 VanDerWaalsContact C-N 3.26Å; P97-D99 PolarHBondContact O-N 2.89Å
100A78.6Confident86.9Confident12 Ų1239.4 Ų39.410%0.09921%0.212CC..G310 helixtrans-91.26.217600000115.1I82 I84 S98 N102 S103 I107I82-A100 HydrophobicContact CD1-CB 4.39Å; I82-A100 HydrophobicContact CG2-CB 4.1Å; I84-A100 HydrophobicContact CD1-CB 3.96Å; S98-A100 PolarHBondContact O-N 3.48Å; S98-A100 VanDerWaalsContact O-N 3.13Å; A100-N102 PolarHBondContact O-N 3.11Å; A100-S103 PolarHBondContact O-N 3.41Å; A100-I107 HydrophobicContact CB-CD1 2.91Å; A100-I107 HydrophobicContact CB-CG1 4.36Å
101G81.8Confident87Confident38 Ų3835.4 Ų35.439%0.39219%0.19SC..G310 helixtrans53.4-125.4-17900000112.1S98 S103 D104S98-G101 PolarHBondContact O-N 3.22Å; G101-S103 PolarHBondContact O-N 3.13Å; G101-S103 VanDerWaalsContact O-N 3.07Å; G101-D104 WeakPolarHBondContact O-CB 3.23Å; G101-D104 PolarHBondContact O-N 2.86Å
102N83.3Confident87Confident153 Ų15333.7 Ų33.782%0.81818%0.184SC*.G310 helixtrans-69.5-4.7-174.7-67.7-2.8000115.2A100A100-N102 PolarHBondContact O-N 3.11Å
103S84.5Confident86.9Confident29 Ų2937 Ų3720%0.20320%0.198CC..G310 helixtrans-97.34.7178.1-61.40000113.6T76 A100 G101 R105 V106 I107T76-S103 VanDerWaalsContact CG2-OG 3.25Å; T76-S103 WeakPolarHBondContact CG2-OG 3.47Å; A100-S103 PolarHBondContact O-N 3.41Å; G101-S103 PolarHBondContact O-N 3.13Å; G101-S103 VanDerWaalsContact O-N 3.07Å; S103-R105 PolarHBondContact O-N 3.5Å; S103-R105 VanDerWaalsContact O-N 3.11Å; S103-V106 PolarHBondContact O-N 2.87Å; S103-V106 VanDerWaalsContact O-N 3.1Å; S103-I107 WeakPolarHBondContact O-CD1 3.32Å
104D86.9Confident86.7Confident2 Ų238.7 Ų38.71%0.01121%0.209CC..Hα-helixtrans-46.5-37.1177.860.1-10000114.1G101 V106 I107 I108 L140 T141 A144G101-D104 WeakPolarHBondContact O-CB 3.23Å; G101-D104 PolarHBondContact O-N 2.86Å; D104-V106 PolarHBondContact O-N 3.3Å; D104-I107 PolarHBondContact O-N 2.73Å; D104-I108 WeakPolarHBondContact O-CG1 3.43Å; D104-I108 PolarHBondContact O-N 3.15Å; D104-I108 VanDerWaalsContact O-N 3.1Å; D104-L140 HydrophobicContact CB-CD2 3.85Å; D104-T141 VanDerWaalsContact CG-OG1 3.26Å; D104-T141 PolarHBondContact OD1-OG1 3.21Å; D104-T141 WeakPolarHBondContact OD2-CB 3.3Å; D104-T141 VanDerWaalsContact OD2-CG2 3.3Å; D104-T141 WeakPolarHBondContact OD2-CG2 3.49Å; D104-T141 PolarHBondContact OD2-N 3.48Å; D104-T141 PolarHBondContact OD2-OG1 3.07Å; D104-A144 HydrophobicContact CB-CB 4.08Å; D104-A144 WeakPolarHBondContact OD1-CB 3.46Å; D104-A144 WeakPolarHBondContact OD2-CB 3.27Å
105R89.9Confident86.4Confident93 Ų9338.1 Ų38.135%0.35121%0.207SC..Hα-helixtrans-55.8-45.1177.8-169.6-17268.673.1-5.1113.6S103 I107 Q109 A144 A147S103-R105 PolarHBondContact O-N 3.5Å; S103-R105 VanDerWaalsContact O-N 3.11Å; R105-I107 VanDerWaalsContact C-N 3.34Å; R105-Q109 WeakPolarHBondContact O-CG 3.46Å; R105-Q109 PolarHBondContact O-N 2.88Å; R105-A144 HydrophobicContact CB-CB 4.27Å; R105-A147 HydrophobicContact CG-CB 3.67Å
106V88.3Confident86.1Confident31 Ų3139 Ų3919%0.18822%0.215CC..Hα-helixtrans-70.9-37.4-176.1177.70000110I74 S103 D104 Q109 E110I74-V106 HydrophobicContact CG2-CG1 3.96Å; S103-V106 PolarHBondContact O-N 2.87Å; S103-V106 VanDerWaalsContact O-N 3.1Å; D104-V106 PolarHBondContact O-N 3.3Å; V106-Q109 PolarHBondContact O-N 3.46Å; V106-E110 PolarHBondContact O-N 3.48Å
107I86.6Confident85.7Confident2 Ų244.1 Ų44.11%0.0124%0.238CC..Hα-helixtrans-65.4-47.9-178.2-65.1147000110.4I74 I84 A100 S103 D104 R105 Q109 E110 M111I74-I107 HydrophobicContact CD1-CB 4.1Å; I74-I107 HydrophobicContact CD1-CG1 3.52Å; I74-I107 HydrophobicContact CD1-CG2 3.99Å; I74-I107 HydrophobicContact CG2-CG1 4.31Å; I84-I107 HydrophobicContact CD1-CB 4.17Å; I84-I107 HydrophobicContact CD1-CD1 3.27Å; I84-I107 HydrophobicContact CD1-CG1 3.46Å; I84-I107 VanDerWaalsContact CD1-CG1 3.46Å; I84-I107 HydrophobicContact CD1-CG2 3.64Å; A100-I107 HydrophobicContact CB-CD1 2.91Å; A100-I107 HydrophobicContact CB-CG1 4.36Å; S103-I107 WeakPolarHBondContact O-CD1 3.32Å; D104-I107 PolarHBondContact O-N 2.73Å; R105-I107 VanDerWaalsContact C-N 3.34Å; I107-Q109 PolarHBondContact O-N 3.26Å; I107-E110 PolarHBondContact O-N 2.95Å; I107-M111 HydrophobicContact CG2-CG 3.84Å; I107-M111 WeakPolarHBondContact O-CB 3.33Å; I107-M111 WeakPolarHBondContact O-CG 3.42Å; I107-M111 PolarHBondContact O-N 3.42Å
108I90Very high85.5Confident3 Ų346.4 Ų46.42%0.01525%0.254CS..Hα-helixtrans-57.1-41.3177.3-68.7177.3000111.2P97 D104 L112 L140 A144 L148P97-I108 HydrophobicContact CB-CD1 4.5Å; P97-I108 HydrophobicContact CB-CG1 4.05Å; D104-I108 WeakPolarHBondContact O-CG1 3.43Å; D104-I108 PolarHBondContact O-N 3.15Å; D104-I108 VanDerWaalsContact O-N 3.1Å; I108-L112 HydrophobicContact CG2-CD1 3.8Å; I108-L112 VanDerWaalsContact O-CB 3.31Å; I108-L112 WeakPolarHBondContact O-CB 3.29Å; I108-L112 WeakPolarHBondContact O-CD1 3.32Å; I108-L112 VanDerWaalsContact O-CG 3.31Å; I108-L112 WeakPolarHBondContact O-CG 3.44Å; I108-L112 PolarHBondContact O-N 3.49Å; I108-L140 HydrophobicContact CD1-CD1 3.72Å; I108-L140 HydrophobicContact CD1-CD2 3.95Å; I108-L140 HydrophobicContact CD1-CG 4.49Å; I108-A144 HydrophobicContact CD1-CB 3.89Å; I108-L148 HydrophobicContact CD1-CB 4.31Å; I108-L148 HydrophobicContact CG2-CB 3.94Å; I108-L148 HydrophobicContact CG2-CD1 3.68Å; I108-L148 HydrophobicContact CG2-CG 4.42Å
109Q88Confident84.4Confident64 Ų6452.4 Ų52.430%0.29928%0.279SS..Hα-helixtrans-67.4-46.4-180-71.1-179.3-24.600112.1R105 V106 I107 K113 A147R105-Q109 WeakPolarHBondContact O-CG 3.46Å; R105-Q109 PolarHBondContact O-N 2.88Å; V106-Q109 PolarHBondContact O-N 3.46Å; I107-Q109 PolarHBondContact O-N 3.26Å; Q109-K113 WeakPolarHBondContact O-CB 3.5Å; Q109-K113 PolarHBondContact O-N 3.28Å; Q109-K113 VanDerWaalsContact O-N 3.12Å; Q109-A147 HydrophobicContact CG-CB 4.17Å
110E88Confident83.4Confident74 Ų7449.3 Ų49.335%0.34626%0.261SS..Hα-helixtrans-72.9-43.9-176.7-159.561-152.800111.6V106 I107 L112 K113 T114V106-E110 PolarHBondContact O-N 3.48Å; I107-E110 PolarHBondContact O-N 2.95Å; E110-L112 PolarHBondContact O-N 2.97Å; E110-K113 WeakPolarHBondContact O-CB 3.45Å; E110-K113 PolarHBondContact O-N 2.98Å; E110-K113 IonicContact OE1-NZ 3.08Å; E110-T114 WeakPolarHBondContact O-CG2 3.29Å; E110-T114 PolarHBondContact O-N 3.4Å; E110-T114 PolarHBondContact O-OG1 2.9Å
111M86.4Confident82.3Confident4 Ų456.5 Ų56.52%0.0230%0.297CS..Hα-helixtrans-61.6-44.2178.5-64.8-54.292.100112Q72 I74 T86 I107 K113 T114 V115Q72-M111 HydrophobicContact CB-CE 4.48Å; Q72-M111 PolarHBondContact OE1-SD 3.09Å; I74-M111 HydrophobicContact CD1-CE 3.57Å; I74-M111 HydrophobicContact CG1-CE 4.2Å; T86-M111 HydrophobicContact CG2-SD 4.14Å; I107-M111 HydrophobicContact CG2-CG 3.84Å; I107-M111 WeakPolarHBondContact O-CB 3.33Å; I107-M111 WeakPolarHBondContact O-CG 3.42Å; I107-M111 PolarHBondContact O-N 3.42Å; M111-K113 VanDerWaalsContact C-N 3.3Å; M111-K113 PolarHBondContact O-N 3.22Å; M111-T114 WeakPolarHBondContact CA-OG1 3.4Å; M111-T114 PolarHBondContact O-N 2.88Å; M111-T114 PolarHBondContact O-OG1 3.49Å; M111-V115 VanDerWaalsContact O-CG2 3.28Å; M111-V115 WeakPolarHBondContact O-CG2 3.45Å; M111-V115 PolarHBondContact O-N 3.32Å
112L88.4Confident80.9Confident1 Ų160.8 Ų60.81%0.00531%0.307CS..Hα-helixtrans-69.1-32.7178.3-73.6172.3000111.6I108 E110 A116 V132 L148 T151 L161I108-L112 HydrophobicContact CG2-CD1 3.8Å; I108-L112 VanDerWaalsContact O-CB 3.31Å; I108-L112 WeakPolarHBondContact O-CB 3.29Å; I108-L112 WeakPolarHBondContact O-CD1 3.32Å; I108-L112 VanDerWaalsContact O-CG 3.31Å; I108-L112 WeakPolarHBondContact O-CG 3.44Å; I108-L112 PolarHBondContact O-N 3.49Å; E110-L112 PolarHBondContact O-N 2.97Å; L112-A116 WeakPolarHBondContact O-CB 3.21Å; L112-A116 PolarHBondContact O-N 3.12Å; L112-V132 HydrophobicContact CD2-CB 4Å; L112-V132 HydrophobicContact CD2-CG1 3.91Å; L112-V132 HydrophobicContact CD2-CG2 3.92Å; L112-L148 HydrophobicContact CD1-CD1 3.78Å; L112-T151 HydrophobicContact CB-CG2 3.44Å; L112-T151 VanDerWaalsContact CB-CG2 3.44Å; L112-T151 HydrophobicContact CD1-CG2 3.43Å; L112-T151 VanDerWaalsContact CD1-CG2 3.43Å; L112-T151 HydrophobicContact CG-CG2 4.06Å; L112-L161 HydrophobicContact CD1-CD2 4.29Å; L112-L161 HydrophobicContact CD2-CD1 4.18Å; L112-L161 HydrophobicContact CD2-CD2 4.24Å; L112-L161 HydrophobicContact CD2-CG 4.27Å
113K88.8Confident79.5Confident74 Ų7458.6 Ų58.632%0.32230%0.299SS..Hα-helixtrans-68.2-45.5175.4-179.8-172.9169.3-157.30111.5Q109 E110 M111 A116 Q117Q109-K113 WeakPolarHBondContact O-CB 3.5Å; Q109-K113 PolarHBondContact O-N 3.28Å; Q109-K113 VanDerWaalsContact O-N 3.12Å; E110-K113 WeakPolarHBondContact O-CB 3.45Å; E110-K113 PolarHBondContact O-N 2.98Å; E110-K113 IonicContact OE1-NZ 3.08Å; M111-K113 VanDerWaalsContact C-N 3.3Å; M111-K113 PolarHBondContact O-N 3.22Å; K113-A116 PolarHBondContact O-N 2.92Å; K113-Q117 WeakPolarHBondContact O-CB 3.3Å; K113-Q117 VanDerWaalsContact O-CG 3.27Å; K113-Q117 WeakPolarHBondContact O-CG 3.5Å; K113-Q117 PolarHBondContact O-N 3.35Å
114T87.3Confident78.2Confident48 Ų4862.6 Ų62.629%0.29433%0.328SS..Hα-helixtrans-63.4-43.2177.750.40000111.1E110 M111 Q117 S118E110-T114 WeakPolarHBondContact O-CG2 3.29Å; E110-T114 PolarHBondContact O-N 3.4Å; E110-T114 PolarHBondContact O-OG1 2.9Å; M111-T114 WeakPolarHBondContact CA-OG1 3.4Å; M111-T114 PolarHBondContact O-N 2.88Å; M111-T114 PolarHBondContact O-OG1 3.49Å; T114-Q117 PolarHBondContact O-N 3.4Å; T114-S118 WeakPolarHBondContact O-CB 3.26Å; T114-S118 PolarHBondContact O-N 3.07Å
115V86.4Confident76.8Confident13 Ų1364.4 Ų64.48%0.07934%0.34CS..Hα-helixtrans-63.9-43.8175.8175.80000111.4L93 M111 Q117 S118 K130 V132L93-V115 HydrophobicContact CB-CG2 4.09Å; L93-V115 HydrophobicContact CD1-CG2 4.09Å; L93-V115 HydrophobicContact CD2-CG2 4.28Å; L93-V115 HydrophobicContact CG-CG2 4.39Å; M111-V115 VanDerWaalsContact O-CG2 3.28Å; M111-V115 WeakPolarHBondContact O-CG2 3.45Å; M111-V115 PolarHBondContact O-N 3.32Å; V115-Q117 VanDerWaalsContact C-N 3.29Å; V115-Q117 PolarHBondContact O-N 2.97Å; V115-S118 PolarHBondContact O-N 3.47Å; V115-S118 PolarHBondContact O-OG 3.03Å; V115-K130 HydrophobicContact CG1-CB 3.96Å; V115-K130 HydrophobicContact CG1-CD 4.16Å; V115-V132 HydrophobicContact CB-CG2 4.07Å; V115-V132 HydrophobicContact CG1-CG2 3.68Å; V115-V132 HydrophobicContact CG2-CG2 4.06Å
116A84.8Confident75.6Confident22 Ų2266.5 Ų66.518%0.18235%0.354CS..Hα-helixtrans-65-30.7178.400000113.4L112 K113 Y155L112-A116 WeakPolarHBondContact O-CB 3.21Å; L112-A116 PolarHBondContact O-N 3.12Å; K113-A116 PolarHBondContact O-N 2.92Å; A116-Y155 HydrophobicContact CB-CD1 3.64Å; A116-Y155 HydrophobicContact CB-CD2 4.08Å; A116-Y155 HydrophobicContact CB-CE1 4.05Å; A116-Y155 HydrophobicContact CB-CE2 4.43Å; A116-Y155 HydrophobicContact CB-CG 3.67Å
117Q84.1Confident74.8Confident134 Ų13468.1 Ų68.163%0.62636%0.357SS*.Hα-helixtrans-83-22.3176.3-71.5178.3-18.400113.1K113 T114 V115 Q119K113-Q117 WeakPolarHBondContact O-CB 3.3Å; K113-Q117 VanDerWaalsContact O-CG 3.27Å; K113-Q117 WeakPolarHBondContact O-CG 3.5Å; K113-Q117 PolarHBondContact O-N 3.35Å; T114-Q117 PolarHBondContact O-N 3.4Å; V115-Q117 VanDerWaalsContact C-N 3.29Å; V115-Q117 PolarHBondContact O-N 2.97Å; Q117-Q119 PolarHBondContact O-N 3.26Å
118S78.9Confident74.5Confident50 Ų5074.7 Ų74.735%0.3539%0.392SS..  trans-71.197.9-18070.60000111T114 V115 K130T114-S118 WeakPolarHBondContact O-CB 3.26Å; T114-S118 PolarHBondContact O-N 3.07Å; V115-S118 PolarHBondContact O-N 3.47Å; V115-S118 PolarHBondContact O-OG 3.03Å; S118-K130 PolarHBondContact O-NZ 2.61Å; S118-K130 PolarHBondContact OG-NZ 2.68Å
119Q59.2Low74.4Confident149 Ų14975.2 Ų75.270%0.69639%0.394SS*.  trans-63.5138.8176.6-161.9-133.1-2.100110.4Q117 L121Q117-Q119 PolarHBondContact O-N 3.26Å; Q119-L121 PolarHBondContact O-N 3.35Å
120Q60.6Low74.4Confident39 Ų3973.7 Ų73.718%0.18239%0.387CS..  trans-73.4120.2168.5-67.9178-9.800108.3E122 R127 F129 K130Q120-E122 PolarHBondContact O-N 3.25Å; Q120-R127 PolarHBondContact NE2-O 2.97Å; Q120-R127 PolarHBondContact OE1-O 2.9Å; Q120-F129 PolarHBondContact NE2-O 3.02Å; Q120-K130 HydrophobicContact CG-CG 4.31Å
121L55.6Low74.6Confident163 Ų16370.2 Ų70.285%0.85337%0.37SS*.SBendtrans-73.8-12.5178.4-68.8163.6000112.7Q119Q119-L121 PolarHBondContact O-N 3.35Å
122E53.7Low75Confident129 Ų12970 Ų7060%0.60337%0.369SS*.  trans-132.391.5-177.9-67.6-174.417600111.3Q120 S124Q120-E122 PolarHBondContact O-N 3.25Å; E122-S124 PolarHBondContact O-N 3.36Å
123T53.6Low75.4Confident106 Ų10670.1 Ų70.165%0.6537%0.37SS*.THydrogen-bonded Turntrans-76.2-4.3178.9-36.80000113.3
124S57.7Low75.6Confident114 Ų11466.7 Ų66.780%0.79736%0.355SS*.THydrogen-bonded Turntrans-84.6-15.6-17646.70000114E122E122-S124 PolarHBondContact O-N 3.36Å
125S55.8Low75.9Confident40 Ų4064.9 Ų64.928%0.2834%0.344SS..SBendtrans-117.673.7179.161.80000112.8
126Q64.7Low76.2Confident137 Ų13767.2 Ų67.264%0.6435%0.354SS*.SBend102.4-6.4123.7-139.9157.21100121.6
127R71.9Confident76.6Confident64 Ų6466.2 Ų66.224%0.24235%0.346CS..  trans-167.6144.6155.7-73.5-47.9174.9143.410.7111.9V30 C32 G33 Y60 Q120 F129V30-R127 PolarHBondContact O-NH2 3.45Å; C32-R127 PolarHBondContact O-NH2 3.48Å; G33-R127 PolarHBondContact O-NH1 2.75Å; Y60-R127 HydrophobicContact CE1-CB 4.09Å; Q120-R127 PolarHBondContact NE2-O 2.97Å; Q120-R127 PolarHBondContact OE1-O 2.9Å; R127-F129 HydrophobicContact CB-CD1 4.26Å; R127-F129 HydrophobicContact CB-CE1 3.99Å; R127-F129 HydrophobicContact CB-CZ 4.29Å; R127-F129 HydrophobicContact CG-CE1 4.04Å; R127-F129 HydrophobicContact CG-CZ 4.15Å; R127-F129 PolarHBondContact O-N 2.76Å; R127-F129 VanDerWaalsContact O-N 3.11Å
128D81.1Confident76.9Confident140 Ų14060.7 Ų60.775%0.74932%0.321SS*.SBendtrans-73.6-0.8-174.2-51.5-20.7000115.6
129F87.2Confident77.4Confident15 Ų1563.2 Ų63.27%0.06633%0.325CS..SBendtrans-125.8155-176.663.4-97.3000112F35 Y60 Q120 R127 V131 T158 R160F35-F129 HydrophobicContact CB-CE1 4.13Å; F35-F129 HydrophobicContact CB-CE2 4.4Å; F35-F129 HydrophobicContact CB-CZ 3.58Å; F35-F129 HydrophobicContact CD1-CE2 4.08Å; F35-F129 HydrophobicContact CD1-CZ 4.09Å; F35-F129 HydrophobicContact CG-CZ 4.1Å; Y60-F129 VanDerWaalsContact OH-CD2 3.28Å; Y60-F129 WeakPolarHBondContact OH-CD2 3.45Å; Y60-F129 VanDerWaalsContact OH-CE2 3.3Å; Y60-F129 WeakPolarHBondContact OH-CE2 3.44Å; Y60-F129 PolarHBondContact OH-O 3.36Å; Q120-F129 PolarHBondContact NE2-O 3.02Å; R127-F129 HydrophobicContact CB-CD1 4.26Å; R127-F129 HydrophobicContact CB-CE1 3.99Å; R127-F129 HydrophobicContact CB-CZ 4.29Å; R127-F129 HydrophobicContact CG-CE1 4.04Å; R127-F129 HydrophobicContact CG-CZ 4.15Å; R127-F129 PolarHBondContact O-N 2.76Å; R127-F129 VanDerWaalsContact O-N 3.11Å; F129-V131 HydrophobicContact CD2-CG2 4.33Å; F129-V131 HydrophobicContact CE2-CG2 3.98Å; F129-T158 VanDerWaalsContact CA-O 3.29Å; F129-T158 WeakPolarHBondContact CA-O 2.77Å; F129-T158 WeakPolarHBondContact CB-O 3.37Å; F129-R160 HydrophobicContact CB-CG 4.18Å; F129-R160 HydrophobicContact CD1-CG 4.11Å; F129-R160 HydrophobicContact CD2-CB 3.76Å; F129-R160 HydrophobicContact CD2-CG 3.19Å; F129-R160 HydrophobicContact CE1-CG 4.33Å; F129-R160 HydrophobicContact CE2-CB 3.92Å; F129-R160 HydrophobicContact CE2-CG 3.46Å; F129-R160 VanDerWaalsContact CE2-CG 3.46Å; F129-R160 HydrophobicContact CG-CG 3.56Å; F129-R160 HydrophobicContact CZ-CG 4.04Å
130K89.3Confident79Confident32 Ų3256.5 Ų56.514%0.13929%0.294CS..EExtended strand (participates in β ladder)trans-98.6150.8169.1-70.5-173.5178.7179.20111.7Y91 V115 S118 Q120 T158 C159 R160Y91-K130 WeakPolarHBondContact O-CA 3.36Å; V115-K130 HydrophobicContact CG1-CB 3.96Å; V115-K130 HydrophobicContact CG1-CD 4.16Å; S118-K130 PolarHBondContact O-NZ 2.61Å; S118-K130 PolarHBondContact OG-NZ 2.68Å; Q120-K130 HydrophobicContact CG-CG 4.31Å; K130-T158 PolarHBondContact N-O 3.36Å; K130-C159 CarbonylContact O-C 3.49Å; K130-C159 VanDerWaalsContact O-CA 3.27Å; K130-C159 WeakPolarHBondContact O-CA 3.47Å; K130-R160 PolarHBondContact O-N 2.73Å
131V91.9Very high80.5Confident0 Ų056.8 Ų56.80%030%0.299CS..EExtended strand (participates in β ladder)trans-97.8133.2175171.40000111.6L56 Y60 Y91 H92 L93 F129 R160 I162L56-V131 HydrophobicContact CD2-CB 3.81Å; L56-V131 HydrophobicContact CD2-CG1 3.78Å; L56-V131 HydrophobicContact CD2-CG2 4.01Å; Y60-V131 HydrophobicContact CE2-CB 4.27Å; Y60-V131 HydrophobicContact CE2-CG2 3.82Å; Y60-V131 WeakPolarHBondContact OH-CG2 3.46Å; Y60-V131 PolarHBondContact OH-N 2.68Å; Y91-V131 PolarHBondContact O-N 3.43Å; Y91-V131 VanDerWaalsContact O-N 3.15Å; H92-V131 CarbonylContact C-O 3.47Å; H92-V131 WeakPolarHBondContact CA-O 3.48Å; H92-V131 HydrophobicContact CB-CB 4.04Å; H92-V131 HydrophobicContact CB-CG1 4.49Å; H92-V131 VanDerWaalsContact CB-O 3.27Å; H92-V131 WeakPolarHBondContact CB-O 3Å; L93-V131 PolarHBondContact N-O 2.97Å; F129-V131 HydrophobicContact CD2-CG2 4.33Å; F129-V131 HydrophobicContact CE2-CG2 3.98Å; V131-R160 CarbonylContact C-O 3.55Å; V131-R160 VanDerWaalsContact CA-O 3.24Å; V131-R160 WeakPolarHBondContact CA-O 3.43Å; V131-R160 HydrophobicContact CG2-CB 4.34Å; V131-I162 HydrophobicContact CG1-CB 4.39Å; V131-I162 HydrophobicContact CG1-CD1 3.7Å; V131-I162 HydrophobicContact CG1-CG1 3.78Å
132V94.3Very high82.2Confident0 Ų056.4 Ų56.40%029%0.29CS..EExtended strand (participates in β ladder)trans-110.4114.7169.5-177.60000109.1L93 L112 V115 L134 R160 L161 I162L93-V132 HydrophobicContact CD2-CG1 4.3Å; L93-V132 CarbonylContact O-C 3.51Å; L93-V132 WeakPolarHBondContact O-CA 3.34Å; L112-V132 HydrophobicContact CD2-CB 4Å; L112-V132 HydrophobicContact CD2-CG1 3.91Å; L112-V132 HydrophobicContact CD2-CG2 3.92Å; V115-V132 HydrophobicContact CB-CG2 4.07Å; V115-V132 HydrophobicContact CG1-CG2 3.68Å; V115-V132 HydrophobicContact CG2-CG2 4.06Å; V132-L134 HydrophobicContact CG1-CD2 3.85Å; V132-L134 HydrophobicContact CG1-CG 4.36Å; V132-R160 PolarHBondContact N-O 3.44Å; V132-L161 WeakPolarHBondContact O-CA 3.41Å; V132-I162 PolarHBondContact O-N 3.45Å
133L95.8Very high84.1Confident3 Ų355.5 Ų55.52%0.01629%0.289CS..EExtended strand (participates in β ladder)trans-93.5111.2176.7172.357.3000109.3I52 L93 E94 V95 T135 I162 C164I52-L133 HydrophobicContact CD1-CD1 3.9Å; I52-L133 HydrophobicContact CG2-CD1 4.03Å; I52-L133 HydrophobicContact CG2-CD2 3.9Å; L93-L133 PolarHBondContact O-N 2.79Å; E94-L133 WeakPolarHBondContact CA-O 3.37Å; E94-L133 HydrophobicContact CB-CB 4.23Å; E94-L133 HydrophobicContact CB-CD2 4.08Å; E94-L133 HydrophobicContact CB-CG 4.31Å; E94-L133 HydrophobicContact CG-CD2 3.89Å; E94-L133 HydrophobicContact CG-CG 4.11Å; V95-L133 PolarHBondContact N-O 3.43Å; L133-T135 HydrophobicContact CG-CG2 4.37Å; L133-I162 WeakPolarHBondContact CA-O 3.34Å; L133-I162 HydrophobicContact CD1-CB 4.22Å; L133-I162 HydrophobicContact CD1-CG2 4Å; L133-I162 WeakPolarHBondContact CD1-O 3.38Å; L133-C164 HydrophobicContact CD1-CB 4.2Å
134L94.4Very high86Confident3 Ų350.5 Ų50.52%0.01626%0.258CS..EExtended strand (participates in β ladder)trans-99.2120.1172.2-56.2-175.3000109V95 V132 V137 L148 L161 I162 L163 C164V95-L134 HydrophobicContact CG1-CD2 3.26Å; V132-L134 HydrophobicContact CG1-CD2 3.85Å; V132-L134 HydrophobicContact CG1-CG 4.36Å; L134-V137 HydrophobicContact CB-CG2 3.7Å; L134-V137 WeakPolarHBondContact O-CG2 3.34Å; L134-L148 HydrophobicContact CD1-CD1 3.53Å; L134-L148 HydrophobicContact CD1-CD2 3.82Å; L134-L148 HydrophobicContact CD1-CG 4.35Å; L134-L161 HydrophobicContact CD1-CD2 4.39Å; L134-I162 PolarHBondContact N-O 2.9Å; L134-L163 HydrophobicContact CB-CD2 3.95Å; L134-L163 HydrophobicContact CD1-CD2 3.75Å; L134-L163 HydrophobicContact CG-CD2 4.07Å; L134-C164 PolarHBondContact O-N 2.83Å
