A0A3Q0KPZ2_SCHMA Loading...

Putative centrosomal protein of 135 kDa (Cep135 protein) (Centrosomal protein 4)

AlphaFold DB , UniProt , Accession A0A3Q0KPZ2, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 625 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
1M55.1Low81Confident182 Ų18290.5 Ų90.590%0.89744%0.437SS*.  0-59.20-76.6-127.8-102.800114.1D4 K5M1-D4 VanDerWaalsContact CA-OD2 3.24Å; M1-D4 WeakPolarHBondContact CA-OD2 3.45Å; M1-D4 PolarHBondContact N-OD2 2.96Å; M1-K5 PolarHBondContact O-N 3.4Å
2L65Low82Confident129 Ų12996.1 Ų96.168%0.67545%0.45SS*.Hα-helixtrans-65-50.2176.5-97.4145.3000111.7D4 K5 E6L2-D4 VanDerWaalsContact C-N 3.33Å; L2-D4 PolarHBondContact O-N 2.97Å; L2-K5 PolarHBondContact O-N 3.3Å; L2-K5 VanDerWaalsContact O-N 3.09Å; L2-E6 PolarHBondContact O-N 3.43Å; L2-E6 VanDerWaalsContact O-N 3.14Å
3Y72.5Confident82.9Confident82 Ų8295.4 Ų95.432%0.32245%0.451SS..Hα-helixtrans-55.1-43.8175.3-68.6-79000113.1K5 E6 I7 W265 I269 N272Y3-K5 VanDerWaalsContact C-N 3.27Å; Y3-K5 PolarHBondContact O-N 3.21Å; Y3-E6 PolarHBondContact O-N 2.87Å; Y3-E6 VanDerWaalsContact O-N 3.09Å; Y3-I7 WeakPolarHBondContact O-CG2 3.45Å; Y3-I7 PolarHBondContact O-N 2.89Å; Y3-W265 AromaticContact CD1-CE3 3.87Å; Y3-W265 HydrophobicContact CD1-CE3 3.87Å; Y3-W265 AromaticContact CD1-CZ3 3.63Å; Y3-W265 HydrophobicContact CD1-CZ3 3.63Å; Y3-W265 HydrophobicContact CE1-CZ3 4.14Å; Y3-I269 HydrophobicContact CD1-CG1 3.86Å; Y3-I269 HydrophobicContact CD2-CG1 4.48Å; Y3-I269 HydrophobicContact CE1-CG1 4.35Å; Y3-I269 HydrophobicContact CG-CD1 4.37Å; Y3-I269 HydrophobicContact CG-CG1 3.95Å; Y3-N272 PolarHBondContact OH-ND2 3.27Å
4D78.3Confident83.6Confident94 Ų9490.7 Ų90.750%0.50343%0.429SS..Hα-helixtrans-61.3-35.2179-52.6-52.6000112.7M1 L2 I7 S8M1-D4 VanDerWaalsContact CA-OD2 3.24Å; M1-D4 WeakPolarHBondContact CA-OD2 3.45Å; M1-D4 PolarHBondContact N-OD2 2.96Å; L2-D4 VanDerWaalsContact C-N 3.33Å; L2-D4 PolarHBondContact O-N 2.97Å; D4-I7 VanDerWaalsContact O-CG2 3.31Å; D4-I7 WeakPolarHBondContact O-CG2 3.47Å; D4-S8 WeakPolarHBondContact O-CB 3.39Å; D4-S8 PolarHBondContact O-N 3Å; D4-S8 PolarHBondContact O-OG 2.92Å
5K85Confident84.2Confident145 Ų14589.9 Ų89.963%0.6343%0.425SS*.Hα-helixtrans-73.1-33.1176.5-72-179.4-179-179.20112M1 L2 Y3 R9M1-K5 PolarHBondContact O-N 3.4Å; L2-K5 PolarHBondContact O-N 3.3Å; L2-K5 VanDerWaalsContact O-N 3.09Å; Y3-K5 VanDerWaalsContact C-N 3.27Å; Y3-K5 PolarHBondContact O-N 3.21Å; K5-R9 WeakPolarHBondContact O-CB 3.48Å; K5-R9 PolarHBondContact O-N 2.89Å
6E86.1Confident84.8Confident61 Ų6193.5 Ų93.529%0.28544%0.438SS..Hα-helixtrans-77-48.9-179.8-70.1175.917400111.9L2 Y3 S8 R9 D10 W265L2-E6 PolarHBondContact O-N 3.43Å; L2-E6 VanDerWaalsContact O-N 3.14Å; Y3-E6 PolarHBondContact O-N 2.87Å; Y3-E6 VanDerWaalsContact O-N 3.09Å; E6-S8 PolarHBondContact O-N 3.16Å; E6-R9 WeakPolarHBondContact O-CA 3.24Å; E6-R9 VanDerWaalsContact O-CB 3.26Å; E6-R9 WeakPolarHBondContact O-CB 3.47Å; E6-R9 PolarHBondContact O-N 3.46Å; E6-D10 PolarHBondContact O-N 3.42Å; E6-W265 HydrophobicContact CB-CH2 3.41Å; E6-W265 VanDerWaalsContact CB-CH2 3.41Å; E6-W265 HydrophobicContact CB-CZ2 3.69Å; E6-W265 HydrophobicContact CB-CZ3 4.14Å; E6-W265 HydrophobicContact CG-CH2 4.33Å; E6-W265 VanDerWaalsContact OE2-CH2 3.27Å; E6-W265 WeakPolarHBondContact OE2-CH2 3.38Å
7I88.1Confident85.3Confident35 Ų3594.1 Ų94.118%0.17944%0.444CS..Hα-helixtrans-56.6-41.6172.7-168173.9000111.1Y3 D4 R9 D10 I11 Q262 W265Y3-I7 WeakPolarHBondContact O-CG2 3.45Å; Y3-I7 PolarHBondContact O-N 2.89Å; D4-I7 VanDerWaalsContact O-CG2 3.31Å; D4-I7 WeakPolarHBondContact O-CG2 3.47Å; I7-R9 PolarHBondContact O-N 3.39Å; I7-D10 PolarHBondContact O-N 2.88Å; I7-I11 HydrophobicContact CD1-CD1 4.44Å; I7-I11 HydrophobicContact CG1-CD1 3.83Å; I7-I11 HydrophobicContact CG1-CG1 4.39Å; I7-I11 WeakPolarHBondContact O-CB 3.3Å; I7-I11 VanDerWaalsContact O-CG1 3.25Å; I7-I11 WeakPolarHBondContact O-CG1 3.46Å; I7-I11 PolarHBondContact O-N 3.03Å; I7-Q262 HydrophobicContact CD1-CG 4.41Å; I7-W265 HydrophobicContact CB-CB 4.49Å; I7-W265 HydrophobicContact CB-CD2 4.18Å; I7-W265 HydrophobicContact CB-CG 3.94Å; I7-W265 HydrophobicContact CD1-CB 3.78Å; I7-W265 HydrophobicContact CD1-CG 4.03Å; I7-W265 HydrophobicContact CG1-CB 4.18Å; I7-W265 HydrophobicContact CG1-CG 3.85Å
8S88.4Confident85.7Confident58 Ų5889.4 Ų89.441%0.40642%0.422SS..Hα-helixtrans-65.7-26.4176.1-64.30000113.1D4 E6 R12D4-S8 WeakPolarHBondContact O-CB 3.39Å; D4-S8 PolarHBondContact O-N 3Å; D4-S8 PolarHBondContact O-OG 2.92Å; E6-S8 PolarHBondContact O-N 3.16Å; S8-R12 WeakPolarHBondContact O-CB 3.39Å; S8-R12 VanDerWaalsContact O-CG 3.23Å; S8-R12 WeakPolarHBondContact O-CG 3.33Å; S8-R12 PolarHBondContact O-N 2.9Å; S8-R12 PolarHBondContact O-NE 3.27Å
9R90.7Very high86.1Confident128 Ų12892.6 Ų92.648%0.48344%0.435SS..Hα-helixtrans-76.1-46.2175.6-166.5-170.6-42.7175.212.2110.5K5 E6 I7 R12 N13K5-R9 WeakPolarHBondContact O-CB 3.48Å; K5-R9 PolarHBondContact O-N 2.89Å; E6-R9 WeakPolarHBondContact O-CA 3.24Å; E6-R9 VanDerWaalsContact O-CB 3.26Å; E6-R9 WeakPolarHBondContact O-CB 3.47Å; E6-R9 PolarHBondContact O-N 3.46Å; I7-R9 PolarHBondContact O-N 3.39Å; R9-R12 PolarHBondContact O-N 3.34Å; R9-N13 WeakPolarHBondContact O-CB 3.49Å; R9-N13 VanDerWaalsContact O-CG 3.32Å; R9-N13 PolarHBondContact O-N 2.89Å
10D90.4Very high86.6Confident57 Ų5793.5 Ų93.531%0.30544%0.439SS..Hα-helixtrans-61.6-45.8177.3-76.3-0.3000111.5E6 I7 R12 N13 F14 I261 W265E6-D10 PolarHBondContact O-N 3.42Å; I7-D10 PolarHBondContact O-N 2.88Å; D10-R12 VanDerWaalsContact C-N 3.33Å; D10-R12 PolarHBondContact O-N 2.99Å; D10-N13 PolarHBondContact O-N 3.32Å; D10-F14 VanDerWaalsContact O-CB 3.27Å; D10-F14 WeakPolarHBondContact O-CB 3.28Å; D10-F14 PolarHBondContact O-N 2.95Å; D10-I261 HydrophobicContact CB-CG2 4.19Å; D10-W265 WeakPolarHBondContact OD2-CZ2 3.23Å; D10-W265 PolarHBondContact OD2-NE1 2.99Å
11I91.7Very high87Confident24 Ų2496 Ų9612%0.12344%0.444CS..Hα-helixtrans-59.5-44175.4-69.8168.5000110.7I7 F14 Q15 Y258 I261I7-I11 HydrophobicContact CD1-CD1 4.44Å; I7-I11 HydrophobicContact CG1-CD1 3.83Å; I7-I11 HydrophobicContact CG1-CG1 4.39Å; I7-I11 WeakPolarHBondContact O-CB 3.3Å; I7-I11 VanDerWaalsContact O-CG1 3.25Å; I7-I11 WeakPolarHBondContact O-CG1 3.46Å; I7-I11 PolarHBondContact O-N 3.03Å; I11-F14 PolarHBondContact O-N 3.14Å; I11-Q15 HydrophobicContact CG2-CG 4.36Å; I11-Q15 WeakPolarHBondContact O-CB 3.25Å; I11-Q15 VanDerWaalsContact O-CG 3.23Å; I11-Q15 WeakPolarHBondContact O-CG 3.42Å; I11-Q15 PolarHBondContact O-N 2.85Å; I11-Y258 HydrophobicContact CD1-CE2 3.88Å; I11-Y258 HydrophobicContact CG1-CD2 4.35Å; I11-Y258 HydrophobicContact CG1-CE2 4.17Å; I11-Y258 HydrophobicContact CG2-CD2 4.25Å; I11-Y258 HydrophobicContact CG2-CE2 3.99Å; I11-I261 HydrophobicContact CG1-CG2 4.23Å
12R92.5Very high88.9Confident158 Ų15892.9 Ų92.960%0.59642%0.422SS*.Hα-helixtrans-65.3-43.4178.2-80.5-176.6-66.3169.4-0.2112.6S8 R9 D10 F14 Q15 K16S8-R12 WeakPolarHBondContact O-CB 3.39Å; S8-R12 VanDerWaalsContact O-CG 3.23Å; S8-R12 WeakPolarHBondContact O-CG 3.33Å; S8-R12 PolarHBondContact O-N 2.9Å; S8-R12 PolarHBondContact O-NE 3.27Å; R9-R12 PolarHBondContact O-N 3.34Å; D10-R12 VanDerWaalsContact C-N 3.33Å; D10-R12 PolarHBondContact O-N 2.99Å; R12-F14 VanDerWaalsContact C-N 3.34Å; R12-Q15 PolarHBondContact O-N 3.32Å; R12-K16 PolarHBondContact O-N 3.24Å
13N93.5Very high90.4Very high87 Ų8793.3 Ų93.347%0.46542%0.421SS..Hα-helixtrans-61.1-46.1176.3-73.6-17.2000110.6R9 D10 K16 I17R9-N13 WeakPolarHBondContact O-CB 3.49Å; R9-N13 VanDerWaalsContact O-CG 3.32Å; R9-N13 PolarHBondContact O-N 2.89Å; D10-N13 PolarHBondContact O-N 3.32Å; N13-K16 WeakPolarHBondContact O-CB 3.26Å; N13-K16 PolarHBondContact O-N 3.23Å; N13-I17 WeakPolarHBondContact O-CG1 3.36Å; N13-I17 PolarHBondContact O-N 3.34Å; N13-I17 VanDerWaalsContact O-N 3.07Å
14F93.2Very high91.5Very high30 Ų3093.2 Ų93.213%0.13243%0.426CS..Hα-helixtrans-60.5-45.7175.9174.6-110.7000112.7D10 I11 R12 K16 I17 C18 Q254 T257 I261D10-F14 VanDerWaalsContact O-CB 3.27Å; D10-F14 WeakPolarHBondContact O-CB 3.28Å; D10-F14 PolarHBondContact O-N 2.95Å; I11-F14 PolarHBondContact O-N 3.14Å; R12-F14 VanDerWaalsContact C-N 3.34Å; F14-K16 VanDerWaalsContact C-N 3.31Å; F14-K16 PolarHBondContact O-N 2.85Å; F14-I17 PolarHBondContact O-N 3.1Å; F14-C18 VanDerWaalsContact CE2-SG 3.52Å; F14-C18 WeakPolarHBondContact CZ-SG 3.28Å; F14-C18 PolarHBondContact O-N 3.21Å; F14-C18 PolarHBondContact O-SG 3.46Å; F14-Q254 HydrophobicContact CE1-CG 4.03Å; F14-Q254 WeakPolarHBondContact CE1-O 3.18Å; F14-Q254 HydrophobicContact CZ-CG 4.32Å; F14-T257 HydrophobicContact CD2-CG2 3.82Å; F14-T257 HydrophobicContact CE1-CG2 4.4Å; F14-T257 HydrophobicContact CE2-CG2 3.31Å; F14-T257 VanDerWaalsContact CZ-CB 3.41Å; F14-T257 HydrophobicContact CZ-CG2 3.64Å; F14-I261 HydrophobicContact CB-CD1 3.82Å; F14-I261 HydrophobicContact CD1-CD1 4.14Å; F14-I261 HydrophobicContact CD2-CD1 4.26Å; F14-I261 HydrophobicContact CG-CD1 3.8Å
15Q92.5Very high92.3Very high79 Ų7990 Ų9037%0.36941%0.408SS..Hα-helixtrans-61.4-38.4176-76.3175.7-3.400112.3I11 R12 C18 K19I11-Q15 HydrophobicContact CG2-CG 4.36Å; I11-Q15 WeakPolarHBondContact O-CB 3.25Å; I11-Q15 VanDerWaalsContact O-CG 3.23Å; I11-Q15 WeakPolarHBondContact O-CG 3.42Å; I11-Q15 PolarHBondContact O-N 2.85Å; R12-Q15 PolarHBondContact O-N 3.32Å; Q15-C18 PolarHBondContact O-N 3.26Å; Q15-K19 WeakPolarHBondContact O-CG 3.47Å; Q15-K19 PolarHBondContact O-N 3.36Å
16K94Very high92.8Very high147 Ų14785.6 Ų85.664%0.63939%0.392SS*.Hα-helixtrans-61.7-48.1175.7-172.7-176.4177.2-1730111R12 N13 F14 C18 K19 E20R12-K16 PolarHBondContact O-N 3.24Å; N13-K16 WeakPolarHBondContact O-CB 3.26Å; N13-K16 PolarHBondContact O-N 3.23Å; F14-K16 VanDerWaalsContact C-N 3.31Å; F14-K16 PolarHBondContact O-N 2.85Å; K16-C18 VanDerWaalsContact C-N 3.33Å; K16-C18 PolarHBondContact O-N 3.03Å; K16-K19 PolarHBondContact O-N 2.83Å; K16-E20 PolarHBondContact O-N 2.92Å
17I93.4Very high93.3Very high104 Ų10487 Ų8753%0.53340%0.398SS..Hα-helixtrans-60.5-42.6177.1-65.8166.1000110.9N13 F14 K19 E20 R21N13-I17 WeakPolarHBondContact O-CG1 3.36Å; N13-I17 PolarHBondContact O-N 3.34Å; N13-I17 VanDerWaalsContact O-N 3.07Å; F14-I17 PolarHBondContact O-N 3.1Å; I17-K19 PolarHBondContact O-N 3.36Å; I17-E20 PolarHBondContact O-N 3.4Å; I17-R21 WeakPolarHBondContact O-CB 3.45Å; I17-R21 PolarHBondContact O-N 3Å
18C93Very high93.7Very high9 Ų991.2 Ų91.26%0.06142%0.417CS..Hα-helixtrans-62.9-41.4177.3-69.10000112.4F14 Q15 K16 R22 Q254F14-C18 VanDerWaalsContact CE2-SG 3.52Å; F14-C18 WeakPolarHBondContact CZ-SG 3.28Å; F14-C18 PolarHBondContact O-N 3.21Å; F14-C18 PolarHBondContact O-SG 3.46Å; Q15-C18 PolarHBondContact O-N 3.26Å; K16-C18 VanDerWaalsContact C-N 3.33Å; K16-C18 PolarHBondContact O-N 3.03Å; C18-R22 VanDerWaalsContact O-CB 3.31Å; C18-R22 WeakPolarHBondContact O-CB 3.32Å; C18-R22 PolarHBondContact O-N 3.39Å; C18-Q254 HydrophobicContact CB-CG 4.33Å
19K93.4Very high94.1Very high151 Ų15189.6 Ų89.666%0.65740%0.402SS*.Hα-helixtrans-63.5-46.4176.6-75.7177.5-179.7-177.70111.8Q15 K16 I17 R22 Q23Q15-K19 WeakPolarHBondContact O-CG 3.47Å; Q15-K19 PolarHBondContact O-N 3.36Å; K16-K19 PolarHBondContact O-N 2.83Å; I17-K19 PolarHBondContact O-N 3.36Å; K19-R22 WeakPolarHBondContact O-CB 3.3Å; K19-R22 PolarHBondContact O-N 3.43Å; K19-Q23 PolarHBondContact O-N 3.33Å
20E95.7Very high94.4Very high110 Ų11089.8 Ų89.851%0.51441%0.407SS..Hα-helixtrans-61.1-48.6177.1-176.5176.717900111.2K16 I17 R22 Q23 N24K16-E20 PolarHBondContact O-N 2.92Å; I17-E20 PolarHBondContact O-N 3.4Å; E20-R22 VanDerWaalsContact C-N 3.3Å; E20-R22 PolarHBondContact O-N 2.89Å; E20-Q23 PolarHBondContact O-N 2.89Å; E20-Q23 VanDerWaalsContact O-N 3.12Å; E20-N24 VanDerWaalsContact O-CG 3.3Å; E20-N24 PolarHBondContact O-N 3.44Å
21R94.2Very high94.7Very high145 Ų14590.8 Ų90.855%0.54741%0.412SS..Hα-helixtrans-59.9-40176.4-172.6168.3-176.9163.63.3112.4I17 L25 L250I17-R21 WeakPolarHBondContact O-CB 3.45Å; I17-R21 PolarHBondContact O-N 3Å; R21-L25 VanDerWaalsContact O-CB 3.29Å; R21-L25 WeakPolarHBondContact O-CB 3.49Å; R21-L25 PolarHBondContact O-N 2.88Å; R21-L250 HydrophobicContact CB-CD1 4.39Å; R21-L250 HydrophobicContact CG-CD1 3.97Å
22R95.6Very high94.9Very high118 Ų11893 Ų9345%0.44542%0.422SS..Hα-helixtrans-63.1-43.5175.2-174.3-179.9179.5116.3-1.4111.5C18 K19 E20 L26 L247 L250C18-R22 VanDerWaalsContact O-CB 3.31Å; C18-R22 WeakPolarHBondContact O-CB 3.32Å; C18-R22 PolarHBondContact O-N 3.39Å; K19-R22 WeakPolarHBondContact O-CB 3.3Å; K19-R22 PolarHBondContact O-N 3.43Å; E20-R22 VanDerWaalsContact C-N 3.3Å; E20-R22 PolarHBondContact O-N 2.89Å; R22-L26 HydrophobicContact CG-CD1 4.25Å; R22-L26 WeakPolarHBondContact O-CB 3.42Å; R22-L26 VanDerWaalsContact O-CG 3.3Å; R22-L26 WeakPolarHBondContact O-CG 3.39Å; R22-L26 PolarHBondContact O-N 2.82Å; R22-L247 HydrophobicContact CG-CD2 4.05Å; R22-L250 HydrophobicContact CB-CD2 3.65Å; R22-L250 HydrophobicContact CG-CD2 4.2Å
23Q95.6Very high95.1Very high137 Ų13788.3 Ų88.364%0.6441%0.407SS*.Hα-helixtrans-65.8-44.7179.3-176174.4-7.500111.5K19 E20 L25 L26 Q27K19-Q23 PolarHBondContact O-N 3.33Å; E20-Q23 PolarHBondContact O-N 2.89Å; E20-Q23 VanDerWaalsContact O-N 3.12Å; Q23-L25 VanDerWaalsContact C-N 3.35Å; Q23-L25 PolarHBondContact O-N 3.3Å; Q23-L26 PolarHBondContact O-N 2.67Å; Q23-Q27 WeakPolarHBondContact O-CB 3.41Å; Q23-Q27 PolarHBondContact O-N 3.05Å
24N96.4Very high95.3Very high80 Ų8090 Ų9043%0.42841%0.41SS..Hα-helixtrans-59.1-47.5176.1-67.5-12.2000110.9E20 L26 Q27 E28E20-N24 VanDerWaalsContact O-CG 3.3Å; E20-N24 PolarHBondContact O-N 3.44Å; N24-L26 PolarHBondContact O-N 3.47Å; N24-Q27 PolarHBondContact O-N 3.35Å; N24-Q27 VanDerWaalsContact O-N 3.12Å; N24-E28 WeakPolarHBondContact O-CG 3.35Å; N24-E28 PolarHBondContact O-N 3.22Å
25L95.1Very high95.5Very high26 Ų2693.3 Ų93.314%0.13643%0.429CS..Hα-helixtrans-60.7-43.4177.9-168.2136.3000112.4R21 Q23 Q27 E28 Y29 L247R21-L25 VanDerWaalsContact O-CB 3.29Å; R21-L25 WeakPolarHBondContact O-CB 3.49Å; R21-L25 PolarHBondContact O-N 2.88Å; Q23-L25 VanDerWaalsContact C-N 3.35Å; Q23-L25 PolarHBondContact O-N 3.3Å; L25-Q27 VanDerWaalsContact C-N 3.32Å; L25-Q27 PolarHBondContact O-N 3.34Å; L25-E28 PolarHBondContact O-N 2.8Å; L25-Y29 HydrophobicContact CD2-CD2 3.76Å; L25-Y29 HydrophobicContact CD2-CE2 3.6Å; L25-Y29 HydrophobicContact CG-CD2 4.15Å; L25-Y29 HydrophobicContact CG-CE2 3.87Å; L25-Y29 WeakPolarHBondContact O-CD2 3.3Å; L25-Y29 PolarHBondContact O-N 3.34Å; L25-Y29 VanDerWaalsContact O-N 3.16Å; L25-L247 HydrophobicContact CD2-CD2 3.74Å; L25-L247 HydrophobicContact CD2-CG 3.87Å
26L96.1Very high95.7Very high54 Ų5491.1 Ų91.128%0.28342%0.42SS..Hα-helixtrans-64.9-36.5175.5-74174.6000112.4R22 Q23 N24 K30 L247R22-L26 HydrophobicContact CG-CD1 4.25Å; R22-L26 WeakPolarHBondContact O-CB 3.42Å; R22-L26 VanDerWaalsContact O-CG 3.3Å; R22-L26 WeakPolarHBondContact O-CG 3.39Å; R22-L26 PolarHBondContact O-N 2.82Å; Q23-L26 PolarHBondContact O-N 2.67Å; N24-L26 PolarHBondContact O-N 3.47Å; L26-K30 VanDerWaalsContact O-CB 3.31Å; L26-K30 WeakPolarHBondContact O-CB 3.39Å; L26-K30 PolarHBondContact O-N 3.11Å; L26-L247 HydrophobicContact CD2-CD1 3.97Å; L26-L247 HydrophobicContact CD2-CD2 4.17Å; L26-L247 HydrophobicContact CG-CD2 4.35Å
27Q96.1Very high95.8Very high89 Ų8987.1 Ų87.142%0.41641%0.405SS..Hα-helixtrans-70.8-39.9178.3-171.859.447.800111.8Q23 N24 L25 K30 N31Q23-Q27 WeakPolarHBondContact O-CB 3.41Å; Q23-Q27 PolarHBondContact O-N 3.05Å; N24-Q27 PolarHBondContact O-N 3.35Å; N24-Q27 VanDerWaalsContact O-N 3.12Å; L25-Q27 VanDerWaalsContact C-N 3.32Å; L25-Q27 PolarHBondContact O-N 3.34Å; Q27-K30 PolarHBondContact O-N 3.28Å; Q27-N31 PolarHBondContact NE2-OD1 2.86Å; Q27-N31 PolarHBondContact O-N 3.5Å; Q27-N31 PolarHBondContact O-ND2 3.1Å; Q27-N31 PolarHBondContact O-OD1 3.13Å
28E96.1Very high96Very high125 Ų12586 Ų8658%0.58440%0.398SS*.Hα-helixtrans-57.1-52.6173.2-75.3169.9-17000111.1N24 L25 K30 N31 E32N24-E28 WeakPolarHBondContact O-CG 3.35Å; N24-E28 PolarHBondContact O-N 3.22Å; L25-E28 PolarHBondContact O-N 2.8Å; E28-K30 VanDerWaalsContact C-N 3.29Å; E28-K30 PolarHBondContact O-N 3.07Å; E28-N31 PolarHBondContact O-N 3.46Å; E28-N31 VanDerWaalsContact O-N 3.14Å; E28-E32 PolarHBondContact O-N 3.43Å
29Y97.4Very high96.2Very high23 Ų2389.1 Ų89.19%0.0941%0.414CS..Hα-helixtrans-64.4-32.7177.7-77.2-64.9000113.2L25 E33 L239 R242 R243 S246L25-Y29 HydrophobicContact CD2-CD2 3.76Å; L25-Y29 HydrophobicContact CD2-CE2 3.6Å; L25-Y29 HydrophobicContact CG-CD2 4.15Å; L25-Y29 HydrophobicContact CG-CE2 3.87Å; L25-Y29 WeakPolarHBondContact O-CD2 3.3Å; L25-Y29 PolarHBondContact O-N 3.34Å; L25-Y29 VanDerWaalsContact O-N 3.16Å; Y29-E33 VanDerWaalsContact O-CB 3.27Å; Y29-E33 WeakPolarHBondContact O-CB 3.37Å; Y29-E33 PolarHBondContact O-N 3.08Å; Y29-L239 HydrophobicContact CD1-CD2 3.98Å; Y29-L239 HydrophobicContact CD1-CG 4.18Å; Y29-R242 HydrophobicContact CE1-CB 4.03Å; Y29-R242 PolarHBondContact OH-O 2.92Å; Y29-R243 HydrophobicContact CD1-CB 3.92Å; Y29-R243 HydrophobicContact CD2-CB 3.77Å; Y29-R243 HydrophobicContact CD2-CG 3.74Å; Y29-R243 HydrophobicContact CE1-CB 4.09Å; Y29-R243 HydrophobicContact CE2-CB 3.98Å; Y29-R243 HydrophobicContact CE2-CG 4.26Å; Y29-R243 HydrophobicContact CG-CB 3.76Å; Y29-R243 HydrophobicContact CG-CG 3.95Å; Y29-S246 PolarHBondContact OH-OG 3.45Å
30K95.9Very high96.3Very high133 Ų13383.2 Ų83.258%0.57839%0.388SS*.Hα-helixtrans-66.2-39.3174.6-176.7-180178.7-177.30111.6L26 Q27 E28 K34L26-K30 VanDerWaalsContact O-CB 3.31Å; L26-K30 WeakPolarHBondContact O-CB 3.39Å; L26-K30 PolarHBondContact O-N 3.11Å; Q27-K30 PolarHBondContact O-N 3.28Å; E28-K30 VanDerWaalsContact C-N 3.29Å; E28-K30 PolarHBondContact O-N 3.07Å; K30-K34 WeakPolarHBondContact O-CB 3.31Å; K30-K34 PolarHBondContact O-N 3.11Å; K30-K34 VanDerWaalsContact O-N 3.11Å
31N97.2Very high96.4Very high78 Ų7881.7 Ų81.742%0.41738%0.381SS..Hα-helixtrans-68.1-46175.7-66.2-13.5000110.5Q27 E28 E33 K34 D35Q27-N31 PolarHBondContact NE2-OD1 2.86Å; Q27-N31 PolarHBondContact O-N 3.5Å; Q27-N31 PolarHBondContact O-ND2 3.1Å; Q27-N31 PolarHBondContact O-OD1 3.13Å; E28-N31 PolarHBondContact O-N 3.46Å; E28-N31 VanDerWaalsContact O-N 3.14Å; N31-E33 VanDerWaalsContact C-N 3.34Å; N31-E33 PolarHBondContact O-N 2.85Å; N31-K34 WeakPolarHBondContact O-CB 3.4Å; N31-K34 PolarHBondContact O-N 3.37Å; N31-K34 VanDerWaalsContact O-N 3.15Å; N31-D35 VanDerWaalsContact O-CG 3.31Å; N31-D35 PolarHBondContact O-N 3.22Å
32E96.9Very high96.5Very high70 Ų7080.6 Ų80.633%0.32738%0.377SS..Hα-helixtrans-61.5-40.1177.6-165.4-176.7174.700112E28 D35 L36 L239 R242E28-E32 PolarHBondContact O-N 3.43Å; E32-D35 PolarHBondContact O-N 3.35Å; E32-L36 WeakPolarHBondContact O-CB 3.46Å; E32-L36 PolarHBondContact O-N 3.49Å; E32-L239 HydrophobicContact CB-CD1 3.93Å; E32-L239 HydrophobicContact CG-CD1 3.63Å; E32-R242 IonicContact OE1-CZ 3.05Å; E32-R242 IonicContact OE1-NH1 3.56Å; E32-R242 PolarHBondContact OE1-NH1 3.4Å; E32-R242 IonicContact OE1-NH2 2.72Å; E32-R242 PolarHBondContact OE1-NH2 2.9Å; E32-R242 IonicContact OE2-NH1 3Å; E32-R242 IonicContact OE2-NH2 3.27Å
33E96.9Very high96.6Very high59 Ų5977.8 Ų77.828%0.27637%0.371SS..Hα-helixtrans-64.6-39.5174.9-179.1171.7-167.900111.9Y29 N31 N37 L236 L239Y29-E33 VanDerWaalsContact O-CB 3.27Å; Y29-E33 WeakPolarHBondContact O-CB 3.37Å; Y29-E33 PolarHBondContact O-N 3.08Å; N31-E33 VanDerWaalsContact C-N 3.34Å; N31-E33 PolarHBondContact O-N 2.85Å; E33-N37 WeakPolarHBondContact O-CB 3.41Å; E33-N37 PolarHBondContact O-N 3.45Å; E33-L236 HydrophobicContact CG-CD1 3.97Å; E33-L239 HydrophobicContact CB-CD1 4.31Å; E33-L239 HydrophobicContact CB-CD2 4.29Å
34K96.8Very high96.7Very high124 Ų12475.1 Ų75.154%0.53936%0.355SS..Hα-helixtrans-62.8-48.2174.3-178.3-175.1168.6-170.40110.8K30 N31 L36 N37 E38K30-K34 WeakPolarHBondContact O-CB 3.31Å; K30-K34 PolarHBondContact O-N 3.11Å; K30-K34 VanDerWaalsContact O-N 3.11Å; N31-K34 WeakPolarHBondContact O-CB 3.4Å; N31-K34 PolarHBondContact O-N 3.37Å; N31-K34 VanDerWaalsContact O-N 3.15Å; K34-L36 VanDerWaalsContact C-N 3.33Å; K34-L36 PolarHBondContact O-N 2.85Å; K34-N37 PolarHBondContact O-N 3.44Å; K34-E38 WeakPolarHBondContact CE-OE1 3.47Å; K34-E38 IonicContact NZ-OE1 3.89Å; K34-E38 WeakPolarHBondContact O-CG 3.18Å; K34-E38 PolarHBondContact O-N 2.77Å
35D97.2Very high96.7Very high98 Ų9878.4 Ų78.452%0.52436%0.362SS..Hα-helixtrans-62.5-41.4179.7-67.3-18.7000111.3N31 E32 E38 N39N31-D35 VanDerWaalsContact O-CG 3.31Å; N31-D35 PolarHBondContact O-N 3.22Å; E32-D35 PolarHBondContact O-N 3.35Å; D35-E38 PolarHBondContact O-N 2.89Å; D35-N39 VanDerWaalsContact O-CB 3.3Å; D35-N39 WeakPolarHBondContact O-CB 3.34Å; D35-N39 PolarHBondContact O-N 2.88Å
36L96.4Very high96.8Very high34 Ų3482.7 Ų82.718%0.17838%0.381CS..Hα-helixtrans-61-45.6175.3-176.668000111.6E32 K34 N39 F40 Y232 N235 L236 L239E32-L36 WeakPolarHBondContact O-CB 3.46Å; E32-L36 PolarHBondContact O-N 3.49Å; K34-L36 VanDerWaalsContact C-N 3.33Å; K34-L36 PolarHBondContact O-N 2.85Å; L36-N39 PolarHBondContact O-N 2.99Å; L36-F40 WeakPolarHBondContact O-CB 3.45Å; L36-F40 PolarHBondContact O-N 3.29Å; L36-Y232 HydrophobicContact CD2-CD2 4.34Å; L36-Y232 HydrophobicContact CD2-CE2 4.18Å; L36-Y232 HydrophobicContact CG-CD2 4.01Å; L36-Y232 HydrophobicContact CG-CE2 3.96Å; L36-N235 HydrophobicContact CD1-CB 3.83Å; L36-N235 HydrophobicContact CD2-CB 4Å; L36-L236 HydrophobicContact CD2-CB 4.1Å; L36-L236 HydrophobicContact CD2-CD1 4.35Å; L36-L239 HydrophobicContact CD2-CD1 4.38Å
37N96.4Very high96.8Very high62 Ų6281.8 Ų81.833%0.33238%0.376SS..Hα-helixtrans-65.7-43.8177.2-176.946.9000111.8E33 K34 N39 F40 Q41 Y232E33-N37 WeakPolarHBondContact O-CB 3.41Å; E33-N37 PolarHBondContact O-N 3.45Å; K34-N37 PolarHBondContact O-N 3.44Å; N37-N39 VanDerWaalsContact C-N 3.33Å; N37-N39 PolarHBondContact O-N 2.85Å; N37-F40 PolarHBondContact O-N 3.05Å; N37-Q41 WeakPolarHBondContact O-CB 3.28Å; N37-Q41 VanDerWaalsContact O-CG 3.24Å; N37-Q41 WeakPolarHBondContact O-CG 3.36Å; N37-Q41 PolarHBondContact O-N 3.09Å; N37-Y232 HydrophobicContact CB-CE2 4.45Å
38E96.8Very high96.8Very high82 Ų8279.9 Ų79.938%0.38337%0.37SS..Hα-helixtrans-61.8-40.8176.9-75-174.2-173.500112.2K34 D35 Q41 R42K34-E38 WeakPolarHBondContact CE-OE1 3.47Å; K34-E38 IonicContact NZ-OE1 3.89Å; K34-E38 WeakPolarHBondContact O-CG 3.18Å; K34-E38 PolarHBondContact O-N 2.77Å; D35-E38 PolarHBondContact O-N 2.89Å; E38-Q41 PolarHBondContact O-N 3.46Å; E38-R42 WeakPolarHBondContact O-CB 3.34Å; E38-R42 PolarHBondContact O-N 3.29Å
39N97.2Very high96.8Very high73 Ų7381.2 Ų81.239%0.3937%0.374SS..Hα-helixtrans-63.3-47.2175.1-168.613.2000111.3D35 L36 N37 Q41 R42 N43D35-N39 VanDerWaalsContact O-CB 3.3Å; D35-N39 WeakPolarHBondContact O-CB 3.34Å; D35-N39 PolarHBondContact O-N 2.88Å; L36-N39 PolarHBondContact O-N 2.99Å; N37-N39 VanDerWaalsContact C-N 3.33Å; N37-N39 PolarHBondContact O-N 2.85Å; N39-Q41 PolarHBondContact O-N 3.48Å; N39-R42 PolarHBondContact O-N 3.06Å; N39-N43 WeakPolarHBondContact O-CB 3.45Å; N39-N43 VanDerWaalsContact O-CG 3.24Å; N39-N43 PolarHBondContact O-N 3.4Å; N39-N43 PolarHBondContact O-ND2 2.83Å; N39-N43 PolarHBondContact OD1-ND2 3.03Å; N39-N43 VanDerWaalsContact OD1-ND2 3.1Å
40F97.4Very high96.8Very high27 Ų2782.6 Ų82.612%0.11839%0.388CS..Hα-helixtrans-57.1-48.3174168.1-106.4000112.1L36 N37 R42 N43 Y44 L228 R229 Y232L36-F40 WeakPolarHBondContact O-CB 3.45Å; L36-F40 PolarHBondContact O-N 3.29Å; N37-F40 PolarHBondContact O-N 3.05Å; F40-R42 VanDerWaalsContact C-N 3.3Å; F40-R42 PolarHBondContact O-N 3.07Å; F40-N43 PolarHBondContact O-N 3.47Å; F40-Y44 HydrophobicContact CE2-CD2 4.44Å; F40-Y44 HydrophobicContact CZ-CD2 4.26Å; F40-Y44 VanDerWaalsContact O-CB 3.25Å; F40-Y44 WeakPolarHBondContact O-CB 3.31Å; F40-Y44 PolarHBondContact O-N 3.36Å; F40-L228 HydrophobicContact CD2-CD2 4.47Å; F40-L228 HydrophobicContact CD2-CG 4.11Å; F40-L228 HydrophobicContact CE2-CD2 4.38Å; F40-L228 HydrophobicContact CE2-CG 4.07Å; F40-R229 HydrophobicContact CE2-CB 4.46Å; F40-Y232 HydrophobicContact CB-CD2 3.48Å; F40-Y232 VanDerWaalsContact CB-CD2 3.48Å; F40-Y232 HydrophobicContact CB-CE2 4.01Å; F40-Y232 HydrophobicContact CB-CG 3.9Å; F40-Y232 HydrophobicContact CD1-CD1 4.23Å; F40-Y232 HydrophobicContact CD1-CD2 4.31Å; F40-Y232 HydrophobicContact CD1-CE1 4.44Å; F40-Y232 HydrophobicContact CD1-CG 4.15Å; F40-Y232 VanDerWaalsContact CD2-CB 3.47Å; F40-Y232 HydrophobicContact CD2-CD1 4.33Å; F40-Y232 HydrophobicContact CD2-CD2 4.25Å; F40-Y232 AromaticContact CD2-CG 3.76Å; F40-Y232 HydrophobicContact CD2-CG 3.76Å; F40-Y232 HydrophobicContact CE1-CD1 4.44Å; F40-Y232 HydrophobicContact CE2-CG 4.34Å; F40-Y232 HydrophobicContact CG-CD1 4.17Å; F40-Y232 AromaticContact CG-CD2 3.76Å; F40-Y232 HydrophobicContact CG-CD2 3.76Å; F40-Y232 HydrophobicContact CG-CE2 4.34Å; F40-Y232 AromaticContact CG-CG 3.65Å; F40-Y232 HydrophobicContact CG-CG 3.65Å
41Q97.2Very high96.9Very high78 Ų7876.3 Ų76.336%0.36436%0.36SS..Hα-helixtrans-64.3-33.3179.1-68.2-63.1-23.400112.7N37 E38 N39 R45N37-Q41 WeakPolarHBondContact O-CB 3.28Å; N37-Q41 VanDerWaalsContact O-CG 3.24Å; N37-Q41 WeakPolarHBondContact O-CG 3.36Å; N37-Q41 PolarHBondContact O-N 3.09Å; E38-Q41 PolarHBondContact O-N 3.46Å; N39-Q41 PolarHBondContact O-N 3.48Å; Q41-R45 WeakPolarHBondContact O-CB 3.44Å; Q41-R45 VanDerWaalsContact O-CG 3.25Å; Q41-R45 WeakPolarHBondContact O-CG 3.32Å; Q41-R45 PolarHBondContact O-N 2.89Å; Q41-R45 PolarHBondContact O-NE 2.96Å
42R97.1Very high96.8Very high123 Ų12380.2 Ų80.246%0.46437%0.374SS..Hα-helixtrans-66.7-53.7173.7-168.8-177.2-59.51323.3110.6E38 N39 F40 Y44 R45 E46E38-R42 WeakPolarHBondContact O-CB 3.34Å; E38-R42 PolarHBondContact O-N 3.29Å; N39-R42 PolarHBondContact O-N 3.06Å; F40-R42 VanDerWaalsContact C-N 3.3Å; F40-R42 PolarHBondContact O-N 3.07Å; R42-Y44 VanDerWaalsContact C-N 3.32Å; R42-Y44 PolarHBondContact O-N 2.84Å; R42-R45 PolarHBondContact O-N 2.84Å; R42-E46 PolarHBondContact O-N 2.74Å