135T93.8Very high87.7Confident10 Ų1045.2 Ų45.26%0.06122%0.221CC..EExtended strand (participates in β ladder)trans-92.5157173.859.80000111.7E94 V95 N96 L133 V137 C164E94-T135 HydrophobicContact CG-CG2 4.28Å; V95-T135 PolarHBondContact O-N 2.79Å; V95-T135 VanDerWaalsContact O-N 3.17Å; N96-T135 WeakPolarHBondContact CB-OG1 3.45Å; N96-T135 PolarHBondContact OD1-O 3.23Å; N96-T135 PolarHBondContact OD1-OG1 2.93Å; N96-T135 VanDerWaalsContact OD1-OG1 3.08Å; L133-T135 HydrophobicContact CG-CG2 4.37Å; T135-V137 PolarHBondContact O-N 3.46Å; T135-C164 CarbonylContact C-O 3.46Å
136E91.4Very high89.5Confident62 Ų6247.2 Ų47.229%0.2923%0.226SC..  trans52.539.1176.4-51.9-157.3144.100114.3D138 K139 C164E136-D138 PolarHBondContact O-N 3.42Å; E136-D138 VanDerWaalsContact O-N 3.07Å; E136-K139 HydrophobicContact CB-CD 4.32Å; E136-K139 VanDerWaalsContact CD-NZ 3.35Å; E136-K139 PolarHBondContact O-N 3.36Å; E136-K139 IonicContact OE1-NZ 2.64Å; E136-K139 PolarHBondContact OE1-NZ 3.28Å; E136-K139 WeakPolarHBondContact OE2-CD 3.44Å; E136-K139 WeakPolarHBondContact OE2-CE 3.18Å; E136-K139 IonicContact OE2-NZ 2.79Å; E136-K139 PolarHBondContact OE2-NZ 3.31Å; E136-C164 PolarHBondContact N-O 3.02Å
137V92.9Very high90.8Very high0 Ų040.7 Ų40.70%020%0.195CC..G310 helixtrans-59.6-23.5-1781780000112.6L134 T135 K139 L140 L163 C164 C165L134-V137 HydrophobicContact CB-CG2 3.7Å; L134-V137 WeakPolarHBondContact O-CG2 3.34Å; T135-V137 PolarHBondContact O-N 3.46Å; V137-K139 VanDerWaalsContact C-N 3.25Å; V137-K139 PolarHBondContact O-N 2.87Å; V137-L140 HydrophobicContact CB-CD1 4.44Å; V137-L140 HydrophobicContact CG1-CD1 4.06Å; V137-L140 WeakPolarHBondContact O-CB 3.28Å; V137-L140 PolarHBondContact O-N 2.92Å; V137-L163 HydrophobicContact CG1-CD1 4.48Å; V137-L163 HydrophobicContact CG2-CB 4.02Å; V137-L163 HydrophobicContact CG2-CD2 4.1Å; V137-C164 PolarHBondContact N-O 3.12Å; V137-C165 HydrophobicContact CB-CB 4.4Å
138D91.1Very high91.9Very high19 Ų1937.6 Ų37.610%0.10218%0.184CC..G310 helixtrans-70.4-15.7174.949.2-20.3000114.5E136 C165 N166 S167 K170E136-D138 PolarHBondContact O-N 3.42Å; E136-D138 VanDerWaalsContact O-N 3.07Å; D138-C165 HydrophobicContact CB-CB 3.89Å; D138-N166 PolarHBondContact OD2-N 2.89Å; D138-N166 VanDerWaalsContact OD2-N 3.08Å; D138-S167 PolarHBondContact OD2-N 3.35Å; D138-K170 HydrophobicContact CB-CB 4.4Å; D138-K170 WeakPolarHBondContact O-CB 3.39Å; D138-K170 WeakPolarHBondContact O-CD 3.38Å
139K90.5Very high92.5Very high102 Ų10234.8 Ų34.844%0.44316%0.163SC..G310 helixtrans-93.4-5.8173.9-63.5-175.3-175.2165.40113.6E136 V137E136-K139 HydrophobicContact CB-CD 4.32Å; E136-K139 VanDerWaalsContact CD-NZ 3.35Å; E136-K139 PolarHBondContact O-N 3.36Å; E136-K139 IonicContact OE1-NZ 2.64Å; E136-K139 PolarHBondContact OE1-NZ 3.28Å; E136-K139 WeakPolarHBondContact OE2-CD 3.44Å; E136-K139 WeakPolarHBondContact OE2-CE 3.18Å; E136-K139 IonicContact OE2-NZ 2.79Å; E136-K139 PolarHBondContact OE2-NZ 3.31Å; V137-K139 VanDerWaalsContact C-N 3.25Å; V137-K139 PolarHBondContact O-N 2.87Å
140L91.8Very high92.6Very high9 Ų941 Ų415%0.04719%0.186CC..SBendtrans-67143178.1-75.1176.5000112.3P97 D104 I108 V137 A144 Q145 L148P97-L140 HydrophobicContact CB-CD2 3.87Å; P97-L140 HydrophobicContact CG-CD1 4.22Å; P97-L140 HydrophobicContact CG-CD2 3.66Å; P97-L140 HydrophobicContact CG-CG 4.25Å; D104-L140 HydrophobicContact CB-CD2 3.85Å; I108-L140 HydrophobicContact CD1-CD1 3.72Å; I108-L140 HydrophobicContact CD1-CD2 3.95Å; I108-L140 HydrophobicContact CD1-CG 4.49Å; V137-L140 HydrophobicContact CB-CD1 4.44Å; V137-L140 HydrophobicContact CG1-CD1 4.06Å; V137-L140 WeakPolarHBondContact O-CB 3.28Å; V137-L140 PolarHBondContact O-N 2.92Å; L140-A144 HydrophobicContact CD2-CB 4.26Å; L140-Q145 HydrophobicContact CB-CG 3.9Å; L140-Q145 PolarHBondContact O-NE2 2.92Å; L140-Q145 VanDerWaalsContact O-NE2 3.08Å; L140-L148 HydrophobicContact CD1-CD2 4.48Å
141T92.5Very high92.7Very high45 Ų4540.1 Ų40.128%0.27618%0.183SC..  trans-63153.5171.9660000111D104 D143 A144 Q145D104-T141 VanDerWaalsContact CG-OG1 3.26Å; D104-T141 PolarHBondContact OD1-OG1 3.21Å; D104-T141 WeakPolarHBondContact OD2-CB 3.3Å; D104-T141 VanDerWaalsContact OD2-CG2 3.3Å; D104-T141 WeakPolarHBondContact OD2-CG2 3.49Å; D104-T141 PolarHBondContact OD2-N 3.48Å; D104-T141 PolarHBondContact OD2-OG1 3.07Å; T141-D143 PolarHBondContact O-N 3.13Å; T141-A144 PolarHBondContact O-N 2.94Å; T141-A144 VanDerWaalsContact OG1-CB 3.24Å; T141-A144 WeakPolarHBondContact OG1-CB 3.45Å; T141-A144 PolarHBondContact OG1-N 3.35Å; T141-Q145 WeakPolarHBondContact O-CG 3.45Å; T141-Q145 PolarHBondContact O-N 3.35Å
142K91.9Very high92.7Very high155 Ų15540.2 Ų40.267%0.67418%0.183SC*.Hα-helixtrans-59-37.6178.2-69.8-176.6178.9177.50111.7Q145 H146K142-Q145 PolarHBondContact O-N 3.43Å; K142-H146 PolarHBondContact O-CD2 3.16Å; K142-H146 PolarHBondContact O-N 3.2Å
143D92.5Very high92.5Very high110 Ų11044.8 Ų44.859%0.58821%0.205SC*.Hα-helixtrans-66.1-40.5178.3-64.3-29000112.1T141 H146 A147T141-D143 PolarHBondContact O-N 3.13Å; D143-H146 PolarHBondContact O-N 3.43Å; D143-A147 WeakPolarHBondContact O-CB 3.34Å; D143-A147 PolarHBondContact O-N 3.44Å
144A92.9Very high92.2Very high0 Ų051.6 Ų51.60%023%0.234CC..Hα-helixtrans-65-40.1173.300000111.8D104 R105 I108 L140 T141 H146 A147 L148D104-A144 HydrophobicContact CB-CB 4.08Å; D104-A144 WeakPolarHBondContact OD1-CB 3.46Å; D104-A144 WeakPolarHBondContact OD2-CB 3.27Å; R105-A144 HydrophobicContact CB-CB 4.27Å; I108-A144 HydrophobicContact CD1-CB 3.89Å; L140-A144 HydrophobicContact CD2-CB 4.26Å; T141-A144 PolarHBondContact O-N 2.94Å; T141-A144 VanDerWaalsContact OG1-CB 3.24Å; T141-A144 WeakPolarHBondContact OG1-CB 3.45Å; T141-A144 PolarHBondContact OG1-N 3.35Å; A144-H146 PolarHBondContact O-N 3.01Å; A144-A147 WeakPolarHBondContact O-CB 3.48Å; A144-A147 PolarHBondContact O-N 2.86Å; A144-L148 WeakPolarHBondContact O-CB 3.47Å; A144-L148 PolarHBondContact O-N 2.73Å
145Q94.1Very high92Very high4 Ų453.5 Ų53.52%0.01924%0.242CC..Hα-helixtrans-63.7-39.5173.9-67.7-17542.500112.3L140 T141 K142 L148 R149 K170 I172 I175L140-Q145 HydrophobicContact CB-CG 3.9Å; L140-Q145 PolarHBondContact O-NE2 2.92Å; L140-Q145 VanDerWaalsContact O-NE2 3.08Å; T141-Q145 WeakPolarHBondContact O-CG 3.45Å; T141-Q145 PolarHBondContact O-N 3.35Å; K142-Q145 PolarHBondContact O-N 3.43Å; Q145-L148 WeakPolarHBondContact O-CB 3.46Å; Q145-L148 PolarHBondContact O-N 3.36Å; Q145-R149 PolarHBondContact O-N 3.44Å; Q145-K170 PolarHBondContact NE2-O 3.2Å; Q145-K170 PolarHBondContact OE1-O 3.27Å; Q145-I172 HydrophobicContact CB-CD1 3.84Å; Q145-I172 HydrophobicContact CB-CG1 4.06Å; Q145-I172 HydrophobicContact CB-CG2 4.47Å; Q145-I175 HydrophobicContact CB-CD1 3.79Å; Q145-I175 HydrophobicContact CG-CD1 4.19Å
146H93.7Very high91.8Very high81 Ų8156.4 Ų56.438%0.37526%0.255SS..Hα-helixtrans-67.3-36173.4-76-61.8000112.8K142 D143 A144 R150K142-H146 PolarHBondContact O-CD2 3.16Å; K142-H146 PolarHBondContact O-N 3.2Å; D143-H146 PolarHBondContact O-N 3.43Å; A144-H146 PolarHBondContact O-N 3.01Å; H146-R150 PolarHBondContact O-N 3.09Å
147A92.7Very high91.5Very high0 Ų058.2 Ų58.20%028%0.275CS..Hα-helixtrans-64.4-46.5171.400000111.3R105 Q109 D143 A144 R149 R150 T151R105-A147 HydrophobicContact CG-CB 3.67Å; Q109-A147 HydrophobicContact CG-CB 4.17Å; D143-A147 WeakPolarHBondContact O-CB 3.34Å; D143-A147 PolarHBondContact O-N 3.44Å; A144-A147 WeakPolarHBondContact O-CB 3.48Å; A144-A147 PolarHBondContact O-N 2.86Å; A147-R149 VanDerWaalsContact C-N 3.34Å; A147-R149 PolarHBondContact O-N 3.26Å; A147-R150 PolarHBondContact O-N 3.37Å; A147-T151 PolarHBondContact O-N 3.26Å; A147-T151 PolarHBondContact O-OG1 2.87Å
148L93.5Very high91.3Very high0 Ų061 Ų610%029%0.291CS..Hα-helixtrans-54.6-48.5176.2-178.458.6000111.5I108 L112 L134 L140 A144 Q145 R150 T151 M152 L161 L163 I175I108-L148 HydrophobicContact CD1-CB 4.31Å; I108-L148 HydrophobicContact CG2-CB 3.94Å; I108-L148 HydrophobicContact CG2-CD1 3.68Å; I108-L148 HydrophobicContact CG2-CG 4.42Å; L112-L148 HydrophobicContact CD1-CD1 3.78Å; L134-L148 HydrophobicContact CD1-CD1 3.53Å; L134-L148 HydrophobicContact CD1-CD2 3.82Å; L134-L148 HydrophobicContact CD1-CG 4.35Å; L140-L148 HydrophobicContact CD1-CD2 4.48Å; A144-L148 WeakPolarHBondContact O-CB 3.47Å; A144-L148 PolarHBondContact O-N 2.73Å; Q145-L148 WeakPolarHBondContact O-CB 3.46Å; Q145-L148 PolarHBondContact O-N 3.36Å; L148-R150 PolarHBondContact O-N 3.04Å; L148-T151 PolarHBondContact O-N 3.22Å; L148-M152 WeakPolarHBondContact O-CB 3.13Å; L148-M152 PolarHBondContact O-N 3.38Å; L148-L161 HydrophobicContact CD1-CD2 3.46Å; L148-L161 VanDerWaalsContact CD1-CD2 3.46Å; L148-L161 HydrophobicContact CG-CD2 4.41Å; L148-L163 HydrophobicContact CD2-CD1 4.47Å; L148-L163 HydrophobicContact CD2-CD2 4.06Å; L148-I175 HydrophobicContact CD2-CD1 4.05Å
149R93.4Very high91.2Very high81 Ų8160.1 Ų60.131%0.30629%0.287SS..Hα-helixtrans-53.8-49.6176.7179.8-156.4162.5-159.8-9.3112Q145 A147 M152 E153 P174 I175 R178Q145-R149 PolarHBondContact O-N 3.44Å; A147-R149 VanDerWaalsContact C-N 3.34Å; A147-R149 PolarHBondContact O-N 3.26Å; R149-M152 PolarHBondContact O-N 2.8Å; R149-E153 IonicContact NE-OE1 3.44Å; R149-E153 PolarHBondContact O-N 3.18Å; R149-P174 HydrophobicContact CG-CB 4.35Å; R149-I175 HydrophobicContact CB-CG1 4.41Å; R149-R178 VanDerWaalsContact NH2-NH2 3.16Å
150R91.3Very high91.3Very high146 Ų14656.4 Ų56.455%0.55127%0.27SS*.Hα-helixtrans-63.6-42.7-179.1-71.9-175.3-71.4-178-2.8111.6H146 A147 L148 E153 K154H146-R150 PolarHBondContact O-N 3.09Å; A147-R150 PolarHBondContact O-N 3.37Å; L148-R150 PolarHBondContact O-N 3.04Å; R150-E153 PolarHBondContact O-N 3.06Å; R150-K154 WeakPolarHBondContact O-CB 3.34Å; R150-K154 PolarHBondContact O-N 3.21Å; R150-K154 VanDerWaalsContact O-N 3.09Å
151T90.9Very high91.4Very high12 Ų1256 Ų567%0.07427%0.268CS..Hα-helixtrans-70.6-34.9-177.9-49.60000112.2L112 A147 L148 K154 Y155L112-T151 HydrophobicContact CB-CG2 3.44Å; L112-T151 VanDerWaalsContact CB-CG2 3.44Å; L112-T151 HydrophobicContact CD1-CG2 3.43Å; L112-T151 VanDerWaalsContact CD1-CG2 3.43Å; L112-T151 HydrophobicContact CG-CG2 4.06Å; A147-T151 PolarHBondContact O-N 3.26Å; A147-T151 PolarHBondContact O-OG1 2.87Å; L148-T151 PolarHBondContact O-N 3.22Å; T151-K154 PolarHBondContact O-N 3.43Å; T151-Y155 HydrophobicContact CG2-CD2 3.49Å; T151-Y155 VanDerWaalsContact CG2-CD2 3.49Å; T151-Y155 HydrophobicContact CG2-CE2 3.6Å; T151-Y155 PolarHBondContact O-N 3.42Å; T151-Y155 VanDerWaalsContact O-N 3.09Å
152M91.1Very high91.6Very high2 Ų253.9 Ų53.91%0.0126%0.255CS..Hα-helixtrans-61.6-42.3175.2-174.2174.471.700111.7H37 L148 R149 M156 L161 R178H37-M152 WeakPolarHBondContact CD2-CG 2.82Å; H37-M152 PolarHBondContact CD2-SD 3.45Å; H37-M152 WeakPolarHBondContact NE2-CG 3.4Å; L148-M152 WeakPolarHBondContact O-CB 3.13Å; L148-M152 PolarHBondContact O-N 3.38Å; R149-M152 PolarHBondContact O-N 2.8Å; M152-M156 PolarHBondContact O-N 3.36Å; M152-L161 HydrophobicContact CB-CD2 4.44Å; M152-L161 HydrophobicContact CG-CD1 4.25Å; M152-L161 HydrophobicContact CG-CD2 4.37Å; M152-R178 HydrophobicContact CE-CB 3.41Å; M152-R178 VanDerWaalsContact CE-CB 3.41Å; M152-R178 HydrophobicContact CE-CG 4.04Å
153E89.8Confident91.8Very high96 Ų9646.5 Ų46.545%0.44922%0.223SC..Hα-helixtrans-68.6-40.9174.1-69.3173.2167.400111.9R149 R150 Y155 R178R149-E153 IonicContact NE-OE1 3.44Å; R149-E153 PolarHBondContact O-N 3.18Å; R150-E153 PolarHBondContact O-N 3.06Å; E153-Y155 PolarHBondContact O-N 2.93Å; E153-R178 IonicContact OE1-CZ 2.61Å; E153-R178 IonicContact OE1-NE 2.68Å; E153-R178 PolarHBondContact OE1-NE 3.39Å; E153-R178 IonicContact OE1-NH2 3.13Å; E153-R178 PolarHBondContact OE1-NH2 3.43Å
154K91.1Very high92Very high147 Ų14741.7 Ų41.764%0.63920%0.198SC*.Hα-helixtrans-64.4-38-176.4-174.8177.2179.2-175.50113.5R150 T151R150-K154 WeakPolarHBondContact O-CB 3.34Å; R150-K154 PolarHBondContact O-N 3.21Å; R150-K154 VanDerWaalsContact O-N 3.09Å; T151-K154 PolarHBondContact O-N 3.43Å
155Y89.8Confident92.1Very high43 Ų4341.8 Ų41.817%0.16920%0.198CC..THydrogen-bonded Turntrans-113.121.6-174.2-57-56.7000113.3A116 T151 E153 S157 T158 C159A116-Y155 HydrophobicContact CB-CD1 3.64Å; A116-Y155 HydrophobicContact CB-CD2 4.08Å; A116-Y155 HydrophobicContact CB-CE1 4.05Å; A116-Y155 HydrophobicContact CB-CE2 4.43Å; A116-Y155 HydrophobicContact CB-CG 3.67Å; T151-Y155 HydrophobicContact CG2-CD2 3.49Å; T151-Y155 VanDerWaalsContact CG2-CD2 3.49Å; T151-Y155 HydrophobicContact CG2-CE2 3.6Å; T151-Y155 PolarHBondContact O-N 3.42Å; T151-Y155 VanDerWaalsContact O-N 3.09Å; E153-Y155 PolarHBondContact O-N 2.93Å; Y155-S157 PolarHBondContact O-N 3.34Å; Y155-S157 VanDerWaalsContact O-N 3.11Å; Y155-T158 PolarHBondContact O-N 3.47Å; Y155-T158 VanDerWaalsContact O-N 3.1Å; Y155-T158 PolarHBondContact O-OG1 2.88Å; Y155-C159 VanDerWaalsContact CB-SG 3.56Å; Y155-C159 PolarHBondContact O-N 3.39Å; Y155-C159 PolarHBondContact O-SG 3.02Å; Y155-C159 VanDerWaalsContact O-SG 3.34Å
156M88Confident92Very high71 Ų7144.7 Ų44.735%0.3521%0.214SC..THydrogen-bonded Turntrans-54.6-32.2-177.1-178.155.6170.300113.8H37 M152 R160H37-M156 PolarHBondContact CE1-SD 3.3Å; H37-M156 PolarHBondContact NE2-SD 3.17Å; M152-M156 PolarHBondContact O-N 3.36Å; M156-R160 PolarHBondContact O-NH1 3.1Å; M156-R160 PolarHBondContact SD-NH1 3.16Å
157S86.8Confident91.9Very high100 Ų10043.4 Ų43.470%0.69921%0.214SC*.THydrogen-bonded Turntrans-76.6-30.1-179.455.30000113.8Y155Y155-S157 PolarHBondContact O-N 3.34Å; Y155-S157 VanDerWaalsContact O-N 3.11Å
158T87.5Confident91.9Very high57 Ų5744.7 Ų44.735%0.3522%0.222SC..THydrogen-bonded Turntrans-103.1-26.3-174.459.50000113.2F129 K130 Y155F129-T158 VanDerWaalsContact CA-O 3.29Å; F129-T158 WeakPolarHBondContact CA-O 2.77Å; F129-T158 WeakPolarHBondContact CB-O 3.37Å; K130-T158 PolarHBondContact N-O 3.36Å; Y155-T158 PolarHBondContact O-N 3.47Å; Y155-T158 VanDerWaalsContact O-N 3.1Å; Y155-T158 PolarHBondContact O-OG1 2.88Å
159C88.9Confident91.8Very high1 Ų149.3 Ų49.31%0.00725%0.254CS..EExtended strand (participates in β ladder)trans-133.6145.2-179.473.50000113.4K130 Y155K130-C159 CarbonylContact O-C 3.49Å; K130-C159 VanDerWaalsContact O-CA 3.27Å; K130-C159 WeakPolarHBondContact O-CA 3.47Å; Y155-C159 VanDerWaalsContact CB-SG 3.56Å; Y155-C159 PolarHBondContact O-N 3.39Å; Y155-C159 PolarHBondContact O-SG 3.02Å; Y155-C159 VanDerWaalsContact O-SG 3.34Å
160R92.6Very high91.7Very high25 Ų2550.9 Ų50.99%0.09426%0.264CS..EExtended strand (participates in β ladder)trans-115.7134.5172.4-59.6-61.3-164.4-166.914.4109.4D34 F35 F129 K130 V131 V132 M156D34-R160 IonicContact OD1-CZ 3.07Å; D34-R160 IonicContact OD1-NH2 2.6Å; D34-R160 PolarHBondContact OD1-NH2 3.23Å; F35-R160 HydrophobicContact CD1-CB 4.03Å; F35-R160 HydrophobicContact CD1-CG 4.15Å; F35-R160 HydrophobicContact CE1-CB 4.37Å; F35-R160 VanDerWaalsContact O-CD 3.29Å; F35-R160 WeakPolarHBondContact O-CD 3.45Å; F35-R160 PolarHBondContact O-NE 3.02Å; F129-R160 HydrophobicContact CB-CG 4.18Å; F129-R160 HydrophobicContact CD1-CG 4.11Å; F129-R160 HydrophobicContact CD2-CB 3.76Å; F129-R160 HydrophobicContact CD2-CG 3.19Å; F129-R160 HydrophobicContact CE1-CG 4.33Å; F129-R160 HydrophobicContact CE2-CB 3.92Å; F129-R160 HydrophobicContact CE2-CG 3.46Å; F129-R160 VanDerWaalsContact CE2-CG 3.46Å; F129-R160 HydrophobicContact CG-CG 3.56Å; F129-R160 HydrophobicContact CZ-CG 4.04Å; K130-R160 PolarHBondContact O-N 2.73Å; V131-R160 CarbonylContact C-O 3.55Å; V131-R160 VanDerWaalsContact CA-O 3.24Å; V131-R160 WeakPolarHBondContact CA-O 3.43Å; V131-R160 HydrophobicContact CG2-CB 4.34Å; V132-R160 PolarHBondContact N-O 3.44Å; M156-R160 PolarHBondContact O-NH1 3.1Å; M156-R160 PolarHBondContact SD-NH1 3.16Å
161L94.8Very high91.8Very high0 Ų044.2 Ų44.20%024%0.239CC..EExtended strand (participates in β ladder)trans-98.7137.2-179.7-75.175.5000111.1H37 L38 L112 V132 L134 L148 M152 L163H37-L161 WeakPolarHBondContact CA-O 3.22Å; H37-L161 PolarHBondContact ND1-N 3.41Å; L38-L161 PolarHBondContact N-O 3.28Å; L112-L161 HydrophobicContact CD1-CD2 4.29Å; L112-L161 HydrophobicContact CD2-CD1 4.18Å; L112-L161 HydrophobicContact CD2-CD2 4.24Å; L112-L161 HydrophobicContact CD2-CG 4.27Å; V132-L161 WeakPolarHBondContact O-CA 3.41Å; L134-L161 HydrophobicContact CD1-CD2 4.39Å; L148-L161 HydrophobicContact CD1-CD2 3.46Å; L148-L161 VanDerWaalsContact CD1-CD2 3.46Å; L148-L161 HydrophobicContact CG-CD2 4.41Å; M152-L161 HydrophobicContact CB-CD2 4.44Å; M152-L161 HydrophobicContact CG-CD1 4.25Å; M152-L161 HydrophobicContact CG-CD2 4.37Å; L161-L163 HydrophobicContact CB-CD2 4.33Å; L161-L163 HydrophobicContact CD2-CD2 4.3Å
162I96.5Very high92Very high0 Ų044.6 Ų44.60%024%0.24CC..EExtended strand (participates in β ladder)trans-115.6113.4164.4-59.3-179.2000107.3F35 L38 V40 I52 I55 V131 V132 L133 L134F35-I162 HydrophobicContact CE1-CD1 4.35Å; F35-I162 HydrophobicContact CE1-CG1 4.34Å; F35-I162 HydrophobicContact CZ-CD1 4.12Å; F35-I162 HydrophobicContact CZ-CG1 4.43Å; L38-I162 HydrophobicContact CB-CG1 4.21Å; L38-I162 HydrophobicContact CB-CG2 4.24Å; L38-I162 HydrophobicContact CD1-CD1 4.41Å; L38-I162 HydrophobicContact CD1-CG1 4.46Å; L38-I162 HydrophobicContact CG-CG1 4.48Å; L38-I162 WeakPolarHBondContact O-CA 3.38Å; V40-I162 HydrophobicContact CG2-CG2 4.1Å; I52-I162 HydrophobicContact CD1-CG2 3.93Å; I52-I162 HydrophobicContact CG1-CG2 3.96Å; I52-I162 HydrophobicContact CG2-CD1 4.2Å; I52-I162 HydrophobicContact CG2-CG2 4.08Å; I55-I162 HydrophobicContact CG2-CD1 4.48Å; V131-I162 HydrophobicContact CG1-CB 4.39Å; V131-I162 HydrophobicContact CG1-CD1 3.7Å; V131-I162 HydrophobicContact CG1-CG1 3.78Å; V132-I162 PolarHBondContact O-N 3.45Å; L133-I162 WeakPolarHBondContact CA-O 3.34Å; L133-I162 HydrophobicContact CD1-CB 4.22Å; L133-I162 HydrophobicContact CD1-CG2 4Å; L133-I162 WeakPolarHBondContact CD1-O 3.38Å; L134-I162 PolarHBondContact N-O 2.9Å
163L96.3Very high92.2Very high0 Ų049.1 Ų49.10%027%0.27CS..EExtended strand (participates in β ladder)trans-96.6121.8179.5-54.8-176.4000108.7L38 L39 V40 L134 V137 L148 L161 I175L38-L163 PolarHBondContact O-N 2.87Å; L39-L163 CarbonylContact C-O 3.51Å; L39-L163 HydrophobicContact CD1-CB 3.69Å; L39-L163 HydrophobicContact CD1-CD1 4.4Å; V40-L163 PolarHBondContact N-O 3.41Å; L134-L163 HydrophobicContact CB-CD2 3.95Å; L134-L163 HydrophobicContact CD1-CD2 3.75Å; L134-L163 HydrophobicContact CG-CD2 4.07Å; V137-L163 HydrophobicContact CG1-CD1 4.48Å; V137-L163 HydrophobicContact CG2-CB 4.02Å; V137-L163 HydrophobicContact CG2-CD2 4.1Å; L148-L163 HydrophobicContact CD2-CD1 4.47Å; L148-L163 HydrophobicContact CD2-CD2 4.06Å; L161-L163 HydrophobicContact CB-CD2 4.33Å; L161-L163 HydrophobicContact CD2-CD2 4.3Å; L163-I175 HydrophobicContact CD1-CG2 3.38Å
164C96.2Very high92.4Very high9 Ų946.2 Ų46.26%0.06126%0.259CS..EExtended strand (participates in β ladder)trans-110.6115.9176.9179.50000110.2V40 I52 L133 L134 T135 E136 V137V40-C164 WeakPolarHBondContact O-CA 3.33Å; I52-C164 HydrophobicContact CD1-CB 3.86Å; L133-C164 HydrophobicContact CD1-CB 4.2Å; L134-C164 PolarHBondContact O-N 2.83Å; T135-C164 CarbonylContact C-O 3.46Å; E136-C164 PolarHBondContact N-O 3.02Å; V137-C164 PolarHBondContact N-O 3.12Å
165C94.6Very high92.6Very high2 Ų239.2 Ų39.21%0.01423%0.229CC..EExtended strand (participates in β ladder)trans-131.8168.117566.90000112.1V40 Y41 K48 V137 D138V40-C165 PolarHBondContact O-N 3.39Å; V40-C165 VanDerWaalsContact O-N 3.09Å; Y41-C165 VanDerWaalsContact CA-O 3.31Å; Y41-C165 WeakPolarHBondContact CA-O 3.49Å; Y41-C165 VanDerWaalsContact CB-SG 3.56Å; K48-C165 WeakPolarHBondContact CD-O 3.46Å; K48-C165 WeakPolarHBondContact CE-O 3.44Å; V137-C165 HydrophobicContact CB-CB 4.4Å; D138-C165 HydrophobicContact CB-CB 3.89Å
166N92.8Very high92.8Very high65 Ų6543.5 Ų43.535%0.34825%0.245SC..SBendtrans-88.6-47173.3-66.6-38.8000111.1G42 K48 D138G42-N166 CarbonylContact C-O 3.57Å; G42-N166 PolarHBondContact N-O 2.92Å; G42-N166 VanDerWaalsContact O-CA 3.26Å; G42-N166 WeakPolarHBondContact O-CA 3.4Å; G42-N166 VanDerWaalsContact O-O 3.11Å; K48-N166 PolarHBondContact NZ-OD1 3.06Å; D138-N166 PolarHBondContact OD2-N 2.89Å; D138-N166 VanDerWaalsContact OD2-N 3.08Å
167S90.8Very high93.1Very high55 Ų5544.6 Ų44.639%0.38526%0.259SS..  trans-122140.9176.9-177.90000111.3D138 S169D138-S167 PolarHBondContact OD2-N 3.35Å; S167-S169 VanDerWaalsContact C-N 3.31Å; S167-S169 PolarHBondContact OG-N 3.16Å; S167-S169 PolarHBondContact OG-OG 3.19Å
168T93.1Very high93.4Very high27 Ų2743.7 Ų43.717%0.16624%0.24CC..SBendtrans-84.1-5.3174.857.10000113.2L39 Y41 K170 V171L39-T168 HydrophobicContact CD2-CG2 4.16Å; Y41-T168 HydrophobicContact CD1-CG2 3.65Å; Y41-T168 HydrophobicContact CD2-CG2 3.59Å; Y41-T168 HydrophobicContact CE1-CG2 4.08Å; Y41-T168 HydrophobicContact CE2-CG2 3.99Å; Y41-T168 HydrophobicContact CG-CG2 3.37Å; T168-K170 PolarHBondContact O-N 2.87Å; T168-V171 PolarHBondContact O-N 3.44Å
169S92.4Very high93.7Very high96 Ų9641.5 Ų41.567%0.67123%0.228SC*.THydrogen-bonded Turntrans-63.8-37.2-174.757.80000113.3S167 V171S167-S169 VanDerWaalsContact C-N 3.31Å; S167-S169 PolarHBondContact OG-N 3.16Å; S167-S169 PolarHBondContact OG-OG 3.19Å; S169-V171 VanDerWaalsContact C-N 3.32Å
170K90.1Very high94.1Very high115 Ų11545 Ų4550%0.525%0.246SC..THydrogen-bonded Turntrans-84-2.8177.9-70.3-174.6176.6-1800113.8D138 Q145 T168D138-K170 HydrophobicContact CB-CB 4.4Å; D138-K170 WeakPolarHBondContact O-CB 3.39Å; D138-K170 WeakPolarHBondContact O-CD 3.38Å; Q145-K170 PolarHBondContact NE2-O 3.2Å; Q145-K170 PolarHBondContact OE1-O 3.27Å; T168-K170 PolarHBondContact O-N 2.87Å
171V94.3Very high94.2Very high6 Ų646.5 Ų46.54%0.03626%0.264CS..SBendtrans-90.3126.2179.7-177.90000110T168 S169 I175 R176T168-V171 PolarHBondContact O-N 3.44Å; S169-V171 VanDerWaalsContact C-N 3.32Å; V171-I175 HydrophobicContact CG1-CB 3.97Å; V171-I175 HydrophobicContact CG1-CG2 3.94Å; V171-R176 HydrophobicContact CB-CG 4.47Å; V171-R176 HydrophobicContact CG1-CG 4.07Å
172I95.2Very high94.2Very high20 Ų2046.9 Ų46.910%0.10327%0.266CS..  trans-61.3140.6-17863.6174000111.5Q145 P174 I175 R176Q145-I172 HydrophobicContact CB-CD1 3.84Å; Q145-I172 HydrophobicContact CB-CG1 4.06Å; Q145-I172 HydrophobicContact CB-CG2 4.47Å; I172-P174 VanDerWaalsContact C-N 3.29Å; I172-P174 HydrophobicContact CD1-CB 4.41Å; I172-P174 HydrophobicContact CD1-CG 4.43Å; I172-P174 VanDerWaalsContact O-N 3.17Å; I172-I175 HydrophobicContact CD1-CD1 4.16Å; I172-I175 HydrophobicContact CD1-CG1 4.13Å; I172-I175 HydrophobicContact CG1-CB 4.28Å; I172-I175 HydrophobicContact CG1-CD1 3.82Å; I172-I175 HydrophobicContact CG1-CG1 3.78Å; I172-I175 PolarHBondContact O-N 2.97Å; I172-R176 PolarHBondContact O-N 2.88Å
173P95Very high94.2Very high96 Ų9654.5 Ų54.562%0.62330%0.295SS*.Hα-helixtrans-52-36.6178.9-25.432.8000115.3I175 R176 S177P173-I175 VanDerWaalsContact C-N 3.27Å; P173-I175 PolarHBondContact O-N 3.36Å; P173-R176 PolarHBondContact O-N 3.25Å; P173-R176 VanDerWaalsContact O-N 3.13Å; P173-S177 PolarHBondContact O-N 2.96Å
174P94.9Very high94.2Very high35 Ų3554.5 Ų54.523%0.22730%0.295CS..Hα-helixtrans-59.7-30.2176.3-28.637.4000115.2R149 I172 S177 R178R149-P174 HydrophobicContact CG-CB 4.35Å; I172-P174 VanDerWaalsContact C-N 3.29Å; I172-P174 HydrophobicContact CD1-CB 4.41Å; I172-P174 HydrophobicContact CD1-CG 4.43Å; I172-P174 VanDerWaalsContact O-N 3.17Å; P174-S177 PolarHBondContact O-OG 3.49Å; P174-R178 WeakPolarHBondContact O-CD 3.33Å; P174-R178 WeakPolarHBondContact O-CG 3.4Å; P174-R178 PolarHBondContact O-NH1 3.49Å
175I94.6Very high94.1Very high0 Ų056.3 Ų56.30%031%0.306CS..Hα-helixtrans-75.2-46.3174.1-68.4175.7000109Q145 L148 R149 L163 V171 I172 P173 S177 R178 C179Q145-I175 HydrophobicContact CB-CD1 3.79Å; Q145-I175 HydrophobicContact CG-CD1 4.19Å; L148-I175 HydrophobicContact CD2-CD1 4.05Å; R149-I175 HydrophobicContact CB-CG1 4.41Å; L163-I175 HydrophobicContact CD1-CG2 3.38Å; V171-I175 HydrophobicContact CG1-CB 3.97Å; V171-I175 HydrophobicContact CG1-CG2 3.94Å; I172-I175 HydrophobicContact CD1-CD1 4.16Å; I172-I175 HydrophobicContact CD1-CG1 4.13Å; I172-I175 HydrophobicContact CG1-CB 4.28Å; I172-I175 HydrophobicContact CG1-CD1 3.82Å; I172-I175 HydrophobicContact CG1-CG1 3.78Å; I172-I175 PolarHBondContact O-N 2.97Å; P173-I175 VanDerWaalsContact C-N 3.27Å; P173-I175 PolarHBondContact O-N 3.36Å; I175-S177 VanDerWaalsContact C-N 3.26Å; I175-S177 PolarHBondContact O-N 3.33Å; I175-R178 PolarHBondContact O-N 2.91Å; I175-C179 PolarHBondContact O-N 3.38Å; I175-C179 PolarHBondContact O-SG 3.21Å; I175-C179 VanDerWaalsContact O-SG 3.39Å
176R94Very high94.1Very high133 Ų13357.3 Ų57.350%0.50232%0.315SS..Hα-helixtrans-57.2-37.1-179.6-69.3-17954.8-167.7-7.2113.2L39 V171 I172 P173 R178L39-R176 HydrophobicContact CD2-CG 4.01Å; V171-R176 HydrophobicContact CB-CG 4.47Å; V171-R176 HydrophobicContact CG1-CG 4.07Å; I172-R176 PolarHBondContact O-N 2.88Å; P173-R176 PolarHBondContact O-N 3.25Å; P173-R176 VanDerWaalsContact O-N 3.13Å; R176-R178 PolarHBondContact O-N 3.33Å
177S93.3Very high94.2Very high94 Ų9454.2 Ų54.266%0.65730%0.298SS*.THydrogen-bonded Turntrans-72.8-14.7-179.772.60000114P173 P174 I175P173-S177 PolarHBondContact O-N 2.96Å; P174-S177 PolarHBondContact O-OG 3.49Å; I175-S177 VanDerWaalsContact C-N 3.26Å; I175-S177 PolarHBondContact O-N 3.33Å
178R93.6Very high94.5Very high81 Ų8153.5 Ų53.531%0.30629%0.293SS..THydrogen-bonded Turntrans-108-2.2-176.3-67.4172.1177.163.86.4113.2R149 M152 E153 P174 I175 R176R149-R178 VanDerWaalsContact NH2-NH2 3.16Å; M152-R178 HydrophobicContact CE-CB 3.41Å; M152-R178 VanDerWaalsContact CE-CB 3.41Å; M152-R178 HydrophobicContact CE-CG 4.04Å; E153-R178 IonicContact OE1-CZ 2.61Å; E153-R178 IonicContact OE1-NE 2.68Å; E153-R178 PolarHBondContact OE1-NE 3.39Å; E153-R178 IonicContact OE1-NH2 3.13Å; E153-R178 PolarHBondContact OE1-NH2 3.43Å; P174-R178 WeakPolarHBondContact O-CD 3.33Å; P174-R178 WeakPolarHBondContact O-CG 3.4Å; P174-R178 PolarHBondContact O-NH1 3.49Å; I175-R178 PolarHBondContact O-N 2.91Å; R176-R178 PolarHBondContact O-N 3.33Å
179C94.8Very high94.6Very high12 Ų1254.1 Ų54.18%0.08130%0.295CS..SBendtrans-121.6139.6-179.9-56.10000109.9H37 L39 I175 A181H37-C179 HydrophobicContact CB-CB 4.31Å; H37-C179 CarbonylContact O-C 3.59Å; H37-C179 VanDerWaalsContact O-CA 3.29Å; H37-C179 WeakPolarHBondContact O-CA 3.44Å; L39-C179 HydrophobicContact CB-CB 3.75Å; I175-C179 PolarHBondContact O-N 3.38Å; I175-C179 PolarHBondContact O-SG 3.21Å; I175-C179 VanDerWaalsContact O-SG 3.39Å; C179-A181 PolarHBondContact O-N 2.92Å
180L95.5Very high94.7Very high73 Ų7355 Ų5538%0.38229%0.289SS..EExtended strand (participates in β ladder)trans-69.4117.7167.2-171.9157.5000108.5L29 P36 H37 L38 L39 V182L29-L180 HydrophobicContact CD1-CD1 4.04Å; L29-L180 HydrophobicContact CD2-CD1 4.08Å; P36-L180 HydrophobicContact CG-CB 4.13Å; P36-L180 HydrophobicContact CG-CD1 4.02Å; H37-L180 PolarHBondContact O-N 3.06Å; L38-L180 HydrophobicContact CD2-CB 3.89Å; L38-L180 HydrophobicContact CD2-CD2 4.11Å; L38-L180 HydrophobicContact CD2-CG 4.45Å; L39-L180 PolarHBondContact N-O 3.31Å; L180-V182 HydrophobicContact CD2-CG2 3.47Å; L180-V182 VanDerWaalsContact CD2-CG2 3.47Å; L180-V182 PolarHBondContact O-N 3.44Å
181A95.6Very high95Very high58 Ų5851.5 Ų51.548%0.47928%0.276SS..EExtended strand (participates in β ladder)trans-84.6110.3-175.100000111L39 Y41 C179L39-A181 CarbonylContact O-C 3.57Å; L39-A181 WeakPolarHBondContact O-CA 3.47Å; Y41-A181 HydrophobicContact CE1-CB 4.03Å; C179-A181 PolarHBondContact O-N 2.92Å
182V95.8Very high95Very high8 Ų851.2 Ų51.25%0.04827%0.274CS..EExtended strand (participates in β ladder)trans-103106177.9-177.20000109.2L26 L38 L39 V40 Y41 L180 V184L26-V182 HydrophobicContact CD2-CG1 4.17Å; L26-V182 HydrophobicContact CD2-CG2 4.1Å; L38-V182 HydrophobicContact CD2-CG2 4.37Å; L39-V182 PolarHBondContact O-N 2.95Å; V40-V182 WeakPolarHBondContact CA-O 3.4Å; V40-V182 HydrophobicContact CG2-CB 4.23Å; Y41-V182 WeakPolarHBondContact CD1-O 3.44Å; Y41-V182 PolarHBondContact N-O 3.17Å; L180-V182 HydrophobicContact CD2-CG2 3.47Å; L180-V182 VanDerWaalsContact CD2-CG2 3.47Å; L180-V182 PolarHBondContact O-N 3.44Å; V182-V184 HydrophobicContact CG1-CG2 4.35Å
183R95.6Very high95.1Very high160 Ų16050.7 Ų50.760%0.60427%0.272SS*.EExtended strand (participates in β ladder)trans-84.8118.3175.5-173.8177.7173.9-169.5-1.8110.3Q22 Y41 P185Q22-R183 PolarHBondContact NE2-O 3.49Å; Y41-R183 HydrophobicContact CD2-CG 4.38Å; Y41-R183 HydrophobicContact CE1-CB 3.94Å; Y41-R183 HydrophobicContact CE2-CB 3.94Å; Y41-R183 HydrophobicContact CE2-CG 3.72Å; R183-P185 VanDerWaalsContact O-CD 3.26Å; R183-P185 WeakPolarHBondContact O-CD 3.45Å
184V95.8Very high95.1Very high0 Ų051 Ų510%027%0.268CS..  trans-104.297.2173.5-175.80000108.5V40 Y41 G42 A46 K48 V182V40-V184 HydrophobicContact CG1-CG2 3.77Å; Y41-V184 PolarHBondContact O-N 2.95Å; G42-V184 WeakPolarHBondContact CA-O 3.47Å; A46-V184 HydrophobicContact CB-CG1 4.27Å; A46-V184 WeakPolarHBondContact O-CG1 3.46Å; K48-V184 HydrophobicContact CG-CB 4.08Å; K48-V184 HydrophobicContact CG-CG1 4.45Å; K48-V184 HydrophobicContact CG-CG2 4.36Å; V182-V184 HydrophobicContact CG1-CG2 4.35Å
185P95.1Very high95.1Very high46 Ų4649.7 Ų49.730%0.29926%0.259SS..PPolyproline II helixtrans-69.9155.9178.426.2-27.6000111.1H19 R183H19-P185 PolarHBondContact NE2-O 3.03Å; R183-P185 VanDerWaalsContact O-CD 3.26Å; R183-P185 WeakPolarHBondContact O-CD 3.45Å
186A94.5Very high95.1Very high24 Ų2449.7 Ų49.720%0.19826%0.26CS..PPolyproline II helixtrans-58141.3170.100000109.8P43 R221P43-A186 HydrophobicContact CG-CB 3.67Å; A186-R221 HydrophobicContact CB-CB 3.93Å
187P95.3Very high95.1Very high0 Ų045 Ų450%025%0.247CC..PPolyproline II helixtrans-60.3153.6173.123.7-30.2000111.2Y18 D191 I192 L223Y18-P187 HydrophobicContact CD1-CB 4.44Å; Y18-P187 HydrophobicContact CD2-CB 3.83Å; Y18-P187 HydrophobicContact CE1-CB 4.42Å; Y18-P187 HydrophobicContact CE2-CB 3.75Å; Y18-P187 HydrophobicContact CE2-CG 4.04Å; Y18-P187 HydrophobicContact CG-CB 4.19Å; P187-D191 HydrophobicContact CB-CB 3.83Å; P187-I192 HydrophobicContact CB-CG1 4.04Å; P187-I192 HydrophobicContact CG-CD1 4.08Å; P187-I192 HydrophobicContact CG-CG1 3.74Å; P187-L223 HydrophobicContact CG-CB 4.19Å
188S95.8Very high95.2Very high39 Ų3943 Ų4327%0.27323%0.231SC..PPolyproline II helixtrans-67166.2170.765.60000111E190 D191 I192S188-E190 WeakPolarHBondContact CB-OE2 3.4Å; S188-E190 PolarHBondContact O-N 3.47Å; S188-E190 PolarHBondContact OG-OE2 2.88Å; S188-D191 PolarHBondContact N-OD2 2.88Å; S188-D191 PolarHBondContact O-N 3.04Å; S188-D191 WeakPolarHBondContact OG-CB 3.36Å; S188-D191 PolarHBondContact OG-N 3.42Å; S188-D191 PolarHBondContact OG-OD2 3.44Å; S188-I192 WeakPolarHBondContact O-CG1 3.26Å; S188-I192 PolarHBondContact O-N 3.44Å; S188-I192 VanDerWaalsContact O-N 3.07Å
189I95.5Very high95.2Very high41 Ų4139.5 Ų39.521%0.2122%0.218CC..Hα-helixtrans-63.3-39.7176.8-63.5-61.9000109.3I192 C193 A216 R221I189-I192 PolarHBondContact O-N 3.1Å; I189-C193 PolarHBondContact O-N 3.36Å; I189-C193 PolarHBondContact O-SG 3.1Å; I189-A216 HydrophobicContact CD1-CB 4.4Å; I189-A216 HydrophobicContact CG2-CB 3.74Å; I189-R221 HydrophobicContact CD1-CG 3.89Å
190E95.1Very high95.2Very high115 Ų11539 Ų3954%0.53722%0.215SC..Hα-helixtrans-63.6-43.1176.7-58.779.1-172.300111.7S188 I192 C193 N194S188-E190 WeakPolarHBondContact CB-OE2 3.4Å; S188-E190 PolarHBondContact O-N 3.47Å; S188-E190 PolarHBondContact OG-OE2 2.88Å; E190-I192 VanDerWaalsContact C-N 3.31Å; E190-I192 PolarHBondContact O-N 3.17Å; E190-C193 PolarHBondContact O-N 2.77Å; E190-N194 WeakPolarHBondContact O-CB 2.95Å; E190-N194 PolarHBondContact O-N 2.93Å; E190-N194 PolarHBondContact O-ND2 3.47Å
191D95.3Very high95.1Very high41 Ų4143.4 Ų43.422%0.21923%0.231CC..Hα-helixtrans-60.5-41.8175.1-69.7-40.6000111.4P187 S188 N194 V195P187-D191 HydrophobicContact CB-CB 3.83Å; S188-D191 PolarHBondContact N-OD2 2.88Å; S188-D191 PolarHBondContact O-N 3.04Å; S188-D191 WeakPolarHBondContact OG-CB 3.36Å; S188-D191 PolarHBondContact OG-N 3.42Å; S188-D191 PolarHBondContact OG-OD2 3.44Å; D191-N194 PolarHBondContact O-N 3.46Å; D191-V195 VanDerWaalsContact O-CG2 3.29Å; D191-V195 WeakPolarHBondContact O-CG2 3.47Å; D191-V195 PolarHBondContact O-N 3.25Å
192I95.7Very high95Very high0 Ų046 Ų460%023%0.232CC..Hα-helixtrans-64.4-46.9177.2-65.3167.4000110.1P187 S188 I189 E190 N194 V195 L196 A216 R221 L223 A226P187-I192 HydrophobicContact CB-CG1 4.04Å; P187-I192 HydrophobicContact CG-CD1 4.08Å; P187-I192 HydrophobicContact CG-CG1 3.74Å; S188-I192 WeakPolarHBondContact O-CG1 3.26Å; S188-I192 PolarHBondContact O-N 3.44Å; S188-I192 VanDerWaalsContact O-N 3.07Å; I189-I192 PolarHBondContact O-N 3.1Å; E190-I192 VanDerWaalsContact C-N 3.31Å; E190-I192 PolarHBondContact O-N 3.17Å; I192-N194 VanDerWaalsContact C-N 3.31Å; I192-N194 PolarHBondContact O-N 3.14Å; I192-V195 PolarHBondContact O-N 3.47Å; I192-L196 HydrophobicContact CG2-CD1 4.04Å; I192-L196 HydrophobicContact CG2-CG 4.24Å; I192-L196 WeakPolarHBondContact O-CG 3.26Å; I192-L196 PolarHBondContact O-N 3.14Å; I192-A216 HydrophobicContact CB-CB 3.99Å; I192-A216 HydrophobicContact CG2-CB 3.72Å; I192-R221 HydrophobicContact CD1-CB 4.45Å; I192-L223 HydrophobicContact CB-CD1 4.44Å; I192-L223 HydrophobicContact CG1-CD1 4.15Å; I192-L223 HydrophobicContact CG2-CD1 4.14Å; I192-A226 HydrophobicContact CG2-CB 3.64Å
193C95.8Very high94.9Very high9 Ų947.6 Ų47.66%0.06124%0.239CC..Hα-helixtrans-55.9-46.6175.6-69.90000111.5I189 E190 V195 L196 S197 A212I189-C193 PolarHBondContact O-N 3.36Å; I189-C193 PolarHBondContact O-SG 3.1Å; E190-C193 PolarHBondContact O-N 2.77Å; C193-V195 PolarHBondContact O-N 2.94Å; C193-L196 PolarHBondContact O-N 3.32Å; C193-S197 PolarHBondContact O-N 3.12Å; C193-S197 PolarHBondContact O-OG 2.78Å; C193-A212 HydrophobicContact CB-CB 4.46Å
194N94.9Very high94.6Very high101 Ų10143 Ų4354%0.5424%0.241SC..Hα-helixtrans-60.7-42.5178.4-72.7-28.2000112.3E190 D191 I192 T198E190-N194 WeakPolarHBondContact O-CB 2.95Å; E190-N194 PolarHBondContact O-N 2.93Å; E190-N194 PolarHBondContact O-ND2 3.47Å; D191-N194 PolarHBondContact O-N 3.46Å; I192-N194 VanDerWaalsContact C-N 3.31Å; I192-N194 PolarHBondContact O-N 3.14Å; N194-T198 VanDerWaalsContact O-CB 3.32Å; N194-T198 WeakPolarHBondContact O-CB 3.45Å; N194-T198 PolarHBondContact O-N 3.15Å; N194-T198 PolarHBondContact O-OG1 3.18Å
195V95.2Very high94.4Very high8 Ų843.7 Ų43.75%0.04824%0.244CC..Hα-helixtrans-65.1-46.7175.8173.60000110.8D17 Y18 D191 I192 C193 S197 T198 V199 L223D17-V195 HydrophobicContact CB-CG2 3.52Å; Y18-V195 HydrophobicContact CD1-CG2 4.34Å; D191-V195 VanDerWaalsContact O-CG2 3.29Å; D191-V195 WeakPolarHBondContact O-CG2 3.47Å; D191-V195 PolarHBondContact O-N 3.25Å; I192-V195 PolarHBondContact O-N 3.47Å; C193-V195 PolarHBondContact O-N 2.94Å; V195-S197 PolarHBondContact O-N 3.09Å; V195-T198 PolarHBondContact O-N 2.9Å; V195-T198 VanDerWaalsContact O-N 3.16Å; V195-V199 HydrophobicContact CG1-CG2 4.34Å; V195-V199 WeakPolarHBondContact O-CG2 3.35Å; V195-V199 PolarHBondContact O-N 2.73Å; V195-L223 HydrophobicContact CB-CD1 4.11Å; V195-L223 HydrophobicContact CG1-CD1 3.92Å; V195-L223 HydrophobicContact CG1-CD2 4.48Å
196L94.8Very high94.2Very high1 Ų145.4 Ų45.41%0.00526%0.262CS..Hα-helixtrans-59-46.9178.2-71.5178.5000111.5I192 C193 T198 V199 C200 L207 L215 A226 L227 C230I192-L196 HydrophobicContact CG2-CD1 4.04Å; I192-L196 HydrophobicContact CG2-CG 4.24Å; I192-L196 WeakPolarHBondContact O-CG 3.26Å; I192-L196 PolarHBondContact O-N 3.14Å; C193-L196 PolarHBondContact O-N 3.32Å; L196-T198 VanDerWaalsContact C-N 3.33Å; L196-T198 PolarHBondContact O-N 2.7Å; L196-V199 PolarHBondContact O-N 3.09Å; L196-C200 WeakPolarHBondContact O-CB 3.39Å; L196-C200 PolarHBondContact O-N 3.35Å; L196-C200 PolarHBondContact O-SG 3.29Å; L196-L207 HydrophobicContact CB-CD2 3.93Å; L196-L215 HydrophobicContact CD1-CB 3.91Å; L196-L215 HydrophobicContact CD1-CD1 4.27Å; L196-A226 HydrophobicContact CD1-CB 4.41Å; L196-A226 HydrophobicContact CD2-CB 4.41Å; L196-L227 HydrophobicContact CD2-CD2 4.04Å; L196-L227 HydrophobicContact CD2-CG 4.33Å; L196-C230 HydrophobicContact CD2-CB 3.88Å
197S94.8Very high94.1Very high33 Ų3345.4 Ų45.423%0.23126%0.259CS..Hα-helixtrans-63-38.4175.7-61.70000112.2C193 V195 K201C193-S197 PolarHBondContact O-N 3.12Å; C193-S197 PolarHBondContact O-OG 2.78Å; V195-S197 PolarHBondContact O-N 3.09Å; S197-K201 WeakPolarHBondContact O-CB 3.22Å; S197-K201 WeakPolarHBondContact O-CG 3.47Å; S197-K201 PolarHBondContact O-N 3.07Å
198T94.6Very high94Very high52 Ų5246.7 Ų46.732%0.31927%0.268SS..Hα-helixtrans-66.4-41.8177.7-60.80000111.7N194 V195 L196 K202N194-T198 VanDerWaalsContact O-CB 3.32Å; N194-T198 WeakPolarHBondContact O-CB 3.45Å; N194-T198 PolarHBondContact O-N 3.15Å; N194-T198 PolarHBondContact O-OG1 3.18Å; V195-T198 PolarHBondContact O-N 2.9Å; V195-T198 VanDerWaalsContact O-N 3.16Å; L196-T198 VanDerWaalsContact C-N 3.33Å; L196-T198 PolarHBondContact O-N 2.7Å; T198-K202 HydrophobicContact CG2-CD 4.42Å; T198-K202 VanDerWaalsContact O-CG 3.31Å; T198-K202 WeakPolarHBondContact O-CG 3.26Å; T198-K202 PolarHBondContact O-N 3.16Å; T198-K202 VanDerWaalsContact O-N 3.08Å
199V94.6Very high93.8Very high8 Ų848.8 Ų48.85%0.04828%0.282CS..Hα-helixtrans-65.9-46.2175.9170.70000110.6W4 Y8 V195 L196 K201 K202 E203 L227W4-V199 HydrophobicContact CE3-CG1 4Å; Y8-V199 HydrophobicContact CD2-CG1 3.62Å; Y8-V199 HydrophobicContact CD2-CG2 4.39Å; Y8-V199 HydrophobicContact CE2-CG1 3.95Å; Y8-V199 HydrophobicContact CG-CG1 4.16Å; Y8-V199 HydrophobicContact CG-CG2 4.13Å; V195-V199 HydrophobicContact CG1-CG2 4.34Å; V195-V199 WeakPolarHBondContact O-CG2 3.35Å; V195-V199 PolarHBondContact O-N 2.73Å; L196-V199 PolarHBondContact O-N 3.09Å; V199-K201 PolarHBondContact O-N 2.92Å; V199-K202 PolarHBondContact O-N 2.94Å; V199-K202 VanDerWaalsContact O-N 3.15Å; V199-E203 PolarHBondContact O-N 2.86Å; V199-L227 HydrophobicContact CB-CD2 4.37Å; V199-L227 HydrophobicContact CG1-CD2 4.29Å; V199-L227 HydrophobicContact CG2-CD2 3.99Å
200C93.3Very high93.7Very high1 Ų152.5 Ų52.51%0.00730%0.297CS..Hα-helixtrans-61.7-43.3177.8-68.70000112L196 K202 E203 G204 L205 L207L196-C200 WeakPolarHBondContact O-CB 3.39Å; L196-C200 PolarHBondContact O-N 3.35Å; L196-C200 PolarHBondContact O-SG 3.29Å; C200-K202 VanDerWaalsContact C-N 3.32Å; C200-K202 PolarHBondContact O-N 3.33Å; C200-E203 CarbonylContact O-C 3.58Å; C200-E203 PolarHBondContact O-N 3.41Å; C200-E203 VanDerWaalsContact O-N 3.12Å; C200-G204 PolarHBondContact O-N 2.85Å; C200-L205 CarbonylContact C-O 3.53Å; C200-L205 HydrophobicContact CB-CB 4.1Å; C200-L205 PolarHBondContact O-N 2.88Å; C200-L207 HydrophobicContact CB-CB 3.84Å
201K94.2Very high93.6Very high167 Ų16747 Ų4773%0.72627%0.271SS*.Hα-helixtrans-58.9-41.4173.8-76.7174.2-178.1-179.50112.3S197 V199 E203 G204S197-K201 WeakPolarHBondContact O-CB 3.22Å; S197-K201 WeakPolarHBondContact O-CG 3.47Å; S197-K201 PolarHBondContact O-N 3.07Å; V199-K201 PolarHBondContact O-N 2.92Å; K201-E203 VanDerWaalsContact C-N 3.29Å; K201-E203 PolarHBondContact O-N 2.77Å; K201-G204 PolarHBondContact O-N 3.35Å; K201-G204 VanDerWaalsContact O-N 3.12Å
202K93.5Very high93.6Very high112 Ų11245.1 Ų45.149%0.48726%0.261SS..Hα-helixtrans-68.3-26.5176.6-73.6173-176.9168.10113.4Y8 T198 V199 C200 G204Y8-K202 HydrophobicContact CD1-CB 4.38Å; Y8-K202 HydrophobicContact CD1-CD 3.77Å; Y8-K202 HydrophobicContact CE1-CB 3.59Å; Y8-K202 HydrophobicContact CE1-CD 3.73Å; Y8-K202 HydrophobicContact CE1-CG 4.29Å; T198-K202 HydrophobicContact CG2-CD 4.42Å; T198-K202 VanDerWaalsContact O-CG 3.31Å; T198-K202 WeakPolarHBondContact O-CG 3.26Å; T198-K202 PolarHBondContact O-N 3.16Å; T198-K202 VanDerWaalsContact O-N 3.08Å; V199-K202 PolarHBondContact O-N 2.94Å; V199-K202 VanDerWaalsContact O-N 3.15Å; C200-K202 VanDerWaalsContact C-N 3.32Å; C200-K202 PolarHBondContact O-N 3.33Å; K202-G204 VanDerWaalsContact C-N 3.34Å