43N97.2Very high96.8Very high59 Ų5983.7 Ų83.732%0.31639%0.388SS..Hα-helixtrans-60.5-42.1-179.7-64.9-18.3000111.6N39 F40 R45 E46 L47 L228N39-N43 WeakPolarHBondContact O-CB 3.45Å; N39-N43 VanDerWaalsContact O-CG 3.24Å; N39-N43 PolarHBondContact O-N 3.4Å; N39-N43 PolarHBondContact O-ND2 2.83Å; N39-N43 PolarHBondContact OD1-ND2 3.03Å; N39-N43 VanDerWaalsContact OD1-ND2 3.1Å; F40-N43 PolarHBondContact O-N 3.47Å; N43-R45 PolarHBondContact O-N 3.47Å; N43-E46 PolarHBondContact O-N 2.85Å; N43-L47 VanDerWaalsContact O-CB 3.23Å; N43-L47 WeakPolarHBondContact O-CB 3.33Å; N43-L47 PolarHBondContact O-N 3.49Å; N43-L228 HydrophobicContact CB-CD1 4.14Å; N43-L228 HydrophobicContact CB-CD2 4.02Å
44Y97.1Very high96.7Very high80 Ų8084.4 Ų84.431%0.31439%0.391SS..Hα-helixtrans-63.1-42.5177.8-172.6-94.5000111.8F40 R42 L47 V48 R225 L228F40-Y44 HydrophobicContact CE2-CD2 4.44Å; F40-Y44 HydrophobicContact CZ-CD2 4.26Å; F40-Y44 VanDerWaalsContact O-CB 3.25Å; F40-Y44 WeakPolarHBondContact O-CB 3.31Å; F40-Y44 PolarHBondContact O-N 3.36Å; R42-Y44 VanDerWaalsContact C-N 3.32Å; R42-Y44 PolarHBondContact O-N 2.84Å; Y44-L47 PolarHBondContact O-N 2.85Å; Y44-V48 HydrophobicContact CD1-CG2 4.01Å; Y44-V48 HydrophobicContact CE1-CG2 3.66Å; Y44-V48 WeakPolarHBondContact O-CB 3.43Å; Y44-V48 VanDerWaalsContact O-CG2 3.24Å; Y44-V48 WeakPolarHBondContact O-CG2 3.32Å; Y44-V48 PolarHBondContact O-N 3.46Å; Y44-R225 HydrophobicContact CE2-CB 4.17Å; Y44-R225 HydrophobicContact CE2-CG 4.03Å; Y44-L228 HydrophobicContact CD2-CD2 4.3Å
45R96.6Very high96.6Very high150 Ų15080.6 Ų80.657%0.56638%0.376SS*.Hα-helixtrans-64.7-41.6176.6-77.9-178.3-69.6-163.40.7112.3Q41 R42 N43 K49Q41-R45 WeakPolarHBondContact O-CB 3.44Å; Q41-R45 VanDerWaalsContact O-CG 3.25Å; Q41-R45 WeakPolarHBondContact O-CG 3.32Å; Q41-R45 PolarHBondContact O-N 2.89Å; Q41-R45 PolarHBondContact O-NE 2.96Å; R42-R45 PolarHBondContact O-N 2.84Å; N43-R45 PolarHBondContact O-N 3.47Å; R45-K49 WeakPolarHBondContact O-CG 3.4Å; R45-K49 PolarHBondContact O-N 2.88Å
46E96.7Very high96.5Very high115 Ų11579.5 Ų79.554%0.53738%0.376SS..Hα-helixtrans-65.3-43.4176.6-71.9-180-178.100111.6R42 N43 V48 K49 S50R42-E46 PolarHBondContact O-N 2.74Å; N43-E46 PolarHBondContact O-N 2.85Å; E46-V48 PolarHBondContact O-N 2.91Å; E46-K49 PolarHBondContact O-N 3.28Å; E46-S50 PolarHBondContact O-N 3.43Å
47L96.6Very high96.5Very high35 Ų3581.3 Ų81.318%0.18339%0.386CS..Hα-helixtrans-60.8-46.3176.1-17165.9000111.5N43 Y44 K49 S50 H51 E224 R225 L228N43-L47 VanDerWaalsContact O-CB 3.23Å; N43-L47 WeakPolarHBondContact O-CB 3.33Å; N43-L47 PolarHBondContact O-N 3.49Å; Y44-L47 PolarHBondContact O-N 2.85Å; L47-K49 VanDerWaalsContact C-N 3.35Å; L47-K49 PolarHBondContact O-N 3.48Å; L47-S50 WeakPolarHBondContact O-CB 3.37Å; L47-S50 PolarHBondContact O-N 3.14Å; L47-H51 WeakPolarHBondContact CD1-NE2 3.38Å; L47-H51 VanDerWaalsContact CG-CE1 3.46Å; L47-H51 WeakPolarHBondContact CG-CE1 3.36Å; L47-H51 WeakPolarHBondContact CG-NE2 3.36Å; L47-H51 PolarHBondContact O-CD2 2.94Å; L47-H51 VanDerWaalsContact O-CD2 3.23Å; L47-H51 PolarHBondContact O-N 3.44Å; L47-E224 HydrophobicContact CD2-CB 4.43Å; L47-R225 HydrophobicContact CD2-CG 3.91Å; L47-L228 HydrophobicContact CD2-CB 4.37Å; L47-L228 HydrophobicContact CD2-CD2 3.97Å
48V95.2Very high96.4Very high49 Ų4979.3 Ų79.330%0.29738%0.375SS..Hα-helixtrans-61.1-41.6176.1170.10000111.9Y44 E46 H51 K52Y44-V48 HydrophobicContact CD1-CG2 4.01Å; Y44-V48 HydrophobicContact CE1-CG2 3.66Å; Y44-V48 WeakPolarHBondContact O-CB 3.43Å; Y44-V48 VanDerWaalsContact O-CG2 3.24Å; Y44-V48 WeakPolarHBondContact O-CG2 3.32Å; Y44-V48 PolarHBondContact O-N 3.46Å; E46-V48 PolarHBondContact O-N 2.91Å; V48-H51 PolarHBondContact O-N 3.44Å; V48-K52 WeakPolarHBondContact O-CB 3.48Å; V48-K52 PolarHBondContact O-N 3.27Å
49K96.8Very high96.3Very high153 Ų15378.9 Ų78.967%0.66537%0.373SS*.Hα-helixtrans-62.5-43.1175.1-74.4174-178.5179.70111.4R45 E46 L47 K52 K53R45-K49 WeakPolarHBondContact O-CG 3.4Å; R45-K49 PolarHBondContact O-N 2.88Å; E46-K49 PolarHBondContact O-N 3.28Å; L47-K49 VanDerWaalsContact C-N 3.35Å; L47-K49 PolarHBondContact O-N 3.48Å; K49-K52 PolarHBondContact O-N 2.88Å; K49-K53 PolarHBondContact O-N 2.93Å; K49-K53 VanDerWaalsContact O-N 3.1Å
50S97.5Very high96.2Very high53 Ų5377.7 Ų77.737%0.37137%0.37SS..Hα-helixtrans-59.6-50.2175.5-174.30000111.4E46 L47 K52 K53 Q54E46-S50 PolarHBondContact O-N 3.43Å; L47-S50 WeakPolarHBondContact O-CB 3.37Å; L47-S50 PolarHBondContact O-N 3.14Å; S50-K52 VanDerWaalsContact C-N 3.34Å; S50-K52 PolarHBondContact O-N 3.23Å; S50-K53 WeakPolarHBondContact O-CB 3.36Å; S50-K53 PolarHBondContact O-N 3.3Å; S50-K53 VanDerWaalsContact O-N 3.1Å; S50-Q54 WeakPolarHBondContact O-CG 3.44Å; S50-Q54 PolarHBondContact O-N 3.2Å
51H97Very high96Very high0 Ų083.2 Ų83.20%040%0.395CS..Hα-helixtrans-59.8-43.6179-64.3-178.8000111.9L47 V48 K53 Q54 L55 C221 E224 R225L47-H51 WeakPolarHBondContact CD1-NE2 3.38Å; L47-H51 VanDerWaalsContact CG-CE1 3.46Å; L47-H51 WeakPolarHBondContact CG-CE1 3.36Å; L47-H51 WeakPolarHBondContact CG-NE2 3.36Å; L47-H51 PolarHBondContact O-CD2 2.94Å; L47-H51 VanDerWaalsContact O-CD2 3.23Å; L47-H51 PolarHBondContact O-N 3.44Å; V48-H51 PolarHBondContact O-N 3.44Å; H51-K53 VanDerWaalsContact C-N 3.29Å; H51-K53 PolarHBondContact O-N 2.85Å; H51-Q54 PolarHBondContact O-N 3.45Å; H51-L55 WeakPolarHBondContact O-CB 3.37Å; H51-L55 WeakPolarHBondContact O-CG 3.42Å; H51-L55 PolarHBondContact O-N 3.48Å; H51-C221 HydrophobicContact CB-CB 4.17Å; H51-C221 PolarHBondContact CE1-O 2.88Å; H51-C221 WeakPolarHBondContact ND1-CB 3.41Å; H51-C221 PolarHBondContact ND1-O 3.32Å; H51-E224 IonicContact CE1-OE2 3.52Å; H51-E224 IonicContact NE2-OE2 3.56Å; H51-E224 PolarHBondContact NE2-OE2 3.18Å; H51-R225 PolarHBondContact ND1-NE 3.41Å
52K95.6Very high95.8Very high161 Ų16179.7 Ų79.770%0.738%0.378SS*.Hα-helixtrans-60.5-40.1177.2-173175.4-178.5177.20111.7V48 K49 S50 S56V48-K52 WeakPolarHBondContact O-CB 3.48Å; V48-K52 PolarHBondContact O-N 3.27Å; K49-K52 PolarHBondContact O-N 2.88Å; S50-K52 VanDerWaalsContact C-N 3.34Å; S50-K52 PolarHBondContact O-N 3.23Å; K52-S56 WeakPolarHBondContact O-CB 3.45Å; K52-S56 PolarHBondContact O-N 2.98Å
53K96.8Very high95.6Very high143 Ų14376.3 Ų76.362%0.62237%0.369SS*.Hα-helixtrans-65.4-48.4175.8-173.7-179.5178.3-176.30111.3K49 S50 H51 L55 S56 D57K49-K53 PolarHBondContact O-N 2.93Å; K49-K53 VanDerWaalsContact O-N 3.1Å; S50-K53 WeakPolarHBondContact O-CB 3.36Å; S50-K53 PolarHBondContact O-N 3.3Å; S50-K53 VanDerWaalsContact O-N 3.1Å; H51-K53 VanDerWaalsContact C-N 3.29Å; H51-K53 PolarHBondContact O-N 2.85Å; K53-L55 PolarHBondContact O-N 3.42Å; K53-S56 PolarHBondContact O-N 2.93Å; K53-D57 WeakPolarHBondContact O-CB 3.27Å; K53-D57 VanDerWaalsContact O-CG 3.3Å; K53-D57 PolarHBondContact O-N 2.82Å
54Q95.4Very high95.4Very high74 Ų7480.6 Ų80.635%0.34639%0.385SS..Hα-helixtrans-59.5-43.9178.8-68.7177.4-3.200112.4S50 H51 D57 L58 L217S50-Q54 WeakPolarHBondContact O-CG 3.44Å; S50-Q54 PolarHBondContact O-N 3.2Å; H51-Q54 PolarHBondContact O-N 3.45Å; Q54-D57 PolarHBondContact O-N 3.43Å; Q54-L58 WeakPolarHBondContact O-CB 3.37Å; Q54-L58 PolarHBondContact O-N 3.32Å; Q54-L217 HydrophobicContact CB-CD2 4.16Å
55L94.8Very high95.2Very high43 Ų4379.2 Ų79.223%0.22539%0.387CS..Hα-helixtrans-64.2-44.8176.6-75.5166.7000111.8H51 K53 D57 L58 Q59 I214 L217 E218H51-L55 WeakPolarHBondContact O-CB 3.37Å; H51-L55 WeakPolarHBondContact O-CG 3.42Å; H51-L55 PolarHBondContact O-N 3.48Å; K53-L55 PolarHBondContact O-N 3.42Å; L55-D57 VanDerWaalsContact C-N 3.34Å; L55-D57 PolarHBondContact O-N 3.46Å; L55-L58 PolarHBondContact O-N 2.85Å; L55-Q59 VanDerWaalsContact O-CB 3.28Å; L55-Q59 WeakPolarHBondContact O-CB 3.35Å; L55-Q59 PolarHBondContact O-N 3.46Å; L55-I214 HydrophobicContact CD2-CG2 4.47Å; L55-L217 HydrophobicContact CD2-CB 4.43Å; L55-L217 HydrophobicContact CD2-CD2 3.88Å; L55-L217 HydrophobicContact CD2-CG 4.12Å; L55-L217 HydrophobicContact CG-CD2 4.26Å; L55-E218 HydrophobicContact CD1-CG 4.27Å; L55-E218 HydrophobicContact CD2-CG 3.49Å; L55-E218 VanDerWaalsContact CD2-CG 3.49Å
56S95.2Very high94.9Very high75 Ų7573.8 Ų73.852%0.52437%0.368SS..Hα-helixtrans-59.9-43.9175.6-178.50000112K52 K53 Q59 S60K52-S56 WeakPolarHBondContact O-CB 3.45Å; K52-S56 PolarHBondContact O-N 2.98Å; K53-S56 PolarHBondContact O-N 2.93Å; S56-Q59 PolarHBondContact O-N 2.92Å; S56-S60 WeakPolarHBondContact O-CB 3.45Å; S56-S60 PolarHBondContact O-N 3.4Å
57D95.9Very high94.7Very high73 Ų7375.9 Ų75.939%0.3937%0.371SS..Hα-helixtrans-65.1-44.2178.7-72-17.9000111.3K53 Q54 L55 S60 K61K53-D57 WeakPolarHBondContact O-CB 3.27Å; K53-D57 VanDerWaalsContact O-CG 3.3Å; K53-D57 PolarHBondContact O-N 2.82Å; Q54-D57 PolarHBondContact O-N 3.43Å; L55-D57 VanDerWaalsContact C-N 3.34Å; L55-D57 PolarHBondContact O-N 3.46Å; D57-S60 PolarHBondContact O-N 3.42Å; D57-S60 PolarHBondContact O-OG 3.48Å; D57-K61 WeakPolarHBondContact O-CG 3.23Å; D57-K61 PolarHBondContact O-N 3.46Å
58L94.9Very high94.5Very high19 Ų1982 Ų8210%0.09940%0.396CS..Hα-helixtrans-65.5-41.6177.4-17763.9000112.1Q54 L55 K61 T62 R213 I214 L217Q54-L58 WeakPolarHBondContact O-CB 3.37Å; Q54-L58 PolarHBondContact O-N 3.32Å; L55-L58 PolarHBondContact O-N 2.85Å; L58-K61 PolarHBondContact O-N 3.41Å; L58-T62 VanDerWaalsContact O-CB 3.24Å; L58-T62 WeakPolarHBondContact O-CB 3.46Å; L58-T62 PolarHBondContact O-N 2.95Å; L58-T62 PolarHBondContact O-OG1 3.5Å; L58-R213 HydrophobicContact CD1-CG 4.23Å; L58-R213 HydrophobicContact CD2-CG 4.27Å; L58-R213 WeakPolarHBondContact CD2-O 3.39Å; L58-I214 HydrophobicContact CD2-CG1 4.08Å; L58-I214 HydrophobicContact CG-CG1 4.38Å; L58-L217 HydrophobicContact CB-CD2 4Å; L58-L217 HydrophobicContact CD2-CB 3.89Å; L58-L217 HydrophobicContact CD2-CD2 3.56Å; L58-L217 HydrophobicContact CD2-CG 4.36Å; L58-L217 HydrophobicContact CG-CD2 4.41Å
59Q94.1Very high94.4Very high74 Ų7482.5 Ų82.535%0.34639%0.394SS..Hα-helixtrans-60.2-47175.7-176.16331.300110.6L55 S56 K61 T62 D63L55-Q59 VanDerWaalsContact O-CB 3.28Å; L55-Q59 WeakPolarHBondContact O-CB 3.35Å; L55-Q59 PolarHBondContact O-N 3.46Å; S56-Q59 PolarHBondContact O-N 2.92Å; Q59-K61 PolarHBondContact O-N 3.18Å; Q59-T62 WeakPolarHBondContact O-CB 3.45Å; Q59-T62 PolarHBondContact O-N 3.19Å; Q59-D63 PolarHBondContact NE2-OD1 3.2Å; Q59-D63 PolarHBondContact NE2-OD2 3.28Å; Q59-D63 VanDerWaalsContact NE2-OD2 3.13Å; Q59-D63 PolarHBondContact O-N 3.43Å
60S94.5Very high94.1Very high47 Ų4781.4 Ų81.433%0.32939%0.386SS..Hα-helixtrans-62.7-39.3178.979.90000112.9S56 D57 K64S56-S60 WeakPolarHBondContact O-CB 3.45Å; S56-S60 PolarHBondContact O-N 3.4Å; D57-S60 PolarHBondContact O-N 3.42Å; D57-S60 PolarHBondContact O-OG 3.48Å; S60-K64 VanDerWaalsContact O-CG 3.3Å; S60-K64 WeakPolarHBondContact O-CG 3.35Å; S60-K64 PolarHBondContact O-N 2.82Å; S60-K64 VanDerWaalsContact O-N 3.13Å
61K94.2Very high93.9Very high144 Ų14486.5 Ų86.563%0.62640%0.397SS*.Hα-helixtrans-66.3-42.4175.1-74174.6-178.31770111.2D57 L58 Q59 K64 S65D57-K61 WeakPolarHBondContact O-CG 3.23Å; D57-K61 PolarHBondContact O-N 3.46Å; L58-K61 PolarHBondContact O-N 3.41Å; Q59-K61 PolarHBondContact O-N 3.18Å; K61-K64 PolarHBondContact O-N 3.32Å; K61-S65 WeakPolarHBondContact O-CB 3.36Å; K61-S65 PolarHBondContact O-N 2.93Å
62T92.5Very high93.7Very high3 Ų392 Ų922%0.01842%0.422CS..Hα-helixtrans-62-46.4177.2-69.90000111.6L58 Q59 K64 S65 K66 H210 I214L58-T62 VanDerWaalsContact O-CB 3.24Å; L58-T62 WeakPolarHBondContact O-CB 3.46Å; L58-T62 PolarHBondContact O-N 2.95Å; L58-T62 PolarHBondContact O-OG1 3.5Å; Q59-T62 WeakPolarHBondContact O-CB 3.45Å; Q59-T62 PolarHBondContact O-N 3.19Å; T62-K64 PolarHBondContact O-N 2.8Å; T62-S65 WeakPolarHBondContact O-CB 3.47Å; T62-S65 PolarHBondContact O-N 3.35Å; T62-K66 HydrophobicContact CG2-CD 4.04Å; T62-K66 VanDerWaalsContact CG2-CE 3.4Å; T62-K66 HydrophobicContact CG2-CG 4.43Å; T62-K66 WeakPolarHBondContact O-CB 3.35Å; T62-K66 WeakPolarHBondContact O-CG 3.31Å; T62-K66 PolarHBondContact O-N 3.5Å; T62-H210 HydrophobicContact CG2-CB 3.56Å; T62-I214 HydrophobicContact CG2-CD1 4.33Å
63D92Very high93.4Very high52 Ų5284.9 Ų84.928%0.27839%0.392SS..Hα-helixtrans-67.2-36.8179.6-69.8-26.8000112.4Q59 R67Q59-D63 PolarHBondContact NE2-OD1 3.2Å; Q59-D63 PolarHBondContact NE2-OD2 3.28Å; Q59-D63 VanDerWaalsContact NE2-OD2 3.13Å; Q59-D63 PolarHBondContact O-N 3.43Å; D63-R67 VanDerWaalsContact O-CG 3.31Å; D63-R67 WeakPolarHBondContact O-CG 3.36Å; D63-R67 PolarHBondContact O-N 3.33Å; D63-R67 VanDerWaalsContact O-N 3.09Å
64K93.8Very high93.1Very high149 Ų14981.9 Ų81.965%0.64838%0.38SS*.Hα-helixtrans-62.6-45.1171.2-73.4173.4-177.1177.40111.6S60 K61 T62 R67 K68S60-K64 VanDerWaalsContact O-CG 3.3Å; S60-K64 WeakPolarHBondContact O-CG 3.35Å; S60-K64 PolarHBondContact O-N 2.82Å; S60-K64 VanDerWaalsContact O-N 3.13Å; K61-K64 PolarHBondContact O-N 3.32Å; T62-K64 PolarHBondContact O-N 2.8Å; K64-R67 PolarHBondContact O-N 2.9Å; K64-K68 PolarHBondContact O-N 2.97Å
65S92.3Very high92.9Very high51 Ų5182.1 Ų82.136%0.35739%0.389SS..Hα-helixtrans-61.3-49.9177.5-176.20000111.8K61 T62 R67 K68 F69 H210K61-S65 WeakPolarHBondContact O-CB 3.36Å; K61-S65 PolarHBondContact O-N 2.93Å; T62-S65 WeakPolarHBondContact O-CB 3.47Å; T62-S65 PolarHBondContact O-N 3.35Å; S65-R67 PolarHBondContact O-N 2.94Å; S65-K68 WeakPolarHBondContact O-CB 3.49Å; S65-K68 PolarHBondContact O-N 2.71Å; S65-K68 VanDerWaalsContact O-N 3.11Å; S65-F69 PolarHBondContact O-N 2.85Å; S65-H210 PolarHBondContact OG-CE1 3.43Å; S65-H210 PolarHBondContact OG-NE2 2.87Å
66K91Very high92.6Very high37 Ų3782.9 Ų82.916%0.16139%0.391CS..Hα-helixtrans-55.8-46.8176.7-73.7173.8-177.8171.90112.3T62 K68 F69 R70 L207T62-K66 HydrophobicContact CG2-CD 4.04Å; T62-K66 VanDerWaalsContact CG2-CE 3.4Å; T62-K66 HydrophobicContact CG2-CG 4.43Å; T62-K66 WeakPolarHBondContact O-CB 3.35Å; T62-K66 WeakPolarHBondContact O-CG 3.31Å; T62-K66 PolarHBondContact O-N 3.5Å; K66-K68 VanDerWaalsContact C-N 3.34Å; K66-K68 PolarHBondContact O-N 2.82Å; K66-F69 PolarHBondContact O-N 3.23Å; K66-R70 WeakPolarHBondContact O-CB 3.41Å; K66-R70 PolarHBondContact O-N 2.92Å; K66-L207 HydrophobicContact CD-CD1 4.22Å; K66-L207 VanDerWaalsContact CE-CD1 3.48Å
67R92.3Very high92.3Very high159 Ų15980.5 Ų80.560%0.637%0.373SS*.Hα-helixtrans-62.4-40.9177.2-71.6178.9-152.7174.16.2111.9D63 K64 S65 R71D63-R67 VanDerWaalsContact O-CG 3.31Å; D63-R67 WeakPolarHBondContact O-CG 3.36Å; D63-R67 PolarHBondContact O-N 3.33Å; D63-R67 VanDerWaalsContact O-N 3.09Å; K64-R67 PolarHBondContact O-N 2.9Å; S65-R67 PolarHBondContact O-N 2.94Å; R67-R71 VanDerWaalsContact O-CG 3.3Å; R67-R71 WeakPolarHBondContact O-CG 3.36Å; R67-R71 PolarHBondContact O-N 3.47Å; R67-R71 VanDerWaalsContact O-N 3.13Å
68K93.1Very high91.9Very high162 Ų16285.5 Ų85.570%0.70439%0.386SS*.Hα-helixtrans-65.4-44.8177.7-171-179178.3-174.50111.1K64 S65 K66 R71 H72K64-K68 PolarHBondContact O-N 2.97Å; S65-K68 WeakPolarHBondContact O-CB 3.49Å; S65-K68 PolarHBondContact O-N 2.71Å; S65-K68 VanDerWaalsContact O-N 3.11Å; K66-K68 VanDerWaalsContact C-N 3.34Å; K66-K68 PolarHBondContact O-N 2.82Å; K68-R71 PolarHBondContact O-N 3.44Å; K68-H72 PolarHBondContact O-N 3.49Å; K68-H72 VanDerWaalsContact O-N 3.1Å
69F92.5Very high91.5Very high61 Ų6187.1 Ų87.127%0.26840%0.399SS..Hα-helixtrans-65-44.2178.7-169.3-117.1000112S65 K66 R71 H72 L73 F203 C206S65-F69 PolarHBondContact O-N 2.85Å; K66-F69 PolarHBondContact O-N 3.23Å; F69-R71 PolarHBondContact O-N 2.84Å; F69-H72 WeakPolarHBondContact O-CB 3.45Å; F69-H72 PolarHBondContact O-N 3.27Å; F69-H72 VanDerWaalsContact O-N 3.08Å; F69-L73 HydrophobicContact CD1-CD1 3.91Å; F69-L73 HydrophobicContact CD1-CG 4.46Å; F69-L73 HydrophobicContact CE1-CD1 3.57Å; F69-L73 HydrophobicContact CE1-CD2 4.43Å; F69-L73 HydrophobicContact CE1-CG 4.18Å; F69-L73 HydrophobicContact CE2-CD2 4.47Å; F69-L73 HydrophobicContact CZ-CD1 4.06Å; F69-L73 HydrophobicContact CZ-CD2 4.07Å; F69-L73 HydrophobicContact CZ-CG 4.24Å; F69-L73 PolarHBondContact O-N 3.17Å; F69-F203 AromaticContact CD1-CD2 3.95Å; F69-F203 HydrophobicContact CD1-CD2 3.95Å; F69-F203 HydrophobicContact CE1-CD2 4.45Å; F69-C206 HydrophobicContact CD1-CB 3.64Å; F69-C206 HydrophobicContact CE1-CB 3.55Å; F69-C206 HydrophobicContact CZ-CB 4.4Å
70R91.8Very high91.1Very high129 Ų12987.6 Ų87.649%0.48740%0.401SS..Hα-helixtrans-59.4-44.7175.7-172.3165.1179.2142.10.4112.8K66 H72 L73 E74 F203K66-R70 WeakPolarHBondContact O-CB 3.41Å; K66-R70 PolarHBondContact O-N 2.92Å; R70-H72 VanDerWaalsContact C-N 3.26Å; R70-H72 PolarHBondContact O-N 2.67Å; R70-L73 PolarHBondContact O-N 3.01Å; R70-E74 IonicContact NE-OE1 3.4Å; R70-E74 WeakPolarHBondContact O-CB 3.45Å; R70-E74 WeakPolarHBondContact O-CG 3.21Å; R70-E74 PolarHBondContact O-N 2.94Å; R70-F203 HydrophobicContact CB-CD2 4.37Å; R70-F203 HydrophobicContact CB-CE2 3.85Å; R70-F203 HydrophobicContact CG-CE2 4.37Å
71R92.6Very high90.6Very high161 Ų16190.2 Ų90.261%0.60841%0.407SS*.Hα-helixtrans-61.1-36174.9-72.2174.2-168.8155.8-0.4112.3R67 K68 F69 C75R67-R71 VanDerWaalsContact O-CG 3.3Å; R67-R71 WeakPolarHBondContact O-CG 3.36Å; R67-R71 PolarHBondContact O-N 3.47Å; R67-R71 VanDerWaalsContact O-N 3.13Å; K68-R71 PolarHBondContact O-N 3.44Å; F69-R71 PolarHBondContact O-N 2.84Å; R71-C75 PolarHBondContact O-N 2.89Å; R71-C75 PolarHBondContact O-SG 3.42Å
72H92.6Very high90.2Very high114 Ų11489.8 Ų89.853%0.52841%0.405SS..Hα-helixtrans-65.2-49.4177.3-176.167.5000111.4K68 F69 R70 E74 C75 E76K68-H72 PolarHBondContact O-N 3.49Å; K68-H72 VanDerWaalsContact O-N 3.1Å; F69-H72 WeakPolarHBondContact O-CB 3.45Å; F69-H72 PolarHBondContact O-N 3.27Å; F69-H72 VanDerWaalsContact O-N 3.08Å; R70-H72 VanDerWaalsContact C-N 3.26Å; R70-H72 PolarHBondContact O-N 2.67Å; H72-E74 VanDerWaalsContact C-N 3.34Å; H72-E74 PolarHBondContact O-N 2.94Å; H72-C75 WeakPolarHBondContact O-CB 3.37Å; H72-C75 PolarHBondContact O-N 3.09Å; H72-C75 VanDerWaalsContact O-N 3.14Å; H72-E76 PolarHBondContact O-N 3.47Å
73L89.9Confident89.7Confident13 Ų1393.3 Ų93.37%0.06842%0.424CS..Hα-helixtrans-62.2-39.3176.5-61.8174.2000112.2F69 R70 C75 E76 L77 L199 F203F69-L73 HydrophobicContact CD1-CD1 3.91Å; F69-L73 HydrophobicContact CD1-CG 4.46Å; F69-L73 HydrophobicContact CE1-CD1 3.57Å; F69-L73 HydrophobicContact CE1-CD2 4.43Å; F69-L73 HydrophobicContact CE1-CG 4.18Å; F69-L73 HydrophobicContact CE2-CD2 4.47Å; F69-L73 HydrophobicContact CZ-CD1 4.06Å; F69-L73 HydrophobicContact CZ-CD2 4.07Å; F69-L73 HydrophobicContact CZ-CG 4.24Å; F69-L73 PolarHBondContact O-N 3.17Å; R70-L73 PolarHBondContact O-N 3.01Å; L73-C75 VanDerWaalsContact C-N 3.32Å; L73-C75 PolarHBondContact O-N 3.44Å; L73-E76 PolarHBondContact O-N 2.99Å; L73-L77 WeakPolarHBondContact O-CB 3.46Å; L73-L77 PolarHBondContact O-N 3.22Å; L73-L199 HydrophobicContact CD2-CD2 3.63Å; L73-F203 HydrophobicContact CD1-CB 3.76Å; L73-F203 HydrophobicContact CD1-CD2 4.16Å; L73-F203 HydrophobicContact CD1-CG 4.41Å
74E90.2Very high89Confident80 Ų8093.5 Ų93.537%0.37442%0.424SS..Hα-helixtrans-62.4-37.9174.5-76.7175.2-165.700112.3R70 H72 R78R70-E74 IonicContact NE-OE1 3.4Å; R70-E74 WeakPolarHBondContact O-CB 3.45Å; R70-E74 WeakPolarHBondContact O-CG 3.21Å; R70-E74 PolarHBondContact O-N 2.94Å; H72-E74 VanDerWaalsContact C-N 3.34Å; H72-E74 PolarHBondContact O-N 2.94Å; E74-R78 WeakPolarHBondContact O-CB 3.34Å; E74-R78 WeakPolarHBondContact O-CG 3.5Å; E74-R78 PolarHBondContact O-N 3.21Å
75C90.8Very high88.3Confident79 Ų7994.4 Ų94.453%0.53443%0.428SS..Hα-helixtrans-66.8-43.1174.2-76.30000111.9R71 H72 L73 R78 S79R71-C75 PolarHBondContact O-N 2.89Å; R71-C75 PolarHBondContact O-SG 3.42Å; H72-C75 WeakPolarHBondContact O-CB 3.37Å; H72-C75 PolarHBondContact O-N 3.09Å; H72-C75 VanDerWaalsContact O-N 3.14Å; L73-C75 VanDerWaalsContact C-N 3.32Å; L73-C75 PolarHBondContact O-N 3.44Å; C75-R78 PolarHBondContact O-N 2.95Å; C75-S79 PolarHBondContact O-N 3.4Å; C75-S79 PolarHBondContact O-OG 2.74Å; C75-S79 VanDerWaalsContact O-OG 3.08Å
76E89.3Confident87.6Confident58 Ų5897.7 Ų97.727%0.27144%0.436SS..Hα-helixtrans-59.7-48.3176.8-170.8175.9171.400111.2H72 L73 R78 S79 E80 L199 R202H72-E76 PolarHBondContact O-N 3.47Å; L73-E76 PolarHBondContact O-N 2.99Å; E76-R78 VanDerWaalsContact C-N 3.31Å; E76-R78 PolarHBondContact O-N 3.27Å; E76-S79 WeakPolarHBondContact CA-OG 3.48Å; E76-S79 PolarHBondContact O-N 3.47Å; E76-S79 PolarHBondContact O-OG 3.48Å; E76-E80 PolarHBondContact O-N 3.24Å; E76-L199 HydrophobicContact CG-CD2 4.49Å; E76-R202 IonicContact OE1-NH1 3.96Å
77L88.1Confident86.8Confident25 Ų25101.6 Ų101.613%0.13145%0.453CS..Hα-helixtrans-59.8-40.3175-175.964.8000112L73 K81 L195 L199L73-L77 WeakPolarHBondContact O-CB 3.46Å; L73-L77 PolarHBondContact O-N 3.22Å; L77-K81 HydrophobicContact CG-CD 4.36Å; L77-K81 WeakPolarHBondContact O-CB 3.43Å; L77-K81 VanDerWaalsContact O-CG 3.3Å; L77-K81 WeakPolarHBondContact O-CG 3.44Å; L77-K81 PolarHBondContact O-N 2.92Å; L77-L195 HydrophobicContact CD1-CD2 4.18Å; L77-L199 HydrophobicContact CB-CD1 3.84Å; L77-L199 HydrophobicContact CD1-CD1 4.17Å
78R87.8Confident85.7Confident178 Ų17898.7 Ų98.767%0.67244%0.443SS*.Hα-helixtrans-67.7-41.3177.2-76.8173.5-175.1-157.33.7112E74 C75 E76 K82E74-R78 WeakPolarHBondContact O-CB 3.34Å; E74-R78 WeakPolarHBondContact O-CG 3.5Å; E74-R78 PolarHBondContact O-N 3.21Å; C75-R78 PolarHBondContact O-N 2.95Å; E76-R78 VanDerWaalsContact C-N 3.31Å; E76-R78 PolarHBondContact O-N 3.27Å; R78-K82 WeakPolarHBondContact O-CB 3.47Å; R78-K82 PolarHBondContact O-N 3.47Å
79S87Confident84.5Confident54 Ų5492.3 Ų92.338%0.37842%0.423SS..Hα-helixtrans-64.6-42176.443.30000111.7C75 E76 K82 N83C75-S79 PolarHBondContact O-N 3.4Å; C75-S79 PolarHBondContact O-OG 2.74Å; C75-S79 VanDerWaalsContact O-OG 3.08Å; E76-S79 WeakPolarHBondContact CA-OG 3.48Å; E76-S79 PolarHBondContact O-N 3.47Å; E76-S79 PolarHBondContact O-OG 3.48Å; S79-K82 WeakPolarHBondContact O-CB 3.45Å; S79-K82 PolarHBondContact O-N 3Å; S79-N83 WeakPolarHBondContact O-CB 3.48Å; S79-N83 VanDerWaalsContact O-CG 3.25Å; S79-N83 PolarHBondContact O-N 2.99Å; S79-N83 PolarHBondContact O-ND2 3.47Å
80E85.2Confident83.3Confident84 Ų8495.2 Ų95.239%0.39344%0.438SS..Hα-helixtrans-65.4-45.6176.8-82-60.2150.800111.8E76 K82 N83 L84 L195E76-E80 PolarHBondContact O-N 3.24Å; E80-K82 VanDerWaalsContact C-N 3.25Å; E80-K82 PolarHBondContact O-N 3.49Å; E80-N83 PolarHBondContact O-N 3.13Å; E80-N83 VanDerWaalsContact O-N 3.13Å; E80-L84 WeakPolarHBondContact O-CB 3.38Å; E80-L84 PolarHBondContact O-N 2.98Å; E80-L195 HydrophobicContact CB-CD2 3.59Å; E80-L195 HydrophobicContact CG-CD2 3.7Å
81K84Confident81.9Confident102 Ų10294.5 Ų94.544%0.44344%0.438SS..Hα-helixtrans-56.4-40.1172-76.7178.3179.1179.10112.2L77 K85L77-K81 HydrophobicContact CG-CD 4.36Å; L77-K81 WeakPolarHBondContact O-CB 3.43Å; L77-K81 VanDerWaalsContact O-CG 3.3Å; L77-K81 WeakPolarHBondContact O-CG 3.44Å; L77-K81 PolarHBondContact O-N 2.92Å; K81-K85 WeakPolarHBondContact O-CB 3.49Å; K81-K85 PolarHBondContact O-N 3.4Å
82K86.2Confident80.1Confident135 Ų13590.1 Ų90.159%0.58743%0.432SS*.Hα-helixtrans-67.9-41.2176.8-172.2178.2-178.5179.20111.8R78 S79 E80 K85 K86R78-K82 WeakPolarHBondContact O-CB 3.47Å; R78-K82 PolarHBondContact O-N 3.47Å; S79-K82 WeakPolarHBondContact O-CB 3.45Å; S79-K82 PolarHBondContact O-N 3Å; E80-K82 VanDerWaalsContact C-N 3.25Å; E80-K82 PolarHBondContact O-N 3.49Å; K82-K85 PolarHBondContact O-N 3.44Å; K82-K86 WeakPolarHBondContact O-CG 3.44Å; K82-K86 PolarHBondContact O-N 3.11Å
83N81.2Confident78.2Confident76 Ų7690.2 Ų90.241%0.40643%0.433SS..Hα-helixtrans-64.9-44.3176.5-71.5-19.1000111.3S79 E80 K85 K86 F87S79-N83 WeakPolarHBondContact O-CB 3.48Å; S79-N83 VanDerWaalsContact O-CG 3.25Å; S79-N83 PolarHBondContact O-N 2.99Å; S79-N83 PolarHBondContact O-ND2 3.47Å; E80-N83 PolarHBondContact O-N 3.13Å; E80-N83 VanDerWaalsContact O-N 3.13Å; N83-K85 PolarHBondContact O-N 2.88Å; N83-K86 WeakPolarHBondContact O-CB 3.28Å; N83-K86 PolarHBondContact O-N 2.84Å; N83-F87 WeakPolarHBondContact O-CB 3.42Å; N83-F87 PolarHBondContact O-N 3.3Å
84L77.8Confident76.5Confident56 Ų5692.8 Ų92.829%0.29345%0.452SS..Hα-helixtrans-61.4-44175.3-143.182.9000111.3E80 K86 F87 Y88 I192E80-L84 WeakPolarHBondContact O-CB 3.38Å; E80-L84 PolarHBondContact O-N 2.98Å; L84-K86 VanDerWaalsContact C-N 3.34Å; L84-K86 PolarHBondContact O-N 3.22Å; L84-F87 PolarHBondContact O-N 3.35Å; L84-Y88 HydrophobicContact CD2-CD2 4.37Å; L84-Y88 HydrophobicContact CD2-CE2 3.83Å; L84-Y88 HydrophobicContact CG-CD2 4.07Å; L84-Y88 HydrophobicContact CG-CE2 3.77Å; L84-Y88 VanDerWaalsContact O-CD2 3.22Å; L84-Y88 WeakPolarHBondContact O-CD2 3.39Å; L84-Y88 PolarHBondContact O-N 2.93Å; L84-I192 HydrophobicContact CD2-CD1 3.69Å; L84-I192 HydrophobicContact CD2-CG1 3.8Å
85K78.4Confident74.7Confident169 Ų16993.2 Ų93.274%0.73546%0.456SS*.Hα-helixtrans-60.1-41.9174.8-173.6175.5-1791770112K81 K82 N83 G89K81-K85 WeakPolarHBondContact O-CB 3.49Å; K81-K85 PolarHBondContact O-N 3.4Å; K82-K85 PolarHBondContact O-N 3.44Å; N83-K85 PolarHBondContact O-N 2.88Å; K85-G89 PolarHBondContact O-N 3.47Å
86K78.7Confident72.6Confident119 Ų11991.6 Ų91.652%0.51745%0.446SS..Hα-helixtrans-61.9-46.3173.8-76.2178.7176-176.30111.6K82 N83 L84 G89 Q90K82-K86 WeakPolarHBondContact O-CG 3.44Å; K82-K86 PolarHBondContact O-N 3.11Å; N83-K86 WeakPolarHBondContact O-CB 3.28Å; N83-K86 PolarHBondContact O-N 2.84Å; L84-K86 VanDerWaalsContact C-N 3.34Å; L84-K86 PolarHBondContact O-N 3.22Å; K86-G89 PolarHBondContact O-N 2.93Å; K86-Q90 WeakPolarHBondContact O-CB 3.37Å; K86-Q90 WeakPolarHBondContact O-CG 3.44Å; K86-Q90 PolarHBondContact O-N 3.45Å
87F73.6Confident70.5Confident120 Ų12094.7 Ų94.753%0.52646%0.46SS..Hα-helixtrans-60-47.1179.2-177.2-95.4000111.9N83 L84 Q90 K91N83-F87 WeakPolarHBondContact O-CB 3.42Å; N83-F87 PolarHBondContact O-N 3.3Å; L84-F87 PolarHBondContact O-N 3.35Å; F87-Q90 PolarHBondContact O-N 3.37Å; F87-K91 HydrophobicContact CE1-CD 4.47Å; F87-K91 WeakPolarHBondContact O-CB 3.28Å; F87-K91 PolarHBondContact O-N 3.23Å
88Y69.9Low68.4Low98 Ų9898.6 Ų98.638%0.38448%0.48SS..Hα-helixtrans-68.1-37.3175.6-78.1-71.3000113L84 K91 S92 S188L84-Y88 HydrophobicContact CD2-CD2 4.37Å; L84-Y88 HydrophobicContact CD2-CE2 3.83Å; L84-Y88 HydrophobicContact CG-CD2 4.07Å; L84-Y88 HydrophobicContact CG-CE2 3.77Å; L84-Y88 VanDerWaalsContact O-CD2 3.22Å; L84-Y88 WeakPolarHBondContact O-CD2 3.39Å; L84-Y88 PolarHBondContact O-N 2.93Å; Y88-K91 PolarHBondContact O-N 3.05Å; Y88-S92 WeakPolarHBondContact O-CB 3.27Å; Y88-S92 PolarHBondContact O-N 3.23Å; Y88-S92 PolarHBondContact O-OG 3Å; Y88-S188 WeakPolarHBondContact OH-CB 3.36Å