203E92.9Very high93.6Very high42 Ų4249 Ų4920%0.19628%0.279CS..THydrogen-bonded Turntrans-86.6-3.1172.5-78.7-72.1147.700112.8W4 K7 Y8 V199 C200 K201 L205 R234W4-E203 HydrophobicContact CD2-CG 4.48Å; K7-E203 IonicContact NZ-OE1 3.43Å; K7-E203 PolarHBondContact NZ-OE1 3.47Å; Y8-E203 HydrophobicContact CE2-CG 3.75Å; Y8-E203 WeakPolarHBondContact CE2-OE1 3.3Å; Y8-E203 VanDerWaalsContact OH-CD 3.29Å; Y8-E203 VanDerWaalsContact OH-CG 3.31Å; Y8-E203 WeakPolarHBondContact OH-CG 3.3Å; Y8-E203 PolarHBondContact OH-OE1 3.41Å; V199-E203 PolarHBondContact O-N 2.86Å; C200-E203 CarbonylContact O-C 3.58Å; C200-E203 PolarHBondContact O-N 3.41Å; C200-E203 VanDerWaalsContact O-N 3.12Å; K201-E203 VanDerWaalsContact C-N 3.29Å; K201-E203 PolarHBondContact O-N 2.77Å; E203-L205 VanDerWaalsContact C-N 3.33Å; E203-L205 HydrophobicContact CB-CD1 3.47Å; E203-L205 VanDerWaalsContact CB-CD1 3.47Å; E203-L205 HydrophobicContact CB-CG 4.02Å; E203-L205 HydrophobicContact CG-CD1 4.27Å; E203-R234 IonicContact OE2-CZ 3.85Å; E203-R234 IonicContact OE2-NH1 2.68Å; E203-R234 PolarHBondContact OE2-NH1 3.3Å
204G90.6Very high93.5Very high64 Ų6452.9 Ų52.966%0.6629%0.292SS*.THydrogen-bonded Turntrans74.420.1-17700000114.3C200 K201 K202C200-G204 PolarHBondContact O-N 2.85Å; K201-G204 PolarHBondContact O-N 3.35Å; K201-G204 VanDerWaalsContact O-N 3.12Å; K202-G204 VanDerWaalsContact C-N 3.34Å
205L91.4Very high93.5Very high13 Ų1348 Ų487%0.06827%0.267CS..  trans-98.5139.4-178.4-61.1152.5000111.1W4 C200 E203 L207 R234 Y238 F240W4-L205 HydrophobicContact CH2-CD1 3.83Å; W4-L205 HydrophobicContact CZ2-CD1 4.37Å; W4-L205 HydrophobicContact CZ3-CD1 4.37Å; C200-L205 CarbonylContact C-O 3.53Å; C200-L205 HydrophobicContact CB-CB 4.1Å; C200-L205 PolarHBondContact O-N 2.88Å; E203-L205 VanDerWaalsContact C-N 3.33Å; E203-L205 HydrophobicContact CB-CD1 3.47Å; E203-L205 VanDerWaalsContact CB-CD1 3.47Å; E203-L205 HydrophobicContact CB-CG 4.02Å; E203-L205 HydrophobicContact CG-CD1 4.27Å; L205-L207 PolarHBondContact O-N 3.09Å; L205-R234 HydrophobicContact CD2-CG 4.38Å; L205-Y238 HydrophobicContact CD2-CD2 3.91Å; L205-Y238 HydrophobicContact CD2-CE2 3.38Å; L205-F240 HydrophobicContact CB-CE2 4.08Å; L205-F240 HydrophobicContact CD1-CE2 4.42Å; L205-F240 HydrophobicContact CD2-CE2 4.23Å; L205-F240 HydrophobicContact CG-CE2 4.5Å
206A90.1Very high93.4Very high82 Ų8247.7 Ų47.768%0.67826%0.264SS*.  trans-90.498.617100000110.3F240A206-F240 WeakPolarHBondContact O-CD2 3.43Å
207L91.9Very high93.4Very high24 Ų2453.5 Ų53.513%0.12629%0.292CS..  trans-90.1119.6175.3-174.873.8000110.1L196 C200 L205 L211 A212 L215 F240L196-L207 HydrophobicContact CB-CD2 3.93Å; C200-L207 HydrophobicContact CB-CB 3.84Å; L205-L207 PolarHBondContact O-N 3.09Å; L207-L211 HydrophobicContact CD1-CD2 3.88Å; L207-L211 HydrophobicContact CD1-CG 4.29Å; L207-A212 HydrophobicContact CD2-CB 3.71Å; L207-A212 HydrophobicContact CG-CB 4.3Å; L207-L215 HydrophobicContact CD1-CD1 4.47Å; L207-F240 HydrophobicContact CD1-CD1 4.35Å; L207-F240 HydrophobicContact CD1-CD2 4.08Å; L207-F240 HydrophobicContact CD1-CE1 4.41Å; L207-F240 HydrophobicContact CD1-CE2 4.11Å; L207-F240 HydrophobicContact CD1-CG 4.2Å; L207-F240 HydrophobicContact CD1-CZ 4.27Å
208P93.8Very high93.3Very high28 Ų2855 Ų5518%0.18229%0.294CS..  trans-68.1144.7175.823.3-26.7000111.3K210 L211 A212 F240 E242P208-K210 PolarHBondContact O-N 2.66Å; P208-L211 HydrophobicContact CG-CB 3.77Å; P208-L211 HydrophobicContact CG-CD2 4.31Å; P208-L211 PolarHBondContact O-N 3.03Å; P208-A212 PolarHBondContact O-N 3.33Å; P208-A212 VanDerWaalsContact O-N 3.09Å; P208-F240 HydrophobicContact CG-CB 4.24Å; P208-E242 HydrophobicContact CB-CG 4.29Å
209S91.7Very high93.2Very high83 Ų8352.6 Ų52.658%0.5828%0.279SS*.Hα-helixtrans-62.3-39.6-175.752.40000112.6L211 A212 H213S209-L211 PolarHBondContact O-N 3.08Å; S209-A212 WeakPolarHBondContact O-CB 3.33Å; S209-A212 PolarHBondContact O-N 2.92Å; S209-H213 PolarHBondContact O-CD2 2.85Å; S209-H213 PolarHBondContact O-N 3.03Å
210K93.9Very high93.1Very high118 Ų11857.3 Ų57.351%0.51331%0.311SS..Hα-helixtrans-61.3-43.8176.7-66.1-171.1-165.6161.80112.4P208 A212 H213 R214 E242P208-K210 PolarHBondContact O-N 2.66Å; K210-A212 VanDerWaalsContact C-N 3.34Å; K210-A212 PolarHBondContact O-N 3.23Å; K210-H213 PolarHBondContact O-N 3.41Å; K210-R214 WeakPolarHBondContact O-CG 3.37Å; K210-R214 PolarHBondContact O-N 3.15Å; K210-E242 HydrophobicContact CD-CB 4.46Å; K210-E242 HydrophobicContact CD-CG 4.47Å; K210-E242 WeakPolarHBondContact CD-OE2 3.33Å; K210-E242 WeakPolarHBondContact CE-OE2 3.31Å; K210-E242 IonicContact NZ-OE1 3.57Å; K210-E242 IonicContact NZ-OE2 3.43Å; K210-E242 PolarHBondContact NZ-OE2 2.88Å
211L93.3Very high93.1Very high0 Ų064.3 Ų64.30%034%0.338CS..Hα-helixtrans-65-40177.2-177.261.8000111.1L207 P208 S209 H213 R214 L215 F240 Q244 I246L207-L211 HydrophobicContact CD1-CD2 3.88Å; L207-L211 HydrophobicContact CD1-CG 4.29Å; P208-L211 HydrophobicContact CG-CB 3.77Å; P208-L211 HydrophobicContact CG-CD2 4.31Å; P208-L211 PolarHBondContact O-N 3.03Å; S209-L211 PolarHBondContact O-N 3.08Å; L211-H213 VanDerWaalsContact C-N 3.34Å; L211-H213 PolarHBondContact O-N 3.39Å; L211-R214 PolarHBondContact O-N 3.23Å; L211-L215 HydrophobicContact CD1-CG 4.46Å; L211-L215 HydrophobicContact CG-CD1 4.11Å; L211-L215 HydrophobicContact CG-CG 4.45Å; L211-L215 WeakPolarHBondContact O-CB 3.49Å; L211-L215 VanDerWaalsContact O-CG 3.29Å; L211-L215 WeakPolarHBondContact O-CG 3.13Å; L211-L215 PolarHBondContact O-N 3.3Å; L211-F240 HydrophobicContact CD2-CB 4.01Å; L211-F240 HydrophobicContact CD2-CD1 3.68Å; L211-F240 HydrophobicContact CD2-CE1 4.46Å; L211-F240 HydrophobicContact CD2-CG 4.1Å; L211-Q244 HydrophobicContact CD1-CB 4.28Å; L211-I246 HydrophobicContact CD1-CD1 4.31Å; L211-I246 HydrophobicContact CD1-CG1 4.2Å
212A94.6Very high93.1Very high1 Ų158.3 Ų58.31%0.00831%0.313CS..Hα-helixtrans-59.7-43.2175.700000112.1C193 L207 P208 S209 K210 L215 A216C193-A212 HydrophobicContact CB-CB 4.46Å; L207-A212 HydrophobicContact CD2-CB 3.71Å; L207-A212 HydrophobicContact CG-CB 4.3Å; P208-A212 PolarHBondContact O-N 3.33Å; P208-A212 VanDerWaalsContact O-N 3.09Å; S209-A212 WeakPolarHBondContact O-CB 3.33Å; S209-A212 PolarHBondContact O-N 2.92Å; K210-A212 VanDerWaalsContact C-N 3.34Å; K210-A212 PolarHBondContact O-N 3.23Å; A212-L215 PolarHBondContact O-N 2.98Å; A212-A216 WeakPolarHBondContact O-CB 3.29Å; A212-A216 PolarHBondContact O-N 3.13Å
213H95.1Very high93.2Very high82 Ų8253.8 Ų53.838%0.3829%0.294SS..Hα-helixtrans-63.3-47.1175-87-78.3000112.3S209 K210 L211 L215 A216 E217S209-H213 PolarHBondContact O-CD2 2.85Å; S209-H213 PolarHBondContact O-N 3.03Å; K210-H213 PolarHBondContact O-N 3.41Å; L211-H213 VanDerWaalsContact C-N 3.34Å; L211-H213 PolarHBondContact O-N 3.39Å; H213-L215 VanDerWaalsContact C-N 3.31Å; H213-L215 PolarHBondContact O-N 3.4Å; H213-A216 PolarHBondContact O-N 2.89Å; H213-A216 VanDerWaalsContact O-N 3.12Å; H213-E217 WeakPolarHBondContact O-CG 3.31Å; H213-E217 PolarHBondContact O-N 3.43Å
214R94.6Very high93.3Very high90 Ų9057.7 Ų57.734%0.3431%0.307SS..Hα-helixtrans-59-41.9176.4-70.3175.267.2-142.9-2.9112K210 L211 K218 E242 Q244 I246K210-R214 WeakPolarHBondContact O-CG 3.37Å; K210-R214 PolarHBondContact O-N 3.15Å; L211-R214 PolarHBondContact O-N 3.23Å; R214-K218 WeakPolarHBondContact O-CB 3.39Å; R214-K218 PolarHBondContact O-N 3.48Å; R214-E242 PolarHBondContact NH1-O 3.35Å; R214-Q244 PolarHBondContact NH1-O 3.32Å; R214-Q244 PolarHBondContact NH2-O 3.46Å; R214-I246 HydrophobicContact CB-CD1 3.92Å
215L94.1Very high93.5Very high0 Ų056.7 Ų56.70%029%0.285CS..Hα-helixtrans-62.3-44.3174.6-75168.5000111.7L196 L207 L211 A212 H213 S219 M229 C230 I246L196-L215 HydrophobicContact CD1-CB 3.91Å; L196-L215 HydrophobicContact CD1-CD1 4.27Å; L207-L215 HydrophobicContact CD1-CD1 4.47Å; L211-L215 HydrophobicContact CD1-CG 4.46Å; L211-L215 HydrophobicContact CG-CD1 4.11Å; L211-L215 HydrophobicContact CG-CG 4.45Å; L211-L215 WeakPolarHBondContact O-CB 3.49Å; L211-L215 VanDerWaalsContact O-CG 3.29Å; L211-L215 WeakPolarHBondContact O-CG 3.13Å; L211-L215 PolarHBondContact O-N 3.3Å; A212-L215 PolarHBondContact O-N 2.98Å; H213-L215 VanDerWaalsContact C-N 3.31Å; H213-L215 PolarHBondContact O-N 3.4Å; L215-S219 VanDerWaalsContact O-CB 3.3Å; L215-S219 WeakPolarHBondContact O-CB 3.48Å; L215-S219 PolarHBondContact O-N 2.88Å; L215-M229 HydrophobicContact CD2-CB 3.69Å; L215-C230 HydrophobicContact CD1-CB 4.04Å; L215-I246 HydrophobicContact CD2-CB 4.5Å; L215-I246 HydrophobicContact CD2-CD1 3.94Å; L215-I246 HydrophobicContact CD2-CG1 4.05Å; L215-I246 HydrophobicContact CD2-CG2 3.63Å; L215-I246 HydrophobicContact CG-CD1 4.16Å
216A94.7Very high93.6Very high0 Ų056 Ų560%028%0.281CS..Hα-helixtrans-65.1-43.2179.600000112I189 I192 A212 H213 S219I189-A216 HydrophobicContact CD1-CB 4.4Å; I189-A216 HydrophobicContact CG2-CB 3.74Å; I192-A216 HydrophobicContact CB-CB 3.99Å; I192-A216 HydrophobicContact CG2-CB 3.72Å; A212-A216 WeakPolarHBondContact O-CB 3.29Å; A212-A216 PolarHBondContact O-N 3.13Å; H213-A216 PolarHBondContact O-N 2.89Å; H213-A216 VanDerWaalsContact O-N 3.12Å; A216-S219 PolarHBondContact O-N 2.69Å; A216-S219 PolarHBondContact O-OG 2.72Å
217E93.8Very high93.8Very high124 Ų12452.9 Ų52.958%0.57925%0.253SS*.Hα-helixtrans-62.4-50.8175-72.3173.3-175.200111.6H213 S219 C220H213-E217 WeakPolarHBondContact O-CG 3.31Å; H213-E217 PolarHBondContact O-N 3.43Å; E217-S219 PolarHBondContact O-N 3.29Å; E217-C220 PolarHBondContact O-N 3.04Å
218K92.8Very high94Very high65 Ų6555.2 Ų55.228%0.28327%0.265SS..Hα-helixtrans-64.5-24.4-179.9-163.5169.8-174.1176.10113.2R214 C220 M229 I246 E248R214-K218 WeakPolarHBondContact O-CB 3.39Å; R214-K218 PolarHBondContact O-N 3.48Å; K218-C220 PolarHBondContact O-N 3.08Å; K218-M229 HydrophobicContact CD-CE 4.26Å; K218-M229 HydrophobicContact CG-CE 3.94Å; K218-M229 HydrophobicContact CG-SD 4.46Å; K218-I246 HydrophobicContact CD-CB 4Å; K218-I246 HydrophobicContact CD-CD1 4.17Å; K218-I246 HydrophobicContact CD-CG2 3.93Å; K218-I246 PolarHBondContact NZ-O 3.4Å; K218-E248 VanDerWaalsContact CE-CG 3.45Å; K218-E248 WeakPolarHBondContact CE-OE1 3.49Å; K218-E248 VanDerWaalsContact NZ-CG 3.31Å; K218-E248 IonicContact NZ-OE1 3.78Å; K218-E248 PolarHBondContact NZ-OE1 3.01Å
219S92.7Very high94Very high1 Ų154.4 Ų54.41%0.00726%0.259CS..THydrogen-bonded Turntrans-72.3-11.5174.781.60000114.1L215 A216 E217 R221 N222L215-S219 VanDerWaalsContact O-CB 3.3Å; L215-S219 WeakPolarHBondContact O-CB 3.48Å; L215-S219 PolarHBondContact O-N 2.88Å; A216-S219 PolarHBondContact O-N 2.69Å; A216-S219 PolarHBondContact O-OG 2.72Å; E217-S219 PolarHBondContact O-N 3.29Å; S219-R221 VanDerWaalsContact C-N 3.27Å; S219-R221 PolarHBondContact O-N 2.9Å; S219-N222 WeakPolarHBondContact CB-O 3.46Å; S219-N222 WeakPolarHBondContact O-CB 3.41Å; S219-N222 PolarHBondContact O-N 3.35Å
220C91.8Very high94Very high106 Ų10650.5 Ų50.572%0.71623%0.232SC*.THydrogen-bonded Turntrans52.642.9-175.7-61.90000113E217 K218 N222E217-C220 PolarHBondContact O-N 3.04Å; K218-C220 PolarHBondContact O-N 3.08Å; C220-N222 VanDerWaalsContact C-N 3.26Å; C220-N222 PolarHBondContact O-N 3.3Å
221R93.6Very high94Very high149 Ų14946.3 Ų46.356%0.56221%0.214SC*.THydrogen-bonded Turntrans6225-175.5-56.2-173-72.8-170.8-7.1115.1A186 I189 I192 S219A186-R221 HydrophobicContact CB-CB 3.93Å; I189-R221 HydrophobicContact CD1-CG 3.89Å; I192-R221 HydrophobicContact CD1-CB 4.45Å; S219-R221 VanDerWaalsContact C-N 3.27Å; S219-R221 PolarHBondContact O-N 2.9Å
222N95.3Very high94Very high40 Ų4048.2 Ų48.221%0.21423%0.23CC..  trans-101.1103173-175.6-27.4000110.3G45 S219 C220 R224 K225 A226G45-N222 WeakPolarHBondContact CA-OD1 3.37Å; S219-N222 WeakPolarHBondContact CB-O 3.46Å; S219-N222 WeakPolarHBondContact O-CB 3.41Å; S219-N222 PolarHBondContact O-N 3.35Å; C220-N222 VanDerWaalsContact C-N 3.26Å; C220-N222 PolarHBondContact O-N 3.3Å; N222-R224 VanDerWaalsContact C-N 3.29Å; N222-R224 PolarHBondContact O-N 3.11Å; N222-R224 WeakPolarHBondContact OD1-CB 3.42Å; N222-R224 PolarHBondContact OD1-N 3.17Å; N222-R224 VanDerWaalsContact OD1-N 3.14Å; N222-K225 HydrophobicContact CB-CB 3.86Å; N222-K225 WeakPolarHBondContact O-CB 3.47Å; N222-K225 PolarHBondContact O-N 3.44Å; N222-K225 VanDerWaalsContact O-N 3.09Å; N222-K225 PolarHBondContact OD1-N 3.41Å; N222-K225 VanDerWaalsContact OD1-N 3.12Å; N222-A226 PolarHBondContact O-N 3.41Å
223L94.8Very high93.8Very high17 Ų1748.2 Ų48.29%0.08923%0.23CC..Hα-helixtrans-62.4-34.8-176.3-176.763.4000113.2Y18 G45 P187 I192 V195 K225 A226 L227Y18-L223 HydrophobicContact CE1-CD2 3.52Å; G45-L223 WeakPolarHBondContact O-CB 3.36Å; G45-L223 PolarHBondContact O-N 2.97Å; P187-L223 HydrophobicContact CG-CB 4.19Å; I192-L223 HydrophobicContact CB-CD1 4.44Å; I192-L223 HydrophobicContact CG1-CD1 4.15Å; I192-L223 HydrophobicContact CG2-CD1 4.14Å; V195-L223 HydrophobicContact CB-CD1 4.11Å; V195-L223 HydrophobicContact CG1-CD1 3.92Å; V195-L223 HydrophobicContact CG1-CD2 4.48Å; L223-K225 VanDerWaalsContact C-N 3.35Å; L223-A226 PolarHBondContact O-N 3.03Å; L223-L227 HydrophobicContact CD1-CD1 4.4Å; L223-L227 HydrophobicContact CG-CD1 4.1Å; L223-L227 WeakPolarHBondContact O-CG 3.43Å; L223-L227 PolarHBondContact O-N 3.24Å
224R94.9Very high93.7Very high125 Ų12548.3 Ų48.347%0.47223%0.227SC..Hα-helixtrans-62.6-45.7175.2-177.2-170.9-65.8147.9-5.1110.3V5 N222 L227 L228V5-R224 HydrophobicContact CG1-CG 4.08Å; N222-R224 VanDerWaalsContact C-N 3.29Å; N222-R224 PolarHBondContact O-N 3.11Å; N222-R224 WeakPolarHBondContact OD1-CB 3.42Å; N222-R224 PolarHBondContact OD1-N 3.17Å; N222-R224 VanDerWaalsContact OD1-N 3.14Å; R224-L227 PolarHBondContact O-N 3.08Å; R224-L228 HydrophobicContact CG-CD1 4.15Å; R224-L228 WeakPolarHBondContact O-CG 3.35Å; R224-L228 PolarHBondContact O-N 3.33Å; R224-L228 VanDerWaalsContact O-N 3.1Å
225K94.2Very high93.5Very high42 Ų4250 Ų5018%0.18325%0.247CC..Hα-helixtrans-62.9-44.3178.4-163.3-178.9-177.6-166.70110.8N222 L223 L227 L228 M229 E252N222-K225 HydrophobicContact CB-CB 3.86Å; N222-K225 WeakPolarHBondContact O-CB 3.47Å; N222-K225 PolarHBondContact O-N 3.44Å; N222-K225 VanDerWaalsContact O-N 3.09Å; N222-K225 PolarHBondContact OD1-N 3.41Å; N222-K225 VanDerWaalsContact OD1-N 3.12Å; L223-K225 VanDerWaalsContact C-N 3.35Å; K225-L227 PolarHBondContact O-N 3.33Å; K225-L228 PolarHBondContact O-N 3.13Å; K225-M229 HydrophobicContact CD-CE 4.17Å; K225-M229 HydrophobicContact CD-SD 4.45Å; K225-M229 HydrophobicContact CG-CE 4.16Å; K225-M229 HydrophobicContact CG-CG 4.48Å; K225-M229 HydrophobicContact CG-SD 3.99Å; K225-M229 WeakPolarHBondContact O-CB 3.48Å; K225-M229 VanDerWaalsContact O-CG 3.26Å; K225-M229 WeakPolarHBondContact O-CG 3.36Å; K225-M229 PolarHBondContact O-N 3.11Å; K225-E252 VanDerWaalsContact CE-OE1 3.26Å; K225-E252 WeakPolarHBondContact CE-OE1 3.44Å; K225-E252 WeakPolarHBondContact CE-OE2 3.39Å; K225-E252 IonicContact NZ-OE1 3.78Å; K225-E252 PolarHBondContact NZ-OE1 3.29Å; K225-E252 IonicContact NZ-OE2 2.71Å; K225-E252 PolarHBondContact NZ-OE2 3.08Å
226A94.8Very high93.3Very high0 Ų055.5 Ų55.50%027%0.272CS..Hα-helixtrans-58.1-45.6177.300000112.9I192 L196 N222 L223 M229 C230I192-A226 HydrophobicContact CG2-CB 3.64Å; L196-A226 HydrophobicContact CD1-CB 4.41Å; L196-A226 HydrophobicContact CD2-CB 4.41Å; N222-A226 PolarHBondContact O-N 3.41Å; L223-A226 PolarHBondContact O-N 3.03Å; A226-M229 PolarHBondContact O-N 3.34Å; A226-C230 WeakPolarHBondContact O-CB 3.41Å; A226-C230 PolarHBondContact O-N 3.3Å
227L94.6Very high93.1Very high16 Ų1659.9 Ų59.98%0.08429%0.293CS..Hα-helixtrans-65-44178.2-77.6161.1000112.1V5 L196 V199 L223 R224 K225 C230 E231V5-L227 HydrophobicContact CG2-CB 3.81Å; L196-L227 HydrophobicContact CD2-CD2 4.04Å; L196-L227 HydrophobicContact CD2-CG 4.33Å; V199-L227 HydrophobicContact CB-CD2 4.37Å; V199-L227 HydrophobicContact CG1-CD2 4.29Å; V199-L227 HydrophobicContact CG2-CD2 3.99Å; L223-L227 HydrophobicContact CD1-CD1 4.4Å; L223-L227 HydrophobicContact CG-CD1 4.1Å; L223-L227 WeakPolarHBondContact O-CG 3.43Å; L223-L227 PolarHBondContact O-N 3.24Å; R224-L227 PolarHBondContact O-N 3.08Å; K225-L227 PolarHBondContact O-N 3.33Å; L227-C230 PolarHBondContact O-N 3.17Å; L227-E231 WeakPolarHBondContact O-CB 3.3Å; L227-E231 PolarHBondContact O-N 3.36Å
228L94.9Very high92.8Very high73 Ų7360.1 Ų60.138%0.38229%0.289SS..Hα-helixtrans-64.6-41.1176.9-69.8172.7000111.9L3 V5 R224 K225 E231 A232L3-L228 HydrophobicContact CD1-CD2 4.4Å; V5-L228 HydrophobicContact CG2-CD2 3.69Å; V5-L228 HydrophobicContact CG2-CG 3.81Å; R224-L228 HydrophobicContact CG-CD1 4.15Å; R224-L228 WeakPolarHBondContact O-CG 3.35Å; R224-L228 PolarHBondContact O-N 3.33Å; R224-L228 VanDerWaalsContact O-N 3.1Å; K225-L228 PolarHBondContact O-N 3.13Å; L228-E231 PolarHBondContact O-N 3.45Å; L228-A232 VanDerWaalsContact O-CB 3.31Å; L228-A232 WeakPolarHBondContact O-CB 3.31Å; L228-A232 PolarHBondContact O-N 3.08Å
229M93.4Very high92.6Very high10 Ų1061.4 Ų61.45%0.04930%0.304CS..Hα-helixtrans-62-43.6174.8-75.1170.8151.500111.3L215 K218 K225 A226 E231 A232 C233 I246L215-M229 HydrophobicContact CD2-CB 3.69Å; K218-M229 HydrophobicContact CD-CE 4.26Å; K218-M229 HydrophobicContact CG-CE 3.94Å; K218-M229 HydrophobicContact CG-SD 4.46Å; K225-M229 HydrophobicContact CD-CE 4.17Å; K225-M229 HydrophobicContact CD-SD 4.45Å; K225-M229 HydrophobicContact CG-CE 4.16Å; K225-M229 HydrophobicContact CG-CG 4.48Å; K225-M229 HydrophobicContact CG-SD 3.99Å; K225-M229 WeakPolarHBondContact O-CB 3.48Å; K225-M229 VanDerWaalsContact O-CG 3.26Å; K225-M229 WeakPolarHBondContact O-CG 3.36Å; K225-M229 PolarHBondContact O-N 3.11Å; A226-M229 PolarHBondContact O-N 3.34Å; M229-E231 PolarHBondContact O-N 3.24Å; M229-A232 PolarHBondContact O-N 2.88Å; M229-C233 PolarHBondContact O-N 3.12Å; M229-C233 PolarHBondContact O-SG 3.24Å; M229-I246 HydrophobicContact CB-CG2 4.13Å; M229-I246 HydrophobicContact CG-CG2 4.3Å; M229-I246 HydrophobicContact SD-CG2 4.45Å
230C93.1Very high92.5Very high1 Ų162.3 Ų62.31%0.00731%0.308CS..Hα-helixtrans-62.7-42.2177-172.10000112.3L196 L215 A226 L227 R234L196-C230 HydrophobicContact CD2-CB 3.88Å; L215-C230 HydrophobicContact CD1-CB 4.04Å; A226-C230 WeakPolarHBondContact O-CB 3.41Å; A226-C230 PolarHBondContact O-N 3.3Å; L227-C230 PolarHBondContact O-N 3.17Å; C230-R234 PolarHBondContact O-N 3.46Å
231E93.1Very high92.5Very high31 Ų3160.2 Ų60.215%0.14529%0.292CS..Hα-helixtrans-65.2-43176.3-171.4168.3-176.600110.8W4 L227 L228 M229 R234 V235W4-E231 HydrophobicContact CD2-CB 4.12Å; W4-E231 HydrophobicContact CD2-CG 3.96Å; W4-E231 HydrophobicContact CE3-CB 3.98Å; W4-E231 HydrophobicContact CE3-CG 4.31Å; W4-E231 HydrophobicContact CG-CG 4.29Å; W4-E231 HydrophobicContact CH2-CB 4.3Å; W4-E231 HydrophobicContact CH2-CG 4.34Å; W4-E231 HydrophobicContact CZ2-CB 4.42Å; W4-E231 HydrophobicContact CZ2-CG 3.97Å; W4-E231 HydrophobicContact CZ3-CB 4.11Å; W4-E231 PolarHBondContact N-OE2 3.15Å; L227-E231 WeakPolarHBondContact O-CB 3.3Å; L227-E231 PolarHBondContact O-N 3.36Å; L228-E231 PolarHBondContact O-N 3.45Å; M229-E231 PolarHBondContact O-N 3.24Å; E231-R234 PolarHBondContact O-N 3.4Å; E231-V235 WeakPolarHBondContact O-CG2 3.32Å; E231-V235 PolarHBondContact O-N 2.99Å; E231-V235 VanDerWaalsContact O-N 3.14Å
232A92.8Very high92.2Very high40 Ų4057 Ų5733%0.33128%0.284SS..Hα-helixtrans-64-42.6176.600000112.8L228 M229 R234 V235 Q236 P247L228-A232 VanDerWaalsContact O-CB 3.31Å; L228-A232 WeakPolarHBondContact O-CB 3.31Å; L228-A232 PolarHBondContact O-N 3.08Å; M229-A232 PolarHBondContact O-N 2.88Å; A232-R234 VanDerWaalsContact C-N 3.29Å; A232-R234 PolarHBondContact O-N 3.39Å; A232-V235 PolarHBondContact O-N 2.98Å; A232-Q236 PolarHBondContact O-N 2.98Å; A232-P247 HydrophobicContact CB-CG 3.58Å
233C91.9Very high91.9Very high0 Ų061.9 Ų61.90%031%0.309CS..Hα-helixtrans-55.7-44.5173.8-70.60000111.4M229 V235 Q236 Q237 F240 Q244 P247M229-C233 PolarHBondContact O-N 3.12Å; M229-C233 PolarHBondContact O-SG 3.24Å; C233-V235 PolarHBondContact O-N 2.91Å; C233-Q236 PolarHBondContact O-N 2.95Å; C233-Q237 PolarHBondContact O-N 2.96Å; C233-F240 HydrophobicContact CB-CE1 4Å; C233-Q244 PolarHBondContact O-NE2 3.19Å; C233-P247 VanDerWaalsContact SG-CD 3.57Å
234R91.4Very high91.6Very high85 Ų8561.2 Ų61.232%0.32131%0.306SS..Hα-helixtrans-62.8-42.5178.8179.2-171.1166.2177.5-0.8111.9W4 E203 L205 C230 E231 A232 Q236 F240W4-R234 HydrophobicContact CH2-CB 4.01Å; W4-R234 HydrophobicContact CH2-CG 4.29Å; E203-R234 IonicContact OE2-CZ 3.85Å; E203-R234 IonicContact OE2-NH1 2.68Å; E203-R234 PolarHBondContact OE2-NH1 3.3Å; L205-R234 HydrophobicContact CD2-CG 4.38Å; C230-R234 PolarHBondContact O-N 3.46Å; E231-R234 PolarHBondContact O-N 3.4Å; A232-R234 VanDerWaalsContact C-N 3.29Å; A232-R234 PolarHBondContact O-N 3.39Å; R234-Q236 VanDerWaalsContact C-N 3.32Å; R234-F240 HydrophobicContact CB-CE1 4.12Å; R234-F240 HydrophobicContact CB-CZ 3.83Å; R234-F240 HydrophobicContact CG-CZ 4.48Å
235V91Very high91.3Very high125 Ų12562.3 Ų62.376%0.75832%0.316SS*.Hα-helixtrans-66.2-38-178.6174.30000110.9E231 A232 C233E231-V235 WeakPolarHBondContact O-CG2 3.32Å; E231-V235 PolarHBondContact O-N 2.99Å; E231-V235 VanDerWaalsContact O-N 3.14Å; A232-V235 PolarHBondContact O-N 2.98Å; C233-V235 PolarHBondContact O-N 2.91Å
236Q90.1Very high91.1Very high115 Ų11560.6 Ų60.654%0.53731%0.309SS..Hα-helixtrans-73.9-47179.8-174.3178.4-0.400112.5A232 C233 R234A232-Q236 PolarHBondContact O-N 2.98Å; C233-Q236 PolarHBondContact O-N 2.95Å; R234-Q236 VanDerWaalsContact C-N 3.32Å
237Q89.9Confident90.8Very high92 Ų9262.3 Ų62.343%0.4332%0.321SS..  trans-150.2124.3-177.3179.5-175.9-4.500111.1C233 Q244C233-Q237 PolarHBondContact O-N 2.96Å; Q237-Q244 PolarHBondContact O-NE2 3.27Å
238Y88.1Confident90.6Very high130 Ų13063.9 Ų63.951%0.5133%0.327SS..SBendtrans-134.8136.3170-178.4-100.4000108.9L205 F240L205-Y238 HydrophobicContact CD2-CD2 3.91Å; L205-Y238 HydrophobicContact CD2-CE2 3.38Å; Y238-F240 HydrophobicContact CE2-CD2 4.49Å
239P88Confident90.4Very high91 Ų9163.4 Ų63.459%0.59133%0.327SS*.SBendcis-68.6157.56.4-21.335.1000116.2
240F91.8Very high90.4Very high20 Ų2069.7 Ų69.79%0.08836%0.361CS..  trans-66.2136.4174.3-68.6-62000111.3L205 A206 L207 P208 L211 C233 R234 Y238L205-F240 HydrophobicContact CB-CE2 4.08Å; L205-F240 HydrophobicContact CD1-CE2 4.42Å; L205-F240 HydrophobicContact CD2-CE2 4.23Å; L205-F240 HydrophobicContact CG-CE2 4.5Å; A206-F240 WeakPolarHBondContact O-CD2 3.43Å; L207-F240 HydrophobicContact CD1-CD1 4.35Å; L207-F240 HydrophobicContact CD1-CD2 4.08Å; L207-F240 HydrophobicContact CD1-CE1 4.41Å; L207-F240 HydrophobicContact CD1-CE2 4.11Å; L207-F240 HydrophobicContact CD1-CG 4.2Å; L207-F240 HydrophobicContact CD1-CZ 4.27Å; P208-F240 HydrophobicContact CG-CB 4.24Å; L211-F240 HydrophobicContact CD2-CB 4.01Å; L211-F240 HydrophobicContact CD2-CD1 3.68Å; L211-F240 HydrophobicContact CD2-CE1 4.46Å; L211-F240 HydrophobicContact CD2-CG 4.1Å; C233-F240 HydrophobicContact CB-CE1 4Å; R234-F240 HydrophobicContact CB-CE1 4.12Å; R234-F240 HydrophobicContact CB-CZ 3.83Å; R234-F240 HydrophobicContact CG-CZ 4.48Å; Y238-F240 HydrophobicContact CE2-CD2 4.49Å
241T90.5Very high90.4Very high63 Ų6373.7 Ų73.739%0.38738%0.376SS..  trans-118.4159173.556.20000110.4D243T241-D243 VanDerWaalsContact C-N 3.34Å; T241-D243 PolarHBondContact O-N 3.14Å
242E88.1Confident90.4Very high81 Ų8173.8 Ų73.838%0.37938%0.377SS..THydrogen-bonded Turntrans-65.1-38.9-177.9-60.6-166.8151.500112.3P208 K210 R214P208-E242 HydrophobicContact CB-CG 4.29Å; K210-E242 HydrophobicContact CD-CB 4.46Å; K210-E242 HydrophobicContact CD-CG 4.47Å; K210-E242 WeakPolarHBondContact CD-OE2 3.33Å; K210-E242 WeakPolarHBondContact CE-OE2 3.31Å; K210-E242 IonicContact NZ-OE1 3.57Å; K210-E242 IonicContact NZ-OE2 3.43Å; K210-E242 PolarHBondContact NZ-OE2 2.88Å; R214-E242 PolarHBondContact NH1-O 3.35Å
243D88.4Confident90.5Very high142 Ų14274.4 Ų74.476%0.75938%0.377SS*.THydrogen-bonded Turntrans-9919.7-175.4-60.9-44.5000113.5T241 E245T241-D243 VanDerWaalsContact C-N 3.34Å; T241-D243 PolarHBondContact O-N 3.14Å; D243-E245 PolarHBondContact O-N 3.37Å
244Q88.4Confident90.7Very high3 Ų376.8 Ų76.81%0.01439%0.386CS..  trans-56.6141.3178.8-169.7170.9-9.200111.5L211 R214 C233 Q237 I246L211-Q244 HydrophobicContact CD1-CB 4.28Å; R214-Q244 PolarHBondContact NH1-O 3.32Å; R214-Q244 PolarHBondContact NH2-O 3.46Å; C233-Q244 PolarHBondContact O-NE2 3.19Å; Q237-Q244 PolarHBondContact O-NE2 3.27Å; Q244-I246 PolarHBondContact O-N 3.02Å
245E88.6Confident90.9Very high148 Ų14873 Ų7369%0.69237%0.372SS*.  trans-73.4125.1171.8-170.1166.6-16400109.5D243 P247D243-E245 PolarHBondContact O-N 3.37Å; E245-P247 WeakPolarHBondContact O-CD 3.22Å
246I89.7Confident91.1Very high7 Ų770.7 Ų70.74%0.03635%0.35CS..  trans-93112.8-178.1-58.5165.7000107.5L211 R214 L215 K218 M229 Q244L211-I246 HydrophobicContact CD1-CD1 4.31Å; L211-I246 HydrophobicContact CD1-CG1 4.2Å; R214-I246 HydrophobicContact CB-CD1 3.92Å; L215-I246 HydrophobicContact CD2-CB 4.5Å; L215-I246 HydrophobicContact CD2-CD1 3.94Å; L215-I246 HydrophobicContact CD2-CG1 4.05Å; L215-I246 HydrophobicContact CD2-CG2 3.63Å; L215-I246 HydrophobicContact CG-CD1 4.16Å; K218-I246 HydrophobicContact CD-CB 4Å; K218-I246 HydrophobicContact CD-CD1 4.17Å; K218-I246 HydrophobicContact CD-CG2 3.93Å; K218-I246 PolarHBondContact NZ-O 3.4Å; M229-I246 HydrophobicContact CB-CG2 4.13Å; M229-I246 HydrophobicContact CG-CG2 4.3Å; M229-I246 HydrophobicContact SD-CG2 4.45Å; Q244-I246 PolarHBondContact O-N 3.02Å
247P89.8Confident91.3Very high36 Ų3669.8 Ų69.823%0.23435%0.345CS..  trans-62.8143.1179.227.6-33.7000110.1A232 C233 E245A232-P247 HydrophobicContact CB-CG 3.58Å; C233-P247 VanDerWaalsContact SG-CD 3.57Å; E245-P247 WeakPolarHBondContact O-CD 3.22Å
248E88.9Confident91.6Very high48 Ų4865.4 Ų65.422%0.22433%0.325CS..  trans-107.8163.8173.9-65.2-179.6-176.200109.7K218 V253 R256K218-E248 VanDerWaalsContact CE-CG 3.45Å; K218-E248 WeakPolarHBondContact CE-OE1 3.49Å; K218-E248 VanDerWaalsContact NZ-CG 3.31Å; K218-E248 IonicContact NZ-OE1 3.78Å; K218-E248 PolarHBondContact NZ-OE1 3.01Å; E248-V253 HydrophobicContact CB-CG2 4.03Å; E248-R256 IonicContact OE1-NH1 2.64Å; E248-R256 IonicContact OE1-NH2 3.78Å; E248-R256 PolarHBondContact OE1-NH2 3.11Å; E248-R256 IonicContact OE2-CZ 3.46Å; E248-R256 IonicContact OE2-NH1 2.91Å; E248-R256 PolarHBondContact OE2-NH1 3.07Å; E248-R256 IonicContact OE2-NH2 3.97Å; E248-R256 PolarHBondContact OE2-NH2 3.37Å
249T90.9Very high92Very high63 Ų6359.2 Ų59.239%0.38730%0.301SS..  trans-72.3142.3175.3490000110.6W251 E252 V253T249-W251 PolarHBondContact O-N 3.41Å; T249-W251 VanDerWaalsContact O-N 3.07Å; T249-W251 PolarHBondContact OG1-NE1 3.23Å; T249-W251 VanDerWaalsContact OG1-NE1 3.09Å; T249-E252 WeakPolarHBondContact O-CB 3.31Å; T249-E252 PolarHBondContact O-N 3.14Å; T249-E252 VanDerWaalsContact OG1-CG 3.3Å; T249-E252 WeakPolarHBondContact OG1-CG 3.1Å; T249-V253 PolarHBondContact O-N 2.99Å
250D93.1Very high92.3Very high143 Ų14358.1 Ų58.177%0.76529%0.29SS*.Hα-helixtrans-48.2-43.2-175.8-52.6-24.8000113.6E252 V253 Y254D250-E252 VanDerWaalsContact C-N 3.34Å; D250-E252 PolarHBondContact O-N 3.38Å; D250-V253 PolarHBondContact O-N 3.4Å; D250-Y254 WeakPolarHBondContact O-CB 3.42Å; D250-Y254 PolarHBondContact O-N 2.86Å
251W94.6Very high92.4Very high84 Ų8458 Ų5832%0.31829%0.293SS..Hα-helixtrans-68.8-27.9-179.772.3-89.9000114.1T249 L255 L281 I286 I290T249-W251 PolarHBondContact O-N 3.41Å; T249-W251 VanDerWaalsContact O-N 3.07Å; T249-W251 PolarHBondContact OG1-NE1 3.23Å; T249-W251 VanDerWaalsContact OG1-NE1 3.09Å; W251-L255 HydrophobicContact CE3-CD2 4.43Å; W251-L255 HydrophobicContact CZ3-CD2 4.12Å; W251-L255 WeakPolarHBondContact O-CB 3.49Å; W251-L255 PolarHBondContact O-N 3.36Å; W251-L281 HydrophobicContact CB-CD2 4.39Å; W251-I286 HydrophobicContact CB-CD1 3.38Å; W251-I286 HydrophobicContact CD2-CD1 4.32Å; W251-I286 HydrophobicContact CG-CD1 3.86Å; W251-I290 HydrophobicContact CH2-CG2 3.59Å; W251-I290 HydrophobicContact CZ3-CG2 3.64Å
252E92.6Very high92.7Very high34 Ų3455 Ų5516%0.15927%0.274CS..Hα-helixtrans-70.7-43175.5-74.4-174.3168.200110.1K225 T249 D250 L255 R256K225-E252 VanDerWaalsContact CE-OE1 3.26Å; K225-E252 WeakPolarHBondContact CE-OE1 3.44Å; K225-E252 WeakPolarHBondContact CE-OE2 3.39Å; K225-E252 IonicContact NZ-OE1 3.78Å; K225-E252 PolarHBondContact NZ-OE1 3.29Å; K225-E252 IonicContact NZ-OE2 2.71Å; K225-E252 PolarHBondContact NZ-OE2 3.08Å; T249-E252 WeakPolarHBondContact O-CB 3.31Å; T249-E252 PolarHBondContact O-N 3.14Å; T249-E252 VanDerWaalsContact OG1-CG 3.3Å; T249-E252 WeakPolarHBondContact OG1-CG 3.1Å; D250-E252 VanDerWaalsContact C-N 3.34Å; D250-E252 PolarHBondContact O-N 3.38Å; E252-L255 PolarHBondContact O-N 3.43Å; E252-R256 WeakPolarHBondContact O-CB 3.34Å; E252-R256 PolarHBondContact O-N 3.19Å
253V94.3Very high92.9Very high53 Ų5352.4 Ų52.432%0.32126%0.264SS..Hα-helixtrans-62.5-49.6174.3-177.80000110E248 T249 D250 L255 R256 E257E248-V253 HydrophobicContact CB-CG2 4.03Å; T249-V253 PolarHBondContact O-N 2.99Å; D250-V253 PolarHBondContact O-N 3.4Å; V253-L255 VanDerWaalsContact C-N 3.32Å; V253-L255 PolarHBondContact O-N 3.21Å; V253-R256 WeakPolarHBondContact O-CB 3.31Å; V253-R256 PolarHBondContact O-N 3.28Å; V253-R256 VanDerWaalsContact O-N 3.16Å; V253-E257 WeakPolarHBondContact O-CG 3.31Å; V253-E257 PolarHBondContact O-N 3.19Å
254Y96.4Very high93.1Very high49 Ų4949 Ų4919%0.19225%0.251CS..Hα-helixtrans-61-39.7-179.9-167.3-86.4000112.5D250 T258 R277 E280 L281D250-Y254 WeakPolarHBondContact O-CB 3.42Å; D250-Y254 PolarHBondContact O-N 2.86Å; Y254-T258 WeakPolarHBondContact O-CB 3.29Å; Y254-T258 PolarHBondContact O-N 2.88Å; Y254-T258 PolarHBondContact O-OG1 2.64Å; Y254-R277 HydrophobicContact CE1-CB 3.73Å; Y254-R277 HydrophobicContact CE1-CG 4.22Å; Y254-R277 PolarHBondContact O-NH2 3.35Å; Y254-R277 WeakPolarHBondContact OH-CA 3.49Å; Y254-R277 WeakPolarHBondContact OH-CG 3.42Å; Y254-E280 HydrophobicContact CE1-CB 4.42Å; Y254-E280 VanDerWaalsContact CZ-OE2 3.25Å; Y254-E280 PolarHBondContact OH-OE2 3.14Å; Y254-L281 HydrophobicContact CD1-CD1 4.26Å; Y254-L281 HydrophobicContact CD1-CD2 3.76Å; Y254-L281 HydrophobicContact CD1-CG 3.82Å; Y254-L281 HydrophobicContact CE1-CD2 4.45Å; Y254-L281 HydrophobicContact CE1-CG 4.06Å
255L95.7Very high93.4Very high6 Ų653.2 Ų53.23%0.03127%0.271CS..Hα-helixtrans-67.9-41175.9-176.963.1000111.8W251 E252 V253 T258 A259 L281 I291 L295W251-L255 HydrophobicContact CE3-CD2 4.43Å; W251-L255 HydrophobicContact CZ3-CD2 4.12Å; W251-L255 WeakPolarHBondContact O-CB 3.49Å; W251-L255 PolarHBondContact O-N 3.36Å; E252-L255 PolarHBondContact O-N 3.43Å; V253-L255 VanDerWaalsContact C-N 3.32Å; V253-L255 PolarHBondContact O-N 3.21Å; L255-T258 WeakPolarHBondContact O-CB 3.49Å; L255-T258 PolarHBondContact O-N 3.04Å; L255-A259 PolarHBondContact O-N 3.47Å; L255-L281 HydrophobicContact CD1-CD1 3.77Å; L255-I291 HydrophobicContact CD1-CG2 3.94Å; L255-L295 HydrophobicContact CD1-CB 4.27Å; L255-L295 HydrophobicContact CD1-CD1 4.21Å
256R94.9Very high93.6Very high76 Ų7647.5 Ų47.529%0.28724%0.244SC..Hα-helixtrans-61.5-48.4175.9-176.2174.7-51.4111.25.2111.8E248 E252 V253 T258 A259 N260 E298E248-R256 IonicContact OE1-NH1 2.64Å; E248-R256 IonicContact OE1-NH2 3.78Å; E248-R256 PolarHBondContact OE1-NH2 3.11Å; E248-R256 IonicContact OE2-CZ 3.46Å; E248-R256 IonicContact OE2-NH1 2.91Å; E248-R256 PolarHBondContact OE2-NH1 3.07Å; E248-R256 IonicContact OE2-NH2 3.97Å; E248-R256 PolarHBondContact OE2-NH2 3.37Å; E252-R256 WeakPolarHBondContact O-CB 3.34Å; E252-R256 PolarHBondContact O-N 3.19Å; V253-R256 WeakPolarHBondContact O-CB 3.31Å; V253-R256 PolarHBondContact O-N 3.28Å; V253-R256 VanDerWaalsContact O-N 3.16Å; R256-T258 PolarHBondContact O-N 2.95Å; R256-A259 WeakPolarHBondContact O-CB 3.44Å; R256-A259 PolarHBondContact O-N 2.9Å; R256-A259 VanDerWaalsContact O-N 3.13Å; R256-N260 PolarHBondContact O-N 3.07Å; R256-N260 PolarHBondContact O-ND2 3.39Å; R256-E298 HydrophobicContact CG-CG 3.95Å; R256-E298 WeakPolarHBondContact CG-OE1 3.43Å; R256-E298 IonicContact NE-OE2 3.17Å
257E95.4Very high93.9Very high97 Ų9749.9 Ų49.945%0.45326%0.259SS..Hα-helixtrans-59.5-37.8174.2-72.9177.6178.800112.2V253 N260 A261 R277V253-E257 WeakPolarHBondContact O-CG 3.31Å; V253-E257 PolarHBondContact O-N 3.19Å; E257-N260 PolarHBondContact O-N 3.37Å; E257-A261 WeakPolarHBondContact O-CB 3.41Å; E257-A261 PolarHBondContact O-N 3.11Å; E257-R277 VanDerWaalsContact CB-NH2 3.28Å; E257-R277 IonicContact OE2-CZ 2.74Å; E257-R277 IonicContact OE2-NH1 3.35Å; E257-R277 IonicContact OE2-NH2 2.67Å; E257-R277 PolarHBondContact OE2-NH2 3.26Å
258T96.1Very high94.1Very high0 Ų053.4 Ų53.40%028%0.282CS..Hα-helixtrans-62.2-44.2174.9-53.50000110.9Y254 L255 R256 A261 I262 V274 R277Y254-T258 WeakPolarHBondContact O-CB 3.29Å; Y254-T258 PolarHBondContact O-N 2.88Å; Y254-T258 PolarHBondContact O-OG1 2.64Å; L255-T258 WeakPolarHBondContact O-CB 3.49Å; L255-T258 PolarHBondContact O-N 3.04Å; R256-T258 PolarHBondContact O-N 2.95Å; T258-A261 PolarHBondContact O-N 2.86Å; T258-I262 HydrophobicContact CG2-CD1 4.46Å; T258-I262 VanDerWaalsContact O-CG1 3.28Å; T258-I262 WeakPolarHBondContact O-CG1 3.43Å; T258-I262 PolarHBondContact O-N 3.07Å; T258-I262 VanDerWaalsContact O-N 3.11Å; T258-V274 HydrophobicContact CG2-CG1 3.97Å; T258-R277 HydrophobicContact CG2-CB 4Å; T258-R277 PolarHBondContact OG1-NE 2.91Å
259A95.4Very high94.5Very high0 Ų058.5 Ų58.50%031%0.306CS..Hα-helixtrans-61.7-45175.700000111.9L255 R256 A261 I262 V263 L295 E298 L299L255-A259 PolarHBondContact O-N 3.47Å; R256-A259 WeakPolarHBondContact O-CB 3.44Å; R256-A259 PolarHBondContact O-N 2.9Å; R256-A259 VanDerWaalsContact O-N 3.13Å; A259-A261 VanDerWaalsContact C-N 3.32Å; A259-A261 PolarHBondContact O-N 3.35Å; A259-I262 WeakPolarHBondContact O-CB 3.38Å; A259-I262 PolarHBondContact O-N 3.31Å; A259-I262 VanDerWaalsContact O-N 3.15Å; A259-V263 WeakPolarHBondContact O-CG2 3.29Å; A259-V263 PolarHBondContact O-N 2.93Å; A259-V263 VanDerWaalsContact O-N 3.1Å; A259-L295 HydrophobicContact CB-CD1 3.7Å; A259-E298 HydrophobicContact CB-CB 3.54Å; A259-E298 HydrophobicContact CB-CG 3.51Å; A259-L299 HydrophobicContact CB-CD2 4.28Å
260N94.6Very high94.7Very high68 Ų6857.9 Ų57.936%0.36430%0.296SS..Hα-helixtrans-63.4-38.4177.9-69.3-22.1000111.7R256 E257 I262 V263 S264R256-N260 PolarHBondContact O-N 3.07Å; R256-N260 PolarHBondContact O-ND2 3.39Å; E257-N260 PolarHBondContact O-N 3.37Å; N260-I262 VanDerWaalsContact C-N 3.33Å; N260-I262 PolarHBondContact O-N 2.95Å; N260-V263 PolarHBondContact O-N 2.79Å; N260-S264 WeakPolarHBondContact O-CB 3.42Å; N260-S264 PolarHBondContact O-N 2.95Å
261A94.8Very high94.8Very high18 Ų1852.7 Ų52.715%0.14927%0.268CS..Hα-helixtrans-61.8-39.7173.900000112.1E257 T258 A259 S264E257-A261 WeakPolarHBondContact O-CB 3.41Å; E257-A261 PolarHBondContact O-N 3.11Å; T258-A261 PolarHBondContact O-N 2.86Å; A259-A261 VanDerWaalsContact C-N 3.32Å; A259-A261 PolarHBondContact O-N 3.35Å; A261-S264 PolarHBondContact O-N 3.49Å; A261-S264 PolarHBondContact O-OG 3.4Å
262I95.1Very high94.9Very high0 Ų054.8 Ų54.80%029%0.285CS..Hα-helixtrans-63.6-40.1175.9-65.3163.9000111.7T258 A259 N260 Q266 V274 L295 L299 V336 F339 M340T258-I262 HydrophobicContact CG2-CD1 4.46Å; T258-I262 VanDerWaalsContact O-CG1 3.28Å; T258-I262 WeakPolarHBondContact O-CG1 3.43Å; T258-I262 PolarHBondContact O-N 3.07Å; T258-I262 VanDerWaalsContact O-N 3.11Å; A259-I262 WeakPolarHBondContact O-CB 3.38Å; A259-I262 PolarHBondContact O-N 3.31Å; A259-I262 VanDerWaalsContact O-N 3.15Å; N260-I262 VanDerWaalsContact C-N 3.33Å; N260-I262 PolarHBondContact O-N 2.95Å; I262-Q266 PolarHBondContact O-NE2 3.4Å; I262-V274 HydrophobicContact CD1-CG1 3.9Å; I262-V274 HydrophobicContact CG1-CB 4.4Å; I262-V274 HydrophobicContact CG1-CG1 3.82Å; I262-V274 HydrophobicContact CG1-CG2 3.7Å; I262-L295 HydrophobicContact CD1-CD1 3.76Å; I262-L295 HydrophobicContact CD1-CD2 4.07Å; I262-L295 HydrophobicContact CD1-CG 4.31Å; I262-L299 HydrophobicContact CB-CD2 4.35Å; I262-L299 HydrophobicContact CG2-CD2 4.19Å; I262-V336 HydrophobicContact CD1-CG1 3.85Å; I262-V336 HydrophobicContact CD1-CG2 3.87Å; I262-V336 HydrophobicContact CG1-CG1 3.88Å; I262-V336 HydrophobicContact CG2-CG1 4.18Å; I262-F339 HydrophobicContact CG2-CD1 3.49Å; I262-F339 VanDerWaalsContact CG2-CD1 3.49Å; I262-F339 HydrophobicContact CG2-CE1 3.66Å; I262-M340 HydrophobicContact CB-CE 4.15Å; I262-M340 HydrophobicContact CG1-CE 4.06Å; I262-M340 HydrophobicContact CG2-CE 3.92Å; I262-M340 HydrophobicContact CG2-CG 3.98Å
263V93.4Very high95.1Very high26 Ų2658 Ų5816%0.15830%0.3CS..Hα-helixtrans-73.1-32.8178.8176.10000111.4A259 N260 Q265 Q266 L299 N302 Y343A259-V263 WeakPolarHBondContact O-CG2 3.29Å; A259-V263 PolarHBondContact O-N 2.93Å; A259-V263 VanDerWaalsContact O-N 3.1Å; N260-V263 PolarHBondContact O-N 2.79Å; V263-Q265 PolarHBondContact O-N 2.74Å; V263-Q266 PolarHBondContact O-NE2 3.43Å; V263-L299 HydrophobicContact CG2-CD2 3.62Å; V263-N302 HydrophobicContact CG1-CB 4.11Å; V263-N302 HydrophobicContact CG2-CB 4.07Å; V263-Y343 HydrophobicContact CG1-CE1 4.25Å
264S93.2Very high95.2Very high71 Ų7155.5 Ų55.550%0.49729%0.285SS..Hα-helixtrans-65.9-38.9-176.272.50000113.9N260 A261N260-S264 WeakPolarHBondContact O-CB 3.42Å; N260-S264 PolarHBondContact O-N 2.95Å; A261-S264 PolarHBondContact O-N 3.49Å; A261-S264 PolarHBondContact O-OG 3.4Å
265Q93Very high95.2Very high90 Ų9057.2 Ų57.242%0.42129%0.291SS..  trans-148.6131.9-173.7-69.3-178.9-10.100112.1V263 R270V263-Q265 PolarHBondContact O-N 2.74Å; Q265-R270 HydrophobicContact CB-CB 4.21Å; Q265-R270 HydrophobicContact CB-CG 4.09Å; Q265-R270 VanDerWaalsContact CD-NH2 3.3Å; Q265-R270 WeakPolarHBondContact O-CG 3.26Å; Q265-R270 VanDerWaalsContact OE1-NE 3.1Å
266Q93.4Very high95.3Very high29 Ų2958.9 Ų58.914%0.13631%0.309CS..  trans-110.664.6179.2-63.274.936.400111.2I262 V263 M340 Y343 K344I262-Q266 PolarHBondContact O-NE2 3.4Å; V263-Q266 PolarHBondContact O-NE2 3.43Å; Q266-M340 HydrophobicContact CB-CB 4.31Å; Q266-M340 HydrophobicContact CG-CB 4.13Å; Q266-M340 HydrophobicContact CG-CG 4.31Å; Q266-Y343 HydrophobicContact CG-CD1 4.37Å; Q266-K344 HydrophobicContact CB-CB 3.86Å; Q266-K344 HydrophobicContact CB-CD 4.02Å; Q266-K344 HydrophobicContact CB-CG 4.3Å; Q266-K344 HydrophobicContact CG-CB 4.05Å
267T95.3Very high95.4Very high56 Ų5657.9 Ų57.934%0.34431%0.306SS..SBendtrans-121.9155.3176.468.50000111.9Q269 R270 L271T267-Q269 PolarHBondContact O-N 3.29Å; T267-R270 PolarHBondContact O-N 3.07Å; T267-R270 VanDerWaalsContact O-N 3.17Å; T267-R270 PolarHBondContact OG1-N 3.18Å; T267-L271 PolarHBondContact O-N 3.48Å
268P95.8Very high95.4Very high110 Ų11053.2 Ų53.271%0.71428%0.284SS*.Hα-helixtrans-60.9-30.7176.2-24.434.7000113.8L271 L272P268-L271 PolarHBondContact O-N 3.49Å; P268-L272 PolarHBondContact O-N 3.03Å; P268-L272 VanDerWaalsContact O-N 3.16Å
269Q95.8Very high95.4Very high156 Ų15658 Ų5873%0.72930%0.302SS*.Hα-helixtrans-64.4-45.7175.1-68.1172.3-4.600110.8T267 L271 L272 E273T267-Q269 PolarHBondContact O-N 3.29Å; Q269-L271 VanDerWaalsContact C-N 3.32Å; Q269-L271 PolarHBondContact O-N 3.16Å; Q269-L272 WeakPolarHBondContact O-CB 3.35Å; Q269-L272 PolarHBondContact O-N 3.09Å; Q269-E273 PolarHBondContact O-N 2.67Å