89G67.2Low66.4Low28 Ų2893.8 Ų93.829%0.28947%0.471SS..Hα-helixtrans-59.3-49173.300000111.9K85 K86 K91 S92 Q93K85-G89 PolarHBondContact O-N 3.47Å; K86-G89 PolarHBondContact O-N 2.93Å; G89-K91 PolarHBondContact O-N 3.5Å; G89-S92 PolarHBondContact O-N 3.33Å; G89-S92 PolarHBondContact O-OG 3.04Å; G89-Q93 WeakPolarHBondContact O-CG 3.39Å; G89-Q93 PolarHBondContact O-N 2.99Å
90Q67.2Low64.3Low121 Ų12197.6 Ų97.657%0.56549%0.487SS*.Hα-helixtrans-62.3-41.8175-74.9177.4-17.600112K86 F87 S92 Q93 S94K86-Q90 WeakPolarHBondContact O-CB 3.37Å; K86-Q90 WeakPolarHBondContact O-CG 3.44Å; K86-Q90 PolarHBondContact O-N 3.45Å; F87-Q90 PolarHBondContact O-N 3.37Å; Q90-S92 VanDerWaalsContact C-N 3.34Å; Q90-S92 PolarHBondContact O-N 2.89Å; Q90-Q93 PolarHBondContact O-N 3.46Å; Q90-S94 WeakPolarHBondContact O-CB 3.45Å; Q90-S94 PolarHBondContact O-N 2.87Å; Q90-S94 PolarHBondContact O-OG 3.34Å
91K61.4Low62.2Low114 Ų11499.4 Ų99.450%0.49650%0.499SS..Hα-helixtrans-63.5-39.8176.1-159.8174.8-176.2178.80111.8F87 Y88 G89 S94 I95F87-K91 HydrophobicContact CE1-CD 4.47Å; F87-K91 WeakPolarHBondContact O-CB 3.28Å; F87-K91 PolarHBondContact O-N 3.23Å; Y88-K91 PolarHBondContact O-N 3.05Å; G89-K91 PolarHBondContact O-N 3.5Å; K91-S94 WeakPolarHBondContact O-CB 3.4Å; K91-S94 PolarHBondContact O-N 2.88Å; K91-I95 HydrophobicContact CG-CD1 4.29Å; K91-I95 WeakPolarHBondContact O-CD1 3.27Å; K91-I95 VanDerWaalsContact O-CG1 3.23Å; K91-I95 WeakPolarHBondContact O-CG1 3.27Å; K91-I95 PolarHBondContact O-N 2.86Å
92S55Low60Low70 Ų70100 Ų10049%0.4951%0.506SS..Hα-helixtrans-66.6-38.3175.370.20000112.6Y88 G89 Q90 I95 S96Y88-S92 WeakPolarHBondContact O-CB 3.27Å; Y88-S92 PolarHBondContact O-N 3.23Å; Y88-S92 PolarHBondContact O-OG 3Å; G89-S92 PolarHBondContact O-N 3.33Å; G89-S92 PolarHBondContact O-OG 3.04Å; Q90-S92 VanDerWaalsContact C-N 3.34Å; Q90-S92 PolarHBondContact O-N 2.89Å; S92-I95 PolarHBondContact O-N 3.43Å; S92-S96 PolarHBondContact O-N 2.88Å
93Q54.3Low57.7Low116 Ų116100.8 Ų100.854%0.54252%0.517SS..Hα-helixtrans-65.7-43.6172.4-73.8178.2-14.800111.2G89 Q90 I95 S96 H97G89-Q93 WeakPolarHBondContact O-CG 3.39Å; G89-Q93 PolarHBondContact O-N 2.99Å; Q90-Q93 PolarHBondContact O-N 3.46Å; Q93-I95 VanDerWaalsContact C-N 3.29Å; Q93-I95 PolarHBondContact O-N 3.44Å; Q93-S96 WeakPolarHBondContact CA-OG 3.41Å; Q93-S96 CarbonylContact O-C 3.49Å; Q93-S96 PolarHBondContact O-N 3.05Å; Q93-S96 VanDerWaalsContact O-N 3.08Å; Q93-S96 PolarHBondContact O-OG 2.77Å; Q93-H97 PolarHBondContact O-CD2 3.15Å; Q93-H97 PolarHBondContact O-N 3.21Å
94S54.1Low55.4Low66 Ų66104.5 Ų104.546%0.46254%0.536SS..Hα-helixtrans-58.8-41175.3-50.20000111.7Q90 K91 H97 L98Q90-S94 WeakPolarHBondContact O-CB 3.45Å; Q90-S94 PolarHBondContact O-N 2.87Å; Q90-S94 PolarHBondContact O-OG 3.34Å; K91-S94 WeakPolarHBondContact O-CB 3.4Å; K91-S94 PolarHBondContact O-N 2.88Å; S94-H97 PolarHBondContact O-N 3.13Å; S94-L98 WeakPolarHBondContact O-CG 3.48Å; S94-L98 PolarHBondContact O-N 2.96Å; S94-L98 VanDerWaalsContact O-N 3.11Å
95I50.6Low53.3Low90 Ų90107.1 Ų107.146%0.46256%0.557SS.*Hα-helixtrans-69.3-39.3174.2-66.5162.7000110.8K91 S92 Q93 H97 L98 T99K91-I95 HydrophobicContact CG-CD1 4.29Å; K91-I95 WeakPolarHBondContact O-CD1 3.27Å; K91-I95 VanDerWaalsContact O-CG1 3.23Å; K91-I95 WeakPolarHBondContact O-CG1 3.27Å; K91-I95 PolarHBondContact O-N 2.86Å; S92-I95 PolarHBondContact O-N 3.43Å; Q93-I95 VanDerWaalsContact C-N 3.29Å; Q93-I95 PolarHBondContact O-N 3.44Å; I95-H97 VanDerWaalsContact C-N 3.31Å; I95-H97 PolarHBondContact O-N 3.39Å; I95-L98 CarbonylContact O-C 3.57Å; I95-L98 WeakPolarHBondContact O-CA 3.29Å; I95-L98 WeakPolarHBondContact O-CB 3.48Å; I95-L98 PolarHBondContact O-N 2.97Å; I95-L98 VanDerWaalsContact O-N 3.1Å; I95-T99 PolarHBondContact O-N 3.48Å; I95-T99 PolarHBondContact O-OG1 3.41Å
96S47.2Very low51Low45 Ų45106.5 Ų106.532%0.31556%0.56SS.*Hα-helixtrans-65.9-33.1175.470.80000113.2S92 Q93 L98 T99 N100S92-S96 PolarHBondContact O-N 2.88Å; Q93-S96 WeakPolarHBondContact CA-OG 3.41Å; Q93-S96 CarbonylContact O-C 3.49Å; Q93-S96 PolarHBondContact O-N 3.05Å; Q93-S96 VanDerWaalsContact O-N 3.08Å; Q93-S96 PolarHBondContact O-OG 2.77Å; S96-L98 VanDerWaalsContact C-N 3.3Å; S96-T99 VanDerWaalsContact CA-OG1 3.27Å; S96-T99 WeakPolarHBondContact CA-OG1 3.43Å; S96-T99 PolarHBondContact O-N 3.07Å; S96-T99 PolarHBondContact O-OG1 2.9Å; S96-N100 WeakPolarHBondContact O-CB 3.39Å; S96-N100 PolarHBondContact O-N 3Å
97H44.8Very low48.7Very low123 Ų123106.2 Ų106.257%0.56957%0.573SS**Hα-helixtrans-69.3-30.8172.5-70.2-55000111.4Q93 S94 I95Q93-H97 PolarHBondContact O-CD2 3.15Å; Q93-H97 PolarHBondContact O-N 3.21Å; S94-H97 PolarHBondContact O-N 3.13Å; I95-H97 VanDerWaalsContact C-N 3.31Å; I95-H97 PolarHBondContact O-N 3.39Å
98L44.9Very low46.7Very low106 Ų106106.1 Ų106.156%0.55559%0.588SS**Hα-helixtrans-73.2-33.4170.4-73.5164.1000112.6S94 I95 S96S94-L98 WeakPolarHBondContact O-CG 3.48Å; S94-L98 PolarHBondContact O-N 2.96Å; S94-L98 VanDerWaalsContact O-N 3.11Å; I95-L98 CarbonylContact O-C 3.57Å; I95-L98 WeakPolarHBondContact O-CA 3.29Å; I95-L98 WeakPolarHBondContact O-CB 3.48Å; I95-L98 PolarHBondContact O-N 2.97Å; I95-L98 VanDerWaalsContact O-N 3.1Å; S96-L98 VanDerWaalsContact C-N 3.3Å
99T45.3Very low44.9Very low78 Ų78109.1 Ų109.148%0.47961%0.609SS.*Hα-helixtrans-76.7-25.9177.853.90000113.8I95 S96 L101 N102I95-T99 PolarHBondContact O-N 3.48Å; I95-T99 PolarHBondContact O-OG1 3.41Å; S96-T99 VanDerWaalsContact CA-OG1 3.27Å; S96-T99 WeakPolarHBondContact CA-OG1 3.43Å; S96-T99 PolarHBondContact O-N 3.07Å; S96-T99 PolarHBondContact O-OG1 2.9Å; T99-L101 VanDerWaalsContact C-N 3.34Å; T99-N102 PolarHBondContact O-ND2 3.44Å
100N44.1Very low43.1Very low133 Ų133112.6 Ų112.671%0.71163%0.628SS**THydrogen-bonded Turntrans-85.8-0179.5-76.9-9.8000114.3S96 N102S96-N100 WeakPolarHBondContact O-CB 3.39Å; S96-N100 PolarHBondContact O-N 3Å; N100-N102 VanDerWaalsContact C-N 3.34Å
101L40.1Very low41.3Very low123 Ų123113.7 Ų113.764%0.64464%0.638SS**  trans-98.643.3173.5-75.8166.9000111.6T99T99-L101 VanDerWaalsContact C-N 3.34Å
102N38.2Very low39.9Very low113 Ų113115 Ų11560%0.60465%0.65SS**  trans-86.2-3.4176.2-88.9-32.1000114.4T99 N100T99-N102 PolarHBondContact O-ND2 3.44Å; N100-N102 VanDerWaalsContact C-N 3.34Å
103D36.9Very low38.6Very low152 Ų152119.1 Ų119.181%0.81367%0.666SS**SBendtrans-110.772.7176.1-69.2-25.7000110.7
104L33.6Very low37.4Very low155 Ų155121.8 Ų121.881%0.81268%0.683SS**SBendtrans-164.7146.6150.1-122.684.8000110.1
105P34.4Very low36.1Very low111 Ų111126.9 Ų126.972%0.72170%0.7SS**  trans-79.4144.5-157.530.5-32.6000114.4S107P105-S107 PolarHBondContact O-N 2.97Å
106L30.3Very low34.9Very low155 Ų155128.3 Ų128.381%0.81271%0.713SS**  trans-53.2117.9178.2-7573.7000111.8
107S30.6Very low33.9Very low113 Ų113134.2 Ų134.279%0.7974%0.74SS**  trans-142.4129152.249.50000110.5P105P105-S107 PolarHBondContact O-N 2.97Å
108S29.7Very low32.9Very low118 Ų118136.6 Ų136.683%0.82575%0.752SS**  trans-63.2127.1-171.846.20000113.7
109I32.2Very low31.9Very low161 Ų161141.3 Ų141.383%0.82676%0.764SS**  trans-135.9131.9158.1-59.7-179000110.2
110S29.2Very low30.9Very low101 Ų101144.4 Ų144.471%0.70678%0.777SS**  trans-66.2139.7-175.2179.60000113.8N112S110-N112 PolarHBondContact O-N 3.49Å; S110-N112 VanDerWaalsContact O-N 3.1Å
111L30.3Very low29.9Very low145 Ų145143.4 Ų143.476%0.75978%0.776SS**  trans-73.784.4171.8-73.3160.2000110.1
112N31.4Very low29.2Very low140 Ų140144.6 Ų144.675%0.74978%0.783SS**  trans-127.6106.2156.6-96.1-10.5000107.1S110S110-N112 PolarHBondContact O-N 3.49Å; S110-N112 VanDerWaalsContact O-N 3.1Å
113N28Very low28.5Very low157 Ų157143.8 Ų143.884%0.8479%0.786SS**  trans130.961.8167.8-64.9-17.4000113.2
114L29.1Very low27.8Very low172 Ų172142.8 Ų142.890%0.90179%0.786SS**  trans-127.789.7140.9-110.9141000105.7T116L114-T116 PolarHBondContact O-N 3.4Å
115Q26.5Very low27.5Very low173 Ų173139.5 Ų139.581%0.80878%0.781SS**  trans-47.2115.6163.6-82.6168.5-2200107.3L117Q115-L117 VanDerWaalsContact C-N 3.3Å; Q115-L117 PolarHBondContact O-N 3.5Å
116T26.3Very low27Very low120 Ų120141.1 Ų141.174%0.73678%0.784SS**  trans-33.8100.2145.840.60000108.6L114 Q118L114-T116 PolarHBondContact O-N 3.4Å; T116-Q118 PolarHBondContact O-N 3.4Å
117L25.5Very low26.6Very low169 Ų169139.5 Ų139.589%0.88578%0.78SS**  trans-58.993.7155.8-99.9153.7000104.6Q115 Y119Q115-L117 VanDerWaalsContact C-N 3.3Å; Q115-L117 PolarHBondContact O-N 3.5Å; L117-Y119 PolarHBondContact O-N 2.9Å; L117-Y119 VanDerWaalsContact O-N 3.16Å
118Q23.8Very low26.3Very low173 Ų173139.7 Ų139.781%0.80878%0.777SS**  trans-53.8121.1176-81-177.2-41.300107.1T116 N120T116-Q118 PolarHBondContact O-N 3.4Å; Q118-N120 PolarHBondContact O-N 3.31Å
119Y24.7Very low26Very low206 Ų206140.6 Ų140.681%0.80877%0.772SS**  trans-48.4111.6156.3-85.2-96.4000107.4L117 T121L117-Y119 PolarHBondContact O-N 2.9Å; L117-Y119 VanDerWaalsContact O-N 3.16Å; Y119-T121 PolarHBondContact O-N 2.98Å
120N23.7Very low25.6Very low142 Ų142139 Ų13976%0.75977%0.766SS**  trans-73.174.7167.8-164.212.8000107.5Q118 N122Q118-N120 PolarHBondContact O-N 3.31Å; N120-N122 PolarHBondContact OD1-OD1 3.07Å
121T23.7Very low25.5Very low112 Ų112142.8 Ų142.869%0.68777%0.772SS**  trans-95.597.9163.842.30000107Y119 S123Y119-T121 PolarHBondContact O-N 2.98Å; T121-S123 PolarHBondContact O-N 3.49Å
122N25Very low25.1Very low149 Ų149140.6 Ų140.680%0.79777%0.769SS**  trans-54.2105166.5-71-23.3000109.1N120N120-N122 PolarHBondContact OD1-OD1 3.07Å
123S23.1Very low24.7Very low96 Ų96141.4 Ų141.467%0.67177%0.772SS**  trans-146.9113.4161.7-165.80000110.1T121T121-S123 PolarHBondContact O-N 3.49Å
124T23.2Very low24.3Very low130 Ų130141.3 Ų141.380%0.79877%0.77SS**  trans33.4113.2142.251.60000119.3
125A25.7Very low24.2Very low87 Ų87139.7 Ų139.772%0.71976%0.761SS**  172.2126110.900000112.3
126N24Very low24Very low144 Ų144137.7 Ų137.777%0.7776%0.756SS**  trans94.3110.7146.6-60.1-10000121
127T22.8Very low23.9Very low121 Ų121140.1 Ų140.174%0.74276%0.758SS**  trans91.6114.8133.748.30000120.1
128T24.2Very low23.7Very low117 Ų117137.1 Ų137.172%0.71875%0.751SS**  trans60.2109.6146.155.90000115.3
129D23Very low23.7Very low137 Ų137136.2 Ų136.273%0.73375%0.752SS**  cis-173.1143.745.7-91.5-26000109.8
130N23.6Very low23.7Very low128 Ų128133 Ų13368%0.68475%0.754SS**  trans42.7100.1150.9-56.5-34.3000119.4
131H27Very low23.7Very low181 Ų181131.6 Ų131.684%0.83876%0.755SS**  -177.4122.595.1-94.9-72.4000110.6
132S22.5Very low23.8Very low99 Ų99130.8 Ų130.869%0.69275%0.754SS**  trans-39.4130.2162.849.30000114.1
133L23.6Very low23.6Very low156 Ų156132.3 Ų132.382%0.81776%0.756SS**  trans-147.991.9139.2-134.5102000110.1I135L133-I135 HydrophobicContact CD2-CD1 4.02Å; L133-I135 HydrophobicContact CD2-CG1 4.17Å
134I19.8Very low23.5Very low156 Ų156135.7 Ų135.780%0.877%0.766SS**  trans-77.4112155.4-65.7167.7000105.9
135I27.4Very low23.7Very low137 Ų137134.9 Ų134.970%0.70376%0.763SS**  trans-153.398.5152.7-52.4-177.4000104L133L133-I135 HydrophobicContact CD2-CD1 4.02Å; L133-I135 HydrophobicContact CD2-CG1 4.17Å
136D20.8Very low23.8Very low132 Ų132136.5 Ų136.571%0.70677%0.766SS**  68.8144.963.4-1431.5000113.8
137H24.2Very low23.7Very low170 Ų170138.7 Ų138.779%0.78777%0.772SS**  trans-59.6159.3-161.6-69.3-85.9000116.2
138S22.1Very low23.8Very low106 Ų106139.3 Ų139.374%0.74178%0.775SS**  trans111.9126142.677.50000119.1
139N23.1Very low23.7Very low154 Ų154138.7 Ų138.782%0.82478%0.776SS**  trans49.8101.6139.6-65.5-16.1000119.7
140V26.2Very low23.7Very low139 Ų139137 Ų13784%0.84278%0.775SS**  trans-136.498.4136.7-172.50000110.1
141S23.4Very low23.7Very low113 Ų113138.4 Ų138.479%0.7978%0.781SS**  trans-51.9129147.6155.40000109.4
142S25.3Very low23.6Very low94 Ų94134.3 Ų134.366%0.65777%0.772SS**  trans-170.4120145-78.30000112.2
143Q21.2Very low23.8Very low181 Ų181139.2 Ų139.285%0.84678%0.784SS**  trans68.3102.3144.1-79.1170-39.100120.3
144L21.5Very low23.8Very low167 Ų167136.1 Ų136.187%0.87478%0.775SS**  trans-45.8136.7141.7-72.7121.9000112
145P26.6Very low24.1Very low113 Ų113137.8 Ų137.873%0.73478%0.777SS**PPolyproline II helixtrans-91.1160.5147.720.5-4.5000111.4
146P27.8Very low24Very low121 Ų121139.2 Ų139.279%0.78679%0.786SS**PPolyproline II helixtrans-93.1163.1-147.12.117.6000114.7T148P146-T148 PolarHBondContact O-N 2.95Å
147E21.6Very low24.2Very low190 Ų190140.1 Ų140.189%0.88879%0.786SS**PPolyproline II helixtrans-55.9119.2159.6-61.7-176.815100111
148T24.5Very low24.3Very low134 Ų134139.9 Ų139.982%0.82279%0.79SS**  trans-154.2129.5138.947.40000110.6P146P146-T148 PolarHBondContact O-N 2.95Å
149S21.6Very low24.6Very low104 Ų104142.5 Ų142.573%0.72780%0.795SS**  trans-14.8143.2160.1480000119.9
150S23.5Very low24.6Very low101 Ų101144.2 Ų144.271%0.70680%0.795SS**  trans67.6116.5149.262.80000118.4
151I24.7Very low24.8Very low159 Ų159148.2 Ų148.282%0.81580%0.797SS**  169.9130116.6-81.9153.1000109.6
152S24.2Very low24.8Very low94 Ų94151.5 Ų151.566%0.65780%0.8SS**  trans-0.5125.9170.250.80000121.4S154S152-S154 PolarHBondContact O-N 3.08Å; S152-S154 VanDerWaalsContact O-N 3.16Å
153H26.1Very low24.8Very low202 Ų202153.6 Ų153.694%0.93581%0.809SS**  trans-47106.5154.2-70.5-64.5000113
154S23.9Very low25Very low92 Ų92156.3 Ų156.364%0.64381%0.811SS**  trans-167.892.4149.836.70000111.3S152S152-S154 PolarHBondContact O-N 3.08Å; S152-S154 VanDerWaalsContact O-N 3.16Å
155F26Very low25.1Very low190 Ų190154.6 Ų154.683%0.83380%0.803SS**  trans-139.575.4156.1-92.9-79.2000108.7H157F155-H157 HydrophobicContact CD1-CB 4.35Å
156N26.2Very low25.1Very low167 Ų167156 Ų15689%0.89380%0.804SS**  trans-95.684.5148.7-88.2-24.7000106.1
157H25.5Very low25.2Very low151 Ų151157.4 Ų157.470%0.69981%0.805SS**  trans-134.986.1169-88.9-64.4000108.7F155F155-H157 HydrophobicContact CD1-CB 4.35Å
158L25.7Very low25.5Very low166 Ų166159.2 Ų159.287%0.86980%0.804SS**  trans-156.590.2147.1-135.980.5000108.2
159N28.5Very low25.9Very low160 Ų160158.1 Ų158.186%0.85680%0.799SS**  trans-171.671.7145.2-90.9-18.5000107.6
160K23.1Very low26.5Very low191 Ų191160.3 Ų160.383%0.8380%0.801SS**  trans-85.1107.3153.6-82.8-178.8174.4-179.10106.1
161Y29.8Very low26.8Very low222 Ų222158.9 Ų158.987%0.87180%0.802SS**  trans-142.4111.9144-86-71.1000108
162E23.2Very low27.4Very low182 Ų182157.7 Ų157.785%0.8580%0.797SS**  trans-50138157.1-65.2166.7121.200109.7
163T26Very low27.5Very low139 Ų139159 Ų15985%0.85380%0.796SS**  trans-167.2102.913511.80000111.1
164R23.9Very low27.7Very low238 Ų238157 Ų15790%0.89879%0.785SS**  trans-2.5118.7135.2-140.8176.2-163.3175.73.3115.2
165N24.7Very low27.9Very low130 Ų130161 Ų16170%0.69579%0.794SS**  trans41102.4135.3-142.820.6000118
166N26.8Very low28.2Very low143 Ų143160.3 Ų160.377%0.76580%0.798SS**  -179.5128.7110.8-93.1-20.5000111.8R168N166-R168 PolarHBondContact O-N 2.95Å
167N28.8Very low28.5Very low151 Ų151157.8 Ų157.881%0.80779%0.793SS**  trans-45.4117.8170.2-62.4-35.5000112.3
168R27.6Very low28.7Very low228 Ų228160.3 Ų160.386%0.8680%0.796SS**  trans-164.6113.5140.7-108165.2-165.1-143.93.4110.5N166N166-R168 PolarHBondContact O-N 2.95Å
169P34.5Very low29.2Very low111 Ų111157.1 Ų157.172%0.72179%0.788SS**  trans-77.5131.7-17627.9-28.7000111.2
170I33.2Very low29.4Very low150 Ų150156.8 Ų156.877%0.76979%0.786SS**  trans-86.6105.9178.6-66.5164000107.6
171G31Very low30Very low70 Ų70155.2 Ų155.272%0.72278%0.776SS**  trans-106.8115.9174.600000111.3
172L35.6Very low30.2Very low134 Ų134150.7 Ų150.770%0.70276%0.764SS**  trans-107.7129.6169.4-83.8168.9000110
173N27.9Very low30.9Very low121 Ų121149.5 Ų149.565%0.64776%0.763SS**  trans-67.5136.7-174.2-90.4-60.6000114.4
174K29.7Very low31.2Very low162 Ų162149.8 Ų149.870%0.70475%0.754SS**  trans19.8112135.1-69.9172177.4172.30117.4
175Q28.8Very low32.1Very low176 Ų176140 Ų14082%0.82272%0.722SS**  trans179.643.4130.3-87.9-60.5-14.400110.2
176L31.3Very low33.3Very low175 Ų175141 Ų14192%0.91672%0.721SS**  trans-118.661.5168.1-73.8171.5000110.1R178L176-R178 PolarHBondContact O-N 3.32Å
177S32.4Very low34.4Very low114 Ų114143 Ų14380%0.79772%0.722SS**  trans-74.892.1163.6-170.60000108.8
178R30.8Very low35.5Very low204 Ų204136.8 Ų136.877%0.7769%0.691SS**  trans154.377.9159.2-96.3177.4156161.1-5.6109.9L176L176-R178 PolarHBondContact O-N 3.32Å
179S35.3Very low36.8Very low98 Ų98129.6 Ų129.669%0.68567%0.669SS**G310 helixtrans-87.52.9176.346.40000114.8Y181S179-Y181 VanDerWaalsContact C-N 3.34Å
180D33.8Very low38.1Very low154 Ų154131 Ų13182%0.82466%0.661SS**G310 helixtrans-86.40.8177-67-23.1000114.3
181Y35.1Very low39.9Very low158 Ų158126.2 Ų126.262%0.6265%0.648SS**G310 helixtrans-105.14.3-179.2-89-84.9000115.8S179S179-Y181 VanDerWaalsContact C-N 3.34Å
182M33.8Very low42.1Very low126 Ų126125.2 Ų125.262%0.62163%0.626SS**G310 helixtrans-86-15.1-174.1-79-75.399.100116.1H184M182-H184 PolarHBondContact O-N 3.3Å
183L37.2Very low44.2Very low157 Ų157123.4 Ų123.482%0.82261%0.614SS**G310 helixtrans-74.6-12.9170.9-84.5161.4000113.2
184H34Very low46.7Very low146 Ų146123.7 Ų123.768%0.67661%0.611SS**G310 helixtrans-118.216.5-179.1-63.7-47.2000114M182 K186M182-H184 PolarHBondContact O-N 3.3Å; H184-K186 PolarHBondContact O-N 3.39Å
185S42.5Very low49.2Very low31 Ų31117.6 Ų117.622%0.21759%0.586CS.*  trans-64.1110.9170.9104.50000107.8K187 S188S185-K187 PolarHBondContact O-N 3.42Å; S185-S188 PolarHBondContact O-N 2.89Å; S185-S188 PolarHBondContact O-OG 3.41Å
186K49.1Very low51.9Low153 Ų153112.4 Ų112.467%0.66556%0.564SS**Hα-helixtrans-48.3-29.8177.4-72.4-177.4174.1-178.40111.7H184 S188 L189 Y190H184-K186 PolarHBondContact O-N 3.39Å; K186-S188 PolarHBondContact O-N 3.49Å; K186-L189 PolarHBondContact O-N 3.2Å; K186-Y190 VanDerWaalsContact C-CD2 3.44Å; K186-Y190 HydrophobicContact CB-CD2 4.38Å; K186-Y190 HydrophobicContact CB-CE2 3.81Å; K186-Y190 WeakPolarHBondContact O-CD2 3.43Å; K186-Y190 PolarHBondContact O-N 3.31Å
187K49.6Very low54.6Low183 Ų183108.7 Ų108.780%0.79655%0.545SS*.Hα-helixtrans-56.8-34.5174.6-82.8-175.4175.2-179.10116S185S185-K187 PolarHBondContact O-N 3.42Å
188S52.7Low57.2Low21 Ų21106.3 Ų106.315%0.14752%0.521CS..Hα-helixtrans-82.1-27.3177.269.10000113Y88 S185 K186Y88-S188 WeakPolarHBondContact OH-CB 3.36Å; S185-S188 PolarHBondContact O-N 2.89Å; S185-S188 PolarHBondContact O-OG 3.41Å; K186-S188 PolarHBondContact O-N 3.49Å
189L54.5Low59.9Low77 Ų7797 Ų9740%0.40349%0.487SS..Hα-helixtrans-69.6-39.3173.7-82.8146.3000111K186 G191 I192 E193K186-L189 PolarHBondContact O-N 3.2Å; L189-G191 VanDerWaalsContact C-N 3.27Å; L189-G191 PolarHBondContact O-N 3.03Å; L189-I192 PolarHBondContact O-N 3.37Å; L189-I192 VanDerWaalsContact O-N 3.11Å; L189-E193 WeakPolarHBondContact O-CB 3.43Å; L189-E193 WeakPolarHBondContact O-CG 3.49Å; L189-E193 PolarHBondContact O-N 3Å
190Y61.2Low62.5Low141 Ų14197.4 Ų97.455%0.55348%0.478SS*.Hα-helixtrans-55.3-37.4178-77.9-65.7000113.8K186 H194K186-Y190 VanDerWaalsContact C-CD2 3.44Å; K186-Y190 HydrophobicContact CB-CD2 4.38Å; K186-Y190 HydrophobicContact CB-CE2 3.81Å; K186-Y190 WeakPolarHBondContact O-CD2 3.43Å; K186-Y190 PolarHBondContact O-N 3.31Å; Y190-H194 VanDerWaalsContact O-CB 3.29Å; Y190-H194 WeakPolarHBondContact O-CB 3.39Å; Y190-H194 PolarHBondContact O-N 2.92Å
191G72.1Confident65.1Low49 Ų4996 Ų9651%0.50547%0.467SS..Hα-helixtrans-69.3-38.2178.100000113.6L189 L195L189-G191 VanDerWaalsContact C-N 3.27Å; L189-G191 PolarHBondContact O-N 3.03Å; G191-L195 PolarHBondContact O-N 3.37Å
192I76.7Confident67.8Low50 Ų5093.5 Ų93.526%0.25646%0.456SS..Hα-helixtrans-73.6-40.1176.2-61.7176.7000110.5L84 L189 L195 N196L84-I192 HydrophobicContact CD2-CD1 3.69Å; L84-I192 HydrophobicContact CD2-CG1 3.8Å; L189-I192 PolarHBondContact O-N 3.37Å; L189-I192 VanDerWaalsContact O-N 3.11Å; I192-L195 PolarHBondContact O-N 3.5Å; I192-N196 VanDerWaalsContact O-CB 3.28Å; I192-N196 WeakPolarHBondContact O-CB 3.34Å; I192-N196 PolarHBondContact O-N 2.9Å
193E79.7Confident70.5Confident96 Ų9689 Ų8945%0.44943%0.433SS..Hα-helixtrans-62.9-44.9176.7-74.6174-174.200111.3L189 N196 N197L189-E193 WeakPolarHBondContact O-CB 3.43Å; L189-E193 WeakPolarHBondContact O-CG 3.49Å; L189-E193 PolarHBondContact O-N 3Å; E193-N196 PolarHBondContact O-N 3.37Å; E193-N197 PolarHBondContact O-N 3.38Å; E193-N197 PolarHBondContact O-ND2 3.45Å; E193-N197 PolarHBondContact O-OD1 3.2Å
194H80.1Confident73Confident127 Ų12787.7 Ų87.759%0.58842%0.418SS*.Hα-helixtrans-59.6-48.7175-176.4-75.5000111.8Y190 N196 N197 E198Y190-H194 VanDerWaalsContact O-CB 3.29Å; Y190-H194 WeakPolarHBondContact O-CB 3.39Å; Y190-H194 PolarHBondContact O-N 2.92Å; H194-N196 VanDerWaalsContact C-N 3.3Å; H194-N196 PolarHBondContact O-N 3Å; H194-N197 PolarHBondContact O-N 3.48Å; H194-E198 PolarHBondContact O-N 3.02Å
195L81.9Confident75.7Confident33 Ų3386.8 Ų86.817%0.17341%0.414CS..Hα-helixtrans-60.5-41.4176.5-179.469.1000111.5L77 E80 G191 I192 N197 E198 L199L77-L195 HydrophobicContact CD1-CD2 4.18Å; E80-L195 HydrophobicContact CB-CD2 3.59Å; E80-L195 HydrophobicContact CG-CD2 3.7Å; G191-L195 PolarHBondContact O-N 3.37Å; I192-L195 PolarHBondContact O-N 3.5Å; L195-N197 VanDerWaalsContact C-N 3.32Å; L195-N197 PolarHBondContact O-N 3.28Å; L195-E198 PolarHBondContact O-N 2.91Å; L195-L199 HydrophobicContact CD1-CD1 4.45Å; L195-L199 HydrophobicContact CD1-CG 4.37Å; L195-L199 HydrophobicContact CG-CD1 4.1Å; L195-L199 HydrophobicContact CG-CG 4.4Å; L195-L199 VanDerWaalsContact O-CG 3.26Å; L195-L199 WeakPolarHBondContact O-CG 3.37Å; L195-L199 PolarHBondContact O-N 3.32Å
196N85.7Confident77.9Confident67 Ų6786.4 Ų86.436%0.35841%0.411SS..Hα-helixtrans-62.9-40.8177.9-170.675.5000111.6I192 E193 H194 E200I192-N196 VanDerWaalsContact O-CB 3.28Å; I192-N196 WeakPolarHBondContact O-CB 3.34Å; I192-N196 PolarHBondContact O-N 2.9Å; E193-N196 PolarHBondContact O-N 3.37Å; H194-N196 VanDerWaalsContact C-N 3.3Å; H194-N196 PolarHBondContact O-N 3Å; N196-E200 WeakPolarHBondContact O-CB 3.34Å; N196-E200 PolarHBondContact O-N 2.95Å
197N88.1Confident79.9Confident97 Ų9781.2 Ų81.252%0.51939%0.39SS..Hα-helixtrans-64.9-44.4175.2-66.9-13.7000111.4E193 H194 L195 L199 E200 E201E193-N197 PolarHBondContact O-N 3.38Å; E193-N197 PolarHBondContact O-ND2 3.45Å; E193-N197 PolarHBondContact O-OD1 3.2Å; H194-N197 PolarHBondContact O-N 3.48Å; L195-N197 VanDerWaalsContact C-N 3.32Å; L195-N197 PolarHBondContact O-N 3.28Å; N197-L199 PolarHBondContact O-N 3.27Å; N197-E200 PolarHBondContact O-N 2.96Å; N197-E201 WeakPolarHBondContact O-CG 3.43Å; N197-E201 PolarHBondContact O-N 3.3Å
198E88.2Confident81.9Confident65 Ų6574.7 Ų74.730%0.30436%0.363SS..Hα-helixtrans-60.8-43.4176.8-173.5-173.4165.800112.1H194 L195 E200 E201 R202H194-E198 PolarHBondContact O-N 3.02Å; L195-E198 PolarHBondContact O-N 2.91Å; E198-E200 VanDerWaalsContact C-N 3.33Å; E198-E200 PolarHBondContact O-N 3.29Å; E198-E201 PolarHBondContact O-N 3.01Å; E198-R202 WeakPolarHBondContact O-CG 3.29Å; E198-R202 PolarHBondContact O-N 3.46Å; E198-R202 IonicContact OE1-CZ 2.65Å; E198-R202 IonicContact OE1-NE 2.99Å; E198-R202 IonicContact OE1-NH2 3.71Å; E198-R202 PolarHBondContact OE1-NH2 2.95Å
199L87.3Confident83.7Confident9 Ų978.9 Ų78.95%0.04738%0.384CS..Hα-helixtrans-66.1-36.2176.7-66.2174.1000111.8L73 E76 L77 L195 N197 R202 F203L73-L199 HydrophobicContact CD2-CD2 3.63Å; E76-L199 HydrophobicContact CG-CD2 4.49Å; L77-L199 HydrophobicContact CB-CD1 3.84Å; L77-L199 HydrophobicContact CD1-CD1 4.17Å; L195-L199 HydrophobicContact CD1-CD1 4.45Å; L195-L199 HydrophobicContact CD1-CG 4.37Å; L195-L199 HydrophobicContact CG-CD1 4.1Å; L195-L199 HydrophobicContact CG-CG 4.4Å; L195-L199 VanDerWaalsContact O-CG 3.26Å; L195-L199 WeakPolarHBondContact O-CG 3.37Å; L195-L199 PolarHBondContact O-N 3.32Å; N197-L199 PolarHBondContact O-N 3.27Å; L199-R202 PolarHBondContact O-N 3.37Å; L199-F203 PolarHBondContact O-N 2.88Å
200E89.7Confident85.5Confident105 Ų10576.2 Ų76.249%0.49137%0.369SS..Hα-helixtrans-68.4-39175.5-163.363.6-140.700111.6N196 N197 E198 F203 Y204N196-E200 WeakPolarHBondContact O-CB 3.34Å; N196-E200 PolarHBondContact O-N 2.95Å; N197-E200 PolarHBondContact O-N 2.96Å; E198-E200 VanDerWaalsContact C-N 3.33Å; E198-E200 PolarHBondContact O-N 3.29Å; E200-F203 PolarHBondContact O-N 3.23Å; E200-Y204 WeakPolarHBondContact O-CB 3.34Å; E200-Y204 PolarHBondContact O-N 3.46Å
201E88.8Confident86.9Confident126 Ų12674.7 Ų74.759%0.58937%0.365SS*.Hα-helixtrans-61.1-44.8172.1-76.1179.8-177.600111.7N197 E198 F203 Y204 H205N197-E201 WeakPolarHBondContact O-CG 3.43Å; N197-E201 PolarHBondContact O-N 3.3Å; E198-E201 PolarHBondContact O-N 3.01Å; E201-F203 VanDerWaalsContact C-N 3.33Å; E201-F203 PolarHBondContact O-N 3.41Å; E201-Y204 WeakPolarHBondContact O-CB 3.43Å; E201-Y204 PolarHBondContact O-N 2.91Å; E201-H205 PolarHBondContact O-CD2 2.91Å; E201-H205 VanDerWaalsContact O-CD2 3.22Å; E201-H205 PolarHBondContact O-N 3Å
202R90.9Very high87.9Confident105 Ų10576.7 Ų76.740%0.39637%0.365SS..Hα-helixtrans-61.2-40.8174.2-69.5178.4-172.6-176.12.6111.7E76 E198 L199 H205 C206E76-R202 IonicContact OE1-NH1 3.96Å; E198-R202 WeakPolarHBondContact O-CG 3.29Å; E198-R202 PolarHBondContact O-N 3.46Å; E198-R202 IonicContact OE1-CZ 2.65Å; E198-R202 IonicContact OE1-NE 2.99Å; E198-R202 IonicContact OE1-NH2 3.71Å; E198-R202 PolarHBondContact OE1-NH2 2.95Å; L199-R202 PolarHBondContact O-N 3.37Å; R202-H205 PolarHBondContact O-N 3.01Å; R202-C206 PolarHBondContact O-N 2.97Å; R202-C206 VanDerWaalsContact O-N 3.07Å
203F90.9Very high88.6Confident30 Ų3081.1 Ų81.113%0.13238%0.378CS..Hα-helixtrans-63-42.3174.1-173.5-105.4000112.1F69 R70 L73 L199 E200 E201 C206 L207F69-F203 AromaticContact CD1-CD2 3.95Å; F69-F203 HydrophobicContact CD1-CD2 3.95Å; F69-F203 HydrophobicContact CE1-CD2 4.45Å; R70-F203 HydrophobicContact CB-CD2 4.37Å; R70-F203 HydrophobicContact CB-CE2 3.85Å; R70-F203 HydrophobicContact CG-CE2 4.37Å; L73-F203 HydrophobicContact CD1-CB 3.76Å; L73-F203 HydrophobicContact CD1-CD2 4.16Å; L73-F203 HydrophobicContact CD1-CG 4.41Å; L199-F203 PolarHBondContact O-N 2.88Å; E200-F203 PolarHBondContact O-N 3.23Å; E201-F203 VanDerWaalsContact C-N 3.33Å; E201-F203 PolarHBondContact O-N 3.41Å; F203-C206 WeakPolarHBondContact O-CB 3.41Å; F203-C206 PolarHBondContact O-N 3.15Å; F203-L207 WeakPolarHBondContact O-CB 3.24Å; F203-L207 PolarHBondContact O-N 2.87Å