270R95.7Very high95.5Very high50 Ų5062.4 Ų62.419%0.18932%0.323CS..Hα-helixtrans-62.7-38.9175.1-176.360.465.4166.512.6112Q265 T267 L272 E273 V274 M340Q265-R270 HydrophobicContact CB-CB 4.21Å; Q265-R270 HydrophobicContact CB-CG 4.09Å; Q265-R270 VanDerWaalsContact CD-NH2 3.3Å; Q265-R270 WeakPolarHBondContact O-CG 3.26Å; Q265-R270 VanDerWaalsContact OE1-NE 3.1Å; T267-R270 PolarHBondContact O-N 3.07Å; T267-R270 VanDerWaalsContact O-N 3.17Å; T267-R270 PolarHBondContact OG1-N 3.18Å; R270-L272 VanDerWaalsContact C-N 3.26Å; R270-L272 PolarHBondContact O-N 2.66Å; R270-E273 WeakPolarHBondContact CD-OE2 3.37Å; R270-E273 IonicContact CZ-OE2 3.73Å; R270-E273 VanDerWaalsContact CZ-OE2 3.24Å; R270-E273 IonicContact NE-OE2 2.73Å; R270-E273 PolarHBondContact NE-OE2 3.28Å; R270-E273 IonicContact NH1-OE2 2.76Å; R270-E273 PolarHBondContact NH1-OE2 3.07Å; R270-E273 WeakPolarHBondContact O-CB 3.47Å; R270-E273 PolarHBondContact O-N 2.83Å; R270-V274 HydrophobicContact CG-CG2 4.39Å; R270-V274 WeakPolarHBondContact O-CG2 3.4Å; R270-V274 PolarHBondContact O-N 2.52Å; R270-M340 HydrophobicContact CG-CE 4.12Å
271L96.1Very high95.5Very high34 Ų3459.3 Ų59.318%0.17831%0.307CS..Hα-helixtrans-59.9-37.6176.2-178.463.6000112.1T267 P268 Q269 V274 R275 V336 A337 M340T267-L271 PolarHBondContact O-N 3.48Å; P268-L271 PolarHBondContact O-N 3.49Å; Q269-L271 VanDerWaalsContact C-N 3.32Å; Q269-L271 PolarHBondContact O-N 3.16Å; L271-V274 PolarHBondContact O-N 3.06Å; L271-R275 WeakPolarHBondContact O-CB 3.45Å; L271-R275 PolarHBondContact O-N 3.4Å; L271-V336 HydrophobicContact CD1-CB 4.15Å; L271-V336 HydrophobicContact CD1-CG1 3.65Å; L271-A337 HydrophobicContact CD1-CB 4.24Å; L271-A337 HydrophobicContact CD2-CB 3.82Å; L271-M340 HydrophobicContact CB-SD 4.07Å; L271-M340 HydrophobicContact CD1-SD 4.03Å
272L96.4Very high95.5Very high128 Ų12860.5 Ų60.567%0.6731%0.31SS*.Hα-helixtrans-64.7-43.1175.6-171156.1000111.6P268 Q269 R270 R275 G276P268-L272 PolarHBondContact O-N 3.03Å; P268-L272 VanDerWaalsContact O-N 3.16Å; Q269-L272 WeakPolarHBondContact O-CB 3.35Å; Q269-L272 PolarHBondContact O-N 3.09Å; R270-L272 VanDerWaalsContact C-N 3.26Å; R270-L272 PolarHBondContact O-N 2.66Å; L272-R275 WeakPolarHBondContact O-CB 3.45Å; L272-R275 PolarHBondContact O-N 2.96Å; L272-G276 PolarHBondContact O-N 3.18Å; L272-G276 VanDerWaalsContact O-N 3.11Å
273E96.4Very high95.6Very high100 Ų10065.4 Ų65.447%0.46734%0.341SS..Hα-helixtrans-61.3-46.9174.3-64.2172.9-169.900111.5Q269 R270 R275 G276 R277Q269-E273 PolarHBondContact O-N 2.67Å; R270-E273 WeakPolarHBondContact CD-OE2 3.37Å; R270-E273 IonicContact CZ-OE2 3.73Å; R270-E273 VanDerWaalsContact CZ-OE2 3.24Å; R270-E273 IonicContact NE-OE2 2.73Å; R270-E273 PolarHBondContact NE-OE2 3.28Å; R270-E273 IonicContact NH1-OE2 2.76Å; R270-E273 PolarHBondContact NH1-OE2 3.07Å; R270-E273 WeakPolarHBondContact O-CB 3.47Å; R270-E273 PolarHBondContact O-N 2.83Å; E273-R275 VanDerWaalsContact C-N 3.26Å; E273-R275 PolarHBondContact O-N 3.37Å; E273-G276 WeakPolarHBondContact O-CA 3.04Å; E273-G276 PolarHBondContact O-N 3.27Å; E273-R277 PolarHBondContact O-N 2.94Å
274V96.9Very high95.7Very high1 Ų170.4 Ų70.41%0.00636%0.362CS..Hα-helixtrans-60.8-38.2177.7172.90000110.8T258 I262 R270 L271 G276 R277 L278 V336 M340T258-V274 HydrophobicContact CG2-CG1 3.97Å; I262-V274 HydrophobicContact CD1-CG1 3.9Å; I262-V274 HydrophobicContact CG1-CB 4.4Å; I262-V274 HydrophobicContact CG1-CG1 3.82Å; I262-V274 HydrophobicContact CG1-CG2 3.7Å; R270-V274 HydrophobicContact CG-CG2 4.39Å; R270-V274 WeakPolarHBondContact O-CG2 3.4Å; R270-V274 PolarHBondContact O-N 2.52Å; L271-V274 PolarHBondContact O-N 3.06Å; V274-G276 VanDerWaalsContact C-N 3.31Å; V274-G276 PolarHBondContact O-N 3.47Å; V274-R277 WeakPolarHBondContact O-CB 3.29Å; V274-R277 PolarHBondContact O-N 2.85Å; V274-R277 VanDerWaalsContact O-N 3.16Å; V274-L278 HydrophobicContact CG1-CD1 4.29Å; V274-L278 HydrophobicContact CG1-CG 4.34Å; V274-L278 WeakPolarHBondContact O-CG 3.31Å; V274-L278 PolarHBondContact O-N 3.29Å; V274-V336 HydrophobicContact CG1-CG1 3.96Å; V274-V336 HydrophobicContact CG1-CG2 4.31Å; V274-M340 HydrophobicContact CG2-CE 4.19Å
275R96.7Very high95.6Very high86 Ų8672.4 Ų72.433%0.32538%0.375SS..Hα-helixtrans-59.8-42173.4-175.9-174178.9172.7-11.8111.8L271 L272 E273 R277 L278 Y279 I329 E333L271-R275 WeakPolarHBondContact O-CB 3.45Å; L271-R275 PolarHBondContact O-N 3.4Å; L272-R275 WeakPolarHBondContact O-CB 3.45Å; L272-R275 PolarHBondContact O-N 2.96Å; E273-R275 VanDerWaalsContact C-N 3.26Å; E273-R275 PolarHBondContact O-N 3.37Å; R275-R277 VanDerWaalsContact C-N 3.33Å; R275-R277 PolarHBondContact O-N 2.98Å; R275-L278 PolarHBondContact O-N 3.18Å; R275-Y279 HydrophobicContact CG-CD2 4.05Å; R275-Y279 HydrophobicContact CG-CE2 3.91Å; R275-Y279 PolarHBondContact NH2-OH 2.67Å; R275-Y279 VanDerWaalsContact O-CD2 3.31Å; R275-Y279 WeakPolarHBondContact O-CD2 3.02Å; R275-Y279 PolarHBondContact O-N 3.47Å; R275-I329 HydrophobicContact CG-CD1 4.34Å; R275-E333 VanDerWaalsContact CD-OE2 3.32Å; R275-E333 WeakPolarHBondContact CD-OE2 3.49Å; R275-E333 IonicContact CZ-OE2 3.94Å; R275-E333 IonicContact NE-OE1 3.63Å; R275-E333 IonicContact NE-OE2 3.96Å; R275-E333 PolarHBondContact NE-OE2 3.07Å; R275-E333 IonicContact NH1-OE1 3.9Å; R275-E333 PolarHBondContact NH1-OE1 3.28Å; R275-E333 IonicContact NH1-OE2 2.67Å
276G96.9Very high95.7Very high40 Ų4069.2 Ų69.241%0.41236%0.36SS..Hα-helixtrans-56.7-46.5172.600000112L272 E273 V274 L278 Y279 E280L272-G276 PolarHBondContact O-N 3.18Å; L272-G276 VanDerWaalsContact O-N 3.11Å; E273-G276 WeakPolarHBondContact O-CA 3.04Å; E273-G276 PolarHBondContact O-N 3.27Å; V274-G276 VanDerWaalsContact C-N 3.31Å; V274-G276 PolarHBondContact O-N 3.47Å; G276-L278 PolarHBondContact O-N 3.21Å; G276-Y279 WeakPolarHBondContact O-CB 3.31Å; G276-Y279 PolarHBondContact O-N 3.27Å; G276-E280 PolarHBondContact O-N 3.07Å
277R96.4Very high95.8Very high55 Ų5570.4 Ų70.421%0.20837%0.371CS..Hα-helixtrans-62.5-40.7176.6-60.5-171.968.5101.1-6113Y254 E257 T258 E273 V274 R275 Y279 E280 L281Y254-R277 HydrophobicContact CE1-CB 3.73Å; Y254-R277 HydrophobicContact CE1-CG 4.22Å; Y254-R277 PolarHBondContact O-NH2 3.35Å; Y254-R277 WeakPolarHBondContact OH-CA 3.49Å; Y254-R277 WeakPolarHBondContact OH-CG 3.42Å; E257-R277 VanDerWaalsContact CB-NH2 3.28Å; E257-R277 IonicContact OE2-CZ 2.74Å; E257-R277 IonicContact OE2-NH1 3.35Å; E257-R277 IonicContact OE2-NH2 2.67Å; E257-R277 PolarHBondContact OE2-NH2 3.26Å; T258-R277 HydrophobicContact CG2-CB 4Å; T258-R277 PolarHBondContact OG1-NE 2.91Å; E273-R277 PolarHBondContact O-N 2.94Å; V274-R277 WeakPolarHBondContact O-CB 3.29Å; V274-R277 PolarHBondContact O-N 2.85Å; V274-R277 VanDerWaalsContact O-N 3.16Å; R275-R277 VanDerWaalsContact C-N 3.33Å; R275-R277 PolarHBondContact O-N 2.98Å; R277-Y279 VanDerWaalsContact C-N 3.33Å; R277-Y279 PolarHBondContact O-N 3.08Å; R277-E280 PolarHBondContact O-N 2.6Å; R277-L281 PolarHBondContact O-N 3.22Å; R277-L281 VanDerWaalsContact O-N 3.09Å
278L96.3Very high95.8Very high0 Ų069.3 Ų69.30%036%0.364CS..Hα-helixtrans-64.6-36.9175.1-68.4174.6000112.1V274 R275 G276 L282 I291 I329 L332 V336V274-L278 HydrophobicContact CG1-CD1 4.29Å; V274-L278 HydrophobicContact CG1-CG 4.34Å; V274-L278 WeakPolarHBondContact O-CG 3.31Å; V274-L278 PolarHBondContact O-N 3.29Å; R275-L278 PolarHBondContact O-N 3.18Å; G276-L278 PolarHBondContact O-N 3.21Å; L278-L282 WeakPolarHBondContact O-CB 3.4Å; L278-L282 VanDerWaalsContact O-CG 3.29Å; L278-L282 WeakPolarHBondContact O-CG 3.45Å; L278-L282 PolarHBondContact O-N 2.95Å; L278-I291 HydrophobicContact CD2-CG2 3.96Å; L278-I329 HydrophobicContact CB-CD1 3.78Å; L278-I329 HydrophobicContact CD1-CD1 4.42Å; L278-L332 HydrophobicContact CD1-CB 4Å; L278-V336 HydrophobicContact CD1-CG2 4.24Å
279Y96.3Very high95.6Very high99 Ų9966.8 Ų66.839%0.38834%0.343SS..Hα-helixtrans-63.7-42.1173.1-89.4-66.4000112.1R275 G276 R277 L282 T283 I329R275-Y279 HydrophobicContact CG-CD2 4.05Å; R275-Y279 HydrophobicContact CG-CE2 3.91Å; R275-Y279 PolarHBondContact NH2-OH 2.67Å; R275-Y279 VanDerWaalsContact O-CD2 3.31Å; R275-Y279 WeakPolarHBondContact O-CD2 3.02Å; R275-Y279 PolarHBondContact O-N 3.47Å; G276-Y279 WeakPolarHBondContact O-CB 3.31Å; G276-Y279 PolarHBondContact O-N 3.27Å; R277-Y279 VanDerWaalsContact C-N 3.33Å; R277-Y279 PolarHBondContact O-N 3.08Å; Y279-L282 PolarHBondContact O-N 3.25Å; Y279-T283 VanDerWaalsContact O-CB 3.31Å; Y279-T283 WeakPolarHBondContact O-CB 3.46Å; Y279-T283 PolarHBondContact O-N 3.04Å; Y279-T283 PolarHBondContact O-OG1 2.73Å; Y279-I329 HydrophobicContact CD2-CD1 4.34Å; Y279-I329 HydrophobicContact CD2-CG1 4.46Å; Y279-I329 HydrophobicContact CE1-CB 4.43Å; Y279-I329 HydrophobicContact CE1-CG1 4.09Å; Y279-I329 HydrophobicContact CE1-CG2 4.37Å; Y279-I329 HydrophobicContact CE2-CD1 4.35Å; Y279-I329 HydrophobicContact CE2-CG1 4.01Å
280E96.4Very high95.6Very high93 Ų9361.8 Ų61.844%0.43532%0.321SS..Hα-helixtrans-61.4-46.1178.1-166.8157.9-156.600111Y254 G276 R277 L282 T283 H284Y254-E280 HydrophobicContact CE1-CB 4.42Å; Y254-E280 VanDerWaalsContact CZ-OE2 3.25Å; Y254-E280 PolarHBondContact OH-OE2 3.14Å; G276-E280 PolarHBondContact O-N 3.07Å; R277-E280 PolarHBondContact O-N 2.6Å; E280-L282 PolarHBondContact O-N 3.01Å; E280-T283 PolarHBondContact O-N 3.4Å; E280-H284 PolarHBondContact O-CD2 2.96Å; E280-H284 PolarHBondContact O-N 3.03Å
281L95.4Very high95.6Very high4 Ų459.5 Ų59.52%0.02131%0.312CS..Hα-helixtrans-58.9-43.3174.2-71.6170.3000113.3W251 Y254 L255 R277 H284 I286 I291W251-L281 HydrophobicContact CB-CD2 4.39Å; Y254-L281 HydrophobicContact CD1-CD1 4.26Å; Y254-L281 HydrophobicContact CD1-CD2 3.76Å; Y254-L281 HydrophobicContact CD1-CG 3.82Å; Y254-L281 HydrophobicContact CE1-CD2 4.45Å; Y254-L281 HydrophobicContact CE1-CG 4.06Å; L255-L281 HydrophobicContact CD1-CD1 3.77Å; R277-L281 PolarHBondContact O-N 3.22Å; R277-L281 VanDerWaalsContact O-N 3.09Å; L281-H284 PolarHBondContact O-N 3.37Å; L281-I286 HydrophobicContact CD2-CD1 3.7Å; L281-I286 PolarHBondContact O-N 3.42Å; L281-I291 HydrophobicContact CB-CD1 3.72Å; L281-I291 HydrophobicContact CB-CG1 4.38Å; L281-I291 HydrophobicContact CD1-CG2 4.24Å
282L95.2Very high95.6Very high42 Ų4258 Ų5822%0.2231%0.305CS..Hα-helixtrans-69-34177.4-72.2171.1000112.4L278 Y279 E280 H284 C285 P288 I291 A328 I329 L332L278-L282 WeakPolarHBondContact O-CB 3.4Å; L278-L282 VanDerWaalsContact O-CG 3.29Å; L278-L282 WeakPolarHBondContact O-CG 3.45Å; L278-L282 PolarHBondContact O-N 2.95Å; Y279-L282 PolarHBondContact O-N 3.25Å; E280-L282 PolarHBondContact O-N 3.01Å; L282-H284 VanDerWaalsContact C-N 3.3Å; L282-C285 PolarHBondContact O-N 3.31Å; L282-P288 HydrophobicContact CD2-CB 4.41Å; L282-P288 HydrophobicContact CD2-CG 3.91Å; L282-I291 HydrophobicContact CD2-CD1 3.93Å; L282-I291 HydrophobicContact CG-CD1 4.21Å; L282-A328 HydrophobicContact CD2-CB 4.24Å; L282-I329 HydrophobicContact CD1-CB 3.86Å; L282-I329 HydrophobicContact CD1-CD1 4.11Å; L282-L332 HydrophobicContact CD1-CD1 4.21Å; L282-L332 HydrophobicContact CD2-CD1 4.23Å; L282-L332 HydrophobicContact CG-CD1 4.39Å
283T96.3Very high95.5Very high104 Ų10457.7 Ų57.764%0.63830%0.297SS*.Hα-helixtrans-67.8-34178.9-57.80000111Y279 E280 C285Y279-T283 VanDerWaalsContact O-CB 3.31Å; Y279-T283 WeakPolarHBondContact O-CB 3.46Å; Y279-T283 PolarHBondContact O-N 3.04Å; Y279-T283 PolarHBondContact O-OG1 2.73Å; E280-T283 PolarHBondContact O-N 3.4Å; T283-C285 PolarHBondContact O-N 2.91Å; T283-C285 VanDerWaalsContact O-N 3.13Å
284H95Very high95.4Very high131 Ų13153.9 Ų53.961%0.60629%0.285SS*.THydrogen-bonded Turntrans-7513.5170.6-69.7-60.3000114.2E280 L281 L282 I286E280-H284 PolarHBondContact O-CD2 2.96Å; E280-H284 PolarHBondContact O-N 3.03Å; L281-H284 PolarHBondContact O-N 3.37Å; L282-H284 VanDerWaalsContact C-N 3.3Å; H284-I286 HydrophobicContact CB-CD1 4.38Å; H284-I286 HydrophobicContact CB-CG1 4.41Å; H284-I286 PolarHBondContact O-N 2.91Å
285C92.9Very high95.3Very high113 Ų11353.9 Ų53.976%0.76429%0.285SS*.THydrogen-bonded Turntrans58.729.1175.6-630000114.1L282 T283L282-C285 PolarHBondContact O-N 3.31Å; T283-C285 PolarHBondContact O-N 2.91Å; T283-C285 VanDerWaalsContact O-N 3.13Å
286I95.1Very high95.3Very high23 Ų2351.3 Ų51.312%0.11828%0.278CS..  trans-77.2128.7174-58.3166000108.2W251 L281 H284 I290 I291W251-I286 HydrophobicContact CB-CD1 3.38Å; W251-I286 HydrophobicContact CD2-CD1 4.32Å; W251-I286 HydrophobicContact CG-CD1 3.86Å; L281-I286 HydrophobicContact CD2-CD1 3.7Å; L281-I286 PolarHBondContact O-N 3.42Å; H284-I286 HydrophobicContact CB-CD1 4.38Å; H284-I286 HydrophobicContact CB-CG1 4.41Å; H284-I286 PolarHBondContact O-N 2.91Å; I286-I290 HydrophobicContact CG2-CB 4.27Å; I286-I290 HydrophobicContact CG2-CG2 4.31Å; I286-I291 HydrophobicContact CB-CD1 4.43Å; I286-I291 HydrophobicContact CB-CG1 4.4Å; I286-I291 HydrophobicContact CG2-CD1 4.47Å; I286-I291 HydrophobicContact CG2-CG1 3.92Å
287P93.7Very high95.1Very high54 Ų5452 Ų5235%0.35128%0.276SS..  trans-60135.4-178.1-23.132.1000111.6E289 I290 I291P287-E289 HydrophobicContact CB-CG 3.9Å; P287-E289 PolarHBondContact O-N 2.76Å; P287-E289 VanDerWaalsContact O-N 3.15Å; P287-I290 HydrophobicContact CB-CG1 4.02Å; P287-I290 HydrophobicContact CG-CG1 4.18Å; P287-I290 WeakPolarHBondContact O-CA 3.44Å; P287-I290 WeakPolarHBondContact O-CB 3.08Å; P287-I290 PolarHBondContact O-N 2.79Å; P287-I291 PolarHBondContact O-N 3.37Å
288P95.3Very high95Very high33 Ų3351.2 Ų51.221%0.21428%0.275CS..Hα-helixtrans-61.6-29-176.4-20.929.3000113.9L282 I290 I291 M292 L322 A328 L332L282-P288 HydrophobicContact CD2-CB 4.41Å; L282-P288 HydrophobicContact CD2-CG 3.91Å; P288-I290 VanDerWaalsContact C-N 3.27Å; P288-I290 PolarHBondContact O-N 3Å; P288-I291 PolarHBondContact O-N 3Å; P288-M292 WeakPolarHBondContact O-CB 3.36Å; P288-M292 PolarHBondContact O-N 2.9Å; P288-L322 HydrophobicContact CB-CD1 3.59Å; P288-L322 HydrophobicContact CB-CD2 3.71Å; P288-L322 HydrophobicContact CB-CG 4.26Å; P288-L322 HydrophobicContact CG-CD2 4.19Å; P288-A328 HydrophobicContact CB-CB 3.89Å; P288-A328 HydrophobicContact CG-CB 3.48Å; P288-A328 VanDerWaalsContact CG-CB 3.48Å; P288-L332 HydrophobicContact CB-CD1 4.43Å
289E93.1Very high94.9Very high56 Ų5651.2 Ų51.226%0.26228%0.275SS..Hα-helixtrans-62.7-32.517358.9-173.2-145.800112.6P287 K293 Q323P287-E289 HydrophobicContact CB-CG 3.9Å; P287-E289 PolarHBondContact O-N 2.76Å; P287-E289 VanDerWaalsContact O-N 3.15Å; E289-K293 WeakPolarHBondContact O-CB 3.49Å; E289-K293 WeakPolarHBondContact O-CE 3.49Å; E289-K293 WeakPolarHBondContact O-CG 3.34Å; E289-K293 PolarHBondContact O-N 2.91Å; E289-K293 VanDerWaalsContact O-N 3.16Å; E289-Q323 PolarHBondContact OE2-NE2 2.64Å
290I94.1Very high94.7Very high52 Ų5248.5 Ų48.527%0.26727%0.267SS..Hα-helixtrans-74.7-43.3175.7-58.1-59.7000109.9W251 I286 P287 P288 M292 K293 G294W251-I290 HydrophobicContact CH2-CG2 3.59Å; W251-I290 HydrophobicContact CZ3-CG2 3.64Å; I286-I290 HydrophobicContact CG2-CB 4.27Å; I286-I290 HydrophobicContact CG2-CG2 4.31Å; P287-I290 HydrophobicContact CB-CG1 4.02Å; P287-I290 HydrophobicContact CG-CG1 4.18Å; P287-I290 WeakPolarHBondContact O-CA 3.44Å; P287-I290 WeakPolarHBondContact O-CB 3.08Å; P287-I290 PolarHBondContact O-N 2.79Å; P288-I290 VanDerWaalsContact C-N 3.27Å; P288-I290 PolarHBondContact O-N 3Å; I290-M292 PolarHBondContact O-N 3.11Å; I290-K293 PolarHBondContact O-N 3.25Å; I290-G294 PolarHBondContact O-N 2.8Å
291I96.2Very high94.5Very high1 Ų150.9 Ų50.91%0.00528%0.278CS..Hα-helixtrans-57-50.3174.5-60.2174.3000109.9L255 L278 L281 L282 I286 P287 P288 K293 G294 L295 L332L255-I291 HydrophobicContact CD1-CG2 3.94Å; L278-I291 HydrophobicContact CD2-CG2 3.96Å; L281-I291 HydrophobicContact CB-CD1 3.72Å; L281-I291 HydrophobicContact CB-CG1 4.38Å; L281-I291 HydrophobicContact CD1-CG2 4.24Å; L282-I291 HydrophobicContact CD2-CD1 3.93Å; L282-I291 HydrophobicContact CG-CD1 4.21Å; I286-I291 HydrophobicContact CB-CD1 4.43Å; I286-I291 HydrophobicContact CB-CG1 4.4Å; I286-I291 HydrophobicContact CG2-CD1 4.47Å; I286-I291 HydrophobicContact CG2-CG1 3.92Å; P287-I291 PolarHBondContact O-N 3.37Å; P288-I291 PolarHBondContact O-N 3Å; I291-K293 PolarHBondContact O-N 2.86Å; I291-G294 PolarHBondContact O-N 3.19Å; I291-L295 WeakPolarHBondContact O-CB 3.45Å; I291-L295 PolarHBondContact O-N 3.21Å; I291-L332 HydrophobicContact CD1-CD1 4.4Å; I291-L332 HydrophobicContact CG2-CD1 4.26Å; I291-L332 HydrophobicContact CG2-CD2 4.49Å
292M96Very high94.1Very high4 Ų453.9 Ų53.92%0.0229%0.294CS..Hα-helixtrans-60.1-46-179.9-174.963.780.500112.4P288 I290 L296 A315 E319 L332 F335P288-M292 WeakPolarHBondContact O-CB 3.36Å; P288-M292 PolarHBondContact O-N 2.9Å; I290-M292 PolarHBondContact O-N 3.11Å; M292-L296 VanDerWaalsContact O-CB 3.22Å; M292-L296 WeakPolarHBondContact O-CB 3.3Å; M292-L296 PolarHBondContact O-N 3.17Å; M292-A315 HydrophobicContact SD-CB 4.26Å; M292-E319 HydrophobicContact CG-CB 4.13Å; M292-E319 HydrophobicContact CG-CG 4.32Å; M292-L332 HydrophobicContact CB-CD2 4.43Å; M292-L332 HydrophobicContact CE-CD2 3.79Å; M292-F335 HydrophobicContact CE-CB 3.87Å; M292-F335 HydrophobicContact CE-CD1 3.98Å; M292-F335 HydrophobicContact CE-CG 3.87Å; M292-F335 HydrophobicContact SD-CB 4.46Å; M292-F335 HydrophobicContact SD-CD1 3.5Å; M292-F335 VanDerWaalsContact SD-CD1 3.5Å; M292-F335 HydrophobicContact SD-CD2 4.25Å; M292-F335 HydrophobicContact SD-CE1 3.7Å; M292-F335 HydrophobicContact SD-CE2 4.42Å; M292-F335 HydrophobicContact SD-CG 3.8Å; M292-F335 HydrophobicContact SD-CZ 4.16Å
293K94.3Very high93.7Very high120 Ų12052.3 Ų52.352%0.52229%0.286SS..Hα-helixtrans-66.3-43.3179.9-76.8179.5-68.5-175.70112.7E289 I290 I291 L296 S297E289-K293 WeakPolarHBondContact O-CB 3.49Å; E289-K293 WeakPolarHBondContact O-CE 3.49Å; E289-K293 WeakPolarHBondContact O-CG 3.34Å; E289-K293 PolarHBondContact O-N 2.91Å; E289-K293 VanDerWaalsContact O-N 3.16Å; I290-K293 PolarHBondContact O-N 3.25Å; I291-K293 PolarHBondContact O-N 2.86Å; K293-L296 PolarHBondContact O-N 2.97Å; K293-S297 PolarHBondContact O-N 2.98Å; K293-S297 PolarHBondContact O-OG 3.14Å
294G94.1Very high93.3Very high20 Ų2051.7 Ų51.721%0.20628%0.279CS..Hα-helixtrans-70.2-37.3179.100000112.4I290 I291 S297 E298I290-G294 PolarHBondContact O-N 2.8Å; I291-G294 PolarHBondContact O-N 3.19Å; G294-S297 WeakPolarHBondContact CA-OG 3.28Å; G294-S297 PolarHBondContact O-OG 2.9Å; G294-E298 PolarHBondContact O-N 3.2Å
295L95.5Very high92.8Very high1 Ų147.9 Ų47.91%0.00528%0.276CS..Hα-helixtrans-63.1-48.2172.6-163.562.6000110.4L255 A259 I262 I291 S297 E298 L299 F335 V336L255-L295 HydrophobicContact CD1-CB 4.27Å; L255-L295 HydrophobicContact CD1-CD1 4.21Å; A259-L295 HydrophobicContact CB-CD1 3.7Å; I262-L295 HydrophobicContact CD1-CD1 3.76Å; I262-L295 HydrophobicContact CD1-CD2 4.07Å; I262-L295 HydrophobicContact CD1-CG 4.31Å; I291-L295 WeakPolarHBondContact O-CB 3.45Å; I291-L295 PolarHBondContact O-N 3.21Å; L295-S297 PolarHBondContact O-N 3.08Å; L295-E298 PolarHBondContact O-N 3.13Å; L295-L299 HydrophobicContact CG-CD1 4.05Å; L295-L299 HydrophobicContact CG-CG 4.43Å; L295-L299 WeakPolarHBondContact O-CB 3.4Å; L295-L299 WeakPolarHBondContact O-CG 3.4Å; L295-L299 PolarHBondContact O-N 3.32Å; L295-F335 HydrophobicContact CD2-CD1 4.17Å; L295-F335 HydrophobicContact CD2-CE1 3.93Å; L295-F335 HydrophobicContact CG-CE1 4.41Å; L295-V336 HydrophobicContact CD2-CG2 3.93Å