204Y90.4Very high89.2Confident130 Ų13077.8 Ų77.851%0.5136%0.363SS..Hα-helixtrans-60.9-46.2175.7-177.3-90.8000112E200 E201 C206 L207 M208E200-Y204 WeakPolarHBondContact O-CB 3.34Å; E200-Y204 PolarHBondContact O-N 3.46Å; E201-Y204 WeakPolarHBondContact O-CB 3.43Å; E201-Y204 PolarHBondContact O-N 2.91Å; Y204-C206 VanDerWaalsContact C-N 3.34Å; Y204-C206 PolarHBondContact O-N 3.33Å; Y204-L207 WeakPolarHBondContact O-CB 3.29Å; Y204-L207 PolarHBondContact O-N 2.87Å; Y204-L207 VanDerWaalsContact O-N 3.13Å; Y204-M208 HydrophobicContact CD1-CG 4Å; Y204-M208 HydrophobicContact CD2-CE 4.14Å; Y204-M208 HydrophobicContact CE1-CE 4.08Å; Y204-M208 HydrophobicContact CE1-CG 3.59Å; Y204-M208 HydrophobicContact CE1-SD 4.32Å; Y204-M208 HydrophobicContact CE2-CE 3.52Å; Y204-M208 VanDerWaalsContact CZ-CE 3.48Å; Y204-M208 WeakPolarHBondContact O-CG 3.49Å; Y204-M208 PolarHBondContact O-N 3.25Å
205H89Confident89.8Confident127 Ų12774 Ų7459%0.58835%0.354SS*.Hα-helixtrans-60.5-41.9175.3-77.5-59.3000112.6E201 R202 L207 M208 N209E201-H205 PolarHBondContact O-CD2 2.91Å; E201-H205 VanDerWaalsContact O-CD2 3.22Å; E201-H205 PolarHBondContact O-N 3Å; R202-H205 PolarHBondContact O-N 3.01Å; H205-L207 VanDerWaalsContact C-N 3.34Å; H205-L207 PolarHBondContact O-N 2.94Å; H205-M208 PolarHBondContact O-N 3.37Å; H205-N209 PolarHBondContact O-N 2.84Å
206C89Confident90.3Very high23 Ų2378 Ų7816%0.15537%0.372CS..Hα-helixtrans-60.6-43.5173.4-179.70000111.6F69 R202 F203 Y204 M208 N209 H210F69-C206 HydrophobicContact CD1-CB 3.64Å; F69-C206 HydrophobicContact CE1-CB 3.55Å; F69-C206 HydrophobicContact CZ-CB 4.4Å; R202-C206 PolarHBondContact O-N 2.97Å; R202-C206 VanDerWaalsContact O-N 3.07Å; F203-C206 WeakPolarHBondContact O-CB 3.41Å; F203-C206 PolarHBondContact O-N 3.15Å; Y204-C206 VanDerWaalsContact C-N 3.34Å; Y204-C206 PolarHBondContact O-N 3.33Å; C206-M208 PolarHBondContact O-N 3.36Å; C206-N209 PolarHBondContact O-N 3.45Å; C206-H210 WeakPolarHBondContact O-CB 3.45Å; C206-H210 PolarHBondContact O-CD2 3.4Å; C206-H210 PolarHBondContact O-N 2.93Å; C206-H210 VanDerWaalsContact SG-CD2 3.57Å
207L91Very high90.6Very high45 Ų4576.5 Ų76.524%0.23636%0.363CS..Hα-helixtrans-61.1-42.7176178.663.8000111.9K66 F203 Y204 H205 H210 K211K66-L207 HydrophobicContact CD-CD1 4.22Å; K66-L207 VanDerWaalsContact CE-CD1 3.48Å; F203-L207 WeakPolarHBondContact O-CB 3.24Å; F203-L207 PolarHBondContact O-N 2.87Å; Y204-L207 WeakPolarHBondContact O-CB 3.29Å; Y204-L207 PolarHBondContact O-N 2.87Å; Y204-L207 VanDerWaalsContact O-N 3.13Å; H205-L207 VanDerWaalsContact C-N 3.34Å; H205-L207 PolarHBondContact O-N 2.94Å; L207-H210 PolarHBondContact O-N 3.43Å; L207-K211 WeakPolarHBondContact O-CG 3.35Å; L207-K211 PolarHBondContact O-N 2.92Å
208M91.7Very high90.9Very high45 Ų4576.9 Ų76.922%0.22236%0.362CS..Hα-helixtrans-66.2-43.9177.3-69.1-56.8130.200112.1Y204 H205 C206 H210 K211 N212Y204-M208 HydrophobicContact CD1-CG 4Å; Y204-M208 HydrophobicContact CD2-CE 4.14Å; Y204-M208 HydrophobicContact CE1-CE 4.08Å; Y204-M208 HydrophobicContact CE1-CG 3.59Å; Y204-M208 HydrophobicContact CE1-SD 4.32Å; Y204-M208 HydrophobicContact CE2-CE 3.52Å; Y204-M208 VanDerWaalsContact CZ-CE 3.48Å; Y204-M208 WeakPolarHBondContact O-CG 3.49Å; Y204-M208 PolarHBondContact O-N 3.25Å; H205-M208 PolarHBondContact O-N 3.37Å; C206-M208 PolarHBondContact O-N 3.36Å; M208-H210 VanDerWaalsContact C-N 3.28Å; M208-H210 PolarHBondContact O-N 3.05Å; M208-K211 HydrophobicContact CE-CD 4.06Å; M208-K211 WeakPolarHBondContact O-CB 3.39Å; M208-K211 PolarHBondContact O-N 3.23Å; M208-K211 VanDerWaalsContact O-N 3.1Å; M208-K211 HydrophobicContact SD-CD 4.13Å; M208-N212 VanDerWaalsContact O-CG 3.3Å; M208-N212 PolarHBondContact O-N 3.38Å; M208-N212 PolarHBondContact O-OD1 2.95Å
209N91.1Very high91.1Very high109 Ų10980 Ų8058%0.58337%0.371SS*.Hα-helixtrans-58.5-42.9175-171.5-4.6000111.4H205 C206 K211 N212 R213H205-N209 PolarHBondContact O-N 2.84Å; C206-N209 PolarHBondContact O-N 3.45Å; N209-K211 PolarHBondContact O-N 3.17Å; N209-N212 PolarHBondContact O-N 3.08Å; N209-R213 PolarHBondContact O-N 3.27Å
210H91.1Very high91.4Very high21 Ų2185.4 Ų85.410%0.09739%0.394CS..Hα-helixtrans-62.8-40.3174.1-79.7-49.1000113.7T62 S65 C206 L207 M208 I214T62-H210 HydrophobicContact CG2-CB 3.56Å; S65-H210 PolarHBondContact OG-CE1 3.43Å; S65-H210 PolarHBondContact OG-NE2 2.87Å; C206-H210 WeakPolarHBondContact O-CB 3.45Å; C206-H210 PolarHBondContact O-CD2 3.4Å; C206-H210 PolarHBondContact O-N 2.93Å; C206-H210 VanDerWaalsContact SG-CD2 3.57Å; L207-H210 PolarHBondContact O-N 3.43Å; M208-H210 VanDerWaalsContact C-N 3.28Å; M208-H210 PolarHBondContact O-N 3.05Å; H210-I214 WeakPolarHBondContact O-CG1 3.44Å; H210-I214 PolarHBondContact O-N 2.93Å
211K91.6Very high91.7Very high110 Ų11080.6 Ų80.648%0.47837%0.372SS..Hα-helixtrans-63.7-45.3173.9-75.6-177.9178.1-173.60111.3L207 M208 N209 R213 I214 A215L207-K211 WeakPolarHBondContact O-CG 3.35Å; L207-K211 PolarHBondContact O-N 2.92Å; M208-K211 HydrophobicContact CE-CD 4.06Å; M208-K211 WeakPolarHBondContact O-CB 3.39Å; M208-K211 PolarHBondContact O-N 3.23Å; M208-K211 VanDerWaalsContact O-N 3.1Å; M208-K211 HydrophobicContact SD-CD 4.13Å; N209-K211 PolarHBondContact O-N 3.17Å; K211-R213 VanDerWaalsContact C-N 3.32Å; K211-R213 PolarHBondContact O-N 3.41Å; K211-I214 PolarHBondContact O-N 3.02Å; K211-I214 VanDerWaalsContact O-N 3.17Å; K211-A215 PolarHBondContact O-N 3.38Å
212N93.1Very high91.9Very high91 Ų9178.3 Ų78.349%0.48736%0.363SS..Hα-helixtrans-59.6-43.3177.9-69.6-3.4000111.2M208 N209 I214 A215 E216M208-N212 VanDerWaalsContact O-CG 3.3Å; M208-N212 PolarHBondContact O-N 3.38Å; M208-N212 PolarHBondContact O-OD1 2.95Å; N209-N212 PolarHBondContact O-N 3.08Å; N212-I214 VanDerWaalsContact C-N 3.31Å; N212-I214 PolarHBondContact O-N 2.95Å; N212-A215 PolarHBondContact O-N 3.5Å; N212-E216 WeakPolarHBondContact O-CB 3.26Å; N212-E216 WeakPolarHBondContact O-CG 3.42Å; N212-E216 PolarHBondContact O-N 3.45Å
213R92Very high92.1Very high143 Ų14377.5 Ų77.554%0.5437%0.367SS..Hα-helixtrans-63.3-35177.7-168.1174.8178.7169.63113.5L58 N209 K211 L217L58-R213 HydrophobicContact CD1-CG 4.23Å; L58-R213 HydrophobicContact CD2-CG 4.27Å; L58-R213 WeakPolarHBondContact CD2-O 3.39Å; N209-R213 PolarHBondContact O-N 3.27Å; K211-R213 VanDerWaalsContact C-N 3.32Å; K211-R213 PolarHBondContact O-N 3.41Å; R213-L217 PolarHBondContact O-N 3.5Å
214I91.5Very high92.2Very high25 Ų2580 Ų8013%0.12838%0.379CS..Hα-helixtrans-69.5-47.8174.1-67.2162.3000109.6L55 L58 T62 H210 K211 N212 E216 L217 E218L55-I214 HydrophobicContact CD2-CG2 4.47Å; L58-I214 HydrophobicContact CD2-CG1 4.08Å; L58-I214 HydrophobicContact CG-CG1 4.38Å; T62-I214 HydrophobicContact CG2-CD1 4.33Å; H210-I214 WeakPolarHBondContact O-CG1 3.44Å; H210-I214 PolarHBondContact O-N 2.93Å; K211-I214 PolarHBondContact O-N 3.02Å; K211-I214 VanDerWaalsContact O-N 3.17Å; N212-I214 VanDerWaalsContact C-N 3.31Å; N212-I214 PolarHBondContact O-N 2.95Å; I214-E216 VanDerWaalsContact C-N 3.32Å; I214-E216 PolarHBondContact O-N 2.9Å; I214-L217 PolarHBondContact O-N 3.31Å; I214-L217 VanDerWaalsContact O-N 3.09Å; I214-E218 HydrophobicContact CG2-CG 4.32Å; I214-E218 WeakPolarHBondContact O-CG 3.44Å; I214-E218 PolarHBondContact O-N 2.94Å
215A92.3Very high92.4Very high49 Ų4976.9 Ų76.941%0.40537%0.366SS..Hα-helixtrans-59.3-40.8177.900000112.4K211 N212 L217 E218 W219K211-A215 PolarHBondContact O-N 3.38Å; N212-A215 PolarHBondContact O-N 3.5Å; A215-L217 VanDerWaalsContact C-N 3.33Å; A215-L217 PolarHBondContact O-N 3.3Å; A215-E218 PolarHBondContact O-N 2.89Å; A215-W219 WeakPolarHBondContact O-CB 3.39Å; A215-W219 PolarHBondContact O-N 3.48Å
216E92.7Very high92.6Very high116 Ų11675.4 Ų75.454%0.54236%0.359SS..Hα-helixtrans-60.3-40.9174-78.2174-162.900112.4N212 I214 K220N212-E216 WeakPolarHBondContact O-CB 3.26Å; N212-E216 WeakPolarHBondContact O-CG 3.42Å; N212-E216 PolarHBondContact O-N 3.45Å; I214-E216 VanDerWaalsContact C-N 3.32Å; I214-E216 PolarHBondContact O-N 2.9Å; E216-K220 WeakPolarHBondContact O-CG 3.47Å; E216-K220 PolarHBondContact O-N 3.48Å
217L92.7Very high92.8Very high35 Ų3580.9 Ų80.918%0.18338%0.383CS..Hα-helixtrans-69.8-43.7176.7-177.664.3000111Q54 L55 L58 R213 I214 A215 W219 K220 C221Q54-L217 HydrophobicContact CB-CD2 4.16Å; L55-L217 HydrophobicContact CD2-CB 4.43Å; L55-L217 HydrophobicContact CD2-CD2 3.88Å; L55-L217 HydrophobicContact CD2-CG 4.12Å; L55-L217 HydrophobicContact CG-CD2 4.26Å; L58-L217 HydrophobicContact CB-CD2 4Å; L58-L217 HydrophobicContact CD2-CB 3.89Å; L58-L217 HydrophobicContact CD2-CD2 3.56Å; L58-L217 HydrophobicContact CD2-CG 4.36Å; L58-L217 HydrophobicContact CG-CD2 4.41Å; R213-L217 PolarHBondContact O-N 3.5Å; I214-L217 PolarHBondContact O-N 3.31Å; I214-L217 VanDerWaalsContact O-N 3.09Å; A215-L217 VanDerWaalsContact C-N 3.33Å; A215-L217 PolarHBondContact O-N 3.3Å; L217-W219 VanDerWaalsContact C-N 3.27Å; L217-W219 PolarHBondContact O-N 2.95Å; L217-K220 PolarHBondContact O-N 2.94Å; L217-C221 WeakPolarHBondContact O-CB 3.35Å; L217-C221 PolarHBondContact O-N 2.87Å; L217-C221 PolarHBondContact O-SG 3.34Å
218E93.6Very high93Very high105 Ų10580.6 Ų80.649%0.49138%0.381SS..Hα-helixtrans-58.8-41.2175.5-71.4179.7157.800111.6L55 I214 A215 C221 L222L55-E218 HydrophobicContact CD1-CG 4.27Å; L55-E218 HydrophobicContact CD2-CG 3.49Å; L55-E218 VanDerWaalsContact CD2-CG 3.49Å; I214-E218 HydrophobicContact CG2-CG 4.32Å; I214-E218 WeakPolarHBondContact O-CG 3.44Å; I214-E218 PolarHBondContact O-N 2.94Å; A215-E218 PolarHBondContact O-N 2.89Å; E218-C221 WeakPolarHBondContact O-CB 3.28Å; E218-C221 PolarHBondContact O-N 2.81Å; E218-L222 WeakPolarHBondContact O-CB 3.5Å; E218-L222 PolarHBondContact O-N 2.9Å
219W93.7Very high93.2Very high132 Ų13285.1 Ų85.150%0.540%0.396SS..Hα-helixtrans-62.9-47.3175.2-176.2-108000112.3A215 L217 C221 L222 L223A215-W219 WeakPolarHBondContact O-CB 3.39Å; A215-W219 PolarHBondContact O-N 3.48Å; L217-W219 VanDerWaalsContact C-N 3.27Å; L217-W219 PolarHBondContact O-N 2.95Å; W219-C221 VanDerWaalsContact C-N 3.34Å; W219-C221 PolarHBondContact O-N 3.49Å; W219-L222 HydrophobicContact CE3-CD2 4.16Å; W219-L222 HydrophobicContact CZ3-CD2 4.03Å; W219-L222 WeakPolarHBondContact O-CB 3.46Å; W219-L222 PolarHBondContact O-N 3.5Å; W219-L222 VanDerWaalsContact O-N 3.11Å; W219-L223 HydrophobicContact CZ2-CD2 4.48Å; W219-L223 WeakPolarHBondContact O-CG 3.49Å; W219-L223 PolarHBondContact O-N 3.29Å
220K93.5Very high93.3Very high122 Ų12289.1 Ų89.153%0.5340%0.403SS..Hα-helixtrans-58.8-45.3174.4-75176.8179.8-1800111.9E216 L217 L222 L223 E224E216-K220 WeakPolarHBondContact O-CG 3.47Å; E216-K220 PolarHBondContact O-N 3.48Å; L217-K220 PolarHBondContact O-N 2.94Å; K220-L222 VanDerWaalsContact C-N 3.27Å; K220-L222 PolarHBondContact O-N 3.38Å; K220-L223 PolarHBondContact O-N 3.33Å; K220-E224 WeakPolarHBondContact O-CG 3.33Å; K220-E224 PolarHBondContact O-N 3.49Å
221C94.7Very high93.4Very high4 Ų490.2 Ų90.23%0.02742%0.416CS..Hα-helixtrans-60.8-34.8175.2-74.20000112.8H51 L217 E218 W219 R225H51-C221 HydrophobicContact CB-CB 4.17Å; H51-C221 PolarHBondContact CE1-O 2.88Å; H51-C221 WeakPolarHBondContact ND1-CB 3.41Å; H51-C221 PolarHBondContact ND1-O 3.32Å; L217-C221 WeakPolarHBondContact O-CB 3.35Å; L217-C221 PolarHBondContact O-N 2.87Å; L217-C221 PolarHBondContact O-SG 3.34Å; E218-C221 WeakPolarHBondContact O-CB 3.28Å; E218-C221 PolarHBondContact O-N 2.81Å; W219-C221 VanDerWaalsContact C-N 3.34Å; W219-C221 PolarHBondContact O-N 3.49Å; C221-R225 WeakPolarHBondContact O-CG 3.5Å; C221-R225 PolarHBondContact O-N 3.02Å
222L94.4Very high93.7Very high77 Ų7786.8 Ų86.840%0.40340%0.4SS..Hα-helixtrans-68.6-46.1175.2-174.765.6000110.9E218 W219 K220 E224 R225 Q226E218-L222 WeakPolarHBondContact O-CB 3.5Å; E218-L222 PolarHBondContact O-N 2.9Å; W219-L222 HydrophobicContact CE3-CD2 4.16Å; W219-L222 HydrophobicContact CZ3-CD2 4.03Å; W219-L222 WeakPolarHBondContact O-CB 3.46Å; W219-L222 PolarHBondContact O-N 3.5Å; W219-L222 VanDerWaalsContact O-N 3.11Å; K220-L222 VanDerWaalsContact C-N 3.27Å; K220-L222 PolarHBondContact O-N 3.38Å; L222-E224 PolarHBondContact O-N 2.91Å; L222-R225 PolarHBondContact O-N 3.38Å; L222-Q226 WeakPolarHBondContact O-CG 3.25Å; L222-Q226 PolarHBondContact O-N 2.92Å
223L93.6Very high93.8Very high88 Ų8886.9 Ų86.946%0.46140%0.4SS..Hα-helixtrans-57.4-48.1176.9-73.8171000111.7W219 K220 R225 Q226 E227W219-L223 HydrophobicContact CZ2-CD2 4.48Å; W219-L223 WeakPolarHBondContact O-CG 3.49Å; W219-L223 PolarHBondContact O-N 3.29Å; K220-L223 PolarHBondContact O-N 3.33Å; L223-R225 VanDerWaalsContact C-N 3.29Å; L223-R225 PolarHBondContact O-N 2.94Å; L223-Q226 PolarHBondContact O-N 3.5Å; L223-Q226 VanDerWaalsContact O-N 3.1Å; L223-E227 WeakPolarHBondContact O-CB 3.47Å; L223-E227 PolarHBondContact O-N 2.91Å
224E94Very high93.9Very high82 Ų8284.6 Ų84.638%0.38340%0.398SS..Hα-helixtrans-59.9-37.6178.2-72.9178.2-161.700112.3L47 H51 K220 L222 L228L47-E224 HydrophobicContact CD2-CB 4.43Å; H51-E224 IonicContact CE1-OE2 3.52Å; H51-E224 IonicContact NE2-OE2 3.56Å; H51-E224 PolarHBondContact NE2-OE2 3.18Å; K220-E224 WeakPolarHBondContact O-CG 3.33Å; K220-E224 PolarHBondContact O-N 3.49Å; L222-E224 PolarHBondContact O-N 2.91Å; E224-L228 PolarHBondContact O-N 3.29Å
225R93.4Very high94.1Very high66 Ų6686.7 Ų86.725%0.24941%0.41CS..Hα-helixtrans-67.8-40.2174.9-73.2175.5-168.8164.17112.2Y44 L47 H51 C221 L222 L223 L228 R229Y44-R225 HydrophobicContact CE2-CB 4.17Å; Y44-R225 HydrophobicContact CE2-CG 4.03Å; L47-R225 HydrophobicContact CD2-CG 3.91Å; H51-R225 PolarHBondContact ND1-NE 3.41Å; C221-R225 WeakPolarHBondContact O-CG 3.5Å; C221-R225 PolarHBondContact O-N 3.02Å; L222-R225 PolarHBondContact O-N 3.38Å; L223-R225 VanDerWaalsContact C-N 3.29Å; L223-R225 PolarHBondContact O-N 2.94Å; R225-L228 PolarHBondContact O-N 2.78Å; R225-R229 PolarHBondContact O-N 3.34Å
226Q93.8Very high94.2Very high96 Ų9685.3 Ų85.345%0.44940%0.395SS..Hα-helixtrans-68.3-38177.9-68.6-63.4-1.900111.4L222 L223 R229 R230L222-Q226 WeakPolarHBondContact O-CG 3.25Å; L222-Q226 PolarHBondContact O-N 2.92Å; L223-Q226 PolarHBondContact O-N 3.5Å; L223-Q226 VanDerWaalsContact O-N 3.1Å; Q226-R229 PolarHBondContact O-N 3.5Å; Q226-R230 WeakPolarHBondContact O-CB 3.4Å; Q226-R230 PolarHBondContact O-N 3.35Å
227E93.8Very high94.2Very high137 Ų13781.5 Ų81.564%0.6439%0.387SS*.Hα-helixtrans-62.3-44.9174.6-171.5170.2-166.800111.5L223 R229 R230 A231L223-E227 WeakPolarHBondContact O-CB 3.47Å; L223-E227 PolarHBondContact O-N 2.91Å; E227-R229 VanDerWaalsContact C-N 3.33Å; E227-R229 PolarHBondContact O-N 2.96Å; E227-R230 PolarHBondContact O-N 2.94Å; E227-A231 WeakPolarHBondContact O-CB 3.31Å; E227-A231 PolarHBondContact O-N 3.43Å
228L94.6Very high94.4Very high40 Ų4084.6 Ų84.621%0.20940%0.401CS..Hα-helixtrans-60.7-41.9173.9-177.665.1000112.1F40 N43 Y44 L47 E224 R225 A231 Y232F40-L228 HydrophobicContact CD2-CD2 4.47Å; F40-L228 HydrophobicContact CD2-CG 4.11Å; F40-L228 HydrophobicContact CE2-CD2 4.38Å; F40-L228 HydrophobicContact CE2-CG 4.07Å; N43-L228 HydrophobicContact CB-CD1 4.14Å; N43-L228 HydrophobicContact CB-CD2 4.02Å; Y44-L228 HydrophobicContact CD2-CD2 4.3Å; L47-L228 HydrophobicContact CD2-CB 4.37Å; L47-L228 HydrophobicContact CD2-CD2 3.97Å; E224-L228 PolarHBondContact O-N 3.29Å; R225-L228 PolarHBondContact O-N 2.78Å; L228-A231 PolarHBondContact O-N 3.02Å; L228-Y232 PolarHBondContact O-N 3.22Å
229R95.2Very high94.5Very high139 Ų13979.8 Ų79.853%0.52538%0.378SS..Hα-helixtrans-64.8-42.1176.5-172.4179-177-178.5-0.8111.5F40 R225 Q226 E227 Y232 L233F40-R229 HydrophobicContact CE2-CB 4.46Å; R225-R229 PolarHBondContact O-N 3.34Å; Q226-R229 PolarHBondContact O-N 3.5Å; E227-R229 VanDerWaalsContact C-N 3.33Å; E227-R229 PolarHBondContact O-N 2.96Å; R229-Y232 PolarHBondContact O-N 3.49Å; R229-L233 HydrophobicContact CG-CD1 4.27Å; R229-L233 WeakPolarHBondContact O-CG 3.37Å; R229-L233 PolarHBondContact O-N 3.19Å
230R94.2Very high94.4Very high193 Ų19378.1 Ų78.173%0.72837%0.374SS*.Hα-helixtrans-61.8-45.9176.4-173.4179.5-175.8162.23111Q226 E227 Y232 L233 L234Q226-R230 WeakPolarHBondContact O-CB 3.4Å; Q226-R230 PolarHBondContact O-N 3.35Å; E227-R230 PolarHBondContact O-N 2.94Å; R230-Y232 VanDerWaalsContact C-N 3.34Å; R230-Y232 PolarHBondContact O-N 2.94Å; R230-L233 PolarHBondContact O-N 3Å; R230-L234 WeakPolarHBondContact O-CB 3.44Å; R230-L234 PolarHBondContact O-N 3.22Å
231A93.4Very high94.4Very high45 Ų4578 Ų7837%0.37238%0.376SS..Hα-helixtrans-60-43.617600000111.8E227 L228 L234 N235E227-A231 WeakPolarHBondContact O-CB 3.31Å; E227-A231 PolarHBondContact O-N 3.43Å; L228-A231 PolarHBondContact O-N 3.02Å; A231-L234 PolarHBondContact O-N 3.17Å; A231-N235 WeakPolarHBondContact O-CB 3.36Å; A231-N235 VanDerWaalsContact O-CG 3.22Å; A231-N235 PolarHBondContact O-N 3.43Å; A231-N235 PolarHBondContact O-ND2 3.32Å
232Y96.9Very high94.5Very high38 Ų3883.1 Ų83.115%0.14940%0.395CS..Hα-helixtrans-60.6-47.6174.3166.7-105.9000112.6L36 N37 F40 L228 R229 R230 L234 N235 L236L36-Y232 HydrophobicContact CD2-CD2 4.34Å; L36-Y232 HydrophobicContact CD2-CE2 4.18Å; L36-Y232 HydrophobicContact CG-CD2 4.01Å; L36-Y232 HydrophobicContact CG-CE2 3.96Å; N37-Y232 HydrophobicContact CB-CE2 4.45Å; F40-Y232 HydrophobicContact CB-CD2 3.48Å; F40-Y232 VanDerWaalsContact CB-CD2 3.48Å; F40-Y232 HydrophobicContact CB-CE2 4.01Å; F40-Y232 HydrophobicContact CB-CG 3.9Å; F40-Y232 HydrophobicContact CD1-CD1 4.23Å; F40-Y232 HydrophobicContact CD1-CD2 4.31Å; F40-Y232 HydrophobicContact CD1-CE1 4.44Å; F40-Y232 HydrophobicContact CD1-CG 4.15Å; F40-Y232 VanDerWaalsContact CD2-CB 3.47Å; F40-Y232 HydrophobicContact CD2-CD1 4.33Å; F40-Y232 HydrophobicContact CD2-CD2 4.25Å; F40-Y232 AromaticContact CD2-CG 3.76Å; F40-Y232 HydrophobicContact CD2-CG 3.76Å; F40-Y232 HydrophobicContact CE1-CD1 4.44Å; F40-Y232 HydrophobicContact CE2-CG 4.34Å; F40-Y232 HydrophobicContact CG-CD1 4.17Å; F40-Y232 AromaticContact CG-CD2 3.76Å; F40-Y232 HydrophobicContact CG-CD2 3.76Å; F40-Y232 HydrophobicContact CG-CE2 4.34Å; F40-Y232 AromaticContact CG-CG 3.65Å; F40-Y232 HydrophobicContact CG-CG 3.65Å; L228-Y232 PolarHBondContact O-N 3.22Å; R229-Y232 PolarHBondContact O-N 3.49Å; R230-Y232 VanDerWaalsContact C-N 3.34Å; R230-Y232 PolarHBondContact O-N 2.94Å; Y232-L234 VanDerWaalsContact C-N 3.33Å; Y232-L234 PolarHBondContact O-N 3.34Å; Y232-N235 PolarHBondContact O-N 2.91Å; Y232-L236 HydrophobicContact CE1-CD2 4.32Å; Y232-L236 WeakPolarHBondContact O-CB 3.34Å; Y232-L236 PolarHBondContact O-N 3.42Å
233L95.1Very high94.6Very high92 Ų9283.7 Ų83.748%0.48239%0.392SS..Hα-helixtrans-64.8-37.8179.9-72.2174.5000112.2R229 R230 L236 G237R229-L233 HydrophobicContact CG-CD1 4.27Å; R229-L233 WeakPolarHBondContact O-CG 3.37Å; R229-L233 PolarHBondContact O-N 3.19Å; R230-L233 PolarHBondContact O-N 3Å; L233-L236 PolarHBondContact O-N 3.44Å; L233-G237 PolarHBondContact O-N 3.41Å
234L94.3Very high94.5Very high96 Ų9685.1 Ų85.150%0.50340%0.398SS..Hα-helixtrans-62.6-50.5174.7-174.5142000110.8R230 A231 Y232 L236 G237 E238R230-L234 WeakPolarHBondContact O-CB 3.44Å; R230-L234 PolarHBondContact O-N 3.22Å; A231-L234 PolarHBondContact O-N 3.17Å; Y232-L234 VanDerWaalsContact C-N 3.33Å; Y232-L234 PolarHBondContact O-N 3.34Å; L234-L236 VanDerWaalsContact C-N 3.29Å; L234-L236 PolarHBondContact O-N 2.86Å; L234-G237 WeakPolarHBondContact O-CA 3.24Å; L234-G237 PolarHBondContact O-N 3.37Å; L234-G237 VanDerWaalsContact O-N 3.1Å; L234-E238 HydrophobicContact CD2-CG 4.43Å; L234-E238 WeakPolarHBondContact CD2-OE1 3.3Å; L234-E238 PolarHBondContact O-N 2.97Å
235N95.7Very high94.4Very high69 Ų6985.2 Ų85.237%0.36940%0.401SS..Hα-helixtrans-60.6-37.8176.4-69.1-18.1000112.3L36 A231 Y232 E238 L239L36-N235 HydrophobicContact CD1-CB 3.83Å; L36-N235 HydrophobicContact CD2-CB 4Å; A231-N235 WeakPolarHBondContact O-CB 3.36Å; A231-N235 VanDerWaalsContact O-CG 3.22Å; A231-N235 PolarHBondContact O-N 3.43Å; A231-N235 PolarHBondContact O-ND2 3.32Å; Y232-N235 PolarHBondContact O-N 2.91Å; N235-E238 PolarHBondContact O-N 3.49Å; N235-L239 WeakPolarHBondContact O-CB 3.4Å; N235-L239 PolarHBondContact O-N 2.88Å
236L95.1Very high94.4Very high19 Ų1983.7 Ų83.710%0.09940%0.4CS..Hα-helixtrans-66.9-40.1175.8-177.363.4000111.4E33 L36 Y232 L233 L234 L239 K240E33-L236 HydrophobicContact CG-CD1 3.97Å; L36-L236 HydrophobicContact CD2-CB 4.1Å; L36-L236 HydrophobicContact CD2-CD1 4.35Å; Y232-L236 HydrophobicContact CE1-CD2 4.32Å; Y232-L236 WeakPolarHBondContact O-CB 3.34Å; Y232-L236 PolarHBondContact O-N 3.42Å; L233-L236 PolarHBondContact O-N 3.44Å; L234-L236 VanDerWaalsContact C-N 3.29Å; L234-L236 PolarHBondContact O-N 2.86Å; L236-L239 PolarHBondContact O-N 3.37Å; L236-K240 HydrophobicContact CG-CD 4.37Å; L236-K240 WeakPolarHBondContact O-CB 3.46Å; L236-K240 WeakPolarHBondContact O-CG 3.48Å; L236-K240 PolarHBondContact O-N 2.89Å
237G92.7Very high94.3Very high37 Ų3780.7 Ų80.738%0.38139%0.387SS..Hα-helixtrans-59.9-49.5173.500000111.7L233 L234 L239 K240 Q241L233-G237 PolarHBondContact O-N 3.41Å; L234-G237 WeakPolarHBondContact O-CA 3.24Å; L234-G237 PolarHBondContact O-N 3.37Å; L234-G237 VanDerWaalsContact O-N 3.1Å; G237-L239 PolarHBondContact O-N 3.31Å; G237-K240 PolarHBondContact O-N 3.25Å; G237-Q241 WeakPolarHBondContact O-CB 3.47Å; G237-Q241 PolarHBondContact O-N 3.36Å
238E96Very high94.2Very high100 Ų10080 Ų8047%0.46738%0.38SS..Hα-helixtrans-60.4-43.4176.4-71.2-176.5175.500112.4L234 N235 Q241 R242L234-E238 HydrophobicContact CD2-CG 4.43Å; L234-E238 WeakPolarHBondContact CD2-OE1 3.3Å; L234-E238 PolarHBondContact O-N 2.97Å; N235-E238 PolarHBondContact O-N 3.49Å; E238-Q241 PolarHBondContact O-N 3.03Å; E238-R242 WeakPolarHBondContact O-CB 3.35Å; E238-R242 WeakPolarHBondContact O-CG 3.28Å; E238-R242 PolarHBondContact O-N 3.41Å
239L95.4Very high94.1Very high3 Ų381.3 Ų81.32%0.01639%0.387CS..Hα-helixtrans-60.5-47.1175.9-174.6157.8000110.9Y29 E32 E33 L36 N235 L236 G237 Q241 R242 R243Y29-L239 HydrophobicContact CD1-CD2 3.98Å; Y29-L239 HydrophobicContact CD1-CG 4.18Å; E32-L239 HydrophobicContact CB-CD1 3.93Å; E32-L239 HydrophobicContact CG-CD1 3.63Å; E33-L239 HydrophobicContact CB-CD1 4.31Å; E33-L239 HydrophobicContact CB-CD2 4.29Å; L36-L239 HydrophobicContact CD2-CD1 4.38Å; N235-L239 WeakPolarHBondContact O-CB 3.4Å; N235-L239 PolarHBondContact O-N 2.88Å; L236-L239 PolarHBondContact O-N 3.37Å; G237-L239 PolarHBondContact O-N 3.31Å; L239-Q241 VanDerWaalsContact C-N 3.34Å; L239-Q241 PolarHBondContact O-N 3.48Å; L239-R242 PolarHBondContact O-N 3.35Å; L239-R243 WeakPolarHBondContact O-CB 3.28Å; L239-R243 PolarHBondContact O-N 2.72Å
240K93.4Very high94Very high97 Ų9775.2 Ų75.242%0.42236%0.364SS..Hα-helixtrans-63.8-39.6177.5-74.9178.9178.8179.90111.8L236 G237 R243 I244L236-K240 HydrophobicContact CG-CD 4.37Å; L236-K240 WeakPolarHBondContact O-CB 3.46Å; L236-K240 WeakPolarHBondContact O-CG 3.48Å; L236-K240 PolarHBondContact O-N 2.89Å; G237-K240 PolarHBondContact O-N 3.25Å; K240-R243 WeakPolarHBondContact O-CB 3.39Å; K240-R243 PolarHBondContact O-N 2.98Å; K240-I244 VanDerWaalsContact O-CG1 3.32Å; K240-I244 WeakPolarHBondContact O-CG1 3.39Å; K240-I244 PolarHBondContact O-N 2.75Å
241Q93.3Very high93.8Very high121 Ų12169.4 Ų69.457%0.56535%0.348SS*.Hα-helixtrans-64-46.8175.2-173176500111.4G237 E238 L239 R243 I244 I245G237-Q241 WeakPolarHBondContact O-CB 3.47Å; G237-Q241 PolarHBondContact O-N 3.36Å; E238-Q241 PolarHBondContact O-N 3.03Å; L239-Q241 VanDerWaalsContact C-N 3.34Å; L239-Q241 PolarHBondContact O-N 3.48Å; Q241-R243 VanDerWaalsContact C-N 3.3Å; Q241-R243 PolarHBondContact O-N 3.17Å; Q241-I244 PolarHBondContact O-N 2.95Å; Q241-I245 HydrophobicContact CG-CD1 3.99Å; Q241-I245 WeakPolarHBondContact O-CG1 3.33Å; Q241-I245 PolarHBondContact O-N 2.92Å
242R96.8Very high93.8Very high110 Ų11074.5 Ų74.542%0.41536%0.357SS..Hα-helixtrans-56.8-44.1173.3-77.3-168.8-71.7132.7-1.2111.3Y29 E32 E238 L239 I244 I245 S246Y29-R242 HydrophobicContact CE1-CB 4.03Å; Y29-R242 PolarHBondContact OH-O 2.92Å; E32-R242 IonicContact OE1-CZ 3.05Å; E32-R242 IonicContact OE1-NH1 3.56Å; E32-R242 PolarHBondContact OE1-NH1 3.4Å; E32-R242 IonicContact OE1-NH2 2.72Å; E32-R242 PolarHBondContact OE1-NH2 2.9Å; E32-R242 IonicContact OE2-NH1 3Å; E32-R242 IonicContact OE2-NH2 3.27Å; E238-R242 WeakPolarHBondContact O-CB 3.35Å; E238-R242 WeakPolarHBondContact O-CG 3.28Å; E238-R242 PolarHBondContact O-N 3.41Å; L239-R242 PolarHBondContact O-N 3.35Å; R242-I244 PolarHBondContact O-N 3.33Å; R242-I245 PolarHBondContact O-N 2.95Å; R242-S246 VanDerWaalsContact O-CB 3.25Å; R242-S246 WeakPolarHBondContact O-CB 3.41Å; R242-S246 PolarHBondContact O-N 3.02Å; R242-S246 PolarHBondContact O-OG 2.96Å; R242-S246 VanDerWaalsContact O-OG 3.05Å
243R95.7Very high93.5Very high90 Ų9076.4 Ų76.434%0.3437%0.37SS..Hα-helixtrans-58.5-46.5175.6178.2-179.8167.9-166.1-4.7112.4Y29 L239 K240 Q241 S246 L247Y29-R243 HydrophobicContact CD1-CB 3.92Å; Y29-R243 HydrophobicContact CD2-CB 3.77Å; Y29-R243 HydrophobicContact CD2-CG 3.74Å; Y29-R243 HydrophobicContact CE1-CB 4.09Å; Y29-R243 HydrophobicContact CE2-CB 3.98Å; Y29-R243 HydrophobicContact CE2-CG 4.26Å; Y29-R243 HydrophobicContact CG-CB 3.76Å; Y29-R243 HydrophobicContact CG-CG 3.95Å; L239-R243 WeakPolarHBondContact O-CB 3.28Å; L239-R243 PolarHBondContact O-N 2.72Å; K240-R243 WeakPolarHBondContact O-CB 3.39Å; K240-R243 PolarHBondContact O-N 2.98Å; Q241-R243 VanDerWaalsContact C-N 3.3Å; Q241-R243 PolarHBondContact O-N 3.17Å; R243-S246 PolarHBondContact O-N 3.16Å; R243-L247 HydrophobicContact CG-CD1 4.03Å; R243-L247 WeakPolarHBondContact O-CB 3.48Å; R243-L247 VanDerWaalsContact O-CG 3.32Å; R243-L247 WeakPolarHBondContact O-CG 3.18Å; R243-L247 PolarHBondContact O-N 3.42Å
244I92Very high93.2Very high117 Ų11775 Ų7560%0.636%0.361SS*.Hα-helixtrans-62-49.1178.7-69.6164.9000110.5K240 Q241 R242 S246 L247 Y248K240-I244 VanDerWaalsContact O-CG1 3.32Å; K240-I244 WeakPolarHBondContact O-CG1 3.39Å; K240-I244 PolarHBondContact O-N 2.75Å; Q241-I244 PolarHBondContact O-N 2.95Å; R242-I244 PolarHBondContact O-N 3.33Å; I244-S246 VanDerWaalsContact C-N 3.34Å; I244-S246 PolarHBondContact O-N 2.94Å; I244-L247 PolarHBondContact O-N 3.44Å; I244-Y248 WeakPolarHBondContact O-CB 3.31Å; I244-Y248 PolarHBondContact O-N 3.3Å
245I90.7Very high93Very high84 Ų8474.5 Ų74.543%0.43136%0.358SS..Hα-helixtrans-60.6-44.8179.5-67.5167.9000110.9Q241 R242 Y248 N249Q241-I245 HydrophobicContact CG-CD1 3.99Å; Q241-I245 WeakPolarHBondContact O-CG1 3.33Å; Q241-I245 PolarHBondContact O-N 2.92Å; R242-I245 PolarHBondContact O-N 2.95Å; I245-Y248 WeakPolarHBondContact O-CB 3.34Å; I245-Y248 PolarHBondContact O-N 3.02Å; I245-N249 WeakPolarHBondContact O-CB 3.48Å; I245-N249 PolarHBondContact O-N 3.17Å; I245-N249 PolarHBondContact O-ND2 3.35Å
246S93.5Very high92.8Very high35 Ų3577.5 Ų77.525%0.24537%0.367CS..Hα-helixtrans-62.3-43.6178.2-73.70000112.7Y29 R242 R243 I244 N249 L250Y29-S246 PolarHBondContact OH-OG 3.45Å; R242-S246 VanDerWaalsContact O-CB 3.25Å; R242-S246 WeakPolarHBondContact O-CB 3.41Å; R242-S246 PolarHBondContact O-N 3.02Å; R242-S246 PolarHBondContact O-OG 2.96Å; R242-S246 VanDerWaalsContact O-OG 3.05Å; R243-S246 PolarHBondContact O-N 3.16Å; I244-S246 VanDerWaalsContact C-N 3.34Å; I244-S246 PolarHBondContact O-N 2.94Å; S246-N249 PolarHBondContact O-N 3.08Å; S246-L250 WeakPolarHBondContact O-CB 3.37Å; S246-L250 PolarHBondContact O-N 3.29Å
247L92.2Very high92.6Very high32 Ų3278.4 Ų78.417%0.16837%0.374CS..Hα-helixtrans-66.1-38.9175.2-73.8170.2000112.2R22 L25 L26 R243 I244 L250 N251R22-L247 HydrophobicContact CG-CD2 4.05Å; L25-L247 HydrophobicContact CD2-CD2 3.74Å; L25-L247 HydrophobicContact CD2-CG 3.87Å; L26-L247 HydrophobicContact CD2-CD1 3.97Å; L26-L247 HydrophobicContact CD2-CD2 4.17Å; L26-L247 HydrophobicContact CG-CD2 4.35Å; R243-L247 HydrophobicContact CG-CD1 4.03Å; R243-L247 WeakPolarHBondContact O-CB 3.48Å; R243-L247 VanDerWaalsContact O-CG 3.32Å; R243-L247 WeakPolarHBondContact O-CG 3.18Å; R243-L247 PolarHBondContact O-N 3.42Å; I244-L247 PolarHBondContact O-N 3.44Å; L247-L250 PolarHBondContact O-N 3.16Å; L247-N251 PolarHBondContact O-N 3.06Å
248Y92.6Very high92.5Very high124 Ų12480.4 Ų80.449%0.48637%0.37SS..Hα-helixtrans-62.6-47.2175.1175-101.8000111.5I244 I245 L250 N251 R252I244-Y248 WeakPolarHBondContact O-CB 3.31Å; I244-Y248 PolarHBondContact O-N 3.3Å; I245-Y248 WeakPolarHBondContact O-CB 3.34Å; I245-Y248 PolarHBondContact O-N 3.02Å; Y248-L250 VanDerWaalsContact C-N 3.3Å; Y248-L250 PolarHBondContact O-N 2.86Å; Y248-N251 WeakPolarHBondContact O-CB 3.27Å; Y248-N251 PolarHBondContact O-N 3.11Å; Y248-N251 VanDerWaalsContact O-N 3.13Å; Y248-R252 PolarHBondContact O-N 3.48Å
249N91.8Very high92.3Very high67 Ų6782.1 Ų82.136%0.35837%0.373SS..Hα-helixtrans-60.7-40.2176.7-78.1-30000112.1I245 S246 R252 L253I245-N249 WeakPolarHBondContact O-CB 3.48Å; I245-N249 PolarHBondContact O-N 3.17Å; I245-N249 PolarHBondContact O-ND2 3.35Å; S246-N249 PolarHBondContact O-N 3.08Å; N249-R252 PolarHBondContact O-N 3.46Å; N249-L253 WeakPolarHBondContact O-CB 3.39Å; N249-L253 PolarHBondContact O-N 2.94Å
250L92.6Very high92.1Very high11 Ų1185.4 Ų85.46%0.05839%0.391CS..Hα-helixtrans-62.3-43.4174.2-177.663.3000111.4R21 R22 S246 L247 Y248 L253 Q254R21-L250 HydrophobicContact CB-CD1 4.39Å; R21-L250 HydrophobicContact CG-CD1 3.97Å; R22-L250 HydrophobicContact CB-CD2 3.65Å; R22-L250 HydrophobicContact CG-CD2 4.2Å; S246-L250 WeakPolarHBondContact O-CB 3.37Å; S246-L250 PolarHBondContact O-N 3.29Å; L247-L250 PolarHBondContact O-N 3.16Å; Y248-L250 VanDerWaalsContact C-N 3.3Å; Y248-L250 PolarHBondContact O-N 2.86Å; L250-L253 PolarHBondContact O-N 3.33Å; L250-Q254 WeakPolarHBondContact O-CB 3.41Å; L250-Q254 PolarHBondContact O-N 3.33Å
251N91.1Very high91.9Very high70 Ų7082.1 Ų82.137%0.37438%0.378SS..Hα-helixtrans-65-42.7177.3-167.926.7000111.9L247 Y248 L253 Q254 I255L247-N251 PolarHBondContact O-N 3.06Å; Y248-N251 WeakPolarHBondContact O-CB 3.27Å; Y248-N251 PolarHBondContact O-N 3.11Å; Y248-N251 VanDerWaalsContact O-N 3.13Å; N251-L253 VanDerWaalsContact C-N 3.34Å; N251-L253 PolarHBondContact O-N 3.28Å; N251-Q254 WeakPolarHBondContact O-CB 3.4Å; N251-Q254 PolarHBondContact O-N 2.88Å; N251-Q254 VanDerWaalsContact O-N 3.14Å; N251-I255 WeakPolarHBondContact O-CG1 3.24Å; N251-I255 PolarHBondContact O-N 3.43Å
252R92Very high91.7Very high152 Ų15279.3 Ų79.357%0.57437%0.365SS*.Hα-helixtrans-60.1-44.9175.4-172.7178.169174-0.8111.6Y248 N249 Q254 I255 K256Y248-R252 PolarHBondContact O-N 3.48Å; N249-R252 PolarHBondContact O-N 3.46Å; R252-Q254 VanDerWaalsContact C-N 3.32Å; R252-I255 PolarHBondContact O-N 3.31Å; R252-K256 WeakPolarHBondContact O-CB 3.49Å; R252-K256 PolarHBondContact O-N 2.68Å
253L90.8Very high91.3Very high79 Ų7982.1 Ų82.141%0.41438%0.375SS..Hα-helixtrans-63-41.1174.4-174.968.6000111N249 L250 N251 I255 K256 T257N249-L253 WeakPolarHBondContact O-CB 3.39Å; N249-L253 PolarHBondContact O-N 2.94Å; L250-L253 PolarHBondContact O-N 3.33Å; N251-L253 VanDerWaalsContact C-N 3.34Å; N251-L253 PolarHBondContact O-N 3.28Å; L253-I255 PolarHBondContact O-N 2.97Å; L253-K256 PolarHBondContact O-N 3.21Å; L253-T257 WeakPolarHBondContact O-CB 3.33Å; L253-T257 PolarHBondContact O-N 3.09Å; L253-T257 PolarHBondContact O-OG1 2.92Å; L253-T257 VanDerWaalsContact O-OG1 3.11Å
254Q90.6Very high91Very high62 Ų6284.1 Ų84.129%0.2939%0.386SS..Hα-helixtrans-57.3-49.9177.7-174.2177.5-12.500111.7F14 C18 L250 N251 R252 Y258F14-Q254 HydrophobicContact CE1-CG 4.03Å; F14-Q254 WeakPolarHBondContact CE1-O 3.18Å; F14-Q254 HydrophobicContact CZ-CG 4.32Å; C18-Q254 HydrophobicContact CB-CG 4.33Å; L250-Q254 WeakPolarHBondContact O-CB 3.41Å; L250-Q254 PolarHBondContact O-N 3.33Å; N251-Q254 WeakPolarHBondContact O-CB 3.4Å; N251-Q254 PolarHBondContact O-N 2.88Å; N251-Q254 VanDerWaalsContact O-N 3.14Å; R252-Q254 VanDerWaalsContact C-N 3.32Å; Q254-Y258 WeakPolarHBondContact O-CB 3.31Å; Q254-Y258 PolarHBondContact O-N 2.93Å
255I89.2Confident90.9Very high86 Ų8679.3 Ų79.344%0.44136%0.361SS..Hα-helixtrans-64.6-48.5179.2-65.4166.2000110.5N251 R252 L253 T257 Y258 Y259N251-I255 WeakPolarHBondContact O-CG1 3.24Å; N251-I255 PolarHBondContact O-N 3.43Å; R252-I255 PolarHBondContact O-N 3.31Å; L253-I255 PolarHBondContact O-N 2.97Å; I255-T257 PolarHBondContact O-N 2.89Å; I255-Y258 WeakPolarHBondContact O-CB 3.49Å; I255-Y258 PolarHBondContact O-N 2.95Å; I255-Y259 HydrophobicContact CG2-CD2 3.89Å; I255-Y259 HydrophobicContact CG2-CE2 3.68Å; I255-Y259 VanDerWaalsContact O-CD2 3.24Å; I255-Y259 WeakPolarHBondContact O-CD2 3.25Å; I255-Y259 PolarHBondContact O-N 2.8Å
256K92.1Very high90.7Very high132 Ų13279.5 Ų79.557%0.57436%0.362SS*.Hα-helixtrans-57.8-53.4-179.5-177.3-178.2175.6-177.80111.4R252 L253 Y258 Y259 D260R252-K256 WeakPolarHBondContact O-CB 3.49Å; R252-K256 PolarHBondContact O-N 2.68Å; L253-K256 PolarHBondContact O-N 3.21Å; K256-Y258 VanDerWaalsContact C-N 3.29Å; K256-Y258 PolarHBondContact O-N 3.27Å; K256-Y259 PolarHBondContact O-N 3.09Å; K256-Y259 VanDerWaalsContact O-N 3.14Å; K256-D260 PolarHBondContact O-N 3.29Å
257T90.3Very high90.5Very high37 Ų3781.4 Ų81.423%0.22737%0.374CS..Hα-helixtrans-67.7-29.8-176.9-56.90000112.2F14 L253 I255 D260 I261F14-T257 HydrophobicContact CD2-CG2 3.82Å; F14-T257 HydrophobicContact CE1-CG2 4.4Å; F14-T257 HydrophobicContact CE2-CG2 3.31Å; F14-T257 VanDerWaalsContact CZ-CB 3.41Å; F14-T257 HydrophobicContact CZ-CG2 3.64Å; L253-T257 WeakPolarHBondContact O-CB 3.33Å; L253-T257 PolarHBondContact O-N 3.09Å; L253-T257 PolarHBondContact O-OG1 2.92Å; L253-T257 VanDerWaalsContact O-OG1 3.11Å; I255-T257 PolarHBondContact O-N 2.89Å; T257-D260 PolarHBondContact O-N 3.04Å; T257-I261 HydrophobicContact CG2-CD1 4.1Å; T257-I261 HydrophobicContact CG2-CG1 4.39Å; T257-I261 VanDerWaalsContact O-CG1 3.23Å; T257-I261 WeakPolarHBondContact O-CG1 3.49Å; T257-I261 PolarHBondContact O-N 3.38Å
258Y91.4Very high90.3Very high80 Ų8083.4 Ų83.431%0.31438%0.383SS..Hα-helixtrans-58.4-48.6170.4173.7-96.6000111.8I11 Q254 I255 K256 I261 Q262I11-Y258 HydrophobicContact CD1-CE2 3.88Å; I11-Y258 HydrophobicContact CG1-CD2 4.35Å; I11-Y258 HydrophobicContact CG1-CE2 4.17Å; I11-Y258 HydrophobicContact CG2-CD2 4.25Å; I11-Y258 HydrophobicContact CG2-CE2 3.99Å; Q254-Y258 WeakPolarHBondContact O-CB 3.31Å; Q254-Y258 PolarHBondContact O-N 2.93Å; I255-Y258 WeakPolarHBondContact O-CB 3.49Å; I255-Y258 PolarHBondContact O-N 2.95Å; K256-Y258 VanDerWaalsContact C-N 3.29Å; K256-Y258 PolarHBondContact O-N 3.27Å; Y258-I261 PolarHBondContact O-N 3.14Å; Y258-Q262 VanDerWaalsContact CE1-CD 3.43Å; Y258-Q262 HydrophobicContact CE1-CG 4.32Å; Y258-Q262 WeakPolarHBondContact O-CG 3.26Å; Y258-Q262 PolarHBondContact O-N 3.29Å; Y258-Q262 PolarHBondContact OH-NE2 3.41Å
259Y91.3Very high90.1Very high136 Ų13680.4 Ų80.453%0.53338%0.375SS..Hα-helixtrans-69.4-33.8177.1-73.3-64.4000113I255 K256 I261 Q262 R263I255-Y259 HydrophobicContact CG2-CD2 3.89Å; I255-Y259 HydrophobicContact CG2-CE2 3.68Å; I255-Y259 VanDerWaalsContact O-CD2 3.24Å; I255-Y259 WeakPolarHBondContact O-CD2 3.25Å; I255-Y259 PolarHBondContact O-N 2.8Å; K256-Y259 PolarHBondContact O-N 3.09Å; K256-Y259 VanDerWaalsContact O-N 3.14Å; Y259-I261 VanDerWaalsContact C-N 3.34Å; Y259-Q262 VanDerWaalsContact CD1-OE1 3.31Å; Y259-Q262 PolarHBondContact O-N 3.33Å; Y259-R263 WeakPolarHBondContact O-CB 3.42Å; Y259-R263 PolarHBondContact O-N 2.88Å
260D90.7Very high89.9Confident72 Ų7282.3 Ų82.339%0.38538%0.381SS..Hα-helixtrans-62.9-41.7174.1-67.6-25.4000111.1K256 T257 R263 K264K256-D260 PolarHBondContact O-N 3.29Å; T257-D260 PolarHBondContact O-N 3.04Å; D260-R263 PolarHBondContact O-N 3.41Å; D260-K264 WeakPolarHBondContact O-CB 3.41Å; D260-K264 PolarHBondContact O-N 3.21Å
261I89.2Confident89.8Confident28 Ų2884.5 Ų84.514%0.14440%0.398CS..Hα-helixtrans-61.5-48.4173.9-69.4164.9000110D10 I11 F14 T257 Y258 Y259 R263 K264 W265D10-I261 HydrophobicContact CB-CG2 4.19Å; I11-I261 HydrophobicContact CG1-CG2 4.23Å; F14-I261 HydrophobicContact CB-CD1 3.82Å; F14-I261 HydrophobicContact CD1-CD1 4.14Å; F14-I261 HydrophobicContact CD2-CD1 4.26Å; F14-I261 HydrophobicContact CG-CD1 3.8Å; T257-I261 HydrophobicContact CG2-CD1 4.1Å; T257-I261 HydrophobicContact CG2-CG1 4.39Å; T257-I261 VanDerWaalsContact O-CG1 3.23Å; T257-I261 WeakPolarHBondContact O-CG1 3.49Å; T257-I261 PolarHBondContact O-N 3.38Å; Y258-I261 PolarHBondContact O-N 3.14Å; Y259-I261 VanDerWaalsContact C-N 3.34Å; I261-R263 PolarHBondContact O-N 3.49Å; I261-K264 PolarHBondContact O-N 3.17Å; I261-W265 VanDerWaalsContact O-CD1 3.26Å; I261-W265 PolarHBondContact O-N 2.98Å
262Q88.6Confident89.8Confident62 Ų6283.2 Ų83.229%0.2939%0.391SS..Hα-helixtrans-60-44.8178.3-73.1-174.9-36.300112.4I7 Y258 Y259 W265 L266I7-Q262 HydrophobicContact CD1-CG 4.41Å; Y258-Q262 VanDerWaalsContact CE1-CD 3.43Å; Y258-Q262 HydrophobicContact CE1-CG 4.32Å; Y258-Q262 WeakPolarHBondContact O-CG 3.26Å; Y258-Q262 PolarHBondContact O-N 3.29Å; Y258-Q262 PolarHBondContact OH-NE2 3.41Å; Y259-Q262 VanDerWaalsContact CD1-OE1 3.31Å; Y259-Q262 PolarHBondContact O-N 3.33Å; Q262-W265 PolarHBondContact O-N 3.39Å; Q262-L266 WeakPolarHBondContact O-CB 3.39Å; Q262-L266 PolarHBondContact O-N 3.38Å
263R89.4Confident89.6Confident169 Ų16980.6 Ų80.664%0.63839%0.385SS*.Hα-helixtrans-63.1-43.8178.5-173.1-177.4-62.9-168.9-1.5111.4Y259 D260 I261 W265 L266 C267Y259-R263 WeakPolarHBondContact O-CB 3.42Å; Y259-R263 PolarHBondContact O-N 2.88Å; D260-R263 PolarHBondContact O-N 3.41Å; I261-R263 PolarHBondContact O-N 3.49Å; R263-W265 VanDerWaalsContact C-N 3.34Å; R263-W265 PolarHBondContact O-N 2.87Å; R263-L266 PolarHBondContact O-N 2.97Å; R263-C267 PolarHBondContact O-N 3.06Å; R263-C267 PolarHBondContact O-SG 3.31Å
264K89Confident89.6Confident131 Ų13181.1 Ų81.157%0.5739%0.388SS*.Hα-helixtrans-55.2-51.4175.3-177.9-168.6172.2-164.70110.6D260 I261 L266 C267 E268D260-K264 WeakPolarHBondContact O-CB 3.41Å; D260-K264 PolarHBondContact O-N 3.21Å; I261-K264 PolarHBondContact O-N 3.17Å; K264-L266 PolarHBondContact O-N 3.32Å; K264-C267 PolarHBondContact O-N 2.84Å; K264-E268 WeakPolarHBondContact O-CB 3.24Å; K264-E268 PolarHBondContact O-N 3.38Å
265W90.4Very high89.6Confident16 Ų1684 Ų846%0.06140%0.401CS..Hα-helixtrans-64.7-38.1179.7-82.7105.9000112.7Y3 E6 I7 D10 I261 Q262 R263 E268 I269Y3-W265 AromaticContact CD1-CE3 3.87Å; Y3-W265 HydrophobicContact CD1-CE3 3.87Å; Y3-W265 AromaticContact CD1-CZ3 3.63Å; Y3-W265 HydrophobicContact CD1-CZ3 3.63Å; Y3-W265 HydrophobicContact CE1-CZ3 4.14Å; E6-W265 HydrophobicContact CB-CH2 3.41Å; E6-W265 VanDerWaalsContact CB-CH2 3.41Å; E6-W265 HydrophobicContact CB-CZ2 3.69Å; E6-W265 HydrophobicContact CB-CZ3 4.14Å; E6-W265 HydrophobicContact CG-CH2 4.33Å; E6-W265 VanDerWaalsContact OE2-CH2 3.27Å; E6-W265 WeakPolarHBondContact OE2-CH2 3.38Å; I7-W265 HydrophobicContact CB-CB 4.49Å; I7-W265 HydrophobicContact CB-CD2 4.18Å; I7-W265 HydrophobicContact CB-CG 3.94Å; I7-W265 HydrophobicContact CD1-CB 3.78Å; I7-W265 HydrophobicContact CD1-CG 4.03Å; I7-W265 HydrophobicContact CG1-CB 4.18Å; I7-W265 HydrophobicContact CG1-CG 3.85Å; D10-W265 WeakPolarHBondContact OD2-CZ2 3.23Å; D10-W265 PolarHBondContact OD2-NE1 2.99Å; I261-W265 VanDerWaalsContact O-CD1 3.26Å; I261-W265 PolarHBondContact O-N 2.98Å; Q262-W265 PolarHBondContact O-N 3.39Å; R263-W265 VanDerWaalsContact C-N 3.34Å; R263-W265 PolarHBondContact O-N 2.87Å; W265-E268 PolarHBondContact O-N 3.34Å; W265-I269 VanDerWaalsContact O-CG1 3.28Å; W265-I269 WeakPolarHBondContact O-CG1 3.41Å; W265-I269 PolarHBondContact O-N 3.34Å
266L86.4Confident89.8Confident88 Ų8885.8 Ų85.846%0.46141%0.411SS..Hα-helixtrans-62.2-46.2174.9-176.664.9000111.8Q262 R263 K264 E268 I269 H270Q262-L266 WeakPolarHBondContact O-CB 3.39Å; Q262-L266 PolarHBondContact O-N 3.38Å; R263-L266 PolarHBondContact O-N 2.97Å; K264-L266 PolarHBondContact O-N 3.32Å; L266-E268 VanDerWaalsContact C-N 3.3Å; L266-E268 PolarHBondContact O-N 2.84Å; L266-I269 PolarHBondContact O-N 2.91Å; L266-H270 PolarHBondContact O-N 3.45Å
267C88.4Confident89.7Confident75 Ų7586 Ų8651%0.50741%0.408SS..Hα-helixtrans-61.1-40.1175.7-69.40000111.8R263 K264 H270 S271R263-C267 PolarHBondContact O-N 3.06Å; R263-C267 PolarHBondContact O-SG 3.31Å; K264-C267 PolarHBondContact O-N 2.84Å; C267-H270 PolarHBondContact O-N 3.44Å; C267-S271 VanDerWaalsContact O-CB 3.28Å; C267-S271 WeakPolarHBondContact O-CB 3.49Å; C267-S271 PolarHBondContact O-N 3.06Å
268E88.8Confident89.7Confident75 Ų7587.8 Ų87.835%0.3542%0.417SS..Hα-helixtrans-66-42.1178-169.3168.2173.800111.7K264 W265 L266 S271 N272K264-E268 WeakPolarHBondContact O-CB 3.24Å; K264-E268 PolarHBondContact O-N 3.38Å; W265-E268 PolarHBondContact O-N 3.34Å; L266-E268 VanDerWaalsContact C-N 3.3Å; L266-E268 PolarHBondContact O-N 2.84Å; E268-S271 PolarHBondContact O-N 2.99Å; E268-N272 WeakPolarHBondContact O-CB 3.42Å; E268-N272 PolarHBondContact O-N 3.47Å; E268-N272 PolarHBondContact O-ND2 3.07Å
269I88.2Confident89.7Confident61 Ų6189.8 Ų89.831%0.31343%0.428SS..Hα-helixtrans-61.4-50173.5-69165.5000110.7Y3 W265 L266 S271 N272 E273Y3-I269 HydrophobicContact CD1-CG1 3.86Å; Y3-I269 HydrophobicContact CD2-CG1 4.48Å; Y3-I269 HydrophobicContact CE1-CG1 4.35Å; Y3-I269 HydrophobicContact CG-CD1 4.37Å; Y3-I269 HydrophobicContact CG-CG1 3.95Å; W265-I269 VanDerWaalsContact O-CG1 3.28Å; W265-I269 WeakPolarHBondContact O-CG1 3.41Å; W265-I269 PolarHBondContact O-N 3.34Å; L266-I269 PolarHBondContact O-N 2.91Å; I269-S271 VanDerWaalsContact C-N 3.34Å; I269-S271 PolarHBondContact O-N 3.23Å; I269-N272 PolarHBondContact O-N 3.46Å; I269-E273 PolarHBondContact O-N 2.73Å
270H88.1Confident89.8Confident107 Ų10788.5 Ų88.550%0.49543%0.427SS..Hα-helixtrans-61.9-40.5179.2-71174.8000112.4L266 C267 E273 L274L266-H270 PolarHBondContact O-N 3.45Å; C267-H270 PolarHBondContact O-N 3.44Å; H270-E273 PolarHBondContact O-N 3.34Å; H270-L274 VanDerWaalsContact O-CB 3.31Å; H270-L274 WeakPolarHBondContact O-CB 3.46Å; H270-L274 PolarHBondContact O-N 3.48Å
271S89.9Confident89.7Confident57 Ų5789 Ų8940%0.39943%0.43SS..Hα-helixtrans-63-44176.1-176.60000111.4C267 E268 I269 L274 Q275C267-S271 VanDerWaalsContact O-CB 3.28Å; C267-S271 WeakPolarHBondContact O-CB 3.49Å; C267-S271 PolarHBondContact O-N 3.06Å; E268-S271 PolarHBondContact O-N 2.99Å; I269-S271 VanDerWaalsContact C-N 3.34Å; I269-S271 PolarHBondContact O-N 3.23Å; S271-L274 PolarHBondContact O-N 3.33Å; S271-Q275 WeakPolarHBondContact O-CG 3.23Å; S271-Q275 PolarHBondContact O-N 2.92Å
272N90.6Very high89.8Confident43 Ų4393.1 Ų93.123%0.2345%0.448CS..Hα-helixtrans-66.3-41178-71.7-38.5000111.7Y3 E268 I269 Q275 L276Y3-N272 PolarHBondContact OH-ND2 3.27Å; E268-N272 WeakPolarHBondContact O-CB 3.42Å; E268-N272 PolarHBondContact O-N 3.47Å; E268-N272 PolarHBondContact O-ND2 3.07Å; I269-N272 PolarHBondContact O-N 3.46Å; N272-Q275 PolarHBondContact O-N 3.25Å; N272-L276 WeakPolarHBondContact O-CG 3.36Å; N272-L276 PolarHBondContact O-N 3.23Å
273E89.2Confident90Very high96 Ų9693 Ų9345%0.44945%0.449SS..Hα-helixtrans-63.9-42.6175.3-166.5-168.8146.400111.9I269 H270 Q275 L276 R277I269-E273 PolarHBondContact O-N 2.73Å; H270-E273 PolarHBondContact O-N 3.34Å; E273-Q275 PolarHBondContact O-N 3.41Å; E273-L276 PolarHBondContact O-N 3.14Å; E273-R277 WeakPolarHBondContact O-CB 3.34Å; E273-R277 PolarHBondContact O-N 3.34Å; E273-R277 IonicContact OE1-CZ 2.74Å; E273-R277 IonicContact OE1-NH2 3.96Å; E273-R277 PolarHBondContact OE1-NH2 3.03Å
274L90.5Very high90.1Very high91 Ų9188.1 Ų88.148%0.47644%0.438SS..Hα-helixtrans-62.1-42.9176.2-178.763.5000111.5H270 S271 R277 N278H270-L274 VanDerWaalsContact O-CB 3.31Å; H270-L274 WeakPolarHBondContact O-CB 3.46Å; H270-L274 PolarHBondContact O-N 3.48Å; S271-L274 PolarHBondContact O-N 3.33Å; L274-R277 PolarHBondContact O-N 2.96Å; L274-N278 WeakPolarHBondContact O-CB 3.39Å; L274-N278 VanDerWaalsContact O-CG 3.28Å; L274-N278 PolarHBondContact O-N 3.03Å
275Q90.8Very high90.2Very high121 Ų12186.9 Ų86.957%0.56544%0.436SS*.Hα-helixtrans-62-43.9175.5-76.2178.6-1.500112S271 N272 E273 N278 H279S271-Q275 WeakPolarHBondContact O-CG 3.23Å; S271-Q275 PolarHBondContact O-N 2.92Å; N272-Q275 PolarHBondContact O-N 3.25Å; E273-Q275 PolarHBondContact O-N 3.41Å; Q275-N278 PolarHBondContact O-N 3.14Å; Q275-H279 WeakPolarHBondContact O-CB 3.37Å; Q275-H279 PolarHBondContact O-N 2.9Å
276L91.9Very high90.3Very high125 Ų12590.9 Ų90.965%0.65446%0.458SS*.Hα-helixtrans-61.2-44.1175.6-74.7166.7000111.7N272 E273 H279 Q280N272-L276 WeakPolarHBondContact O-CG 3.36Å; N272-L276 PolarHBondContact O-N 3.23Å; E273-L276 PolarHBondContact O-N 3.14Å; L276-H279 PolarHBondContact O-N 3.22Å; L276-Q280 WeakPolarHBondContact O-CB 3.47Å; L276-Q280 PolarHBondContact O-N 2.91Å
277R90.2Very high90.5Very high136 Ų13693.3 Ų93.351%0.51347%0.465SS..Hα-helixtrans-64.4-44.6177.5-167.2-176-59.2166.42.6111.8E273 L274 H279 Q280 N281E273-R277 WeakPolarHBondContact O-CB 3.34Å; E273-R277 PolarHBondContact O-N 3.34Å; E273-R277 IonicContact OE1-CZ 2.74Å; E273-R277 IonicContact OE1-NH2 3.96Å; E273-R277 PolarHBondContact OE1-NH2 3.03Å; L274-R277 PolarHBondContact O-N 2.96Å; R277-H279 VanDerWaalsContact C-N 3.34Å; R277-H279 PolarHBondContact O-N 3.31Å; R277-Q280 PolarHBondContact O-N 2.9Å; R277-N281 WeakPolarHBondContact O-CB 3.33Å; R277-N281 VanDerWaalsContact O-CG 3.24Å; R277-N281 PolarHBondContact O-N 3.18Å
278N90.3Very high90.7Very high75 Ų7594.6 Ų94.640%0.40147%0.466SS..Hα-helixtrans-62.5-42.4176-75.5-12.9000111.5L274 Q275 N281 H282L274-N278 WeakPolarHBondContact O-CB 3.39Å; L274-N278 VanDerWaalsContact O-CG 3.28Å; L274-N278 PolarHBondContact O-N 3.03Å; Q275-N278 PolarHBondContact O-N 3.14Å; N278-N281 PolarHBondContact O-N 3.26Å; N278-H282 PolarHBondContact O-CD2 3.17Å; N278-H282 PolarHBondContact O-N 3.32Å
279H91.9Very high90.7Very high122 Ų12295.3 Ų95.357%0.56547%0.472SS*.Hα-helixtrans-61.4-45.4176-173.467.4000111.7Q275 L276 R277 N281 H282 I283Q275-H279 WeakPolarHBondContact O-CB 3.37Å; Q275-H279 PolarHBondContact O-N 2.9Å; L276-H279 PolarHBondContact O-N 3.22Å; R277-H279 VanDerWaalsContact C-N 3.34Å; R277-H279 PolarHBondContact O-N 3.31Å; H279-N281 PolarHBondContact O-N 3.44Å; H279-H282 PolarHBondContact O-N 2.89Å; H279-I283 WeakPolarHBondContact O-CG1 3.23Å; H279-I283 PolarHBondContact O-N 2.97Å
280Q92.7Very high90.9Very high108 Ų10898 Ų9851%0.50548%0.483SS..Hα-helixtrans-61.8-43.8176-174.563.516.300111.9L276 R277 H282 I283 T284L276-Q280 WeakPolarHBondContact O-CB 3.47Å; L276-Q280 PolarHBondContact O-N 2.91Å; R277-Q280 PolarHBondContact O-N 2.9Å; Q280-H282 VanDerWaalsContact C-N 3.33Å; Q280-H282 PolarHBondContact O-N 3.45Å; Q280-I283 WeakPolarHBondContact O-CB 3.23Å; Q280-I283 PolarHBondContact O-N 3.34Å; Q280-T284 PolarHBondContact O-N 2.93Å; Q280-T284 PolarHBondContact O-OG1 3.48Å
281N89.7Confident91.1Very high84 Ų8496.3 Ų96.345%0.44948%0.483SS..Hα-helixtrans-61.5-40.1176.7-74.3-9.6000112.1R277 N278 H279 T284 M285R277-N281 WeakPolarHBondContact O-CB 3.33Å; R277-N281 VanDerWaalsContact O-CG 3.24Å; R277-N281 PolarHBondContact O-N 3.18Å; N278-N281 PolarHBondContact O-N 3.26Å; H279-N281 PolarHBondContact O-N 3.44Å; N281-T284 VanDerWaalsContact CA-OG1 3.29Å; N281-T284 WeakPolarHBondContact CA-OG1 3.27Å; N281-T284 PolarHBondContact O-N 3.44Å; N281-T284 PolarHBondContact O-OG1 3.15Å; N281-M285 VanDerWaalsContact O-CB 3.26Å; N281-M285 WeakPolarHBondContact O-CB 3.48Å; N281-M285 PolarHBondContact O-N 2.93Å
282H90.5Very high91.1Very high114 Ų11497.7 Ų97.753%0.52848%0.483SS..Hα-helixtrans-62.6-42.5173.4-84.1-62.4000112N278 H279 Q280 M285 N286N278-H282 PolarHBondContact O-CD2 3.17Å; N278-H282 PolarHBondContact O-N 3.32Å; H279-H282 PolarHBondContact O-N 2.89Å; Q280-H282 VanDerWaalsContact C-N 3.33Å; Q280-H282 PolarHBondContact O-N 3.45Å; H282-M285 PolarHBondContact O-N 3.3Å; H282-N286 WeakPolarHBondContact O-CB 3.39Å; H282-N286 VanDerWaalsContact O-CG 3.23Å; H282-N286 PolarHBondContact O-N 3.38Å; H282-N286 PolarHBondContact O-ND2 3.46Å
283I93Very high91.2Very high58 Ų58101.2 Ų101.230%0.29750%0.5SS..Hα-helixtrans-61.6-46.5175.5-67.4166.5000110.6H279 Q280 N286 K287H279-I283 WeakPolarHBondContact O-CG1 3.23Å; H279-I283 PolarHBondContact O-N 2.97Å; Q280-I283 WeakPolarHBondContact O-CB 3.23Å; Q280-I283 PolarHBondContact O-N 3.34Å; I283-N286 PolarHBondContact O-N 2.99Å; I283-K287 HydrophobicContact CG2-CD 4.45Å; I283-K287 WeakPolarHBondContact O-CG 3.39Å; I283-K287 PolarHBondContact O-N 2.98Å; I283-K287 VanDerWaalsContact O-N 3.08Å
284T91.6Very high91.2Very high67 Ų67100.2 Ų100.241%0.41150%0.498SS..Hα-helixtrans-65.6-39.5179.550.50000112.3Q280 N281 K287 L288Q280-T284 PolarHBondContact O-N 2.93Å; Q280-T284 PolarHBondContact O-OG1 3.48Å; N281-T284 VanDerWaalsContact CA-OG1 3.29Å; N281-T284 WeakPolarHBondContact CA-OG1 3.27Å; N281-T284 PolarHBondContact O-N 3.44Å; N281-T284 PolarHBondContact O-OG1 3.15Å; T284-K287 PolarHBondContact O-N 3.01Å; T284-L288 PolarHBondContact O-N 3.47Å
285M91.8Very high91Very high106 Ų106101.8 Ų101.852%0.52250%0.502SS..Hα-helixtrans-64.3-44.9176.4-176.1-175.7-71.700111.3N281 H282 K287 L288 I289N281-M285 VanDerWaalsContact O-CB 3.26Å; N281-M285 WeakPolarHBondContact O-CB 3.48Å; N281-M285 PolarHBondContact O-N 2.93Å; H282-M285 PolarHBondContact O-N 3.3Å; M285-K287 VanDerWaalsContact C-N 3.32Å; M285-K287 PolarHBondContact O-N 2.68Å; M285-L288 WeakPolarHBondContact O-CB 3.48Å; M285-L288 PolarHBondContact O-N 3.27Å; M285-L288 VanDerWaalsContact O-N 3.15Å; M285-I289 HydrophobicContact CG-CD1 4Å; M285-I289 WeakPolarHBondContact O-CG1 3.39Å; M285-I289 PolarHBondContact O-N 3.42Å
286N91.3Very high91Very high99 Ų99104.5 Ų104.553%0.52951%0.507SS..Hα-helixtrans-60.2-41.6176.5-74.3-18.1000111.8H282 I283 L288 I289 E290H282-N286 WeakPolarHBondContact O-CB 3.39Å; H282-N286 VanDerWaalsContact O-CG 3.23Å; H282-N286 PolarHBondContact O-N 3.38Å; H282-N286 PolarHBondContact O-ND2 3.46Å; I283-N286 PolarHBondContact O-N 2.99Å; N286-L288 PolarHBondContact O-N 3.2Å; N286-I289 PolarHBondContact O-N 3.48Å; N286-E290 WeakPolarHBondContact O-CB 3.37Å; N286-E290 PolarHBondContact O-N 2.94Å
287K92.2Very high90.9Very high139 Ų139103.4 Ų103.460%0.60450%0.499SS*.Hα-helixtrans-62.1-40.7174.1-73.3179.1178.3-175.30112.6I283 T284 M285 E290 S291I283-K287 HydrophobicContact CG2-CD 4.45Å; I283-K287 WeakPolarHBondContact O-CG 3.39Å; I283-K287 PolarHBondContact O-N 2.98Å; I283-K287 VanDerWaalsContact O-N 3.08Å; T284-K287 PolarHBondContact O-N 3.01Å; M285-K287 VanDerWaalsContact C-N 3.32Å; M285-K287 PolarHBondContact O-N 2.68Å; K287-E290 PolarHBondContact O-N 3.33Å; K287-S291 WeakPolarHBondContact O-CB 3.43Å; K287-S291 PolarHBondContact O-N 2.91Å
288L90.8Very high91Very high102 Ų102102.7 Ų102.753%0.53450%0.503SS..Hα-helixtrans-64.4-45176.7-178.766.2000111.3T284 M285 N286 E290 S291 Q292T284-L288 PolarHBondContact O-N 3.47Å; M285-L288 WeakPolarHBondContact O-CB 3.48Å; M285-L288 PolarHBondContact O-N 3.27Å; M285-L288 VanDerWaalsContact O-N 3.15Å; N286-L288 PolarHBondContact O-N 3.2Å; L288-E290 VanDerWaalsContact C-N 3.34Å; L288-E290 PolarHBondContact O-N 3.49Å; L288-S291 PolarHBondContact O-N 3.47Å; L288-Q292 WeakPolarHBondContact O-CG 3.38Å; L288-Q292 PolarHBondContact O-N 3.37Å
289I89.8Confident90.8Very high91 Ų91103.2 Ų103.247%0.46751%0.509SS..Hα-helixtrans-60-45.4176.7-68.6167000110.5M285 N286 Q292 M293M285-I289 HydrophobicContact CG-CD1 4Å; M285-I289 WeakPolarHBondContact O-CG1 3.39Å; M285-I289 PolarHBondContact O-N 3.42Å; N286-I289 PolarHBondContact O-N 3.48Å; I289-Q292 PolarHBondContact O-N 3.14Å; I289-M293 WeakPolarHBondContact O-CB 3.35Å; I289-M293 PolarHBondContact O-N 2.9Å
290E91.7Very high90.7Very high118 Ų118101 Ų10155%0.55151%0.506SS*.Hα-helixtrans-61.1-45.1176.7-173178.6-174.900111.7N286 K287 L288 M293 N294N286-E290 WeakPolarHBondContact O-CB 3.37Å; N286-E290 PolarHBondContact O-N 2.94Å; K287-E290 PolarHBondContact O-N 3.33Å; L288-E290 VanDerWaalsContact C-N 3.34Å; L288-E290 PolarHBondContact O-N 3.49Å; E290-M293 PolarHBondContact O-N 3.35Å; E290-N294 VanDerWaalsContact O-CG 3.26Å; E290-N294 PolarHBondContact O-N 3.34Å; E290-N294 PolarHBondContact O-ND2 2.87Å
291S92.2Very high90.7Very high71 Ų71101.7 Ų101.750%0.49751%0.507SS..Hα-helixtrans-60-47.3175.8-171.90000112.3K287 L288 M293 N294 E295K287-S291 WeakPolarHBondContact O-CB 3.43Å; K287-S291 PolarHBondContact O-N 2.91Å; L288-S291 PolarHBondContact O-N 3.47Å; S291-M293 VanDerWaalsContact C-N 3.32Å; S291-M293 PolarHBondContact O-N 2.93Å; S291-N294 PolarHBondContact O-N 3.06Å; S291-E295 PolarHBondContact O-N 3.37Å
292Q91.2Very high90.7Very high85 Ų85102.5 Ų102.540%0.39751%0.511SS..Hα-helixtrans-63.7-37.4177.5-74.2-177.2-9.300112L288 I289 E295 R296L288-Q292 WeakPolarHBondContact O-CG 3.38Å; L288-Q292 PolarHBondContact O-N 3.37Å; I289-Q292 PolarHBondContact O-N 3.14Å; Q292-E295 PolarHBondContact O-N 3.43Å; Q292-R296 WeakPolarHBondContact O-CB 3.38Å; Q292-R296 VanDerWaalsContact O-CG 3.29Å; Q292-R296 WeakPolarHBondContact O-CG 3.33Å; Q292-R296 PolarHBondContact O-N 3.32Å