296L96.1Very high92.5Very high32 Ų3248.9 Ų48.917%0.16827%0.269CS..Hα-helixtrans-58.6-46.5177.817664.1000112.3M292 K293 E298 L299 L300 V311 A315M292-L296 VanDerWaalsContact O-CB 3.22Å; M292-L296 WeakPolarHBondContact O-CB 3.3Å; M292-L296 PolarHBondContact O-N 3.17Å; K293-L296 PolarHBondContact O-N 2.97Å; L296-E298 VanDerWaalsContact C-N 3.3Å; L296-E298 PolarHBondContact O-N 3.44Å; L296-L299 PolarHBondContact O-N 3.09Å; L296-L300 HydrophobicContact CD1-CD1 3.75Å; L296-L300 HydrophobicContact CD1-CD2 4.19Å; L296-L300 HydrophobicContact CD1-CG 3.73Å; L296-L300 HydrophobicContact CD2-CD1 4.39Å; L296-L300 HydrophobicContact CG-CD1 3.76Å; L296-L300 HydrophobicContact CG-CG 4.16Å; L296-L300 WeakPolarHBondContact O-CB 3.37Å; L296-L300 WeakPolarHBondContact O-CG 3.2Å; L296-L300 PolarHBondContact O-N 3.29Å; L296-V311 HydrophobicContact CD1-CG1 3.77Å; L296-A315 HydrophobicContact CB-CB 4.33Å; L296-A315 HydrophobicContact CD1-CB 3.75Å; L296-A315 HydrophobicContact CD2-CB 3.72Å; L296-A315 HydrophobicContact CG-CB 4.13Å
297S93.6Very high92.3Very high55 Ų5548.1 Ų48.139%0.38527%0.265SS..Hα-helixtrans-59-44.8-179.352.90000111.5K293 G294 L295 L300 H301K293-S297 PolarHBondContact O-N 2.98Å; K293-S297 PolarHBondContact O-OG 3.14Å; G294-S297 WeakPolarHBondContact CA-OG 3.28Å; G294-S297 PolarHBondContact O-OG 2.9Å; L295-S297 PolarHBondContact O-N 3.08Å; S297-L300 PolarHBondContact O-N 3.05Å; S297-H301 PolarHBondContact O-CD2 3.13Å; S297-H301 PolarHBondContact O-N 3.28Å
298E94.2Very high92.3Very high39 Ų3949.5 Ų49.518%0.18227%0.266CS..Hα-helixtrans-70.4-39.6-179.4-161.666.5-161.300112R256 A259 G294 L295 L296 L300 H301R256-E298 HydrophobicContact CG-CG 3.95Å; R256-E298 WeakPolarHBondContact CG-OE1 3.43Å; R256-E298 IonicContact NE-OE2 3.17Å; A259-E298 HydrophobicContact CB-CB 3.54Å; A259-E298 HydrophobicContact CB-CG 3.51Å; G294-E298 PolarHBondContact O-N 3.2Å; L295-E298 PolarHBondContact O-N 3.13Å; L296-E298 VanDerWaalsContact C-N 3.3Å; L296-E298 PolarHBondContact O-N 3.44Å; E298-L300 VanDerWaalsContact C-N 3.35Å; E298-L300 PolarHBondContact O-N 3.44Å; E298-H301 WeakPolarHBondContact O-CB 3.38Å; E298-H301 PolarHBondContact O-N 3.39Å
299L93.6Very high92.2Very high0 Ų049.8 Ų49.80%027%0.274CS..Hα-helixtrans-62.9-40.6174.8-67.7179000111.8A259 I262 V263 L295 L296 H301 N302 C303 F335 F339A259-L299 HydrophobicContact CB-CD2 4.28Å; I262-L299 HydrophobicContact CB-CD2 4.35Å; I262-L299 HydrophobicContact CG2-CD2 4.19Å; V263-L299 HydrophobicContact CG2-CD2 3.62Å; L295-L299 HydrophobicContact CG-CD1 4.05Å; L295-L299 HydrophobicContact CG-CG 4.43Å; L295-L299 WeakPolarHBondContact O-CB 3.4Å; L295-L299 WeakPolarHBondContact O-CG 3.4Å; L295-L299 PolarHBondContact O-N 3.32Å; L296-L299 PolarHBondContact O-N 3.09Å; L299-H301 VanDerWaalsContact C-N 3.27Å; L299-H301 PolarHBondContact O-N 3.19Å; L299-N302 PolarHBondContact O-N 3.06Å; L299-N302 VanDerWaalsContact O-N 3.1Å; L299-C303 PolarHBondContact O-N 3.09Å; L299-C303 VanDerWaalsContact O-N 3.15Å; L299-C303 PolarHBondContact O-SG 3.45Å; L299-F335 HydrophobicContact CD1-CE1 4.06Å; L299-F335 HydrophobicContact CD1-CZ 4.11Å; L299-F339 HydrophobicContact CB-CE2 4.18Å; L299-F339 HydrophobicContact CB-CZ 4.19Å; L299-F339 HydrophobicContact CD1-CD1 4.11Å; L299-F339 HydrophobicContact CD1-CD2 4.06Å; L299-F339 HydrophobicContact CD1-CE1 4.17Å; L299-F339 HydrophobicContact CD1-CE2 4.12Å; L299-F339 HydrophobicContact CD1-CG 4.06Å; L299-F339 HydrophobicContact CD1-CZ 4.18Å; L299-F339 HydrophobicContact CD2-CD1 4.34Å; L299-F339 HydrophobicContact CD2-CE1 3.7Å; L299-F339 HydrophobicContact CD2-CE2 4.48Å; L299-F339 HydrophobicContact CD2-CZ 3.78Å; L299-F339 HydrophobicContact CG-CE1 4.44Å; L299-F339 HydrophobicContact CG-CE2 4.49Å; L299-F339 HydrophobicContact CG-CZ 4.25Å
300L93.5Very high92.2Very high42 Ų4251.9 Ų51.922%0.2228%0.284CS..Hα-helixtrans-67.3-24.6178.1-71.1174.2000113.4L296 S297 E298 N302 K308 V311L296-L300 HydrophobicContact CD1-CD1 3.75Å; L296-L300 HydrophobicContact CD1-CD2 4.19Å; L296-L300 HydrophobicContact CD1-CG 3.73Å; L296-L300 HydrophobicContact CD2-CD1 4.39Å; L296-L300 HydrophobicContact CG-CD1 3.76Å; L296-L300 HydrophobicContact CG-CG 4.16Å; L296-L300 WeakPolarHBondContact O-CB 3.37Å; L296-L300 WeakPolarHBondContact O-CG 3.2Å; L296-L300 PolarHBondContact O-N 3.29Å; S297-L300 PolarHBondContact O-N 3.05Å; E298-L300 VanDerWaalsContact C-N 3.35Å; E298-L300 PolarHBondContact O-N 3.44Å; L300-N302 VanDerWaalsContact C-N 3.27Å; L300-K308 HydrophobicContact CD2-CB 3.76Å; L300-K308 HydrophobicContact CD2-CG 3.73Å; L300-K308 WeakPolarHBondContact O-CE 3.49Å; L300-K308 PolarHBondContact O-NZ 2.94Å; L300-V311 HydrophobicContact CD2-CB 4.27Å; L300-V311 HydrophobicContact CD2-CG1 4.22Å
301H91.3Very high92.2Very high142 Ų14249.4 Ų49.466%0.65727%0.271SS*.Hα-helixtrans-66.7-32.5172-79.2-66.2000111.8S297 E298 L299S297-H301 PolarHBondContact O-CD2 3.13Å; S297-H301 PolarHBondContact O-N 3.28Å; E298-H301 WeakPolarHBondContact O-CB 3.38Å; E298-H301 PolarHBondContact O-N 3.39Å; L299-H301 VanDerWaalsContact C-N 3.27Å; L299-H301 PolarHBondContact O-N 3.19Å
302N87.4Confident92.2Very high67 Ų6751.2 Ų51.236%0.35829%0.287SS..Hα-helixtrans-95.2-4.5-178.2-64.2-31.4000114.1V263 L299 L300V263-N302 HydrophobicContact CG1-CB 4.11Å; V263-N302 HydrophobicContact CG2-CB 4.07Å; L299-N302 PolarHBondContact O-N 3.06Å; L299-N302 VanDerWaalsContact O-N 3.1Å; L300-N302 VanDerWaalsContact C-N 3.27Å
303C86.6Confident92.2Very high10 Ų1058 Ų587%0.06832%0.318CS..SBendtrans-95.6150.9-179.7-67.50000113L299 L307 K308L299-C303 PolarHBondContact O-N 3.09Å; L299-C303 VanDerWaalsContact O-N 3.15Å; L299-C303 PolarHBondContact O-SG 3.45Å; C303-L307 HydrophobicContact CB-CB 4.48Å; C303-L307 HydrophobicContact CB-CD2 4.32Å; C303-K308 HydrophobicContact CB-CG 4.15Å; C303-K308 WeakPolarHBondContact O-CE 3.45Å
304D87.6Confident92.2Very high90 Ų9053.5 Ų53.548%0.48130%0.299SS..  trans-67.9149.9168.1-163.7-51.7000111.3Q306 L307 K308 F346D304-Q306 VanDerWaalsContact C-N 3.26Å; D304-Q306 HydrophobicContact CB-CG 4.35Å; D304-Q306 PolarHBondContact O-N 2.85Å; D304-Q306 PolarHBondContact OD1-N 3.24Å; D304-L307 PolarHBondContact O-N 3.01Å; D304-K308 WeakPolarHBondContact O-CG 3.35Å; D304-K308 PolarHBondContact O-N 3.18Å; D304-F346 HydrophobicContact CB-CE1 3.95Å; D304-F346 HydrophobicContact CB-CZ 3.91Å
305G85.2Confident92.3Very high52 Ų5252.6 Ų52.654%0.53629%0.29SS..Hα-helixtrans-52.4-36.7-179.400000114.7
306Q87Confident92.3Very high134 Ų13455.5 Ų55.563%0.62631%0.314SS*.Hα-helixtrans-66.7-38.3175.857.6-175.8-34.900112.6D304 F346D304-Q306 VanDerWaalsContact C-N 3.26Å; D304-Q306 HydrophobicContact CB-CG 4.35Å; D304-Q306 PolarHBondContact O-N 2.85Å; D304-Q306 PolarHBondContact OD1-N 3.24Å; Q306-F346 HydrophobicContact CG-CE2 3.85Å; Q306-F346 HydrophobicContact CG-CZ 3.98Å; Q306-F346 VanDerWaalsContact NE2-CE2 3.31Å; Q306-F346 VanDerWaalsContact NE2-CZ 3.3Å
307L90.4Very high92.4Very high6 Ų659.8 Ų59.83%0.03133%0.329CS..Hα-helixtrans-77.2-26.9-179-172.362.3000112.2C303 D304 G309 E310 V311 L342 Y343 F346C303-L307 HydrophobicContact CB-CB 4.48Å; C303-L307 HydrophobicContact CB-CD2 4.32Å; D304-L307 PolarHBondContact O-N 3.01Å; L307-G309 PolarHBondContact O-N 2.79Å; L307-E310 PolarHBondContact O-N 3.49Å; L307-V311 HydrophobicContact CD1-CG2 4.2Å; L307-V311 HydrophobicContact CG-CG2 3.84Å; L307-V311 WeakPolarHBondContact O-CG2 3.2Å; L307-V311 PolarHBondContact O-N 3.38Å; L307-L342 HydrophobicContact CD1-CD2 3.59Å; L307-L342 HydrophobicContact CD1-CG 3.79Å; L307-Y343 HydrophobicContact CD2-CD2 3.72Å; L307-Y343 HydrophobicContact CD2-CE2 4.35Å; L307-F346 HydrophobicContact CD2-CB 4.46Å; L307-F346 HydrophobicContact CD2-CD1 4.11Å; L307-F346 HydrophobicContact CD2-CG 4.27Å
308K93.2Very high92.5Very high84 Ų8458.4 Ų58.437%0.36532%0.315SS..Hα-helixtrans-55.8-37.5179.4-71.5-178.8-163.6-162.30112.8L300 C303 D304 A312L300-K308 HydrophobicContact CD2-CB 3.76Å; L300-K308 HydrophobicContact CD2-CG 3.73Å; L300-K308 WeakPolarHBondContact O-CE 3.49Å; L300-K308 PolarHBondContact O-NZ 2.94Å; C303-K308 HydrophobicContact CB-CG 4.15Å; C303-K308 WeakPolarHBondContact O-CE 3.45Å; D304-K308 WeakPolarHBondContact O-CG 3.35Å; D304-K308 PolarHBondContact O-N 3.18Å; K308-A312 VanDerWaalsContact O-CB 3.25Å; K308-A312 WeakPolarHBondContact O-CB 3.48Å; K308-A312 PolarHBondContact O-N 3.32Å
309G93.1Very high92.6Very high38 Ų3859.1 Ų59.139%0.39232%0.318SS..Hα-helixtrans-62.1-50178.700000112.3L307 Q313L307-G309 PolarHBondContact O-N 2.79Å; G309-Q313 WeakPolarHBondContact O-CG 3.41Å; G309-Q313 PolarHBondContact O-N 3.24Å; G309-Q313 VanDerWaalsContact O-N 3.14Å
310E93.1Very high92.7Very high101 Ų10164.4 Ų64.447%0.47234%0.343SS..Hα-helixtrans-66.7-44-179.9-63-171.2-174.900112L307 A312 Q313 M314 L342L307-E310 PolarHBondContact O-N 3.49Å; E310-A312 VanDerWaalsContact C-N 3.33Å; E310-A312 PolarHBondContact O-N 3.07Å; E310-Q313 PolarHBondContact O-N 3.13Å; E310-M314 WeakPolarHBondContact O-CB 3.18Å; E310-M314 WeakPolarHBondContact O-CG 3.24Å; E310-M314 PolarHBondContact O-N 3.23Å; E310-L342 HydrophobicContact CB-CD2 4.16Å
311V95.2Very high92.7Very high0 Ų066.6 Ų66.60%035%0.348CS..Hα-helixtrans-63.3-40.1179.8175.70000111.2L296 L300 L307 M314 A315 F339L296-V311 HydrophobicContact CD1-CG1 3.77Å; L300-V311 HydrophobicContact CD2-CB 4.27Å; L300-V311 HydrophobicContact CD2-CG1 4.22Å; L307-V311 HydrophobicContact CD1-CG2 4.2Å; L307-V311 HydrophobicContact CG-CG2 3.84Å; L307-V311 WeakPolarHBondContact O-CG2 3.2Å; L307-V311 PolarHBondContact O-N 3.38Å; V311-M314 PolarHBondContact O-N 2.94Å; V311-A315 WeakPolarHBondContact O-CB 3.49Å; V311-A315 PolarHBondContact O-N 2.82Å; V311-F339 HydrophobicContact CG1-CD2 3.92Å; V311-F339 HydrophobicContact CG1-CE2 4.03Å; V311-F339 HydrophobicContact CG2-CD2 3.89Å; V311-F339 HydrophobicContact CG2-CE2 3.85Å
312A95.4Very high92.9Very high39 Ų3960.5 Ų60.532%0.32232%0.32SS..Hα-helixtrans-64-43.7175.400000112.2K308 E310 A315 A316K308-A312 VanDerWaalsContact O-CB 3.25Å; K308-A312 WeakPolarHBondContact O-CB 3.48Å; K308-A312 PolarHBondContact O-N 3.32Å; E310-A312 VanDerWaalsContact C-N 3.33Å; E310-A312 PolarHBondContact O-N 3.07Å; A312-A315 PolarHBondContact O-N 3.28Å; A312-A316 WeakPolarHBondContact O-CB 3.35Å; A312-A316 PolarHBondContact O-N 3.04Å
313Q95.9Very high93.1Very high145 Ų14561 Ų6168%0.67832%0.321SS*.Hα-helixtrans-63.7-41.8176-70.8176.714.900111.8G309 E310 A316 Y317G309-Q313 WeakPolarHBondContact O-CG 3.41Å; G309-Q313 PolarHBondContact O-N 3.24Å; G309-Q313 VanDerWaalsContact O-N 3.14Å; E310-Q313 PolarHBondContact O-N 3.13Å; Q313-A316 PolarHBondContact O-N 3.12Å; Q313-Y317 WeakPolarHBondContact O-CB 3.3Å; Q313-Y317 PolarHBondContact O-N 2.9Å
314M95Very high93.3Very high26 Ų2667 Ų6713%0.12835%0.351CS..Hα-helixtrans-61.7-49.3176-76.717636.800111.6E310 V311 A316 Y317 Y318 F335 K338 F339 L342E310-M314 WeakPolarHBondContact O-CB 3.18Å; E310-M314 WeakPolarHBondContact O-CG 3.24Å; E310-M314 PolarHBondContact O-N 3.23Å; V311-M314 PolarHBondContact O-N 2.94Å; M314-A316 VanDerWaalsContact C-N 3.29Å; M314-A316 PolarHBondContact O-N 3.28Å; M314-Y317 PolarHBondContact O-N 3.11Å; M314-Y317 VanDerWaalsContact O-N 3.13Å; M314-Y318 VanDerWaalsContact O-CD2 3.23Å; M314-Y318 WeakPolarHBondContact O-CD2 3.13Å; M314-Y318 PolarHBondContact O-N 3.06Å; M314-F335 HydrophobicContact CB-CE2 4.42Å; M314-K338 HydrophobicContact CE-CB 3.74Å; M314-K338 HydrophobicContact CE-CG 3.3Å; M314-K338 HydrophobicContact SD-CG 4.01Å; M314-F339 HydrophobicContact CE-CB 4.46Å; M314-L342 HydrophobicContact SD-CD2 3.71Å
315A95.9Very high93.4Very high2 Ų264.3 Ų64.32%0.01735%0.345CS..Hα-helixtrans-58.4-43.9177.800000111.4M292 L296 V311 A312 Y317 Y318 E319 F335M292-A315 HydrophobicContact SD-CB 4.26Å; L296-A315 HydrophobicContact CB-CB 4.33Å; L296-A315 HydrophobicContact CD1-CB 3.75Å; L296-A315 HydrophobicContact CD2-CB 3.72Å; L296-A315 HydrophobicContact CG-CB 4.13Å; V311-A315 WeakPolarHBondContact O-CB 3.49Å; V311-A315 PolarHBondContact O-N 2.82Å; A312-A315 PolarHBondContact O-N 3.28Å; A315-Y317 PolarHBondContact O-N 3.33Å; A315-Y318 PolarHBondContact O-N 3.27Å; A315-E319 WeakPolarHBondContact O-CB 3.49Å; A315-E319 PolarHBondContact O-N 3.29Å; A315-F335 HydrophobicContact CB-CD2 4.44Å; A315-F335 HydrophobicContact CB-CE2 3.71Å; A315-F335 HydrophobicContact CB-CZ 3.98Å
316A95.8Very high93.6Very high61 Ų6167.6 Ų67.650%0.50436%0.36SS..Hα-helixtrans-61-42.317500000112.5A312 Q313 M314 H320A312-A316 WeakPolarHBondContact O-CB 3.35Å; A312-A316 PolarHBondContact O-N 3.04Å; Q313-A316 PolarHBondContact O-N 3.12Å; M314-A316 VanDerWaalsContact C-N 3.29Å; M314-A316 PolarHBondContact O-N 3.28Å; A316-H320 WeakPolarHBondContact O-CB 3.36Å; A316-H320 PolarHBondContact O-N 3.34Å
317Y96.9Very high93.9Very high123 Ų12366.5 Ų66.548%0.48235%0.353SS..Hα-helixtrans-64.4-47.7177.8171.9-109.6000112.6Q313 M314 A315 H320 R321Q313-Y317 WeakPolarHBondContact O-CB 3.3Å; Q313-Y317 PolarHBondContact O-N 2.9Å; M314-Y317 PolarHBondContact O-N 3.11Å; M314-Y317 VanDerWaalsContact O-N 3.13Å; A315-Y317 PolarHBondContact O-N 3.33Å; Y317-H320 PolarHBondContact O-N 3.48Å; Y317-R321 HydrophobicContact CE2-CG 4.22Å; Y317-R321 WeakPolarHBondContact O-CG 3.43Å; Y317-R321 PolarHBondContact O-N 3.4Å; Y317-R321 VanDerWaalsContact O-N 3.11Å
318Y96.6Very high94.1Very high26 Ų2667.1 Ų67.110%0.10236%0.359CS..Hα-helixtrans-70.5-35.6179.7-78.2-82.1000112.3M314 A315 R321 L322 A334 F335 K338M314-Y318 VanDerWaalsContact O-CD2 3.23Å; M314-Y318 WeakPolarHBondContact O-CD2 3.13Å; M314-Y318 PolarHBondContact O-N 3.06Å; A315-Y318 PolarHBondContact O-N 3.27Å; Y318-R321 PolarHBondContact O-N 2.79Å; Y318-L322 WeakPolarHBondContact O-CB 3.39Å; Y318-L322 PolarHBondContact O-N 3.1Å; Y318-A334 HydrophobicContact CD1-CB 4.15Å; Y318-A334 HydrophobicContact CE1-CB 3.57Å; Y318-F335 HydrophobicContact CD1-CB 4.28Å; Y318-F335 HydrophobicContact CD2-CB 3.99Å; Y318-F335 AromaticContact CD2-CD2 3.99Å; Y318-F335 HydrophobicContact CD2-CD2 3.99Å; Y318-F335 HydrophobicContact CD2-CG 4.5Å; Y318-F335 HydrophobicContact CG-CB 3.82Å; Y318-F335 HydrophobicContact CG-CD2 4.49Å; Y318-K338 HydrophobicContact CE2-CB 4.09Å; Y318-K338 HydrophobicContact CE2-CG 4.2Å; Y318-K338 WeakPolarHBondContact OH-CB 3.31Å
319E95.7Very high94.2Very high53 Ų5363.7 Ų63.725%0.24835%0.345CS..Hα-helixtrans-61.9-45.4172.4-164.5-76152.400111M292 A315 R321 L322 Q323M292-E319 HydrophobicContact CG-CB 4.13Å; M292-E319 HydrophobicContact CG-CG 4.32Å; A315-E319 WeakPolarHBondContact O-CB 3.49Å; A315-E319 PolarHBondContact O-N 3.29Å; E319-R321 VanDerWaalsContact C-N 3.33Å; E319-R321 PolarHBondContact O-N 3.35Å; E319-L322 VanDerWaalsContact O-CB 3.27Å; E319-L322 WeakPolarHBondContact O-CB 3.32Å; E319-L322 PolarHBondContact O-N 2.65Å; E319-L322 VanDerWaalsContact O-N 3.09Å; E319-Q323 WeakPolarHBondContact O-CG 3.48Å; E319-Q323 PolarHBondContact O-N 2.97Å; E319-Q323 WeakPolarHBondContact OE1-CG 3.29Å; E319-Q323 PolarHBondContact OE1-NE2 3.15Å
320H95.3Very high94.3Very high112 Ų11267.5 Ų67.552%0.51935%0.348SS..Hα-helixtrans-59.2-44.7176.8178.458.1000112A316 Y317 L322 Q323A316-H320 WeakPolarHBondContact O-CB 3.36Å; A316-H320 PolarHBondContact O-N 3.34Å; Y317-H320 PolarHBondContact O-N 3.48Å; H320-L322 VanDerWaalsContact C-N 3.31Å; H320-L322 PolarHBondContact O-N 3.43Å; H320-Q323 PolarHBondContact O-N 2.85Å
321R94.9Very high94.5Very high87 Ų8764.3 Ų64.333%0.32833%0.333SS..Hα-helixtrans-66.9-32.7176.1-66.6-156.7-56.5164.23.7112.8Y317 Y318 E319 Q323 L324 G325Y317-R321 HydrophobicContact CE2-CG 4.22Å; Y317-R321 WeakPolarHBondContact O-CG 3.43Å; Y317-R321 PolarHBondContact O-N 3.4Å; Y317-R321 VanDerWaalsContact O-N 3.11Å; Y318-R321 PolarHBondContact O-N 2.79Å; E319-R321 VanDerWaalsContact C-N 3.33Å; E319-R321 PolarHBondContact O-N 3.35Å; R321-Q323 VanDerWaalsContact C-N 3.27Å; R321-Q323 PolarHBondContact O-N 3.34Å; R321-L324 PolarHBondContact O-N 2.95Å; R321-L324 VanDerWaalsContact O-N 3.13Å; R321-G325 PolarHBondContact O-N 3.45Å; R321-G325 VanDerWaalsContact O-N 3.08Å
322L95.1Very high94.6Very high14 Ų1464.3 Ų64.37%0.07333%0.333CS..Hα-helixtrans-59.2-40.4176-176.2151.8000111.3P288 Y318 E319 H320 L324 G325 A328 H331 L332P288-L322 HydrophobicContact CB-CD1 3.59Å; P288-L322 HydrophobicContact CB-CD2 3.71Å; P288-L322 HydrophobicContact CB-CG 4.26Å; P288-L322 HydrophobicContact CG-CD2 4.19Å; Y318-L322 WeakPolarHBondContact O-CB 3.39Å; Y318-L322 PolarHBondContact O-N 3.1Å; E319-L322 VanDerWaalsContact O-CB 3.27Å; E319-L322 WeakPolarHBondContact O-CB 3.32Å; E319-L322 PolarHBondContact O-N 2.65Å; E319-L322 VanDerWaalsContact O-N 3.09Å; H320-L322 VanDerWaalsContact C-N 3.31Å; H320-L322 PolarHBondContact O-N 3.43Å; L322-L324 PolarHBondContact O-N 3.38Å; L322-G325 PolarHBondContact O-N 3.22Å; L322-A328 HydrophobicContact CD1-CB 4.14Å; L322-A328 HydrophobicContact CD2-CB 4.49Å; L322-A328 HydrophobicContact CG-CB 4.26Å; L322-H331 HydrophobicContact CB-CB 3.81Å; L322-H331 HydrophobicContact CD1-CB 4.14Å; L322-H331 HydrophobicContact CG-CB 4.2Å; L322-L332 HydrophobicContact CD1-CD2 3.81Å; L322-L332 HydrophobicContact CD1-CG 3.95Å
323Q90.4Very high94.6Very high78 Ų7864.6 Ų64.636%0.36433%0.328SS..Hα-helixtrans-69-20179.1-61.1-72.6-25.500113.3E289 E319 H320 R321E289-Q323 PolarHBondContact OE2-NE2 2.64Å; E319-Q323 WeakPolarHBondContact O-CG 3.48Å; E319-Q323 PolarHBondContact O-N 2.97Å; E319-Q323 WeakPolarHBondContact OE1-CG 3.29Å; E319-Q323 PolarHBondContact OE1-NE2 3.15Å; H320-Q323 PolarHBondContact O-N 2.85Å; R321-Q323 VanDerWaalsContact C-N 3.27Å; R321-Q323 PolarHBondContact O-N 3.34Å
324L91.1Very high94.7Very high135 Ų13559.2 Ų59.271%0.70731%0.309SS*.Hα-helixtrans-91.8-23.7176.6-60.8175.4000112.4R321 L322R321-L324 PolarHBondContact O-N 2.95Å; R321-L324 VanDerWaalsContact O-N 3.13Å; L322-L324 PolarHBondContact O-N 3.38Å
325G90.3Very high94.8Very high34 Ų3458 Ų5835%0.35130%0.302SS..  trans-86163.7-179.300000113.4R321 L322R321-G325 PolarHBondContact O-N 3.45Å; R321-G325 VanDerWaalsContact O-N 3.08Å; L322-G325 PolarHBondContact O-N 3.22Å
326S88.7Confident94.8Very high122 Ų12258 Ų5885%0.85330%0.302SS*.SBendtrans-91.5-34.117456.30000113
327K93.8Very high94.8Very high110 Ų11056.8 Ų56.848%0.47829%0.292SS..  trans-105.197.6-176.6-67.7-178-178.5-178.10110.5I329 Y330 H331K327-I329 HydrophobicContact CB-CG2 4.48Å; K327-I329 PolarHBondContact O-N 3.27Å; K327-Y330 HydrophobicContact CB-CD2 3.95Å; K327-Y330 HydrophobicContact CB-CE2 4.09Å; K327-Y330 HydrophobicContact CB-CG 4.24Å; K327-Y330 HydrophobicContact CD-CD2 4.15Å; K327-Y330 HydrophobicContact CD-CE1 4.23Å; K327-Y330 HydrophobicContact CD-CE2 3.42Å; K327-Y330 VanDerWaalsContact CD-CE2 3.42Å; K327-Y330 VanDerWaalsContact CD-CZ 3.45Å; K327-Y330 WeakPolarHBondContact CD-OH 3.27Å; K327-Y330 HydrophobicContact CG-CE2 4.36Å; K327-Y330 PolarHBondContact NZ-OH 3.1Å; K327-Y330 PolarHBondContact O-N 3.42Å; K327-H331 PolarHBondContact O-CD2 3.35Å
328A94.5Very high94.8Very high20 Ų2056.2 Ų56.217%0.16529%0.292CS..Hα-helixtrans-55.2-37.6-179.600000113.4L282 P288 L322 Y330 H331 L332L282-A328 HydrophobicContact CD2-CB 4.24Å; P288-A328 HydrophobicContact CB-CB 3.89Å; P288-A328 HydrophobicContact CG-CB 3.48Å; P288-A328 VanDerWaalsContact CG-CB 3.48Å; L322-A328 HydrophobicContact CD1-CB 4.14Å; L322-A328 HydrophobicContact CD2-CB 4.49Å; L322-A328 HydrophobicContact CG-CB 4.26Å; A328-Y330 VanDerWaalsContact C-N 3.29Å; A328-Y330 PolarHBondContact O-N 3.26Å; A328-H331 PolarHBondContact O-N 3.26Å; A328-H331 VanDerWaalsContact O-N 3.11Å; A328-L332 WeakPolarHBondContact O-CG 3.07Å; A328-L332 PolarHBondContact O-N 3.21Å; A328-L332 VanDerWaalsContact O-N 3.08Å