293M91.1Very high90.7Very high118 Ų118101.7 Ų101.758%0.58151%0.51SS*.Hα-helixtrans-64.1-43.8175.6-170.9175.976.600111.2I289 E290 S291 R296 Q297I289-M293 WeakPolarHBondContact O-CB 3.35Å; I289-M293 PolarHBondContact O-N 2.9Å; E290-M293 PolarHBondContact O-N 3.35Å; S291-M293 VanDerWaalsContact C-N 3.32Å; S291-M293 PolarHBondContact O-N 2.93Å; M293-R296 PolarHBondContact O-N 3.14Å; M293-Q297 WeakPolarHBondContact O-CB 3.37Å; M293-Q297 PolarHBondContact O-N 3.24Å
294N89.9Confident90.6Very high75 Ų75106.6 Ų106.640%0.40153%0.529SS..Hα-helixtrans-63.2-43.4176.8-70.9-24.5000112E290 S291 Q297 M298E290-N294 VanDerWaalsContact O-CG 3.26Å; E290-N294 PolarHBondContact O-N 3.34Å; E290-N294 PolarHBondContact O-ND2 2.87Å; S291-N294 PolarHBondContact O-N 3.06Å; N294-Q297 PolarHBondContact O-N 3.43Å; N294-M298 PolarHBondContact O-N 2.89Å
295E87Confident90.5Very high123 Ų123109.7 Ų109.758%0.57554%0.539SS*.Hα-helixtrans-60.2-50175.6-173.5-175.9177.900111.4S291 Q292 Q297 M298 V299S291-E295 PolarHBondContact O-N 3.37Å; Q292-E295 PolarHBondContact O-N 3.43Å; E295-Q297 VanDerWaalsContact C-N 3.28Å; E295-Q297 PolarHBondContact O-N 2.87Å; E295-M298 WeakPolarHBondContact O-CB 3.36Å; E295-M298 PolarHBondContact O-N 2.85Å; E295-M298 VanDerWaalsContact O-N 3.08Å; E295-V299 WeakPolarHBondContact O-CG2 3.45Å; E295-V299 PolarHBondContact O-N 2.9Å
296R89.6Confident90.4Very high178 Ų178106.7 Ų106.767%0.67253%0.528SS*.Hα-helixtrans-59-39.7176.1-72.4176.5-174.2-160.63.4112.2Q292 M293 M298 V299 C300Q292-R296 WeakPolarHBondContact O-CB 3.38Å; Q292-R296 VanDerWaalsContact O-CG 3.29Å; Q292-R296 WeakPolarHBondContact O-CG 3.33Å; Q292-R296 PolarHBondContact O-N 3.32Å; M293-R296 PolarHBondContact O-N 3.14Å; R296-M298 VanDerWaalsContact C-N 3.33Å; R296-V299 PolarHBondContact O-N 3.06Å; R296-C300 WeakPolarHBondContact O-CB 3.39Å; R296-C300 PolarHBondContact O-N 3.29Å; R296-C300 PolarHBondContact O-SG 2.95Å
297Q90.7Very high90.3Very high103 Ų103105.9 Ų105.948%0.48152%0.523SS..Hα-helixtrans-65.1-39.1176.9-165.9-176.618.900111.4M293 N294 E295 C300 K301M293-Q297 WeakPolarHBondContact O-CB 3.37Å; M293-Q297 PolarHBondContact O-N 3.24Å; N294-Q297 PolarHBondContact O-N 3.43Å; E295-Q297 VanDerWaalsContact C-N 3.28Å; E295-Q297 PolarHBondContact O-N 2.87Å; Q297-C300 PolarHBondContact O-N 3.44Å; Q297-K301 WeakPolarHBondContact O-CG 3.31Å; Q297-K301 PolarHBondContact O-N 3.48Å
298M91.7Very high90.2Very high120 Ų120104.5 Ų104.559%0.59152%0.519SS*.Hα-helixtrans-65.8-47.1176.2-168-172.4-50.700111.8N294 E295 R296 C300 K301 L302N294-M298 PolarHBondContact O-N 2.89Å; E295-M298 WeakPolarHBondContact O-CB 3.36Å; E295-M298 PolarHBondContact O-N 2.85Å; E295-M298 VanDerWaalsContact O-N 3.08Å; R296-M298 VanDerWaalsContact C-N 3.33Å; M298-C300 VanDerWaalsContact C-N 3.32Å; M298-C300 PolarHBondContact O-N 2.93Å; M298-K301 WeakPolarHBondContact O-CB 3.4Å; M298-K301 PolarHBondContact O-N 3.44Å; M298-K301 VanDerWaalsContact O-N 3.07Å; M298-L302 HydrophobicContact CG-CD1 4.37Å; M298-L302 WeakPolarHBondContact O-CG 3.35Å; M298-L302 PolarHBondContact O-N 2.9Å
299V87.3Confident90Very high86 Ų86102 Ų10252%0.52151%0.51SS..Hα-helixtrans-57.3-45.9174.9173.10000110.7E295 R296 K301 L302 L303E295-V299 WeakPolarHBondContact O-CG2 3.45Å; E295-V299 PolarHBondContact O-N 2.9Å; R296-V299 PolarHBondContact O-N 3.06Å; V299-K301 VanDerWaalsContact C-N 3.33Å; V299-K301 PolarHBondContact O-N 2.99Å; V299-L302 PolarHBondContact O-N 3.39Å; V299-L303 WeakPolarHBondContact O-CB 3.38Å; V299-L303 PolarHBondContact O-N 2.91Å
300C89.5Confident89.9Confident75 Ų75105.3 Ų105.351%0.50752%0.518SS..Hα-helixtrans-61.3-37.5175.4-76.30000113R296 Q297 M298 K304R296-C300 WeakPolarHBondContact O-CB 3.39Å; R296-C300 PolarHBondContact O-N 3.29Å; R296-C300 PolarHBondContact O-SG 2.95Å; Q297-C300 PolarHBondContact O-N 3.44Å; M298-C300 VanDerWaalsContact C-N 3.32Å; M298-C300 PolarHBondContact O-N 2.93Å; C300-K304 WeakPolarHBondContact O-CG 3.48Å; C300-K304 PolarHBondContact O-N 3.42Å
301K91.5Very high89.7Confident124 Ų124106.2 Ų106.254%0.53952%0.52SS..Hα-helixtrans-66.6-47175.6-78175.4-179.81760111.5Q297 M298 V299 L303 K304 Q305Q297-K301 WeakPolarHBondContact O-CG 3.31Å; Q297-K301 PolarHBondContact O-N 3.48Å; M298-K301 WeakPolarHBondContact O-CB 3.4Å; M298-K301 PolarHBondContact O-N 3.44Å; M298-K301 VanDerWaalsContact O-N 3.07Å; V299-K301 VanDerWaalsContact C-N 3.33Å; V299-K301 PolarHBondContact O-N 2.99Å; K301-L303 VanDerWaalsContact C-N 3.35Å; K301-L303 PolarHBondContact O-N 2.86Å; K301-K304 PolarHBondContact O-N 3.14Å; K301-Q305 WeakPolarHBondContact O-CG 3.34Å; K301-Q305 PolarHBondContact O-N 3.41Å
302L90.8Very high89.6Confident100 Ų100107.9 Ų107.952%0.52452%0.52SS..Hα-helixtrans-61.4-43177.2-71.9170.8000111.4M298 V299 K304 Q305 S306M298-L302 HydrophobicContact CG-CD1 4.37Å; M298-L302 WeakPolarHBondContact O-CG 3.35Å; M298-L302 PolarHBondContact O-N 2.9Å; V299-L302 PolarHBondContact O-N 3.39Å; L302-K304 VanDerWaalsContact C-N 3.35Å; L302-K304 PolarHBondContact O-N 3.45Å; L302-Q305 PolarHBondContact O-N 2.87Å; L302-S306 PolarHBondContact O-N 3.28Å; L302-S306 PolarHBondContact O-OG 2.99Å
303L89.3Confident89.2Confident98 Ų98108 Ų10851%0.51352%0.522SS..Hα-helixtrans-61.8-40.7175.3-176.965000112.1V299 K301 S306 I307V299-L303 WeakPolarHBondContact O-CB 3.38Å; V299-L303 PolarHBondContact O-N 2.91Å; K301-L303 VanDerWaalsContact C-N 3.35Å; K301-L303 PolarHBondContact O-N 2.86Å; L303-S306 PolarHBondContact O-N 2.93Å; L303-S306 PolarHBondContact O-OG 3.47Å; L303-I307 HydrophobicContact CD1-CD1 4.28Å; L303-I307 HydrophobicContact CG-CD1 4Å; L303-I307 WeakPolarHBondContact O-CB 3.49Å; L303-I307 WeakPolarHBondContact O-CD1 3.5Å; L303-I307 WeakPolarHBondContact O-CG1 3.45Å; L303-I307 PolarHBondContact O-N 3.22Å
304K91Very high88.9Confident160 Ų160107.5 Ų107.570%0.69652%0.518SS*.Hα-helixtrans-63.8-41.7174.8-78.9179.2178.8-176.70112.1C300 K301 L302 H308C300-K304 WeakPolarHBondContact O-CG 3.48Å; C300-K304 PolarHBondContact O-N 3.42Å; K301-K304 PolarHBondContact O-N 3.14Å; L302-K304 VanDerWaalsContact C-N 3.35Å; L302-K304 PolarHBondContact O-N 3.45Å; K304-H308 WeakPolarHBondContact O-CB 3.31Å; K304-H308 PolarHBondContact O-N 3.27Å
305Q90.1Very high88.8Confident132 Ų132106.6 Ų106.662%0.61752%0.518SS*.Hα-helixtrans-65.4-43.4176.9-74.5176.7-19.200111.7K301 L302 H308 S309K301-Q305 WeakPolarHBondContact O-CG 3.34Å; K301-Q305 PolarHBondContact O-N 3.41Å; L302-Q305 PolarHBondContact O-N 2.87Å; Q305-H308 WeakPolarHBondContact O-CB 3.39Å; Q305-H308 PolarHBondContact O-N 3.11Å; Q305-S309 PolarHBondContact O-N 2.91Å
306S89.5Confident88.8Confident43 Ų43105.4 Ų105.430%0.30151%0.514SS..Hα-helixtrans-63.2-47.1177.569.80000111.2L302 L303 H308 S309 Y310L302-S306 PolarHBondContact O-N 3.28Å; L302-S306 PolarHBondContact O-OG 2.99Å; L303-S306 PolarHBondContact O-N 2.93Å; L303-S306 PolarHBondContact O-OG 3.47Å; S306-H308 VanDerWaalsContact C-N 3.25Å; S306-H308 PolarHBondContact O-N 3.4Å; S306-S309 PolarHBondContact O-N 2.97Å; S306-S309 VanDerWaalsContact O-N 3.09Å; S306-S309 PolarHBondContact O-OG 2.83Å; S306-Y310 VanDerWaalsContact O-CD2 3.23Å; S306-Y310 WeakPolarHBondContact O-CD2 3.32Å; S306-Y310 PolarHBondContact O-N 3.4Å
307I89.2Confident88.3Confident82 Ų82101.9 Ų101.942%0.42151%0.508SS..Hα-helixtrans-56.1-41.4174.3-69.2166.2000111.2L303 Y310 K311L303-I307 HydrophobicContact CD1-CD1 4.28Å; L303-I307 HydrophobicContact CG-CD1 4Å; L303-I307 WeakPolarHBondContact O-CB 3.49Å; L303-I307 WeakPolarHBondContact O-CD1 3.5Å; L303-I307 WeakPolarHBondContact O-CG1 3.45Å; L303-I307 PolarHBondContact O-N 3.22Å; I307-Y310 PolarHBondContact O-N 3.43Å; I307-K311 WeakPolarHBondContact O-CG 3.46Å; I307-K311 PolarHBondContact O-N 3.28Å
308H91.1Very high88Confident111 Ų111100.8 Ų100.851%0.51450%0.503SS..Hα-helixtrans-63.6-44.6176.7-172.175.2000112.1K304 Q305 S306 Y310 K311 Q312K304-H308 WeakPolarHBondContact O-CB 3.31Å; K304-H308 PolarHBondContact O-N 3.27Å; Q305-H308 WeakPolarHBondContact O-CB 3.39Å; Q305-H308 PolarHBondContact O-N 3.11Å; S306-H308 VanDerWaalsContact C-N 3.25Å; S306-H308 PolarHBondContact O-N 3.4Å; H308-Y310 PolarHBondContact O-N 2.94Å; H308-K311 PolarHBondContact O-N 3.4Å; H308-Q312 PolarHBondContact CD2-NE2 3.49Å; H308-Q312 VanDerWaalsContact CD2-NE2 3.27Å; H308-Q312 PolarHBondContact NE2-NE2 3.45Å; H308-Q312 PolarHBondContact O-N 3.07Å
309S86.3Confident87.7Confident49 Ų4998.4 Ų98.434%0.34349%0.493SS..Hα-helixtrans-62.2-41.1175.970.60000112.4Q305 S306 K311 Q312 I313Q305-S309 PolarHBondContact O-N 2.91Å; S306-S309 PolarHBondContact O-N 2.97Å; S306-S309 VanDerWaalsContact O-N 3.09Å; S306-S309 PolarHBondContact O-OG 2.83Å; S309-K311 VanDerWaalsContact C-N 3.34Å; S309-K311 PolarHBondContact O-N 2.99Å; S309-Q312 WeakPolarHBondContact O-CB 3.4Å; S309-Q312 PolarHBondContact O-N 2.92Å; S309-Q312 VanDerWaalsContact O-N 3.17Å; S309-I313 WeakPolarHBondContact O-CG1 3.3Å; S309-I313 PolarHBondContact O-N 3.31Å
310Y86.8Confident87.4Confident161 Ų16198.2 Ų98.263%0.63149%0.488SS*.Hα-helixtrans-61-41.7173.7-85-69.8000112S306 I307 H308 Q312 I313 Q314S306-Y310 VanDerWaalsContact O-CD2 3.23Å; S306-Y310 WeakPolarHBondContact O-CD2 3.32Å; S306-Y310 PolarHBondContact O-N 3.4Å; I307-Y310 PolarHBondContact O-N 3.43Å; H308-Y310 PolarHBondContact O-N 2.94Å; Y310-Q312 VanDerWaalsContact C-N 3.33Å; Y310-Q312 PolarHBondContact O-N 3.01Å; Y310-I313 PolarHBondContact O-N 3.43Å; Y310-Q314 WeakPolarHBondContact O-CB 3.48Å; Y310-Q314 PolarHBondContact O-N 3.21Å
311K88.8Confident86.7Confident136 Ų136100.1 Ų100.159%0.59149%0.493SS*.Hα-helixtrans-63.3-37.7174.7-75.3-175.9176-171.20112.6I307 H308 S309 Q314 S315I307-K311 WeakPolarHBondContact O-CG 3.46Å; I307-K311 PolarHBondContact O-N 3.28Å; H308-K311 PolarHBondContact O-N 3.4Å; S309-K311 VanDerWaalsContact C-N 3.34Å; S309-K311 PolarHBondContact O-N 2.99Å; K311-Q314 PolarHBondContact O-N 3.25Å; K311-S315 PolarHBondContact O-N 2.84Å
312Q88.6Confident85.9Confident106 Ų106100.3 Ų100.350%0.49549%0.49SS..Hα-helixtrans-65.1-46174.2-69.6-179.13.700111.4H308 S309 Y310 Q314 S315 I316H308-Q312 PolarHBondContact CD2-NE2 3.49Å; H308-Q312 VanDerWaalsContact CD2-NE2 3.27Å; H308-Q312 PolarHBondContact NE2-NE2 3.45Å; H308-Q312 PolarHBondContact O-N 3.07Å; S309-Q312 WeakPolarHBondContact O-CB 3.4Å; S309-Q312 PolarHBondContact O-N 2.92Å; S309-Q312 VanDerWaalsContact O-N 3.17Å; Y310-Q312 VanDerWaalsContact C-N 3.33Å; Y310-Q312 PolarHBondContact O-N 3.01Å; Q312-Q314 VanDerWaalsContact C-N 3.32Å; Q312-Q314 PolarHBondContact O-N 2.93Å; Q312-S315 WeakPolarHBondContact O-CB 3.49Å; Q312-S315 PolarHBondContact O-N 2.72Å; Q312-I316 WeakPolarHBondContact O-CG1 3.42Å; Q312-I316 PolarHBondContact O-N 2.77Å
313I83.7Confident85Confident89 Ų89102.2 Ų102.246%0.45649%0.494SS..Hα-helixtrans-58.7-46.5175.4-67.3165.6000110.2S309 Y310 S315 I316 L317S309-I313 WeakPolarHBondContact O-CG1 3.3Å; S309-I313 PolarHBondContact O-N 3.31Å; Y310-I313 PolarHBondContact O-N 3.43Å; I313-S315 VanDerWaalsContact C-N 3.32Å; I313-S315 PolarHBondContact O-N 2.94Å; I313-I316 PolarHBondContact O-N 2.91Å; I313-L317 HydrophobicContact CG2-CD1 3.83Å; I313-L317 HydrophobicContact CG2-CG 4.28Å; I313-L317 WeakPolarHBondContact O-CB 3.45Å; I313-L317 WeakPolarHBondContact O-CG 3.33Å; I313-L317 PolarHBondContact O-N 3.32Å
314Q83.4Confident83.7Confident107 Ų107101.8 Ų101.850%0.549%0.492SS..Hα-helixtrans-57.6-45.1176.2-175.5-175.8-20.900111.3Y310 K311 Q312 I316 L317 E318Y310-Q314 WeakPolarHBondContact O-CB 3.48Å; Y310-Q314 PolarHBondContact O-N 3.21Å; K311-Q314 PolarHBondContact O-N 3.25Å; Q312-Q314 VanDerWaalsContact C-N 3.32Å; Q312-Q314 PolarHBondContact O-N 2.93Å; Q314-I316 PolarHBondContact O-N 3.5Å; Q314-L317 PolarHBondContact O-N 2.93Å; Q314-E318 HydrophobicContact CG-CG 4.48Å; Q314-E318 PolarHBondContact NE2-OE1 2.89Å; Q314-E318 WeakPolarHBondContact O-CB 3.5Å; Q314-E318 WeakPolarHBondContact O-CG 3.29Å; Q314-E318 PolarHBondContact O-N 2.92Å
315S87.9Confident82.2Confident55 Ų5599 Ų9939%0.38548%0.484SS..Hα-helixtrans-60.8-42.2175.9-172.10000112.5K311 Q312 I313 E318 D319K311-S315 PolarHBondContact O-N 2.84Å; Q312-S315 WeakPolarHBondContact O-CB 3.49Å; Q312-S315 PolarHBondContact O-N 2.72Å; I313-S315 VanDerWaalsContact C-N 3.32Å; I313-S315 PolarHBondContact O-N 2.94Å; S315-E318 PolarHBondContact O-N 3.44Å; S315-D319 WeakPolarHBondContact O-CB 3.33Å; S315-D319 VanDerWaalsContact O-CG 3.29Å; S315-D319 PolarHBondContact O-N 3.31Å
316I87.2Confident80.5Confident98 Ų9898.1 Ų98.150%0.50348%0.483SS..Hα-helixtrans-65-44.9177.2-67.2165.7000110.4Q312 I313 Q314 D319 I320Q312-I316 WeakPolarHBondContact O-CG1 3.42Å; Q312-I316 PolarHBondContact O-N 2.77Å; I313-I316 PolarHBondContact O-N 2.91Å; Q314-I316 PolarHBondContact O-N 3.5Å; I316-D319 PolarHBondContact O-N 2.87Å; I316-I320 HydrophobicContact CG2-CD1 3.91Å; I316-I320 HydrophobicContact CG2-CG1 4.44Å; I316-I320 WeakPolarHBondContact O-CG1 3.46Å; I316-I320 PolarHBondContact O-N 3.4Å
317L79.7Confident78.4Confident105 Ų105102 Ų10255%0.5550%0.497SS..Hα-helixtrans-62.7-42.2176.5-72.4171.4000111.4I313 Q314 D319 I320 L321I313-L317 HydrophobicContact CG2-CD1 3.83Å; I313-L317 HydrophobicContact CG2-CG 4.28Å; I313-L317 WeakPolarHBondContact O-CB 3.45Å; I313-L317 WeakPolarHBondContact O-CG 3.33Å; I313-L317 PolarHBondContact O-N 3.32Å; Q314-L317 PolarHBondContact O-N 2.93Å; L317-D319 VanDerWaalsContact C-N 3.3Å; L317-D319 PolarHBondContact O-N 3.22Å; L317-I320 PolarHBondContact O-N 3.13Å; L317-L321 WeakPolarHBondContact O-CB 3.45Å; L317-L321 PolarHBondContact O-N 3Å
318E85.3Confident76.1Confident80 Ų80103.8 Ų103.837%0.37451%0.507SS..Hα-helixtrans-61.5-38.1173.3-76.5176.7-163.700111.9Q314 S315 L321 R322Q314-E318 HydrophobicContact CG-CG 4.48Å; Q314-E318 PolarHBondContact NE2-OE1 2.89Å; Q314-E318 WeakPolarHBondContact O-CB 3.5Å; Q314-E318 WeakPolarHBondContact O-CG 3.29Å; Q314-E318 PolarHBondContact O-N 2.92Å; S315-E318 PolarHBondContact O-N 3.44Å; E318-L321 PolarHBondContact O-N 2.98Å; E318-R322 WeakPolarHBondContact O-CB 3.3Å; E318-R322 WeakPolarHBondContact O-CG 3.41Å; E318-R322 PolarHBondContact O-N 3.02Å; E318-R322 IonicContact OE2-NH2 3.19Å
319D83.7Confident73.8Confident70 Ų70108.3 Ų108.337%0.37452%0.521SS..Hα-helixtrans-70.7-38.8176.1-75.5-11.2000112.9S315 I316 L317 R322 K323S315-D319 WeakPolarHBondContact O-CB 3.33Å; S315-D319 VanDerWaalsContact O-CG 3.29Å; S315-D319 PolarHBondContact O-N 3.31Å; I316-D319 PolarHBondContact O-N 2.87Å; L317-D319 VanDerWaalsContact C-N 3.3Å; L317-D319 PolarHBondContact O-N 3.22Å; D319-R322 PolarHBondContact O-N 2.89Å; D319-R322 IonicContact OD1-CZ 3.47Å; D319-R322 IonicContact OD1-NE 3.28Å; D319-R322 PolarHBondContact OD1-NE 3.12Å; D319-R322 IonicContact OD1-NH2 2.8Å; D319-R322 PolarHBondContact OD1-NH2 2.89Å; D319-K323 WeakPolarHBondContact O-CB 3.4Å; D319-K323 VanDerWaalsContact O-CG 3.28Å; D319-K323 WeakPolarHBondContact O-CG 3.36Å; D319-K323 PolarHBondContact O-N 3.44Å
320I80.9Confident71.3Confident81 Ų81110.1 Ų110.142%0.41553%0.53SS..Hα-helixtrans-63.4-47171.6-67.8166.6000109.3I316 L317 R322 K323 D324I316-I320 HydrophobicContact CG2-CD1 3.91Å; I316-I320 HydrophobicContact CG2-CG1 4.44Å; I316-I320 WeakPolarHBondContact O-CG1 3.46Å; I316-I320 PolarHBondContact O-N 3.4Å; L317-I320 PolarHBondContact O-N 3.13Å; I320-R322 VanDerWaalsContact C-N 3.33Å; I320-R322 PolarHBondContact O-N 3.41Å; I320-K323 CarbonylContact O-C 3.37Å; I320-K323 WeakPolarHBondContact O-CA 3.32Å; I320-K323 WeakPolarHBondContact O-CB 3.38Å; I320-K323 PolarHBondContact O-N 3.41Å; I320-D324 PolarHBondContact O-N 3.41Å
321L75.7Confident68.7Low115 Ų115108.5 Ų108.560%0.60254%0.537SS*.Hα-helixtrans-60.3-43.5177.7-156.689.1000111.2L317 E318 K323 D324 I325L317-L321 WeakPolarHBondContact O-CB 3.45Å; L317-L321 PolarHBondContact O-N 3Å; E318-L321 PolarHBondContact O-N 2.98Å; L321-K323 VanDerWaalsContact C-N 3.34Å; L321-K323 PolarHBondContact O-N 2.99Å; L321-D324 PolarHBondContact O-N 3.31Å; L321-I325 HydrophobicContact CG-CD1 4.46Å; L321-I325 WeakPolarHBondContact O-CB 3.25Å; L321-I325 WeakPolarHBondContact O-CD1 3.31Å; L321-I325 WeakPolarHBondContact O-CG1 3.16Å; L321-I325 PolarHBondContact O-N 3.34Å
322R74.8Confident65.9Low129 Ų129112.4 Ų112.449%0.48755%0.55SS..Hα-helixtrans-60.2-41.4172-82.3-173-83.1-105.2-1.3111.8E318 D319 I320 N326E318-R322 WeakPolarHBondContact O-CB 3.3Å; E318-R322 WeakPolarHBondContact O-CG 3.41Å; E318-R322 PolarHBondContact O-N 3.02Å; E318-R322 IonicContact OE2-NH2 3.19Å; D319-R322 PolarHBondContact O-N 2.89Å; D319-R322 IonicContact OD1-CZ 3.47Å; D319-R322 IonicContact OD1-NE 3.28Å; D319-R322 PolarHBondContact OD1-NE 3.12Å; D319-R322 IonicContact OD1-NH2 2.8Å; D319-R322 PolarHBondContact OD1-NH2 2.89Å; I320-R322 VanDerWaalsContact C-N 3.33Å; I320-R322 PolarHBondContact O-N 3.41Å; R322-N326 VanDerWaalsContact O-CG 3.28Å; R322-N326 PolarHBondContact O-N 2.72Å; R322-N326 PolarHBondContact O-ND2 2.94Å
323K71.4Confident63.1Low139 Ų139116.9 Ų116.960%0.60457%0.568SS**Hα-helixtrans-69.7-40.3177.8-79.1177-177.91780112.8D319 I320 L321 I325 N326 H327D319-K323 WeakPolarHBondContact O-CB 3.4Å; D319-K323 VanDerWaalsContact O-CG 3.28Å; D319-K323 WeakPolarHBondContact O-CG 3.36Å; D319-K323 PolarHBondContact O-N 3.44Å; I320-K323 CarbonylContact O-C 3.37Å; I320-K323 WeakPolarHBondContact O-CA 3.32Å; I320-K323 WeakPolarHBondContact O-CB 3.38Å; I320-K323 PolarHBondContact O-N 3.41Å; L321-K323 VanDerWaalsContact C-N 3.34Å; L321-K323 PolarHBondContact O-N 2.99Å; K323-I325 VanDerWaalsContact C-N 3.35Å; K323-N326 CarbonylContact O-C 3.59Å; K323-N326 WeakPolarHBondContact O-CA 3.38Å; K323-N326 WeakPolarHBondContact O-CB 3.32Å; K323-N326 PolarHBondContact O-N 3.28Å; K323-N326 VanDerWaalsContact O-N 3.07Å; K323-H327 VanDerWaalsContact O-CB 3.32Å; K323-H327 WeakPolarHBondContact O-CB 3.33Å; K323-H327 PolarHBondContact O-N 3.33Å
324D62.4Low60.6Low89 Ų89118.8 Ų118.848%0.47658%0.583SS.*Hα-helixtrans-67.4-35.8175.5-84.3-14.9000111.4I320 L321 N326 H327 N328I320-D324 PolarHBondContact O-N 3.41Å; L321-D324 PolarHBondContact O-N 3.31Å; D324-N326 VanDerWaalsContact C-N 3.27Å; D324-N326 PolarHBondContact O-N 3.43Å; D324-H327 PolarHBondContact O-N 2.98Å; D324-N328 VanDerWaalsContact O-CB 3.26Å; D324-N328 WeakPolarHBondContact O-CB 3.24Å; D324-N328 PolarHBondContact O-N 3.37Å; D324-N328 PolarHBondContact O-ND2 2.92Å
325I60.1Low58.1Low101 Ų101119.4 Ų119.452%0.51860%0.595SS.*Hα-helixtrans-62.6-38.3169-68164.3000110.3L321 K323L321-I325 HydrophobicContact CG-CD1 4.46Å; L321-I325 WeakPolarHBondContact O-CB 3.25Å; L321-I325 WeakPolarHBondContact O-CD1 3.31Å; L321-I325 WeakPolarHBondContact O-CG1 3.16Å; L321-I325 PolarHBondContact O-N 3.34Å; K323-I325 VanDerWaalsContact C-N 3.35Å
326N54Low55.6Low114 Ų114123.8 Ų123.861%0.6161%0.614SS**Hα-helixtrans-76.8-28.1175.5-69.9-16.1000113.8R322 K323 D324R322-N326 VanDerWaalsContact O-CG 3.28Å; R322-N326 PolarHBondContact O-N 2.72Å; R322-N326 PolarHBondContact O-ND2 2.94Å; K323-N326 CarbonylContact O-C 3.59Å; K323-N326 WeakPolarHBondContact O-CA 3.38Å; K323-N326 WeakPolarHBondContact O-CB 3.32Å; K323-N326 PolarHBondContact O-N 3.28Å; K323-N326 VanDerWaalsContact O-N 3.07Å; D324-N326 VanDerWaalsContact C-N 3.27Å; D324-N326 PolarHBondContact O-N 3.43Å
327H44.6Very low53.7Low125 Ų125125.9 Ų125.958%0.57963%0.626SS**Hα-helixtrans-89.8-21.7-179.3-92.335.1000113.2K323 D324 Y329 T330K323-H327 VanDerWaalsContact O-CB 3.32Å; K323-H327 WeakPolarHBondContact O-CB 3.33Å; K323-H327 PolarHBondContact O-N 3.33Å; D324-H327 PolarHBondContact O-N 2.98Å; H327-Y329 PolarHBondContact O-N 3.46Å; H327-Y329 VanDerWaalsContact O-N 3.14Å; H327-T330 CarbonylContact O-C 3.36Å; H327-T330 PolarHBondContact O-N 3.35Å
328N41.9Very low52Low119 Ų119126.8 Ų126.864%0.63663%0.631SS**THydrogen-bonded Turntrans-66.2-7.1166.8-84.6-32.2000112.9D324D324-N328 VanDerWaalsContact O-CB 3.26Å; D324-N328 WeakPolarHBondContact O-CB 3.24Å; D324-N328 PolarHBondContact O-N 3.37Å; D324-N328 PolarHBondContact O-ND2 2.92Å
329Y42.2Very low50.3Low206 Ų206130.9 Ų130.981%0.80865%0.651SS**THydrogen-bonded Turntrans-88.5-5.6164.5-82-79.3000114.5H327H327-Y329 PolarHBondContact O-N 3.46Å; H327-Y329 VanDerWaalsContact O-N 3.14Å
330T33.7Very low48.5Very low88 Ų88136.9 Ų136.954%0.5467%0.669SS.*SBendtrans-143.888.1-179.742.40000113H327H327-T330 CarbonylContact O-C 3.36Å; H327-T330 PolarHBondContact O-N 3.35Å
331T32.3Very low46.7Very low126 Ų126138.9 Ų138.977%0.77368%0.677SS**  trans45.5103.7140.3-42.90000118.6K333T331-K333 PolarHBondContact O-N 2.95Å; T331-K333 VanDerWaalsContact O-N 3.16Å
332Y30Very low45.4Very low218 Ų218143.4 Ų143.486%0.85569%0.686SS**  trans-33109.6155.9-67.4-92.6000113.7
333K30.1Very low44.2Very low201 Ų201140.5 Ų140.587%0.87469%0.685SS**  trans-126.2134.2152.6-91.8-174177.21790109.5T331T331-K333 PolarHBondContact O-N 2.95Å; T331-K333 VanDerWaalsContact O-N 3.16Å
334T31.4Very low43.3Very low128 Ų128138.1 Ų138.179%0.78568%0.683SS**  trans-65.6160.2-170.639.90000115.4
335T30.3Very low42.9Very low121 Ų121139.1 Ų139.174%0.74269%0.687SS**  trans82.1106.515422.90000119.8
336N35.5Very low43Very low146 Ų146140.2 Ų140.278%0.78169%0.688SS**  -178136.999.3-92-19.7000114.5N338N336-N338 VanDerWaalsContact C-N 3.28Å; N336-N338 PolarHBondContact O-N 3.43Å
337N47.9Very low43.1Very low142 Ų142140.1 Ų140.176%0.75969%0.686SS**THydrogen-bonded Turntrans-6526.8-168.9-80.6-21000118.5
338N43.9Very low43.7Very low125 Ų125140.3 Ų140.367%0.66869%0.687SS**Hα-helixtrans-85.3-16.5-176.6-81.7-3.8000115.2N336N336-N338 VanDerWaalsContact C-N 3.28Å; N336-N338 PolarHBondContact O-N 3.43Å
339E49.3Very low44.5Very low166 Ų166141.2 Ų141.278%0.77669%0.687SS**Hα-helixtrans-79.7-33.1-175.4-72.2-174.2154.500113.6Q341 R342 S343E339-Q341 VanDerWaalsContact C-N 3.31Å; E339-Q341 PolarHBondContact O-N 2.89Å; E339-R342 PolarHBondContact O-N 2.95Å; E339-S343 PolarHBondContact O-OG 3Å
340Y45.5Very low45.1Very low196 Ų196135.5 Ų135.577%0.76967%0.67SS**Hα-helixtrans-66.2-31.4177-87.6-84.9000112.8S343 T344Y340-S343 PolarHBondContact O-OG 2.97Å; Y340-T344 PolarHBondContact O-N 3.38Å; Y340-T344 PolarHBondContact O-OG1 3.29Å
341Q44.1Very low46.1Very low123 Ų123135.8 Ų135.858%0.57567%0.667SS**Hα-helixtrans-67.8-35.4177.6-93.2178.7-15.800112.9E339 T344 L345E339-Q341 VanDerWaalsContact C-N 3.31Å; E339-Q341 PolarHBondContact O-N 2.89Å; Q341-T344 WeakPolarHBondContact CA-OG1 3.39Å; Q341-T344 PolarHBondContact O-OG1 2.97Å; Q341-T344 VanDerWaalsContact O-OG1 3.1Å; Q341-L345 WeakPolarHBondContact O-CB 3.41Å; Q341-L345 PolarHBondContact O-N 3.33Å
342R48.5Very low47.1Very low210 Ų210137.6 Ų137.679%0.79267%0.666SS**Hα-helixtrans-69.4-38.6-179-100.7-172.7176.7174.2-0.2112.8E339 F346E339-R342 PolarHBondContact O-N 2.95Å; R342-F346 VanDerWaalsContact O-CB 3.3Å; R342-F346 WeakPolarHBondContact O-CB 3.43Å; R342-F346 PolarHBondContact O-N 3.47Å; R342-F346 VanDerWaalsContact O-N 3.11Å
343S48.5Very low48.1Very low67 Ų67129.4 Ų129.447%0.46964%0.641SS.*Hα-helixtrans-71.2-36.5177.529.80000112.3E339 Y340 M347E339-S343 PolarHBondContact O-OG 3Å; Y340-S343 PolarHBondContact O-OG 2.97Å; S343-M347 PolarHBondContact O-N 3.38Å; S343-M347 VanDerWaalsContact O-N 3.11Å
344T52.9Low49Very low90 Ų90125.7 Ų125.755%0.55264%0.637SS**Hα-helixtrans-68.3-46.3172.431.40000113.3Y340 Q341 F346 M347 E348Y340-T344 PolarHBondContact O-N 3.38Å; Y340-T344 PolarHBondContact O-OG1 3.29Å; Q341-T344 WeakPolarHBondContact CA-OG1 3.39Å; Q341-T344 PolarHBondContact O-OG1 2.97Å; Q341-T344 VanDerWaalsContact O-OG1 3.1Å; T344-F346 PolarHBondContact O-N 3.19Å; T344-M347 PolarHBondContact O-N 3.39Å; T344-E348 PolarHBondContact O-N 3.37Å
345L55.2Low49.6Very low109 Ų109129.4 Ų129.457%0.57164%0.638SS**Hα-helixtrans-59.5-33.7176.2-93.7154.5000111.9Q341 Q349Q341-L345 WeakPolarHBondContact O-CB 3.41Å; Q341-L345 PolarHBondContact O-N 3.33Å; L345-Q349 PolarHBondContact O-N 2.85Å; L345-Q349 VanDerWaalsContact O-N 3.1Å
346F61.5Low50Low124 Ų124128.6 Ų128.654%0.54462%0.623SS.*Hα-helixtrans-73.7-39.1177.8-174.3-105000113.2R342 T344 E348 Q349 L350R342-F346 VanDerWaalsContact O-CB 3.3Å; R342-F346 WeakPolarHBondContact O-CB 3.43Å; R342-F346 PolarHBondContact O-N 3.47Å; R342-F346 VanDerWaalsContact O-N 3.11Å; T344-F346 PolarHBondContact O-N 3.19Å; F346-E348 VanDerWaalsContact C-N 3.31Å; F346-Q349 PolarHBondContact O-N 3.41Å; F346-L350 HydrophobicContact CD1-CD1 4Å; F346-L350 HydrophobicContact CE1-CD1 3.62Å; F346-L350 HydrophobicContact CE1-CG 4.28Å; F346-L350 HydrophobicContact CZ-CD1 4.22Å; F346-L350 HydrophobicContact CZ-CG 4.47Å; F346-L350 PolarHBondContact O-N 2.88Å; F346-L350 VanDerWaalsContact O-N 3.07Å
347M56Low50Low113 Ų113127 Ų12756%0.55762%0.617SS**Hα-helixtrans-63.3-39.2172.9-78.2-67.7-72.700111.5S343 T344 L350 M351S343-M347 PolarHBondContact O-N 3.38Å; S343-M347 VanDerWaalsContact O-N 3.11Å; T344-M347 PolarHBondContact O-N 3.39Å; M347-L350 PolarHBondContact O-N 3.47Å; M347-L350 HydrophobicContact SD-CD1 4.42Å; M347-M351 WeakPolarHBondContact O-CG 3.32Å; M347-M351 PolarHBondContact O-N 2.89Å; M347-M351 VanDerWaalsContact O-N 3.08Å
348E57.5Low49.6Very low129 Ų129124.8 Ų124.860%0.60361%0.606SS**Hα-helixtrans-63.4-41.3176.3-154.7167.8-15200111.5T344 F346 L350 M351 E352T344-E348 PolarHBondContact O-N 3.37Å; F346-E348 VanDerWaalsContact C-N 3.31Å; E348-L350 VanDerWaalsContact C-N 3.34Å; E348-L350 PolarHBondContact O-N 3.3Å; E348-M351 WeakPolarHBondContact O-CB 3.48Å; E348-M351 PolarHBondContact O-N 3.05Å; E348-M351 VanDerWaalsContact O-N 3.13Å; E348-E352 PolarHBondContact O-N 3.48Å
349Q57.9Low49.4Very low138 Ų138125.8 Ų125.865%0.64561%0.606SS**Hα-helixtrans-67.7-30.5176.2-160.6171.822.200113.5L345 F346L345-Q349 PolarHBondContact O-N 2.85Å; L345-Q349 VanDerWaalsContact O-N 3.1Å; F346-Q349 PolarHBondContact O-N 3.41Å
350L55.6Low48.8Very low85 Ų85126 Ų12645%0.44561%0.61SS.*Hα-helixtrans-70.1-34.4171.4-78.4168.1000111.9F346 M347 E348 S353F346-L350 HydrophobicContact CD1-CD1 4Å; F346-L350 HydrophobicContact CE1-CD1 3.62Å; F346-L350 HydrophobicContact CE1-CG 4.28Å; F346-L350 HydrophobicContact CZ-CD1 4.22Å; F346-L350 HydrophobicContact CZ-CG 4.47Å; F346-L350 PolarHBondContact O-N 2.88Å; F346-L350 VanDerWaalsContact O-N 3.07Å; M347-L350 PolarHBondContact O-N 3.47Å; M347-L350 HydrophobicContact SD-CD1 4.42Å; E348-L350 VanDerWaalsContact C-N 3.34Å; E348-L350 PolarHBondContact O-N 3.3Å; L350-S353 WeakPolarHBondContact O-CB 3.43Å; L350-S353 PolarHBondContact O-N 3.29Å
351M53.7Low48.5Very low95 Ų95123.4 Ų123.447%0.46861%0.609SS.*Hα-helixtrans-73.9-27.9177.9-70.8-175.754.200113.6M347 E348 S353 Y356M347-M351 WeakPolarHBondContact O-CG 3.32Å; M347-M351 PolarHBondContact O-N 2.89Å; M347-M351 VanDerWaalsContact O-N 3.08Å; E348-M351 WeakPolarHBondContact O-CB 3.48Å; E348-M351 PolarHBondContact O-N 3.05Å; E348-M351 VanDerWaalsContact O-N 3.13Å; M351-S353 VanDerWaalsContact C-N 3.26Å; M351-S353 PolarHBondContact O-N 3.47Å; M351-Y356 HydrophobicContact CB-CD1 4.12Å; M351-Y356 HydrophobicContact CB-CE1 4.09Å; M351-Y356 HydrophobicContact CE-CE1 4.13Å; M351-Y356 HydrophobicContact CG-CD1 4.18Å; M351-Y356 HydrophobicContact CG-CE1 3.69Å; M351-Y356 HydrophobicContact CG-CE2 4.08Å
352E53Low47.8Very low164 Ų164126.2 Ų126.277%0.76662%0.622SS**THydrogen-bonded Turntrans-78.2-4.6173.4-89-172.6154.500114.1E348E348-E352 PolarHBondContact O-N 3.48Å
353S51.9Low47Very low46 Ų46123.1 Ų123.132%0.32262%0.619SS.*SBendtrans-62.3135.1177.1179.20000110.6L350 M351 Y355 Y356L350-S353 WeakPolarHBondContact O-CB 3.43Å; L350-S353 PolarHBondContact O-N 3.29Å; M351-S353 VanDerWaalsContact C-N 3.26Å; M351-S353 PolarHBondContact O-N 3.47Å; S353-Y355 PolarHBondContact O-N 3.16Å; S353-Y355 PolarHBondContact OG-N 3.03Å; S353-Y356 WeakPolarHBondContact O-CB 3.35Å; S353-Y356 PolarHBondContact O-N 3.47Å
354P48.1Very low46.2Very low122 Ų122129.3 Ų129.379%0.79264%0.641SS**THydrogen-bonded Turntrans-57.5-10.6174.5-22.132.5000114.2
355Y44.4Very low45.2Very low206 Ų206129.7 Ų129.781%0.80865%0.647SS**THydrogen-bonded Turntrans-105.52.4-179.7-56.2-80.8000113.3S353 V357S353-Y355 PolarHBondContact O-N 3.16Å; S353-Y355 PolarHBondContact OG-N 3.03Å; Y355-V357 PolarHBondContact O-N 3.12Å
356Y38.4Very low43.9Very low105 Ų105132.5 Ų132.541%0.41266%0.659SS.*  trans-84.6102.9175.1-170.4-98.1000109.9M351 S353M351-Y356 HydrophobicContact CB-CD1 4.12Å; M351-Y356 HydrophobicContact CB-CE1 4.09Å; M351-Y356 HydrophobicContact CE-CE1 4.13Å; M351-Y356 HydrophobicContact CG-CD1 4.18Å; M351-Y356 HydrophobicContact CG-CE1 3.69Å; M351-Y356 HydrophobicContact CG-CE2 4.08Å; S353-Y356 WeakPolarHBondContact O-CB 3.35Å; S353-Y356 PolarHBondContact O-N 3.47Å
357V36.5Very low42.4Very low111 Ų111135.4 Ų135.467%0.67367%0.674SS**  trans-98.5113.9176.9-179.50000108.9Y355 E359Y355-V357 PolarHBondContact O-N 3.12Å; V357-E359 HydrophobicContact CG1-CG 4.44Å; V357-E359 PolarHBondContact O-N 2.9Å; V357-E359 VanDerWaalsContact O-N 3.09Å
358N38.2Very low40.9Very low97 Ų97135.3 Ų135.352%0.51969%0.685SS.*  trans-70.397.1166.8-106.5-12.5000108.8M360N358-M360 PolarHBondContact O-N 2.86Å
359E41.1Very low39.4Very low145 Ų145133.9 Ų133.968%0.67869%0.689SS**G310 helixtrans-66.2-2.2179.6-77.3-172.4161.600114.5V357V357-E359 HydrophobicContact CG1-CG 4.44Å; V357-E359 PolarHBondContact O-N 2.9Å; V357-E359 VanDerWaalsContact O-N 3.09Å
360M36.8Very low38Very low171 Ų171133 Ų13384%0.84270%0.699SS**G310 helixtrans-79.2-16.5178.5-86.3-80.617000115.1N358N358-M360 PolarHBondContact O-N 2.86Å
361N37.9Very low36.4Very low141 Ų141135.4 Ų135.475%0.75472%0.717SS**G310 helixtrans-103.56.7-174.6-75.2-4.1000115.6
362H29.9Very low35.2Very low182 Ų182136.2 Ų136.284%0.84373%0.732SS**SBendtrans-121.710.4-179.8-103.4-57.2000116.2
363I31.3Very low33.9Very low145 Ų145133.8 Ų133.874%0.74473%0.733SS**SBendtrans-89.2-6176.3-60.6177.7000112.7S365I363-S365 PolarHBondContact O-N 2.97Å
364E31.3Very low32.6Very low197 Ų197137.8 Ų137.892%0.92176%0.755SS**SBendtrans-82.83.1-173.5-111.9179.7-177.900116.8
365S32.7Very low31.6Very low99 Ų99137.7 Ų137.769%0.69275%0.753SS**SBendtrans-150.580.5179161.30000110.5I363I363-S365 PolarHBondContact O-N 2.97Å
366M29Very low30.6Very low167 Ų167132.5 Ų132.582%0.82375%0.746SS**SBendtrans159.980.3149.8-83.5-97.7159.600106.9
367H28.6Very low30Very low185 Ų185136.5 Ų136.586%0.85677%0.771SS**  trans-177.673.1143-89.8-54.1000108.9
368S25.5Very low29.4Very low111 Ų111138.5 Ų138.578%0.77678%0.778SS**  trans-66.8129.2147-56.70000107.7
369S25.7Very low28.8Very low100 Ų100137.7 Ų137.770%0.69979%0.793SS**  trans58.897.7162.352.10000117.7
370S27.3Very low27.9Very low120 Ų120137.8 Ų137.884%0.83980%0.798SS**  trans-155.887.1131.6-77.10000109.3S372S370-S372 PolarHBondContact O-N 2.84Å
371T23.9Very low27.6Very low135 Ų135135.6 Ų135.683%0.82880%0.799SS**  trans-54.7115.6165.6-25.60000109.4
372S27.3Very low26.8Very low111 Ų111131.7 Ų131.778%0.77679%0.793SS**  trans-150.689.7158.4-76.40000108.7S370 T374S370-S372 PolarHBondContact O-N 2.84Å; S372-T374 PolarHBondContact O-N 2.93Å
373S25.6Very low26.6Very low113 Ų113128.4 Ų128.479%0.7979%0.79SS**  trans-29.3119.6157.343.30000115.4
374T25.6Very low26.2Very low130 Ų130130.2 Ų130.280%0.79880%0.795SS**  trans-133.191.1144.943.60000109.1S372S372-T374 PolarHBondContact O-N 2.93Å
375T25.8Very low25.7Very low121 Ų121129.8 Ų129.874%0.74279%0.794SS**  trans31.499.8139.331.90000118.8
376S23.8Very low25.4Very low96 Ų96129.8 Ų129.867%0.67179%0.793SS**  9.2116.412358.30000117.6
377M25.8Very low25Very low189 Ų189128.9 Ų128.993%0.93179%0.792SS**  trans-12296.3139.2-86.8-74.1169.100107.8G379M377-G379 PolarHBondContact O-N 3Å
378N23.4Very low24.7Very low154 Ų154128.7 Ų128.782%0.82479%0.792SS**  trans-54.1125.3161.9-96-21.3000109.9
379G25.7Very low24.6Very low80 Ų80132.6 Ų132.683%0.82580%0.797SS**  trans-123.678.4158.800000108.2M377M377-G379 PolarHBondContact O-N 3Å
380N23Very low24.4Very low146 Ų146136.7 Ų136.778%0.78181%0.805SS**  trans-74.5123.4179.2-168.331000110.4
381S29.8Very low24.3Very low125 Ų125137.2 Ų137.287%0.87480%0.804SS**  trans-170.699.1158.6-71.30000104.2
382G22.3Very low24.2Very low60 Ų60138 Ų13862%0.61980%0.803SS**  114.397.250.100000107.3
383S24.4Very low24.1Very low112 Ų112136.7 Ų136.778%0.78379%0.794SS**  trans52.8114.7147.157.20000119.7
384Q23.9Very low24.1Very low183 Ų183138.6 Ų138.686%0.85580%0.795SS**  178.2119.897.8-98.2-170.2-53.600111.1
385E21.6Very low24.1Very low189 Ų189140 Ų14088%0.88380%0.798SS**  trans-59.1135.5148.3-66.3168.3138.300109.5
386S24.4Very low24.3Very low98 Ų98139.1 Ų139.169%0.68579%0.792SS**  trans-179111.2133.551.10000111.7
387N22.3Very low24.4Very low149 Ų149144.4 Ų144.480%0.79780%0.803SS**  trans53.6119.2131.8-64.5-8.3000121.6
388E21.8Very low24.6Very low181 Ų181141 Ų14185%0.84679%0.793SS**  22.6116.2119.5-62.9-176.7161.100117.6
389Q23.1Very low24.8Very low192 Ų192143 Ų14390%0.89779%0.794SS**  trans-155.5116.4138.2-112.1168.524.700112
390Q22.2Very low25.2Very low186 Ų186146.7 Ų146.787%0.86979%0.793SS**  trans-57.1135.7152.3-79.3170.5-4000110.9
391T24.9Very low25.8Very low131 Ų131145.6 Ų145.680%0.80479%0.791SS**  trans-159.7101.6136.849.10000106.3
392N22.2Very low26.2Very low152 Ų152147.8 Ų147.881%0.81379%0.788SS**  54.811882.3-132.713.6000114.8
393S24.9Very low27.2Very low83 Ų83148.8 Ų148.858%0.5878%0.778SS**  trans11.7125.1153.757.40000118.7
394N25.9Very low28.2Very low154 Ų154147.8 Ų147.882%0.82477%0.769SS**  -162136.3111.3-96.3-25.3000114.5V396N394-V396 PolarHBondContact O-N 3.4Å
395N25.8Very low29.8Very low158 Ų158147.4 Ų147.485%0.84577%0.765SS**  trans-69.3105.6173.9-157.54.7000108.4
396V28.7Very low31.8Very low103 Ų103144.8 Ų144.862%0.62476%0.757SS**  trans-131.6106.3167.9-179.80000108.7N394 T398N394-V396 PolarHBondContact O-N 3.4Å; V396-T398 VanDerWaalsContact C-N 3.33Å; V396-T398 HydrophobicContact CG1-CG2 3.63Å; V396-T398 PolarHBondContact O-N 3.34Å
397K26.6Very low33.7Very low208 Ų208144.9 Ų144.990%0.90475%0.749SS**  trans-58.395.6158.9-80.4175.5172.9175.70108.2
398T30.3Very low35.8Very low116 Ų116142.9 Ų142.971%0.71274%0.735SS**  trans-116.2107.6166.531.40000110V396V396-T398 VanDerWaalsContact C-N 3.33Å; V396-T398 HydrophobicContact CG1-CG2 3.63Å; V396-T398 PolarHBondContact O-N 3.34Å
399K27.6Very low38.3Very low196 Ų196138.8 Ų138.885%0.85272%0.719SS**  trans14.5112.9151.2-77.8175.71721780115.8V401K399-V401 PolarHBondContact O-N 2.9Å
400I33.6Very low40.6Very low159 Ų159132.7 Ų132.782%0.81570%0.698SS**  trans-38.398153.2-60162.4000108.5E402I400-E402 HydrophobicContact CG2-CG 4.3Å
401V36Very low43Very low122 Ų122127.3 Ų127.374%0.73967%0.674SS**  trans-82.9109.3158.1173.90000103.8K399 I403K399-V401 PolarHBondContact O-N 2.9Å; V401-I403 PolarHBondContact O-N 2.92Å
402E38.7Very low45.3Very low171 Ų171126.3 Ų126.380%0.79966%0.66SS**  trans-57.7105.1175.5-72.6-177.3156.600108.5I400 P404I400-E402 HydrophobicContact CG2-CG 4.3Å; E402-P404 WeakPolarHBondContact O-CD 3.46Å
403I43.1Very low47.7Very low82 Ų82125.3 Ų125.342%0.42165%0.65SS.*  trans-66.8125.9171-61.7172.4000106.2V401 K405 L407 Q408V401-I403 PolarHBondContact O-N 2.92Å; I403-K405 PolarHBondContact O-N 3.2Å; I403-L407 HydrophobicContact CG2-CB 3.92Å; I403-L407 HydrophobicContact CG2-CD2 3.89Å; I403-L407 HydrophobicContact CG2-CG 4.35Å; I403-Q408 HydrophobicContact CG2-CB 4.42Å
404P44.1Very low50Low90 Ų90127.5 Ų127.558%0.58465%0.652SS**  trans-52.7132.1177.2-26.434.3000110.7E402 D406 L407 Q408E402-P404 WeakPolarHBondContact O-CD 3.46Å; P404-D406 PolarHBondContact O-N 2.93Å; P404-L407 WeakPolarHBondContact O-CB 3.27Å; P404-L407 PolarHBondContact O-N 2.87Å; P404-Q408 PolarHBondContact O-N 3.38Å
405K58.3Low52.4Low175 Ų175123.6 Ų123.676%0.76163%0.631SS**Hα-helixtrans-51.4-31.2-173.2-72.8177.8178174.20113.5I403 Q408 N409I403-K405 PolarHBondContact O-N 3.2Å; K405-Q408 PolarHBondContact O-N 3.35Å; K405-N409 PolarHBondContact O-N 2.84Å
406D63.2Low54.8Low134 Ų134122 Ų12272%0.71762%0.618SS**Hα-helixtrans-69-37.4177.5-63.4-30.6000112.9P404 S410P404-D406 PolarHBondContact O-N 2.93Å; D406-S410 WeakPolarHBondContact O-CB 3.46Å; D406-S410 PolarHBondContact O-N 2.86Å
407L64.8Low57Low101 Ų101122.9 Ų122.953%0.52962%0.619SS.*Hα-helixtrans-71.7-36.6175.6-161.677.5000110.8I403 P404 S410 I411I403-L407 HydrophobicContact CG2-CB 3.92Å; I403-L407 HydrophobicContact CG2-CD2 3.89Å; I403-L407 HydrophobicContact CG2-CG 4.35Å; P404-L407 WeakPolarHBondContact O-CB 3.27Å; P404-L407 PolarHBondContact O-N 2.87Å; L407-S410 PolarHBondContact O-N 3.47Å; L407-I411 HydrophobicContact CD2-CD1 4.38Å; L407-I411 HydrophobicContact CG-CD1 4.16Å; L407-I411 WeakPolarHBondContact O-CB 3.45Å; L407-I411 VanDerWaalsContact O-CG1 3.24Å; L407-I411 WeakPolarHBondContact O-CG1 3.34Å; L407-I411 PolarHBondContact O-N 2.96Å
408Q67Low59.3Low106 Ų106116.9 Ų116.950%0.49560%0.595SS.*Hα-helixtrans-66.7-40.8176.7-167.1144.11.500111.9I403 P404 K405 I411 Q412I403-Q408 HydrophobicContact CG2-CB 4.42Å; P404-Q408 PolarHBondContact O-N 3.38Å; K405-Q408 PolarHBondContact O-N 3.35Å; Q408-I411 PolarHBondContact O-N 3.46Å; Q408-Q412 VanDerWaalsContact O-CB 3.3Å; Q408-Q412 WeakPolarHBondContact O-CB 3.45Å; Q408-Q412 PolarHBondContact O-N 2.94Å
409N73.4Confident61.5Low96 Ų96115.9 Ų115.951%0.51359%0.585SS.*Hα-helixtrans-63.8-40.1172.3-76.6-17.6000112.2K405 Q412 Q413K405-N409 PolarHBondContact O-N 2.84Å; N409-Q412 PolarHBondContact O-N 2.99Å; N409-Q413 PolarHBondContact O-N 3.1Å
410S71.6Confident63.7Low64 Ų64115.4 Ų115.445%0.44858%0.578SS.*Hα-helixtrans-64.9-44.7176.4-178.10000112.3D406 L407 Q412 Q413 Q414D406-S410 WeakPolarHBondContact O-CB 3.46Å; D406-S410 PolarHBondContact O-N 2.86Å; L407-S410 PolarHBondContact O-N 3.47Å; S410-Q412 VanDerWaalsContact C-N 3.29Å; S410-Q412 PolarHBondContact O-N 3.33Å; S410-Q413 PolarHBondContact O-N 2.85Å; S410-Q414 WeakPolarHBondContact O-CB 3.29Å; S410-Q414 PolarHBondContact O-N 3.26Å
411I72.2Confident65.4Low73 Ų73110.5 Ų110.537%0.37456%0.561SS.*Hα-helixtrans-61.6-39.7174.7-69.8164.9000110.6L407 Q408 Q414 N415L407-I411 HydrophobicContact CD2-CD1 4.38Å; L407-I411 HydrophobicContact CG-CD1 4.16Å; L407-I411 WeakPolarHBondContact O-CB 3.45Å; L407-I411 VanDerWaalsContact O-CG1 3.24Å; L407-I411 WeakPolarHBondContact O-CG1 3.34Å; L407-I411 PolarHBondContact O-N 2.96Å; Q408-I411 PolarHBondContact O-N 3.46Å; I411-Q414 PolarHBondContact O-N 3.48Å; I411-N415 WeakPolarHBondContact O-CB 3.46Å; I411-N415 VanDerWaalsContact O-CG 3.3Å; I411-N415 PolarHBondContact O-N 3.46Å; I411-N415 PolarHBondContact O-ND2 3.14Å
412Q73.1Confident67.3Low110 Ų110110.3 Ų110.351%0.51455%0.551SS.*Hα-helixtrans-68.8-43.8179.6-160.4157.1600111.8Q408 N409 S410 Q414 N415 E416Q408-Q412 VanDerWaalsContact O-CB 3.3Å; Q408-Q412 WeakPolarHBondContact O-CB 3.45Å; Q408-Q412 PolarHBondContact O-N 2.94Å; N409-Q412 PolarHBondContact O-N 2.99Å; S410-Q412 VanDerWaalsContact C-N 3.29Å; S410-Q412 PolarHBondContact O-N 3.33Å; Q412-Q414 VanDerWaalsContact C-N 3.34Å; Q412-Q414 PolarHBondContact O-N 2.91Å; Q412-N415 PolarHBondContact O-N 2.9Å; Q412-E416 WeakPolarHBondContact O-CG 3.41Å; Q412-E416 PolarHBondContact O-N 2.93Å
413Q73.6Confident69.1Low130 Ų130105.3 Ų105.361%0.60753%0.534SS*.Hα-helixtrans-61.1-40.2170.9-85.6-172.8-800112.6N409 S410 E416 L417N409-Q413 PolarHBondContact O-N 3.1Å; S410-Q413 PolarHBondContact O-N 2.85Å; Q413-E416 PolarHBondContact O-N 3.34Å; Q413-L417 WeakPolarHBondContact O-CB 3.5Å; Q413-L417 WeakPolarHBondContact O-CG 3.45Å; Q413-L417 PolarHBondContact O-N 2.9Å
414Q72.7Confident70.6Confident130 Ų130104.3 Ų104.361%0.60753%0.532SS*.Hα-helixtrans-65.5-41177.2-171.7177.83.200111.5S410 I411 Q412 L417 M418S410-Q414 WeakPolarHBondContact O-CB 3.29Å; S410-Q414 PolarHBondContact O-N 3.26Å; I411-Q414 PolarHBondContact O-N 3.48Å; Q412-Q414 VanDerWaalsContact C-N 3.34Å; Q412-Q414 PolarHBondContact O-N 2.91Å; Q414-L417 PolarHBondContact O-N 3.4Å; Q414-M418 VanDerWaalsContact O-CB 3.28Å; Q414-M418 WeakPolarHBondContact O-CB 3.36Å; Q414-M418 PolarHBondContact O-N 2.88Å
415N76.3Confident71.9Confident72 Ų72106.4 Ų106.439%0.38553%0.534SS..Hα-helixtrans-64.8-40173.9-76.9-29.9000111.9I411 Q412 M418 N419I411-N415 WeakPolarHBondContact O-CB 3.46Å; I411-N415 VanDerWaalsContact O-CG 3.3Å; I411-N415 PolarHBondContact O-N 3.46Å; I411-N415 PolarHBondContact O-ND2 3.14Å; Q412-N415 PolarHBondContact O-N 2.9Å; N415-M418 PolarHBondContact O-N 3.45Å; N415-M418 WeakPolarHBondContact OD1-CE 3.45Å; N415-N419 VanDerWaalsContact O-CB 3.25Å; N415-N419 WeakPolarHBondContact O-CB 3.38Å; N415-N419 PolarHBondContact O-N 3.21Å; N415-N419 PolarHBondContact O-ND2 3.11Å
416E76.4Confident72.9Confident124 Ų124101.4 Ų101.458%0.57952%0.521SS*.Hα-helixtrans-62.7-46.1173.9-77.3178.9-177.700112.1Q412 Q413 N419 R420Q412-E416 WeakPolarHBondContact O-CG 3.41Å; Q412-E416 PolarHBondContact O-N 2.93Å; Q413-E416 PolarHBondContact O-N 3.34Å; E416-N419 PolarHBondContact O-N 3.12Å; E416-R420 VanDerWaalsContact O-CB 3.28Å; E416-R420 WeakPolarHBondContact O-CB 3.22Å; E416-R420 PolarHBondContact O-N 3.28Å
417L75.1Confident73.5Confident121 Ų12199.3 Ų99.363%0.63451%0.509SS*.Hα-helixtrans-62.7-42.8176-76.9170.4000111.8Q413 Q414 R420 A421Q413-L417 WeakPolarHBondContact O-CB 3.5Å; Q413-L417 WeakPolarHBondContact O-CG 3.45Å; Q413-L417 PolarHBondContact O-N 2.9Å; Q414-L417 PolarHBondContact O-N 3.4Å; L417-R420 PolarHBondContact O-N 3.49Å; L417-A421 WeakPolarHBondContact O-CB 3.36Å; L417-A421 PolarHBondContact O-N 3.23Å
418M74.7Confident74.2Confident82 Ų8299.8 Ų99.840%0.40451%0.509SS..Hα-helixtrans-64.9-42.4176.3-178.2176.155.500111.7Q414 N415 R420 A421 K422Q414-M418 VanDerWaalsContact O-CB 3.28Å; Q414-M418 WeakPolarHBondContact O-CB 3.36Å; Q414-M418 PolarHBondContact O-N 2.88Å; N415-M418 PolarHBondContact O-N 3.45Å; N415-M418 WeakPolarHBondContact OD1-CE 3.45Å; M418-R420 VanDerWaalsContact C-N 3.35Å; M418-A421 PolarHBondContact O-N 3.02Å; M418-K422 HydrophobicContact CG-CD 4.36Å; M418-K422 WeakPolarHBondContact O-CB 3.36Å; M418-K422 WeakPolarHBondContact O-CG 3.34Å; M418-K422 PolarHBondContact O-N 3.03Å
419N75.6Confident74.7Confident96 Ų9698.1 Ų98.151%0.51351%0.508SS..Hα-helixtrans-66-38.6175.9-72.9-20.3000111.4N415 E416 K422 S423N415-N419 VanDerWaalsContact O-CB 3.25Å; N415-N419 WeakPolarHBondContact O-CB 3.38Å; N415-N419 PolarHBondContact O-N 3.21Å; N415-N419 PolarHBondContact O-ND2 3.11Å; E416-N419 PolarHBondContact O-N 3.12Å; N419-K422 PolarHBondContact O-N 3.45Å; N419-S423 VanDerWaalsContact O-CB 3.31Å; N419-S423 WeakPolarHBondContact O-CB 3.46Å; N419-S423 PolarHBondContact O-N 2.84Å
420R73.5Confident74.8Confident185 Ų18597.8 Ų97.870%0.69851%0.51SS*.Hα-helixtrans-63.7-44.6173.4-171.8175.4177.6146.1-0.2111.3E416 L417 M418 S423 T424E416-R420 VanDerWaalsContact O-CB 3.28Å; E416-R420 WeakPolarHBondContact O-CB 3.22Å; E416-R420 PolarHBondContact O-N 3.28Å; L417-R420 PolarHBondContact O-N 3.49Å; M418-R420 VanDerWaalsContact C-N 3.35Å; R420-S423 PolarHBondContact O-N 3.31Å; R420-T424 PolarHBondContact O-N 3.27Å; R420-T424 PolarHBondContact O-OG1 2.93Å
421A70.9Confident75.2Confident56 Ų5699.4 Ų99.446%0.46351%0.513SS..Hα-helixtrans-61.8-45.117600000112.1L417 M418 S423 T424 Q425L417-A421 WeakPolarHBondContact O-CB 3.36Å; L417-A421 PolarHBondContact O-N 3.23Å; M418-A421 PolarHBondContact O-N 3.02Å; A421-S423 PolarHBondContact O-N 2.86Å; A421-T424 PolarHBondContact O-N 3.34Å; A421-Q425 WeakPolarHBondContact O-CB 3.42Å; A421-Q425 PolarHBondContact O-N 3.27Å
422K74.7Confident75.7Confident119 Ų11999.8 Ų99.852%0.51752%0.522SS..Hα-helixtrans-61.5-41.6174.3-73174.1-179.3176.50112.2M418 N419 Q425 S426M418-K422 HydrophobicContact CG-CD 4.36Å; M418-K422 WeakPolarHBondContact O-CB 3.36Å; M418-K422 WeakPolarHBondContact O-CG 3.34Å; M418-K422 PolarHBondContact O-N 3.03Å; N419-K422 PolarHBondContact O-N 3.45Å; K422-Q425 PolarHBondContact O-N 3.46Å; K422-S426 WeakPolarHBondContact O-CB 3.43Å; K422-S426 PolarHBondContact O-N 2.91Å
423S77.5Confident76Confident65 Ų6597.5 Ų97.546%0.45552%0.522SS..Hα-helixtrans-63.7-46.6175.3176.20000111.8N419 R420 A421 Q425 S426 I427N419-S423 VanDerWaalsContact O-CB 3.31Å; N419-S423 WeakPolarHBondContact O-CB 3.46Å; N419-S423 PolarHBondContact O-N 2.84Å; R420-S423 PolarHBondContact O-N 3.31Å; A421-S423 PolarHBondContact O-N 2.86Å; S423-Q425 PolarHBondContact O-N 2.9Å; S423-S426 WeakPolarHBondContact O-CB 3.39Å; S423-S426 PolarHBondContact O-N 3.4Å; S423-I427 VanDerWaalsContact O-CG1 3.3Å; S423-I427 WeakPolarHBondContact O-CG1 3.32Å; S423-I427 PolarHBondContact O-N 2.88Å
424T74.8Confident76.4Confident62 Ų6299.4 Ų99.438%0.3852%0.524SS..Hα-helixtrans-62-41.7175.5-55.70000111.8R420 A421 I427 H428R420-T424 PolarHBondContact O-N 3.27Å; R420-T424 PolarHBondContact O-OG1 2.93Å; A421-T424 PolarHBondContact O-N 3.34Å; T424-I427 PolarHBondContact O-N 2.84Å; T424-H428 PolarHBondContact O-CD2 3.28Å; T424-H428 PolarHBondContact O-N 2.87Å
425Q70.7Confident76.9Confident133 Ų13396.9 Ų96.962%0.62152%0.515SS*.Hα-helixtrans-65.3-38.1175-173.2171.33.100112.4A421 K422 S423 H428 S429A421-Q425 WeakPolarHBondContact O-CB 3.42Å; A421-Q425 PolarHBondContact O-N 3.27Å; K422-Q425 PolarHBondContact O-N 3.46Å; S423-Q425 PolarHBondContact O-N 2.9Å; Q425-H428 PolarHBondContact O-N 3.36Å; Q425-S429 WeakPolarHBondContact O-CB 3.25Å; Q425-S429 PolarHBondContact O-N 2.93Å; Q425-S429 PolarHBondContact O-OG 3.24Å
426S80.2Confident77.3Confident70 Ų7096.8 Ų96.849%0.4952%0.52SS..Hα-helixtrans-62.5-44.9172.6-1750000111.2K422 S423 S429 T430K422-S426 WeakPolarHBondContact O-CB 3.43Å; K422-S426 PolarHBondContact O-N 2.91Å; S423-S426 WeakPolarHBondContact O-CB 3.39Å; S423-S426 PolarHBondContact O-N 3.4Å; S426-S429 PolarHBondContact O-N 2.69Å; S426-T430 PolarHBondContact O-N 2.96Å; S426-T430 PolarHBondContact O-OG1 2.69Å
427I75.6Confident77.7Confident90 Ų9096.3 Ų96.346%0.46252%0.521SS..Hα-helixtrans-60.6-47.4176.9-68.4163.7000110.5S423 T424 S429 T430 I431S423-I427 VanDerWaalsContact O-CG1 3.3Å; S423-I427 WeakPolarHBondContact O-CG1 3.32Å; S423-I427 PolarHBondContact O-N 2.88Å; T424-I427 PolarHBondContact O-N 2.84Å; I427-S429 VanDerWaalsContact C-N 3.33Å; I427-S429 PolarHBondContact O-N 3.06Å; I427-T430 PolarHBondContact O-N 3.33Å; I427-I431 HydrophobicContact CG2-CD1 3.78Å; I427-I431 HydrophobicContact CG2-CG1 4.41Å; I427-I431 VanDerWaalsContact O-CG1 3.31Å; I427-I431 WeakPolarHBondContact O-CG1 2.91Å; I427-I431 PolarHBondContact O-N 3.4Å
428H78.4Confident78.1Confident112 Ų11293.4 Ų93.452%0.51951%0.511SS..Hα-helixtrans-62.6-39.2176.8-76.6-61.7000112.4T424 Q425 T430 I431 S432T424-H428 PolarHBondContact O-CD2 3.28Å; T424-H428 PolarHBondContact O-N 2.87Å; Q425-H428 PolarHBondContact O-N 3.36Å; H428-T430 VanDerWaalsContact C-N 3.34Å; H428-T430 PolarHBondContact O-N 2.99Å; H428-I431 PolarHBondContact O-N 3.47Å; H428-S432 WeakPolarHBondContact O-CB 3.45Å; H428-S432 PolarHBondContact O-N 3.44Å; H428-S432 PolarHBondContact O-OG 2.89Å
429S78.7Confident78.7Confident70 Ų7095.1 Ų95.149%0.4952%0.516SS..Hα-helixtrans-61.8-42.6174.9-57.90000111.4Q425 S426 I427 S432 A433Q425-S429 WeakPolarHBondContact O-CB 3.25Å; Q425-S429 PolarHBondContact O-N 2.93Å; Q425-S429 PolarHBondContact O-OG 3.24Å; S426-S429 PolarHBondContact O-N 2.69Å; I427-S429 VanDerWaalsContact C-N 3.33Å; I427-S429 PolarHBondContact O-N 3.06Å; S429-S432 PolarHBondContact O-N 2.9Å; S429-A433 WeakPolarHBondContact O-CB 3.46Å; S429-A433 PolarHBondContact O-N 3.37Å
430T75.4Confident79.3Confident90 Ų9094.4 Ų94.455%0.55252%0.515SS*.Hα-helixtrans-64.6-41.6175-53.40000112S426 I427 H428 A433 Y434S426-T430 PolarHBondContact O-N 2.96Å; S426-T430 PolarHBondContact O-OG1 2.69Å; I427-T430 PolarHBondContact O-N 3.33Å; H428-T430 VanDerWaalsContact C-N 3.34Å; H428-T430 PolarHBondContact O-N 2.99Å; T430-A433 PolarHBondContact O-N 2.86Å; T430-Y434 WeakPolarHBondContact O-CB 3.4Å; T430-Y434 PolarHBondContact O-N 2.99Å
431I79.4Confident79.8Confident98 Ų9891.3 Ų91.350%0.50351%0.507SS..Hα-helixtrans-63.5-46.4176.3-68.3167.1000110.5I427 H428 A433 Y434 D435I427-I431 HydrophobicContact CG2-CD1 3.78Å; I427-I431 HydrophobicContact CG2-CG1 4.41Å; I427-I431 VanDerWaalsContact O-CG1 3.31Å; I427-I431 WeakPolarHBondContact O-CG1 2.91Å; I427-I431 PolarHBondContact O-N 3.4Å; H428-I431 PolarHBondContact O-N 3.47Å; I431-A433 VanDerWaalsContact C-N 3.35Å; I431-A433 PolarHBondContact O-N 3.15Å; I431-Y434 PolarHBondContact O-N 3.4Å; I431-D435 WeakPolarHBondContact O-CB 3.29Å; I431-D435 PolarHBondContact O-N 3.33Å
432S82.6Confident80.6Confident81 Ų8193.8 Ų93.857%0.56651%0.512SS*.Hα-helixtrans-63.2-39.7177.4-67.90000112.3H428 S429 D435 S436H428-S432 WeakPolarHBondContact O-CB 3.45Å; H428-S432 PolarHBondContact O-N 3.44Å; H428-S432 PolarHBondContact O-OG 2.89Å; S429-S432 PolarHBondContact O-N 2.9Å; S432-D435 PolarHBondContact O-N 3.45Å; S432-S436 WeakPolarHBondContact O-CB 3.37Å; S432-S436 PolarHBondContact O-N 2.9Å
433A79.2Confident81.3Confident62 Ų6293.2 Ų93.251%0.51251%0.514SS..Hα-helixtrans-62.9-42.5173.700000111.6S429 T430 I431 S436 L437S429-A433 WeakPolarHBondContact O-CB 3.46Å; S429-A433 PolarHBondContact O-N 3.37Å; T430-A433 PolarHBondContact O-N 2.86Å; I431-A433 VanDerWaalsContact C-N 3.35Å; I431-A433 PolarHBondContact O-N 3.15Å; A433-S436 PolarHBondContact O-N 2.76Å; A433-L437 WeakPolarHBondContact O-CB 3.27Å; A433-L437 PolarHBondContact O-N 2.75Å
434Y81.5Confident81.7Confident169 Ų16993.1 Ų93.166%0.66351%0.508SS*.Hα-helixtrans-66.2-40.8176.6-169.2-91.5000112.4T430 I431 L437 S438T430-Y434 WeakPolarHBondContact O-CB 3.4Å; T430-Y434 PolarHBondContact O-N 2.99Å; I431-Y434 PolarHBondContact O-N 3.4Å; Y434-L437 PolarHBondContact O-N 3.38Å; Y434-S438 VanDerWaalsContact O-CB 3.27Å; Y434-S438 WeakPolarHBondContact O-CB 3.24Å; Y434-S438 PolarHBondContact O-N 2.93Å
435D84.2Confident82.2Confident77 Ų7793.1 Ų93.141%0.41251%0.505SS..Hα-helixtrans-66.8-38.7177.5-161.748.8000111.4I431 S432 S438 K439I431-D435 WeakPolarHBondContact O-CB 3.29Å; I431-D435 PolarHBondContact O-N 3.33Å; S432-D435 PolarHBondContact O-N 3.45Å; D435-S438 PolarHBondContact O-N 3.07Å; D435-K439 WeakPolarHBondContact O-CB 3.47Å; D435-K439 WeakPolarHBondContact O-CG 3.49Å; D435-K439 PolarHBondContact O-N 3.26Å; D435-K439 IonicContact OD2-NZ 3.74Å; D435-K439 PolarHBondContact OD2-NZ 3.25Å
436S83.5Confident83.1Confident71 Ų7189.7 Ų89.750%0.49749%0.493SS..Hα-helixtrans-63.8-44.3172.3-168.10000111.9S432 A433 K439 T440S432-S436 WeakPolarHBondContact O-CB 3.37Å; S432-S436 PolarHBondContact O-N 2.9Å; A433-S436 PolarHBondContact O-N 2.76Å; S436-K439 PolarHBondContact O-N 2.93Å; S436-T440 WeakPolarHBondContact O-CB 3.24Å; S436-T440 PolarHBondContact O-N 2.98Å; S436-T440 PolarHBondContact O-OG1 3.46Å
437L84.9Confident83.6Confident114 Ų11489.8 Ų89.860%0.59749%0.49SS*.Hα-helixtrans-64-44.5176.8-179.363.7000111.5A433 Y434 K439 T440 F441A433-L437 WeakPolarHBondContact O-CB 3.27Å; A433-L437 PolarHBondContact O-N 2.75Å; Y434-L437 PolarHBondContact O-N 3.38Å; L437-K439 PolarHBondContact O-N 3.34Å; L437-T440 PolarHBondContact O-N 3.47Å; L437-F441 WeakPolarHBondContact O-CB 3.42Å; L437-F441 PolarHBondContact O-N 3.43Å
438S84.6Confident84.1Confident59 Ų5993 Ų9341%0.41350%0.497SS..Hα-helixtrans-57.9-48.1176.6177.60000111.6Y434 D435 T440 F441 L442Y434-S438 VanDerWaalsContact O-CB 3.27Å; Y434-S438 WeakPolarHBondContact O-CB 3.24Å; Y434-S438 PolarHBondContact O-N 2.93Å; D435-S438 PolarHBondContact O-N 3.07Å; S438-T440 PolarHBondContact O-N 2.89Å; S438-F441 PolarHBondContact O-N 3.24Å; S438-L442 WeakPolarHBondContact O-CB 3.37Å; S438-L442 PolarHBondContact O-N 3.33Å
439K87.2Confident84.5Confident119 Ų11992.7 Ų92.752%0.51750%0.496SS..Hα-helixtrans-61.8-42.1175.6-76.5166.9176.5154.70112.3D435 S436 L437 L442 N443D435-K439 WeakPolarHBondContact O-CB 3.47Å; D435-K439 WeakPolarHBondContact O-CG 3.49Å; D435-K439 PolarHBondContact O-N 3.26Å; D435-K439 IonicContact OD2-NZ 3.74Å; D435-K439 PolarHBondContact OD2-NZ 3.25Å; S436-K439 PolarHBondContact O-N 2.93Å; L437-K439 PolarHBondContact O-N 3.34Å; K439-L442 PolarHBondContact O-N 2.9Å; K439-N443 WeakPolarHBondContact O-CB 3.4Å; K439-N443 PolarHBondContact O-N 2.81Å
440T87.6Confident85Confident80 Ų8093.4 Ų93.449%0.49149%0.494SS..Hα-helixtrans-63.6-45.1178-540000110.9S436 L437 S438 N443 M444S436-T440 WeakPolarHBondContact O-CB 3.24Å; S436-T440 PolarHBondContact O-N 2.98Å; S436-T440 PolarHBondContact O-OG1 3.46Å; L437-T440 PolarHBondContact O-N 3.47Å; S438-T440 PolarHBondContact O-N 2.89Å; T440-N443 PolarHBondContact O-N 3.41Å; T440-M444 WeakPolarHBondContact O-CB 3.3Å; T440-M444 PolarHBondContact O-N 3.43Å