329I95.6Very high94.8Very high12 Ų1255 Ų556%0.06229%0.288CS..Hα-helixtrans-56.6-38.7-177.5-175.260.7000113.3R275 L278 Y279 L282 K327 H331 L332 E333R275-I329 HydrophobicContact CG-CD1 4.34Å; L278-I329 HydrophobicContact CB-CD1 3.78Å; L278-I329 HydrophobicContact CD1-CD1 4.42Å; Y279-I329 HydrophobicContact CD2-CD1 4.34Å; Y279-I329 HydrophobicContact CD2-CG1 4.46Å; Y279-I329 HydrophobicContact CE1-CB 4.43Å; Y279-I329 HydrophobicContact CE1-CG1 4.09Å; Y279-I329 HydrophobicContact CE1-CG2 4.37Å; Y279-I329 HydrophobicContact CE2-CD1 4.35Å; Y279-I329 HydrophobicContact CE2-CG1 4.01Å; L282-I329 HydrophobicContact CD1-CB 3.86Å; L282-I329 HydrophobicContact CD1-CD1 4.11Å; K327-I329 HydrophobicContact CB-CG2 4.48Å; K327-I329 PolarHBondContact O-N 3.27Å; I329-H331 VanDerWaalsContact C-N 3.28Å; I329-H331 PolarHBondContact O-N 2.95Å; I329-L332 PolarHBondContact O-N 3.27Å; I329-E333 VanDerWaalsContact O-CB 3.3Å; I329-E333 WeakPolarHBondContact O-CB 3.24Å; I329-E333 PolarHBondContact O-N 3.35Å
330Y95.8Very high94.7Very high118 Ų11853 Ų5346%0.46328%0.278SS..Hα-helixtrans-64.4-36.4-179-63.9-12.3000111.8K327 A328 A334K327-Y330 HydrophobicContact CB-CD2 3.95Å; K327-Y330 HydrophobicContact CB-CE2 4.09Å; K327-Y330 HydrophobicContact CB-CG 4.24Å; K327-Y330 HydrophobicContact CD-CD2 4.15Å; K327-Y330 HydrophobicContact CD-CE1 4.23Å; K327-Y330 HydrophobicContact CD-CE2 3.42Å; K327-Y330 VanDerWaalsContact CD-CE2 3.42Å; K327-Y330 VanDerWaalsContact CD-CZ 3.45Å; K327-Y330 WeakPolarHBondContact CD-OH 3.27Å; K327-Y330 HydrophobicContact CG-CE2 4.36Å; K327-Y330 PolarHBondContact NZ-OH 3.1Å; K327-Y330 PolarHBondContact O-N 3.42Å; A328-Y330 VanDerWaalsContact C-N 3.29Å; A328-Y330 PolarHBondContact O-N 3.26Å; Y330-A334 WeakPolarHBondContact O-CB 3.38Å; Y330-A334 PolarHBondContact O-N 3.12Å; Y330-A334 VanDerWaalsContact O-N 3.1Å
331H96.6Very high94.7Very high33 Ų3350.7 Ų50.715%0.15328%0.279CS..Hα-helixtrans-77.6-37179.7-57.9-74.7000111.8L322 K327 A328 I329 F335L322-H331 HydrophobicContact CB-CB 3.81Å; L322-H331 HydrophobicContact CD1-CB 4.14Å; L322-H331 HydrophobicContact CG-CB 4.2Å; K327-H331 PolarHBondContact O-CD2 3.35Å; A328-H331 PolarHBondContact O-N 3.26Å; A328-H331 VanDerWaalsContact O-N 3.11Å; I329-H331 VanDerWaalsContact C-N 3.28Å; I329-H331 PolarHBondContact O-N 2.95Å; H331-F335 WeakPolarHBondContact O-CB 3.47Å; H331-F335 PolarHBondContact O-N 3.28Å
332L96.3Very high94.6Very high1 Ų148.4 Ų48.41%0.00527%0.273CS..Hα-helixtrans-66.2-49.4175.2-65.1178.4000111.5L278 L282 P288 I291 M292 L322 A328 I329 A334 F335 V336L278-L332 HydrophobicContact CD1-CB 4Å; L282-L332 HydrophobicContact CD1-CD1 4.21Å; L282-L332 HydrophobicContact CD2-CD1 4.23Å; L282-L332 HydrophobicContact CG-CD1 4.39Å; P288-L332 HydrophobicContact CB-CD1 4.43Å; I291-L332 HydrophobicContact CD1-CD1 4.4Å; I291-L332 HydrophobicContact CG2-CD1 4.26Å; I291-L332 HydrophobicContact CG2-CD2 4.49Å; M292-L332 HydrophobicContact CB-CD2 4.43Å; M292-L332 HydrophobicContact CE-CD2 3.79Å; L322-L332 HydrophobicContact CD1-CD2 3.81Å; L322-L332 HydrophobicContact CD1-CG 3.95Å; A328-L332 WeakPolarHBondContact O-CG 3.07Å; A328-L332 PolarHBondContact O-N 3.21Å; A328-L332 VanDerWaalsContact O-N 3.08Å; I329-L332 PolarHBondContact O-N 3.27Å; L332-A334 VanDerWaalsContact C-N 3.33Å; L332-A334 PolarHBondContact O-N 3.1Å; L332-F335 WeakPolarHBondContact O-CB 3.48Å; L332-F335 PolarHBondContact O-N 3.11Å; L332-V336 WeakPolarHBondContact O-CG2 3.31Å; L332-V336 PolarHBondContact O-N 2.8Å
333E97.1Very high94.5Very high44 Ų4449.1 Ų49.121%0.20628%0.275CS..Hα-helixtrans-61.2-42.4177.4-176.7179.3175.400111.1R275 I329 F335 V336 A337R275-E333 VanDerWaalsContact CD-OE2 3.32Å; R275-E333 WeakPolarHBondContact CD-OE2 3.49Å; R275-E333 IonicContact CZ-OE2 3.94Å; R275-E333 IonicContact NE-OE1 3.63Å; R275-E333 IonicContact NE-OE2 3.96Å; R275-E333 PolarHBondContact NE-OE2 3.07Å; R275-E333 IonicContact NH1-OE1 3.9Å; R275-E333 PolarHBondContact NH1-OE1 3.28Å; R275-E333 IonicContact NH1-OE2 2.67Å; I329-E333 VanDerWaalsContact O-CB 3.3Å; I329-E333 WeakPolarHBondContact O-CB 3.24Å; I329-E333 PolarHBondContact O-N 3.35Å; E333-F335 VanDerWaalsContact C-N 3.33Å; E333-F335 PolarHBondContact O-N 3.08Å; E333-V336 PolarHBondContact O-N 3.17Å; E333-A337 WeakPolarHBondContact O-CB 3.27Å; E333-A337 PolarHBondContact O-N 2.89Å
334A96.6Very high94.6Very high33 Ų3349.4 Ų49.427%0.27328%0.275SS..Hα-helixtrans-65.8-34.2177.500000113.1Y318 Y330 L332 K338Y318-A334 HydrophobicContact CD1-CB 4.15Å; Y318-A334 HydrophobicContact CE1-CB 3.57Å; Y330-A334 WeakPolarHBondContact O-CB 3.38Å; Y330-A334 PolarHBondContact O-N 3.12Å; Y330-A334 VanDerWaalsContact O-N 3.1Å; L332-A334 VanDerWaalsContact C-N 3.33Å; L332-A334 PolarHBondContact O-N 3.1Å; A334-K338 VanDerWaalsContact O-CB 3.3Å; A334-K338 WeakPolarHBondContact O-CB 3.33Å; A334-K338 PolarHBondContact O-N 2.84Å
335F97.2Very high94.6Very high0 Ų049 Ų490%027%0.267CS..Hα-helixtrans-63.4-48.7171.7166.6-109.8000111M292 L295 L299 M314 A315 Y318 H331 L332 E333 A337 K338 F339M292-F335 HydrophobicContact CE-CB 3.87Å; M292-F335 HydrophobicContact CE-CD1 3.98Å; M292-F335 HydrophobicContact CE-CG 3.87Å; M292-F335 HydrophobicContact SD-CB 4.46Å; M292-F335 HydrophobicContact SD-CD1 3.5Å; M292-F335 VanDerWaalsContact SD-CD1 3.5Å; M292-F335 HydrophobicContact SD-CD2 4.25Å; M292-F335 HydrophobicContact SD-CE1 3.7Å; M292-F335 HydrophobicContact SD-CE2 4.42Å; M292-F335 HydrophobicContact SD-CG 3.8Å; M292-F335 HydrophobicContact SD-CZ 4.16Å; L295-F335 HydrophobicContact CD2-CD1 4.17Å; L295-F335 HydrophobicContact CD2-CE1 3.93Å; L295-F335 HydrophobicContact CG-CE1 4.41Å; L299-F335 HydrophobicContact CD1-CE1 4.06Å; L299-F335 HydrophobicContact CD1-CZ 4.11Å; M314-F335 HydrophobicContact CB-CE2 4.42Å; A315-F335 HydrophobicContact CB-CD2 4.44Å; A315-F335 HydrophobicContact CB-CE2 3.71Å; A315-F335 HydrophobicContact CB-CZ 3.98Å; Y318-F335 HydrophobicContact CD1-CB 4.28Å; Y318-F335 HydrophobicContact CD2-CB 3.99Å; Y318-F335 AromaticContact CD2-CD2 3.99Å; Y318-F335 HydrophobicContact CD2-CD2 3.99Å; Y318-F335 HydrophobicContact CD2-CG 4.5Å; Y318-F335 HydrophobicContact CG-CB 3.82Å; Y318-F335 HydrophobicContact CG-CD2 4.49Å; H331-F335 WeakPolarHBondContact O-CB 3.47Å; H331-F335 PolarHBondContact O-N 3.28Å; L332-F335 WeakPolarHBondContact O-CB 3.48Å; L332-F335 PolarHBondContact O-N 3.11Å; E333-F335 VanDerWaalsContact C-N 3.33Å; E333-F335 PolarHBondContact O-N 3.08Å; F335-A337 PolarHBondContact O-N 2.77Å; F335-K338 PolarHBondContact O-N 2.71Å; F335-F339 WeakPolarHBondContact O-CB 3.42Å; F335-F339 PolarHBondContact O-N 2.94Å
336V96.6Very high94.6Very high1 Ų150.1 Ų50.11%0.00626%0.263CS..Hα-helixtrans-61-47.1178.8175.20000111.3I262 L271 V274 L278 L295 L332 E333 K338 F339 M340I262-V336 HydrophobicContact CD1-CG1 3.85Å; I262-V336 HydrophobicContact CD1-CG2 3.87Å; I262-V336 HydrophobicContact CG1-CG1 3.88Å; I262-V336 HydrophobicContact CG2-CG1 4.18Å; L271-V336 HydrophobicContact CD1-CB 4.15Å; L271-V336 HydrophobicContact CD1-CG1 3.65Å; V274-V336 HydrophobicContact CG1-CG1 3.96Å; V274-V336 HydrophobicContact CG1-CG2 4.31Å; L278-V336 HydrophobicContact CD1-CG2 4.24Å; L295-V336 HydrophobicContact CD2-CG2 3.93Å; L332-V336 WeakPolarHBondContact O-CG2 3.31Å; L332-V336 PolarHBondContact O-N 2.8Å; E333-V336 PolarHBondContact O-N 3.17Å; V336-K338 VanDerWaalsContact C-N 3.31Å; V336-K338 PolarHBondContact O-N 2.79Å; V336-F339 PolarHBondContact O-N 2.82Å; V336-M340 HydrophobicContact CG1-CE 3.83Å; V336-M340 HydrophobicContact CG1-CG 4.3Å; V336-M340 HydrophobicContact CG1-SD 4.11Å; V336-M340 WeakPolarHBondContact O-CG 3.25Å; V336-M340 PolarHBondContact O-N 2.84Å
337A96.6Very high94.5Very high36 Ų3647.8 Ų47.830%0.29824%0.239SC..Hα-helixtrans-60.4-4217900000111.8L271 E333 F335 M340 A341L271-A337 HydrophobicContact CD1-CB 4.24Å; L271-A337 HydrophobicContact CD2-CB 3.82Å; E333-A337 WeakPolarHBondContact O-CB 3.27Å; E333-A337 PolarHBondContact O-N 2.89Å; F335-A337 PolarHBondContact O-N 2.77Å; A337-M340 PolarHBondContact O-N 2.96Å; A337-A341 PolarHBondContact O-N 3.34Å
338K96.1Very high94.2Very high111 Ų11147.2 Ų47.248%0.48324%0.238SC..Hα-helixtrans-67.6-40.8177.1-171.571.1-179.3-174.70111.6M314 Y318 A334 F335 V336 A341 L342M314-K338 HydrophobicContact CE-CB 3.74Å; M314-K338 HydrophobicContact CE-CG 3.3Å; M314-K338 HydrophobicContact SD-CG 4.01Å; Y318-K338 HydrophobicContact CE2-CB 4.09Å; Y318-K338 HydrophobicContact CE2-CG 4.2Å; Y318-K338 WeakPolarHBondContact OH-CB 3.31Å; A334-K338 VanDerWaalsContact O-CB 3.3Å; A334-K338 WeakPolarHBondContact O-CB 3.33Å; A334-K338 PolarHBondContact O-N 2.84Å; F335-K338 PolarHBondContact O-N 2.71Å; V336-K338 VanDerWaalsContact C-N 3.31Å; V336-K338 PolarHBondContact O-N 2.79Å; K338-A341 PolarHBondContact O-N 3.23Å; K338-L342 WeakPolarHBondContact O-CB 3.28Å; K338-L342 PolarHBondContact O-N 3.38Å; K338-L342 VanDerWaalsContact O-N 3.07Å
339F95.8Very high93.7Very high1 Ų150.4 Ų50.40%0.00425%0.252CS..Hα-helixtrans-60.9-49174.2173.5-92.6000111.2I262 L299 V311 M314 F335 V336 A341 L342 Y343I262-F339 HydrophobicContact CG2-CD1 3.49Å; I262-F339 VanDerWaalsContact CG2-CD1 3.49Å; I262-F339 HydrophobicContact CG2-CE1 3.66Å; L299-F339 HydrophobicContact CB-CE2 4.18Å; L299-F339 HydrophobicContact CB-CZ 4.19Å; L299-F339 HydrophobicContact CD1-CD1 4.11Å; L299-F339 HydrophobicContact CD1-CD2 4.06Å; L299-F339 HydrophobicContact CD1-CE1 4.17Å; L299-F339 HydrophobicContact CD1-CE2 4.12Å; L299-F339 HydrophobicContact CD1-CG 4.06Å; L299-F339 HydrophobicContact CD1-CZ 4.18Å; L299-F339 HydrophobicContact CD2-CD1 4.34Å; L299-F339 HydrophobicContact CD2-CE1 3.7Å; L299-F339 HydrophobicContact CD2-CE2 4.48Å; L299-F339 HydrophobicContact CD2-CZ 3.78Å; L299-F339 HydrophobicContact CG-CE1 4.44Å; L299-F339 HydrophobicContact CG-CE2 4.49Å; L299-F339 HydrophobicContact CG-CZ 4.25Å; V311-F339 HydrophobicContact CG1-CD2 3.92Å; V311-F339 HydrophobicContact CG1-CE2 4.03Å; V311-F339 HydrophobicContact CG2-CD2 3.89Å; V311-F339 HydrophobicContact CG2-CE2 3.85Å; M314-F339 HydrophobicContact CE-CB 4.46Å; F335-F339 WeakPolarHBondContact O-CB 3.42Å; F335-F339 PolarHBondContact O-N 2.94Å; V336-F339 PolarHBondContact O-N 2.82Å; F339-A341 VanDerWaalsContact C-N 3.32Å; F339-A341 PolarHBondContact O-N 3.32Å; F339-L342 PolarHBondContact O-N 3Å; F339-Y343 HydrophobicContact CE1-CD2 4.39Å; F339-Y343 HydrophobicContact CE1-CG 4.17Å; F339-Y343 HydrophobicContact CE2-CD2 4.35Å; F339-Y343 AromaticContact CZ-CD2 3.76Å; F339-Y343 HydrophobicContact CZ-CD2 3.76Å; F339-Y343 HydrophobicContact CZ-CE2 4.48Å; F339-Y343 AromaticContact CZ-CG 3.99Å; F339-Y343 HydrophobicContact CZ-CG 3.99Å; F339-Y343 VanDerWaalsContact O-CB 3.24Å; F339-Y343 WeakPolarHBondContact O-CB 3.38Å; F339-Y343 PolarHBondContact O-N 3.03Å
340M95.2Very high92.6Very high11 Ų1151.7 Ų51.75%0.05427%0.268CS..Hα-helixtrans-58.2-43.2178.6-74.5-179.916900112.1I262 Q266 R270 L271 V274 V336 A337 K344I262-M340 HydrophobicContact CB-CE 4.15Å; I262-M340 HydrophobicContact CG1-CE 4.06Å; I262-M340 HydrophobicContact CG2-CE 3.92Å; I262-M340 HydrophobicContact CG2-CG 3.98Å; Q266-M340 HydrophobicContact CB-CB 4.31Å; Q266-M340 HydrophobicContact CG-CB 4.13Å; Q266-M340 HydrophobicContact CG-CG 4.31Å; R270-M340 HydrophobicContact CG-CE 4.12Å; L271-M340 HydrophobicContact CB-SD 4.07Å; L271-M340 HydrophobicContact CD1-SD 4.03Å; V274-M340 HydrophobicContact CG2-CE 4.19Å; V336-M340 HydrophobicContact CG1-CE 3.83Å; V336-M340 HydrophobicContact CG1-CG 4.3Å; V336-M340 HydrophobicContact CG1-SD 4.11Å; V336-M340 WeakPolarHBondContact O-CG 3.25Å; V336-M340 PolarHBondContact O-N 2.84Å; A337-M340 PolarHBondContact O-N 2.96Å; M340-K344 WeakPolarHBondContact O-CB 3.4Å; M340-K344 PolarHBondContact O-N 2.85Å
341A94.6Very high91.1Very high64 Ų6451.4 Ų51.453%0.52927%0.274SS..Hα-helixtrans-64.3-42.3178.100000112.3A337 K338 F339 K345A337-A341 PolarHBondContact O-N 3.34Å; K338-A341 PolarHBondContact O-N 3.23Å; F339-A341 VanDerWaalsContact C-N 3.32Å; F339-A341 PolarHBondContact O-N 3.32Å; A341-K345 WeakPolarHBondContact O-CB 3.42Å; A341-K345 PolarHBondContact O-N 3.47Å
342L93.1Very high89.3Confident38 Ų3855.9 Ų55.920%0.19930%0.295CS..Hα-helixtrans-69.8-47.9179.2-175.767.6000111.7L307 E310 M314 K338 F339 K344 K345 F346L307-L342 HydrophobicContact CD1-CD2 3.59Å; L307-L342 HydrophobicContact CD1-CG 3.79Å; E310-L342 HydrophobicContact CB-CD2 4.16Å; M314-L342 HydrophobicContact SD-CD2 3.71Å; K338-L342 WeakPolarHBondContact O-CB 3.28Å; K338-L342 PolarHBondContact O-N 3.38Å; K338-L342 VanDerWaalsContact O-N 3.07Å; F339-L342 PolarHBondContact O-N 3Å; L342-K344 PolarHBondContact O-N 3.12Å; L342-K345 PolarHBondContact O-N 2.95Å; L342-F346 WeakPolarHBondContact O-CB 3.44Å; L342-F346 PolarHBondContact O-N 3.17Å
343Y92.7Very high87.4Confident30 Ų3058.6 Ų58.612%0.11832%0.324CS..Hα-helixtrans-62.8-42.1-179.2-171.5-97.2000111.5V263 Q266 L307 F339 F346 M347V263-Y343 HydrophobicContact CG1-CE1 4.25Å; Q266-Y343 HydrophobicContact CG-CD1 4.37Å; L307-Y343 HydrophobicContact CD2-CD2 3.72Å; L307-Y343 HydrophobicContact CD2-CE2 4.35Å; F339-Y343 HydrophobicContact CE1-CD2 4.39Å; F339-Y343 HydrophobicContact CE1-CG 4.17Å; F339-Y343 HydrophobicContact CE2-CD2 4.35Å; F339-Y343 AromaticContact CZ-CD2 3.76Å; F339-Y343 HydrophobicContact CZ-CD2 3.76Å; F339-Y343 HydrophobicContact CZ-CE2 4.48Å; F339-Y343 AromaticContact CZ-CG 3.99Å; F339-Y343 HydrophobicContact CZ-CG 3.99Å; F339-Y343 VanDerWaalsContact O-CB 3.24Å; F339-Y343 WeakPolarHBondContact O-CB 3.38Å; F339-Y343 PolarHBondContact O-N 3.03Å; Y343-F346 PolarHBondContact O-N 2.91Å; Y343-M347 HydrophobicContact CD1-CE 4.34Å; Y343-M347 HydrophobicContact CD1-CG 4.28Å; Y343-M347 HydrophobicContact CD1-SD 4.05Å; Y343-M347 HydrophobicContact CE1-CE 4.09Å; Y343-M347 HydrophobicContact CE1-CG 3.95Å; Y343-M347 HydrophobicContact CE1-SD 3.35Å; Y343-M347 WeakPolarHBondContact CE1-SD 3.47Å; Y343-M347 WeakPolarHBondContact O-CG 3.18Å; Y343-M347 PolarHBondContact O-N 3.49Å
344K92.8Very high85.2Confident84 Ų8464.7 Ų64.737%0.36535%0.354SS..Hα-helixtrans-60.8-49.6175.3-177.9172.9175.3172.80111.8Q266 M340 L342 F346 M347 E348Q266-K344 HydrophobicContact CB-CB 3.86Å; Q266-K344 HydrophobicContact CB-CD 4.02Å; Q266-K344 HydrophobicContact CB-CG 4.3Å; Q266-K344 HydrophobicContact CG-CB 4.05Å; M340-K344 WeakPolarHBondContact O-CB 3.4Å; M340-K344 PolarHBondContact O-N 2.85Å; L342-K344 PolarHBondContact O-N 3.12Å; K344-F346 VanDerWaalsContact C-N 3.29Å; K344-F346 PolarHBondContact O-N 3.15Å; K344-M347 PolarHBondContact O-N 3.15Å; K344-E348 WeakPolarHBondContact CE-OE1 3.22Å; K344-E348 HydrophobicContact CG-CG 4.45Å; K344-E348 IonicContact NZ-OE1 2.69Å; K344-E348 WeakPolarHBondContact O-CG 3.27Å; K344-E348 PolarHBondContact O-N 2.95Å
345K91.6Very high83Confident125 Ų12569.3 Ų69.354%0.54337%0.373SS..Hα-helixtrans-58.5-43.9178.3-175.4177.9179.1-176.40111.4A341 L342 M347 E348 D349A341-K345 WeakPolarHBondContact O-CB 3.42Å; A341-K345 PolarHBondContact O-N 3.47Å; L342-K345 PolarHBondContact O-N 2.95Å; K345-M347 PolarHBondContact O-N 2.94Å; K345-E348 PolarHBondContact O-N 2.82Å; K345-D349 WeakPolarHBondContact CE-OD2 3.35Å; K345-D349 WeakPolarHBondContact O-CB 3.43Å; K345-D349 PolarHBondContact O-N 2.77Å
346F89.2Confident80.4Confident59 Ų5980.9 Ų80.926%0.25942%0.424SS..Hα-helixtrans-62.2-42177.9179.8-99.9000112.9D304 Q306 L307 L342 Y343 K344 G350D304-F346 HydrophobicContact CB-CE1 3.95Å; D304-F346 HydrophobicContact CB-CZ 3.91Å; Q306-F346 HydrophobicContact CG-CE2 3.85Å; Q306-F346 HydrophobicContact CG-CZ 3.98Å; Q306-F346 VanDerWaalsContact NE2-CE2 3.31Å; Q306-F346 VanDerWaalsContact NE2-CZ 3.3Å; L307-F346 HydrophobicContact CD2-CB 4.46Å; L307-F346 HydrophobicContact CD2-CD1 4.11Å; L307-F346 HydrophobicContact CD2-CG 4.27Å; L342-F346 WeakPolarHBondContact O-CB 3.44Å; L342-F346 PolarHBondContact O-N 3.17Å; Y343-F346 PolarHBondContact O-N 2.91Å; K344-F346 VanDerWaalsContact C-N 3.29Å; K344-F346 PolarHBondContact O-N 3.15Å; F346-G350 PolarHBondContact O-N 2.85Å
347M86.7Confident79.5Confident72 Ų7284.9 Ų84.936%0.35544%0.444SS..Hα-helixtrans-66.5-41.4175.6-69.6-163.7-41.100112.2Y343 K344 K345 G350 L351Y343-M347 HydrophobicContact CD1-CE 4.34Å; Y343-M347 HydrophobicContact CD1-CG 4.28Å; Y343-M347 HydrophobicContact CD1-SD 4.05Å; Y343-M347 HydrophobicContact CE1-CE 4.09Å; Y343-M347 HydrophobicContact CE1-CG 3.95Å; Y343-M347 HydrophobicContact CE1-SD 3.35Å; Y343-M347 WeakPolarHBondContact CE1-SD 3.47Å; Y343-M347 WeakPolarHBondContact O-CG 3.18Å; Y343-M347 PolarHBondContact O-N 3.49Å; K344-M347 PolarHBondContact O-N 3.15Å; K345-M347 PolarHBondContact O-N 2.94Å; M347-G350 PolarHBondContact O-N 3.01Å; M347-L351 WeakPolarHBondContact O-CB 3.18Å; M347-L351 WeakPolarHBondContact O-CD1 3.47Å; M347-L351 PolarHBondContact O-N 3.41Å
348E87.8Confident78.6Confident98 Ų9887.5 Ų87.546%0.45845%0.452SS..Hα-helixtrans-63.6-49.4178.1-72.5173.9166.400111.2K344 K345 G350 L351 E352K344-E348 WeakPolarHBondContact CE-OE1 3.22Å; K344-E348 HydrophobicContact CG-CG 4.45Å; K344-E348 IonicContact NZ-OE1 2.69Å; K344-E348 WeakPolarHBondContact O-CG 3.27Å; K344-E348 PolarHBondContact O-N 2.95Å; K345-E348 PolarHBondContact O-N 2.82Å; E348-G350 VanDerWaalsContact C-N 3.29Å; E348-G350 PolarHBondContact O-N 2.91Å; E348-L351 PolarHBondContact O-N 2.93Å; E348-E352 PolarHBondContact O-N 2.88Å
349D83.2Confident77.7Confident88 Ų8886.2 Ų86.247%0.47145%0.45SS..Hα-helixtrans-61.8-36.4177.6-66.7-10.4000111.6K345 G353K345-D349 WeakPolarHBondContact CE-OD2 3.35Å; K345-D349 WeakPolarHBondContact O-CB 3.43Å; K345-D349 PolarHBondContact O-N 2.77Å; D349-G353 PolarHBondContact O-N 3.07Å; D349-G353 VanDerWaalsContact O-N 3.14Å
350G74.1Confident76.6Confident38 Ų3891.2 Ų91.239%0.39248%0.477SS..Hα-helixtrans-70.4-33.9176.400000114F346 M347 E348 M354F346-G350 PolarHBondContact O-N 2.85Å; M347-G350 PolarHBondContact O-N 3.01Å; E348-G350 VanDerWaalsContact C-N 3.29Å; E348-G350 PolarHBondContact O-N 2.91Å; G350-M354 PolarHBondContact O-N 3.44Å
351L63Low75.4Confident113 Ų11396.2 Ų96.259%0.59250%0.503SS*.Hα-helixtrans-70.2-40.4174-98.8136.8000111.5M347 E348 G353 M354 I355M347-L351 WeakPolarHBondContact O-CB 3.18Å; M347-L351 WeakPolarHBondContact O-CD1 3.47Å; M347-L351 PolarHBondContact O-N 3.41Å; E348-L351 PolarHBondContact O-N 2.93Å; L351-G353 VanDerWaalsContact C-N 3.31Å; L351-G353 PolarHBondContact O-N 3.4Å; L351-M354 PolarHBondContact O-N 3Å; L351-I355 WeakPolarHBondContact O-CD1 3.49Å; L351-I355 VanDerWaalsContact O-CG1 3.3Å; L351-I355 WeakPolarHBondContact O-CG1 3.45Å; L351-I355 PolarHBondContact O-N 3.48Å
352E59.5Low74.2Confident127 Ų12798.3 Ų98.359%0.59350%0.501SS*.Hα-helixtrans-63.1-37.9174.4-72-173.2171.300111.8E348 M354 I355 F356E348-E352 PolarHBondContact O-N 2.88Å; E352-M354 VanDerWaalsContact C-N 3.31Å; E352-M354 PolarHBondContact O-N 2.79Å; E352-I355 PolarHBondContact O-N 3.05Å; E352-F356 WeakPolarHBondContact O-CD2 3.41Å
353G56.1Low72.8Confident58 Ų58102.6 Ų102.660%0.59852%0.523SS*.Hα-helixtrans-69.6-17.4176.800000115.9D349 L351D349-G353 PolarHBondContact O-N 3.07Å; D349-G353 VanDerWaalsContact O-N 3.14Å; L351-G353 VanDerWaalsContact C-N 3.31Å; L351-G353 PolarHBondContact O-N 3.4Å
354M51.6Low71.3Confident172 Ų172108.2 Ų108.285%0.84755%0.554SS**Hα-helixtrans-93.3-12.1175.9-74.1-171.1177.300113.7G350 L351 E352G350-M354 PolarHBondContact O-N 3.44Å; L351-M354 PolarHBondContact O-N 3Å; E352-M354 VanDerWaalsContact C-N 3.31Å; E352-M354 PolarHBondContact O-N 2.79Å
355I50Low69.5Low129 Ų129110.3 Ų110.366%0.66257%0.57SS**  trans-91.5-3.6-177.5-66.1165.5000111.9L351 E352L351-I355 WeakPolarHBondContact O-CD1 3.49Å; L351-I355 VanDerWaalsContact O-CG1 3.3Å; L351-I355 WeakPolarHBondContact O-CG1 3.45Å; L351-I355 PolarHBondContact O-N 3.48Å; E352-I355 PolarHBondContact O-N 3.05Å
356F41.2Very low67.5Low244 Ų244108.9 Ų108.9100%1.0757%0.572SS**  trans-109.60176.4-74.5-73.9000113.9E352E352-F356 WeakPolarHBondContact O-CD2 3.41Å

Retrieved 356 of 356 residues in 269.2 ms (Link to these results)

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