441F85.2Confident85.7Confident120 Ų12093.6 Ų93.653%0.52649%0.491SS..Hα-helixtrans-65.1-43.3178-171.8-103.8000112.3L437 S438 M444 I445L437-F441 WeakPolarHBondContact O-CB 3.42Å; L437-F441 PolarHBondContact O-N 3.43Å; S438-F441 PolarHBondContact O-N 3.24Å; F441-M444 HydrophobicContact CD2-CE 3.62Å; F441-M444 HydrophobicContact CE2-CE 3.89Å; F441-M444 PolarHBondContact O-N 2.88Å; F441-I445 HydrophobicContact CD1-CD1 3.71Å; F441-I445 HydrophobicContact CE1-CD1 3.2Å; F441-I445 HydrophobicContact CE1-CG1 4.25Å; F441-I445 HydrophobicContact CE2-CD1 4.41Å; F441-I445 HydrophobicContact CZ-CD1 3.61Å; F441-I445 HydrophobicContact CZ-CG1 4.4Å; F441-I445 WeakPolarHBondContact O-CG1 3.47Å; F441-I445 PolarHBondContact O-N 2.97Å
442L87.6Confident86.1Confident108 Ų10894.3 Ų94.357%0.56550%0.496SS*.Hα-helixtrans-62.3-47.9176.3-171.370.5000110.9S438 K439 M444 I445 T446S438-L442 WeakPolarHBondContact O-CB 3.37Å; S438-L442 PolarHBondContact O-N 3.33Å; K439-L442 PolarHBondContact O-N 2.9Å; L442-M444 VanDerWaalsContact C-N 3.32Å; L442-M444 PolarHBondContact O-N 3.44Å; L442-I445 PolarHBondContact O-N 2.92Å; L442-T446 WeakPolarHBondContact O-CB 3.37Å; L442-T446 PolarHBondContact O-N 3.44Å; L442-T446 PolarHBondContact O-OG1 3.39Å; L442-T446 VanDerWaalsContact O-OG1 3.05Å
443N87.8Confident86.5Confident107 Ų10798 Ų9857%0.57250%0.498SS*.Hα-helixtrans-58.1-44.5176.2-80.9-9.2000111.5K439 T440 I445 T446 T447K439-N443 WeakPolarHBondContact O-CB 3.4Å; K439-N443 PolarHBondContact O-N 2.81Å; T440-N443 PolarHBondContact O-N 3.41Å; N443-I445 PolarHBondContact O-N 3.01Å; N443-T446 PolarHBondContact O-N 3Å; N443-T447 WeakPolarHBondContact O-CG2 3.24Å; N443-T447 PolarHBondContact O-N 3.34Å; N443-T447 PolarHBondContact O-OG1 3.22Å
444M86.9Confident87Confident64 Ų6499.3 Ų99.332%0.31550%0.495SS..Hα-helixtrans-62.5-40.3177.7-177.6-174.454.800112.7T440 F441 L442 T447 R448T440-M444 WeakPolarHBondContact O-CB 3.3Å; T440-M444 PolarHBondContact O-N 3.43Å; F441-M444 HydrophobicContact CD2-CE 3.62Å; F441-M444 HydrophobicContact CE2-CE 3.89Å; F441-M444 PolarHBondContact O-N 2.88Å; L442-M444 VanDerWaalsContact C-N 3.32Å; L442-M444 PolarHBondContact O-N 3.44Å; M444-T447 WeakPolarHBondContact CA-OG1 3.46Å; M444-T447 PolarHBondContact O-OG1 2.85Å; M444-T447 VanDerWaalsContact O-OG1 3.11Å; M444-R448 WeakPolarHBondContact O-CB 3.41Å; M444-R448 VanDerWaalsContact O-CG 3.31Å; M444-R448 WeakPolarHBondContact O-CG 3.5Å; M444-R448 PolarHBondContact O-N 3.31Å; M444-R448 VanDerWaalsContact O-N 3.13Å
445I85.8Confident87.5Confident62 Ų6294.3 Ų94.332%0.31848%0.482SS..Hα-helixtrans-67-45.6175.5-70.7175.9000110.3F441 L442 N443 R448 Q449F441-I445 HydrophobicContact CD1-CD1 3.71Å; F441-I445 HydrophobicContact CE1-CD1 3.2Å; F441-I445 HydrophobicContact CE1-CG1 4.25Å; F441-I445 HydrophobicContact CE2-CD1 4.41Å; F441-I445 HydrophobicContact CZ-CD1 3.61Å; F441-I445 HydrophobicContact CZ-CG1 4.4Å; F441-I445 WeakPolarHBondContact O-CG1 3.47Å; F441-I445 PolarHBondContact O-N 2.97Å; L442-I445 PolarHBondContact O-N 2.92Å; N443-I445 PolarHBondContact O-N 3.01Å; I445-R448 PolarHBondContact O-N 3.1Å; I445-Q449 HydrophobicContact CG2-CG 4.39Å; I445-Q449 WeakPolarHBondContact O-CB 3.49Å; I445-Q449 WeakPolarHBondContact O-CG 3.25Å; I445-Q449 PolarHBondContact O-N 2.99Å
446T89.7Confident87.6Confident60 Ų6094 Ų9437%0.36848%0.479SS..Hα-helixtrans-64.4-43.6-178.6-60.70000111.8L442 N443 Q449 N450L442-T446 WeakPolarHBondContact O-CB 3.37Å; L442-T446 PolarHBondContact O-N 3.44Å; L442-T446 PolarHBondContact O-OG1 3.39Å; L442-T446 VanDerWaalsContact O-OG1 3.05Å; N443-T446 PolarHBondContact O-N 3Å; T446-Q449 PolarHBondContact O-N 3.47Å; T446-N450 WeakPolarHBondContact O-CB 3.49Å; T446-N450 VanDerWaalsContact O-CG 3.24Å; T446-N450 PolarHBondContact O-N 3.31Å; T446-N450 PolarHBondContact O-ND2 2.9Å
447T89.4Confident87.9Confident72 Ų7295.2 Ų95.244%0.44248%0.48SS..Hα-helixtrans-63.2-47.7175.952.30000111.1N443 M444 Q449 N450 D451N443-T447 WeakPolarHBondContact O-CG2 3.24Å; N443-T447 PolarHBondContact O-N 3.34Å; N443-T447 PolarHBondContact O-OG1 3.22Å; M444-T447 WeakPolarHBondContact CA-OG1 3.46Å; M444-T447 PolarHBondContact O-OG1 2.85Å; M444-T447 VanDerWaalsContact O-OG1 3.11Å; T447-Q449 VanDerWaalsContact C-N 3.32Å; T447-Q449 PolarHBondContact O-N 2.94Å; T447-N450 PolarHBondContact O-N 3.21Å; T447-N450 VanDerWaalsContact O-N 3.13Å; T447-D451 VanDerWaalsContact O-CG 3.23Å; T447-D451 PolarHBondContact O-N 3.48Å
448R87.3Confident88.2Confident158 Ų15895.5 Ų95.560%0.59648%0.478SS*.Hα-helixtrans-58.8-41.4176-78-176.2177.5166.93.3113.2M444 I445 L452M444-R448 WeakPolarHBondContact O-CB 3.41Å; M444-R448 VanDerWaalsContact O-CG 3.31Å; M444-R448 WeakPolarHBondContact O-CG 3.5Å; M444-R448 PolarHBondContact O-N 3.31Å; M444-R448 VanDerWaalsContact O-N 3.13Å; I445-R448 PolarHBondContact O-N 3.1Å; R448-L452 WeakPolarHBondContact O-CB 3.41Å; R448-L452 VanDerWaalsContact O-CG 3.28Å; R448-L452 WeakPolarHBondContact O-CG 3.25Å; R448-L452 PolarHBondContact O-N 3.1Å
449Q86.3Confident88.4Confident105 Ų10598.6 Ų98.649%0.49149%0.486SS..Hα-helixtrans-64.3-43.5176.3-78.2-177.1-9.400111.3I445 T446 T447 L452 W453I445-Q449 HydrophobicContact CG2-CG 4.39Å; I445-Q449 WeakPolarHBondContact O-CB 3.49Å; I445-Q449 WeakPolarHBondContact O-CG 3.25Å; I445-Q449 PolarHBondContact O-N 2.99Å; T446-Q449 PolarHBondContact O-N 3.47Å; T447-Q449 VanDerWaalsContact C-N 3.32Å; T447-Q449 PolarHBondContact O-N 2.94Å; Q449-L452 PolarHBondContact O-N 3.46Å; Q449-W453 PolarHBondContact O-N 3.18Å
450N89.2Confident88.4Confident85 Ų8598.7 Ų98.746%0.45549%0.488SS..Hα-helixtrans-62.7-44.6177-71.7-16.3000111.8T446 T447 L452 W453 I454T446-N450 WeakPolarHBondContact O-CB 3.49Å; T446-N450 VanDerWaalsContact O-CG 3.24Å; T446-N450 PolarHBondContact O-N 3.31Å; T446-N450 PolarHBondContact O-ND2 2.9Å; T447-N450 PolarHBondContact O-N 3.21Å; T447-N450 VanDerWaalsContact O-N 3.13Å; N450-L452 VanDerWaalsContact C-N 3.32Å; N450-L452 PolarHBondContact O-N 3.32Å; N450-W453 PolarHBondContact O-N 3.48Å; N450-I454 VanDerWaalsContact O-CG1 3.28Å; N450-I454 WeakPolarHBondContact O-CG1 3.49Å; N450-I454 PolarHBondContact O-N 3.06Å
451D89.5Confident88.4Confident94 Ų94100 Ų10050%0.50349%0.489SS..Hα-helixtrans-62.1-40.4178.8-64.8-20.8000111.7T447 I454 T455T447-D451 VanDerWaalsContact O-CG 3.23Å; T447-D451 PolarHBondContact O-N 3.48Å; D451-I454 PolarHBondContact O-N 3.28Å; D451-T455 WeakPolarHBondContact O-CB 3.44Å; D451-T455 PolarHBondContact O-N 3.32Å; D451-T455 PolarHBondContact O-OG1 2.82Å
452L88.4Confident88.7Confident113 Ų11397.1 Ų97.159%0.59248%0.483SS*.Hα-helixtrans-62.7-45.8174.2-74.9169.5000111.6R448 Q449 N450 T455 I456R448-L452 WeakPolarHBondContact O-CB 3.41Å; R448-L452 VanDerWaalsContact O-CG 3.28Å; R448-L452 WeakPolarHBondContact O-CG 3.25Å; R448-L452 PolarHBondContact O-N 3.1Å; Q449-L452 PolarHBondContact O-N 3.46Å; N450-L452 VanDerWaalsContact C-N 3.32Å; N450-L452 PolarHBondContact O-N 3.32Å; L452-T455 PolarHBondContact O-N 3.38Å; L452-I456 VanDerWaalsContact O-CG1 3.27Å; L452-I456 WeakPolarHBondContact O-CG1 3.49Å; L452-I456 PolarHBondContact O-N 2.87Å
453W90.8Very high88.8Confident160 Ų16096.6 Ų96.661%0.60649%0.485SS*.Hα-helixtrans-63.6-42177.6-76.6119.8000112.4Q449 N450 I456 I457Q449-W453 PolarHBondContact O-N 3.18Å; N450-W453 PolarHBondContact O-N 3.48Å; W453-I456 HydrophobicContact CE3-CD1 4.45Å; W453-I456 PolarHBondContact O-N 3.33Å; W453-I457 VanDerWaalsContact O-CG1 3.27Å; W453-I457 WeakPolarHBondContact O-CG1 3.32Å; W453-I457 PolarHBondContact O-N 3.19Å
454I90.1Very high88.8Confident88 Ų8896.1 Ų96.145%0.45148%0.481SS..Hα-helixtrans-60.3-48.2175.8-69.2165.6000110N450 D451 I456 I457 E458N450-I454 VanDerWaalsContact O-CG1 3.28Å; N450-I454 WeakPolarHBondContact O-CG1 3.49Å; N450-I454 PolarHBondContact O-N 3.06Å; D451-I454 PolarHBondContact O-N 3.28Å; I454-I456 VanDerWaalsContact C-N 3.33Å; I454-I456 PolarHBondContact O-N 3.33Å; I454-I457 PolarHBondContact O-N 2.91Å; I454-E458 HydrophobicContact CG2-CG 4.37Å; I454-E458 WeakPolarHBondContact O-CG 3.21Å; I454-E458 PolarHBondContact O-N 3.42Å
455T90.9Very high88.9Confident64 Ų6498.2 Ų98.239%0.39349%0.49SS..Hα-helixtrans-60.3-42179.5-54.20000111.9D451 L452 Q459D451-T455 WeakPolarHBondContact O-CB 3.44Å; D451-T455 PolarHBondContact O-N 3.32Å; D451-T455 PolarHBondContact O-OG1 2.82Å; L452-T455 PolarHBondContact O-N 3.38Å; T455-Q459 WeakPolarHBondContact O-CB 3.48Å; T455-Q459 VanDerWaalsContact O-CG 3.27Å; T455-Q459 WeakPolarHBondContact O-CG 3.4Å; T455-Q459 PolarHBondContact O-N 3.02Å
456I87.3Confident89.1Confident70 Ų70100.2 Ų100.236%0.35950%0.501SS..Hα-helixtrans-63.6-45.9177.4-69.4165.5000110.5L452 W453 I454 Q459 E460L452-I456 VanDerWaalsContact O-CG1 3.27Å; L452-I456 WeakPolarHBondContact O-CG1 3.49Å; L452-I456 PolarHBondContact O-N 2.87Å; W453-I456 HydrophobicContact CE3-CD1 4.45Å; W453-I456 PolarHBondContact O-N 3.33Å; I454-I456 VanDerWaalsContact C-N 3.33Å; I454-I456 PolarHBondContact O-N 3.33Å; I456-Q459 PolarHBondContact O-N 3.37Å; I456-E460 WeakPolarHBondContact O-CG 3.23Å; I456-E460 PolarHBondContact O-N 3.02Å
457I89.7Confident89.1Confident98 Ų98102.3 Ų102.350%0.50351%0.51SS..Hα-helixtrans-63.6-43179.9-69.1167.3000111.2W453 I454 Q459 E460 Q461W453-I457 VanDerWaalsContact O-CG1 3.27Å; W453-I457 WeakPolarHBondContact O-CG1 3.32Å; W453-I457 PolarHBondContact O-N 3.19Å; I454-I457 PolarHBondContact O-N 2.91Å; I457-Q459 VanDerWaalsContact C-N 3.35Å; I457-Q459 PolarHBondContact O-N 3.22Å; I457-E460 PolarHBondContact O-N 2.92Å; I457-Q461 WeakPolarHBondContact O-CB 3.44Å; I457-Q461 PolarHBondContact O-N 3.33Å
458E91.1Very high89.1Confident119 Ų119103.2 Ų103.256%0.55651%0.511SS*.Hα-helixtrans-63.3-40.3176.9-73.2178.8167.800112.1I454 S462I454-E458 HydrophobicContact CG2-CG 4.37Å; I454-E458 WeakPolarHBondContact O-CG 3.21Å; I454-E458 PolarHBondContact O-N 3.42Å; E458-S462 WeakPolarHBondContact O-CB 3.36Å; E458-S462 PolarHBondContact O-N 3.03Å
459Q88.2Confident89.3Confident125 Ų125102.2 Ų102.258%0.58451%0.511SS*.Hα-helixtrans-64.8-45174.7-74.4178.3300111.7T455 I456 I457 S462 V463T455-Q459 WeakPolarHBondContact O-CB 3.48Å; T455-Q459 VanDerWaalsContact O-CG 3.27Å; T455-Q459 WeakPolarHBondContact O-CG 3.4Å; T455-Q459 PolarHBondContact O-N 3.02Å; I456-Q459 PolarHBondContact O-N 3.37Å; I457-Q459 VanDerWaalsContact C-N 3.35Å; I457-Q459 PolarHBondContact O-N 3.22Å; Q459-S462 PolarHBondContact O-N 3.26Å; Q459-V463 WeakPolarHBondContact O-CG2 3.44Å; Q459-V463 PolarHBondContact O-N 2.97Å
460E86.9Confident89.5Confident121 Ų12198.7 Ų98.757%0.56550%0.503SS*.Hα-helixtrans-61.9-44.8176.4-75.4-174.4165.400111.7I456 I457 S462 V463 I464I456-E460 WeakPolarHBondContact O-CG 3.23Å; I456-E460 PolarHBondContact O-N 3.02Å; I457-E460 PolarHBondContact O-N 2.92Å; E460-S462 PolarHBondContact O-N 3.11Å; E460-V463 PolarHBondContact O-N 3.34Å; E460-I464 VanDerWaalsContact O-CG1 3.29Å; E460-I464 WeakPolarHBondContact O-CG1 3.46Å; E460-I464 PolarHBondContact O-N 3.45Å
461Q88.7Confident89.6Confident107 Ų10799.6 Ų99.650%0.551%0.505SS..Hα-helixtrans-59.8-46.1176.4-176.8177.1-12.200111.3I457 V463 I464 E465I457-Q461 WeakPolarHBondContact O-CB 3.44Å; I457-Q461 PolarHBondContact O-N 3.33Å; Q461-V463 VanDerWaalsContact C-N 3.33Å; Q461-V463 PolarHBondContact O-N 2.85Å; Q461-I464 PolarHBondContact O-N 3.44Å; Q461-E465 HydrophobicContact CG-CG 4.44Å; Q461-E465 PolarHBondContact NE2-OE1 3.39Å; Q461-E465 WeakPolarHBondContact O-CB 3.39Å; Q461-E465 WeakPolarHBondContact O-CG 3.33Å; Q461-E465 PolarHBondContact O-N 2.89Å
462S90.6Very high89.7Confident59 Ų5999.3 Ų99.341%0.41350%0.502SS..Hα-helixtrans-60.1-41.1176.8179.50000112.4E458 Q459 E460 N466E458-S462 WeakPolarHBondContact O-CB 3.36Å; E458-S462 PolarHBondContact O-N 3.03Å; Q459-S462 PolarHBondContact O-N 3.26Å; E460-S462 PolarHBondContact O-N 3.11Å; S462-N466 WeakPolarHBondContact O-CB 3.44Å; S462-N466 VanDerWaalsContact O-CG 3.27Å; S462-N466 PolarHBondContact O-N 3.4Å; S462-N466 PolarHBondContact O-ND2 3.36Å; S462-N466 PolarHBondContact OG-ND2 3.06Å
463V89.5Confident89.9Confident98 Ų9897.7 Ų97.759%0.59449%0.494SS*.Hα-helixtrans-65.4-42.9176.3172.20000111.2Q459 E460 Q461 N466 L467Q459-V463 WeakPolarHBondContact O-CG2 3.44Å; Q459-V463 PolarHBondContact O-N 2.97Å; E460-V463 PolarHBondContact O-N 3.34Å; Q461-V463 VanDerWaalsContact C-N 3.33Å; Q461-V463 PolarHBondContact O-N 2.85Å; V463-N466 PolarHBondContact O-N 2.9Å; V463-L467 WeakPolarHBondContact O-CB 3.35Å; V463-L467 PolarHBondContact O-N 3.23Å
464I88.3Confident89.8Confident97 Ų9796.9 Ų96.950%0.49750%0.497SS..Hα-helixtrans-64-46.1178.1-68.7165.9000110.9E460 Q461 N466 L467 L468E460-I464 VanDerWaalsContact O-CG1 3.29Å; E460-I464 WeakPolarHBondContact O-CG1 3.46Å; E460-I464 PolarHBondContact O-N 3.45Å; Q461-I464 PolarHBondContact O-N 3.44Å; I464-N466 PolarHBondContact O-N 3.03Å; I464-L467 PolarHBondContact O-N 3.41Å; I464-L468 HydrophobicContact CG2-CD1 3.83Å; I464-L468 HydrophobicContact CG2-CG 4.41Å; I464-L468 WeakPolarHBondContact O-CB 3.46Å; I464-L468 WeakPolarHBondContact O-CG 3.37Å; I464-L468 PolarHBondContact O-N 2.98Å
465E89.1Confident89.9Confident107 Ų10797.5 Ų97.550%0.550%0.501SS..Hα-helixtrans-61.8-44.1178-75.9-179.3-167.400111.8Q461 L467 L468 K469Q461-E465 HydrophobicContact CG-CG 4.44Å; Q461-E465 PolarHBondContact NE2-OE1 3.39Å; Q461-E465 WeakPolarHBondContact O-CB 3.39Å; Q461-E465 WeakPolarHBondContact O-CG 3.33Å; Q461-E465 PolarHBondContact O-N 2.89Å; E465-L467 PolarHBondContact O-N 3.06Å; E465-L468 PolarHBondContact O-N 3.44Å; E465-K469 VanDerWaalsContact O-CB 3.24Å; E465-K469 WeakPolarHBondContact O-CB 3.44Å; E465-K469 PolarHBondContact O-N 3.18Å
466N90.3Very high89.9Confident104 Ų104100.1 Ų100.156%0.55651%0.507SS*.Hα-helixtrans-64.4-39.9176.8-76.1-44.9000112.2S462 V463 I464 G470S462-N466 WeakPolarHBondContact O-CB 3.44Å; S462-N466 VanDerWaalsContact O-CG 3.27Å; S462-N466 PolarHBondContact O-N 3.4Å; S462-N466 PolarHBondContact O-ND2 3.36Å; S462-N466 PolarHBondContact OG-ND2 3.06Å; V463-N466 PolarHBondContact O-N 2.9Å; I464-N466 PolarHBondContact O-N 3.03Å; N466-G470 PolarHBondContact O-N 2.84Å
467L89.1Confident90.1Very high105 Ų105102.8 Ų102.855%0.5552%0.521SS..Hα-helixtrans-65-47.9176.4-179.862.8000111.5V463 I464 E465 K469 G470 Q471V463-L467 WeakPolarHBondContact O-CB 3.35Å; V463-L467 PolarHBondContact O-N 3.23Å; I464-L467 PolarHBondContact O-N 3.41Å; E465-L467 PolarHBondContact O-N 3.06Å; L467-K469 VanDerWaalsContact C-N 3.34Å; L467-K469 PolarHBondContact O-N 3.49Å; L467-G470 PolarHBondContact O-N 3.29Å; L467-Q471 WeakPolarHBondContact O-CG 3.42Å; L467-Q471 PolarHBondContact O-N 3.25Å
468L89.8Confident90.1Very high91 Ų91103.2 Ų103.248%0.47652%0.524SS..Hα-helixtrans-61.4-43.2177.6-76.1170000111.3I464 E465 Q471 I472I464-L468 HydrophobicContact CG2-CD1 3.83Å; I464-L468 HydrophobicContact CG2-CG 4.41Å; I464-L468 WeakPolarHBondContact O-CB 3.46Å; I464-L468 WeakPolarHBondContact O-CG 3.37Å; I464-L468 PolarHBondContact O-N 2.98Å; E465-L468 PolarHBondContact O-N 3.44Å; L468-Q471 PolarHBondContact O-N 2.87Å; L468-I472 WeakPolarHBondContact O-CB 3.32Å; L468-I472 VanDerWaalsContact O-CG1 3.28Å; L468-I472 WeakPolarHBondContact O-CG1 3.41Å; L468-I472 PolarHBondContact O-N 3.09Å
469K92.2Very high89.9Confident136 Ų136101.5 Ų101.559%0.59152%0.518SS*.Hα-helixtrans-61.2-46175.9-171.9170.4-177.91780111.6E465 L467 Q471 I472 D473E465-K469 VanDerWaalsContact O-CB 3.24Å; E465-K469 WeakPolarHBondContact O-CB 3.44Å; E465-K469 PolarHBondContact O-N 3.18Å; L467-K469 VanDerWaalsContact C-N 3.34Å; L467-K469 PolarHBondContact O-N 3.49Å; K469-Q471 VanDerWaalsContact C-N 3.33Å; K469-Q471 PolarHBondContact O-N 2.9Å; K469-I472 PolarHBondContact O-N 3.4Å; K469-D473 PolarHBondContact O-N 3.33Å
470G90.2Very high90.1Very high32 Ų3299.6 Ų99.633%0.3352%0.515SS..Hα-helixtrans-59.3-41.2175.100000113.1N466 L467 D473 Q474N466-G470 PolarHBondContact O-N 2.84Å; L467-G470 PolarHBondContact O-N 3.29Å; G470-D473 PolarHBondContact O-N 3.38Å; G470-Q474 WeakPolarHBondContact O-CB 3.37Å; G470-Q474 WeakPolarHBondContact O-CG 3.48Å; G470-Q474 PolarHBondContact O-N 3.21Å
471Q89.9Confident90.3Very high104 Ų10496.9 Ų96.949%0.48651%0.509SS..Hα-helixtrans-66.8-42.2176.1-73.6179.9-15.700112.6L467 L468 K469 D473 Q474 L475L467-Q471 WeakPolarHBondContact O-CG 3.42Å; L467-Q471 PolarHBondContact O-N 3.25Å; L468-Q471 PolarHBondContact O-N 2.87Å; K469-Q471 VanDerWaalsContact C-N 3.33Å; K469-Q471 PolarHBondContact O-N 2.9Å; Q471-D473 VanDerWaalsContact C-N 3.34Å; Q471-D473 PolarHBondContact O-N 3.35Å; Q471-Q474 PolarHBondContact O-N 3.17Å; Q471-L475 WeakPolarHBondContact O-CB 3.49Å; Q471-L475 PolarHBondContact O-N 2.89Å
472I91.6Very high90.3Very high87 Ų8797.3 Ų97.345%0.44651%0.511SS..Hα-helixtrans-62.6-42.5176.8-71.9166.9000110.7L468 K469 L475 K476L468-I472 WeakPolarHBondContact O-CB 3.32Å; L468-I472 VanDerWaalsContact O-CG1 3.28Å; L468-I472 WeakPolarHBondContact O-CG1 3.41Å; L468-I472 PolarHBondContact O-N 3.09Å; K469-I472 PolarHBondContact O-N 3.4Å; I472-L475 PolarHBondContact O-N 2.8Å; I472-K476 HydrophobicContact CG2-CD 4.22Å; I472-K476 WeakPolarHBondContact O-CG 3.47Å; I472-K476 PolarHBondContact O-N 3.29Å
473D92.6Very high90.2Very high79 Ų7999 Ų9942%0.42252%0.516SS..Hα-helixtrans-69.5-38.6-179.9-70.1-20.6000111.8K469 G470 Q471 K476 L477K469-D473 PolarHBondContact O-N 3.33Å; G470-D473 PolarHBondContact O-N 3.38Å; Q471-D473 VanDerWaalsContact C-N 3.34Å; Q471-D473 PolarHBondContact O-N 3.35Å; D473-K476 PolarHBondContact O-N 2.91Å; D473-K476 IonicContact OD1-NZ 2.81Å; D473-L477 WeakPolarHBondContact O-CB 3.42Å; D473-L477 PolarHBondContact O-N 3.42Å
474Q89.8Confident90.2Very high143 Ų14397.3 Ų97.367%0.66851%0.512SS*.Hα-helixtrans-61.6-43.2171.2-76179.53.500112.1G470 Q471 L477 L478G470-Q474 WeakPolarHBondContact O-CB 3.37Å; G470-Q474 WeakPolarHBondContact O-CG 3.48Å; G470-Q474 PolarHBondContact O-N 3.21Å; Q471-Q474 PolarHBondContact O-N 3.17Å; Q474-L477 PolarHBondContact O-N 3.03Å; Q474-L478 WeakPolarHBondContact O-CB 3.43Å; Q474-L478 PolarHBondContact O-N 2.93Å
475L91.1Very high90.2Very high101 Ų10195.3 Ų95.353%0.52951%0.51SS..Hα-helixtrans-64.1-43.3177.7-177.365000111.5Q471 I472 L477 L478 I479Q471-L475 WeakPolarHBondContact O-CB 3.49Å; Q471-L475 PolarHBondContact O-N 2.89Å; I472-L475 PolarHBondContact O-N 2.8Å; L475-L477 PolarHBondContact O-N 3.28Å; L475-L478 PolarHBondContact O-N 3.38Å; L475-I479 HydrophobicContact CD1-CD1 4.26Å; L475-I479 HydrophobicContact CG-CD1 3.95Å; L475-I479 VanDerWaalsContact O-CG1 3.3Å; L475-I479 WeakPolarHBondContact O-CG1 3.48Å; L475-I479 PolarHBondContact O-N 3.45Å
476K91.8Very high90.1Very high120 Ų12095.1 Ų95.152%0.52251%0.511SS..Hα-helixtrans-59.3-46.4174.2-75.9173-177168.80111.4I472 D473 L478 I479 T480I472-K476 HydrophobicContact CG2-CD 4.22Å; I472-K476 WeakPolarHBondContact O-CG 3.47Å; I472-K476 PolarHBondContact O-N 3.29Å; D473-K476 PolarHBondContact O-N 2.91Å; D473-K476 IonicContact OD1-NZ 2.81Å; K476-L478 VanDerWaalsContact C-N 3.32Å; K476-L478 PolarHBondContact O-N 3.1Å; K476-I479 PolarHBondContact O-N 2.94Å; K476-T480 WeakPolarHBondContact O-CG2 3.45Å; K476-T480 PolarHBondContact O-N 2.87Å; K476-T480 PolarHBondContact O-OG1 3.35Å
477L91.4Very high90.1Very high126 Ų12697.2 Ų97.266%0.6652%0.516SS*.Hα-helixtrans-60.4-44.2178.3-16773.6000110.9D473 Q474 L475 T480 S481D473-L477 WeakPolarHBondContact O-CB 3.42Å; D473-L477 PolarHBondContact O-N 3.42Å; Q474-L477 PolarHBondContact O-N 3.03Å; L475-L477 PolarHBondContact O-N 3.28Å; L477-T480 WeakPolarHBondContact CA-OG1 3.48Å; L477-T480 PolarHBondContact O-N 3.42Å; L477-T480 PolarHBondContact O-OG1 3.49Å; L477-S481 WeakPolarHBondContact O-CB 3.41Å; L477-S481 PolarHBondContact O-N 3.3Å
478L89.7Confident90.1Very high107 Ų10797.8 Ų97.856%0.5652%0.516SS*.Hα-helixtrans-60.5-49.2176.9-17366.9000111.7Q474 L475 K476 T480 S481 E482Q474-L478 WeakPolarHBondContact O-CB 3.43Å; Q474-L478 PolarHBondContact O-N 2.93Å; L475-L478 PolarHBondContact O-N 3.38Å; K476-L478 VanDerWaalsContact C-N 3.32Å; K476-L478 PolarHBondContact O-N 3.1Å; L478-T480 VanDerWaalsContact C-N 3.34Å; L478-T480 PolarHBondContact O-N 2.94Å; L478-S481 PolarHBondContact O-N 2.95Å; L478-S481 PolarHBondContact O-OG 3.1Å; L478-E482 WeakPolarHBondContact O-CB 3.44Å; L478-E482 PolarHBondContact O-N 3.37Å
479I86.7Confident90.1Very high82 Ų8297.6 Ų97.642%0.42152%0.521SS..Hα-helixtrans-59.6-43.9178.2-68.9167.8000111L475 K476 S481 E482 N483L475-I479 HydrophobicContact CD1-CD1 4.26Å; L475-I479 HydrophobicContact CG-CD1 3.95Å; L475-I479 VanDerWaalsContact O-CG1 3.3Å; L475-I479 WeakPolarHBondContact O-CG1 3.48Å; L475-I479 PolarHBondContact O-N 3.45Å; K476-I479 PolarHBondContact O-N 2.94Å; I479-S481 VanDerWaalsContact C-N 3.35Å; I479-S481 PolarHBondContact O-N 3.4Å; I479-E482 PolarHBondContact O-N 3.42Å; I479-N483 WeakPolarHBondContact O-CB 3.28Å; I479-N483 PolarHBondContact O-N 3.13Å; I479-N483 PolarHBondContact O-ND2 3.23Å
480T92.2Very high89.9Confident86 Ų8696.1 Ų96.153%0.52852%0.516SS..Hα-helixtrans-64-39.9177.457.50000112.2K476 L477 L478 A484K476-T480 WeakPolarHBondContact O-CG2 3.45Å; K476-T480 PolarHBondContact O-N 2.87Å; K476-T480 PolarHBondContact O-OG1 3.35Å; L477-T480 WeakPolarHBondContact CA-OG1 3.48Å; L477-T480 PolarHBondContact O-N 3.42Å; L477-T480 PolarHBondContact O-OG1 3.49Å; L478-T480 VanDerWaalsContact C-N 3.34Å; L478-T480 PolarHBondContact O-N 2.94Å; T480-A484 WeakPolarHBondContact O-CB 3.42Å; T480-A484 PolarHBondContact O-N 3.1Å
481S90.8Very high89.9Confident64 Ų6499 Ų9945%0.44852%0.522SS..Hα-helixtrans-66.5-39.9177.177.50000112.5L477 L478 I479 A484 A485L477-S481 WeakPolarHBondContact O-CB 3.41Å; L477-S481 PolarHBondContact O-N 3.3Å; L478-S481 PolarHBondContact O-N 2.95Å; L478-S481 PolarHBondContact O-OG 3.1Å; I479-S481 VanDerWaalsContact C-N 3.35Å; I479-S481 PolarHBondContact O-N 3.4Å; S481-A484 PolarHBondContact O-N 3.26Å; S481-A485 PolarHBondContact O-N 3.03Å
482E88.9Confident89.8Confident115 Ų11597.3 Ų97.354%0.53752%0.516SS..Hα-helixtrans-67.9-44.2178.4-175.2171.8-166.100111L478 I479 A484 A485 L486L478-E482 WeakPolarHBondContact O-CB 3.44Å; L478-E482 PolarHBondContact O-N 3.37Å; I479-E482 PolarHBondContact O-N 3.42Å; E482-A484 VanDerWaalsContact C-N 3.32Å; E482-A484 PolarHBondContact O-N 3.13Å; E482-A485 PolarHBondContact O-N 3.41Å; E482-L486 HydrophobicContact CG-CD1 4.32Å; E482-L486 WeakPolarHBondContact O-CG 3.42Å; E482-L486 PolarHBondContact O-N 3.49Å
483N90.2Very high89.8Confident96 Ų9699.1 Ų99.151%0.51352%0.521SS..Hα-helixtrans-61.9-38.6175.1-76.3-28.1000112.5I479 L486 K487I479-N483 WeakPolarHBondContact O-CB 3.28Å; I479-N483 PolarHBondContact O-N 3.13Å; I479-N483 PolarHBondContact O-ND2 3.23Å; N483-L486 PolarHBondContact O-N 2.97Å; N483-K487 WeakPolarHBondContact O-CB 3.49Å; N483-K487 PolarHBondContact O-N 3.39Å
484A89.5Confident89.5Confident62 Ų6298.9 Ų98.951%0.51252%0.52SS..Hα-helixtrans-64.7-43.2174.600000111.9T480 S481 E482 K487 Q488T480-A484 WeakPolarHBondContact O-CB 3.42Å; T480-A484 PolarHBondContact O-N 3.1Å; S481-A484 PolarHBondContact O-N 3.26Å; E482-A484 VanDerWaalsContact C-N 3.32Å; E482-A484 PolarHBondContact O-N 3.13Å; A484-K487 PolarHBondContact O-N 2.9Å; A484-Q488 PolarHBondContact O-N 3.22Å
485A87.7Confident89.5Confident54 Ų5495.8 Ų95.845%0.44651%0.514SS..Hα-helixtrans-64.4-41.4176.500000112.3S481 E482 Q488 C489S481-A485 PolarHBondContact O-N 3.03Å; E482-A485 PolarHBondContact O-N 3.41Å; A485-Q488 PolarHBondContact O-N 3.48Å; A485-C489 PolarHBondContact O-N 3.47Å; A485-C489 PolarHBondContact O-SG 2.86Å; A485-C489 VanDerWaalsContact O-SG 3.38Å
486L85.9Confident89.4Confident103 Ų10397.2 Ų97.254%0.53951%0.513SS..Hα-helixtrans-62.9-44.2175.3-74.6173000111.7E482 N483 Q488 C489 Q490E482-L486 HydrophobicContact CG-CD1 4.32Å; E482-L486 WeakPolarHBondContact O-CG 3.42Å; E482-L486 PolarHBondContact O-N 3.49Å; N483-L486 PolarHBondContact O-N 2.97Å; L486-Q488 VanDerWaalsContact C-N 3.32Å; L486-Q488 PolarHBondContact O-N 3.36Å; L486-C489 PolarHBondContact O-N 2.93Å; L486-Q490 PolarHBondContact O-N 3.45Å
487K91.7Very high89.3Confident149 Ų14995.7 Ų95.765%0.64851%0.51SS*.Hα-helixtrans-61.9-40.3176.2-167.7176.3-179.1-177.60111.7N483 A484 Q490 M491N483-K487 WeakPolarHBondContact O-CB 3.49Å; N483-K487 PolarHBondContact O-N 3.39Å; A484-K487 PolarHBondContact O-N 2.9Å; K487-Q490 PolarHBondContact O-N 2.98Å; K487-M491 WeakPolarHBondContact O-CG 3.33Å; K487-M491 PolarHBondContact O-N 3.26Å
488Q89.3Confident89.1Confident117 Ų11792.3 Ų92.355%0.54750%0.5SS..Hα-helixtrans-64.2-43.6175.2-171.364.222.600112.4A484 A485 L486 Q490 M491 D492A484-Q488 PolarHBondContact O-N 3.22Å; A485-Q488 PolarHBondContact O-N 3.48Å; L486-Q488 VanDerWaalsContact C-N 3.32Å; L486-Q488 PolarHBondContact O-N 3.36Å; Q488-Q490 VanDerWaalsContact C-N 3.32Å; Q488-Q490 PolarHBondContact O-N 2.89Å; Q488-M491 PolarHBondContact O-N 3.46Å; Q488-D492 PolarHBondContact O-N 3.43Å
489C88.3Confident89.2Confident87 Ų8795.3 Ų95.359%0.58851%0.505SS*.Hα-helixtrans-62-40175.8-74.90000112.1A485 L486 D492 F493A485-C489 PolarHBondContact O-N 3.47Å; A485-C489 PolarHBondContact O-SG 2.86Å; A485-C489 VanDerWaalsContact O-SG 3.38Å; L486-C489 PolarHBondContact O-N 2.93Å; C489-D492 PolarHBondContact O-N 2.95Å; C489-F493 WeakPolarHBondContact O-CB 3.46Å; C489-F493 PolarHBondContact O-N 3.2Å
490Q88.4Confident89.3Confident104 Ų10495.7 Ų95.749%0.48651%0.507SS..Hα-helixtrans-62.8-46.2176.2-174.560.936.900111.1L486 K487 Q488 D492 F493 D494L486-Q490 PolarHBondContact O-N 3.45Å; K487-Q490 PolarHBondContact O-N 2.98Å; Q488-Q490 VanDerWaalsContact C-N 3.32Å; Q488-Q490 PolarHBondContact O-N 2.89Å; Q490-D492 PolarHBondContact O-N 3.36Å; Q490-F493 WeakPolarHBondContact O-CB 3.43Å; Q490-F493 PolarHBondContact O-N 3.46Å; Q490-D494 PolarHBondContact NE2-OD1 3.13Å; Q490-D494 PolarHBondContact NE2-OD2 3.3Å; Q490-D494 VanDerWaalsContact O-CG 3.27Å; Q490-D494 PolarHBondContact O-N 3.2Å
491M89.6Confident89.2Confident92 Ų9294.8 Ų94.845%0.45350%0.504SS..Hα-helixtrans-63-39.7177.2-68.3-173.6-56.900113.1K487 Q488 D494 S495K487-M491 WeakPolarHBondContact O-CG 3.33Å; K487-M491 PolarHBondContact O-N 3.26Å; Q488-M491 PolarHBondContact O-N 3.46Å; M491-D494 PolarHBondContact O-N 2.9Å; M491-S495 VanDerWaalsContact O-CB 3.24Å; M491-S495 WeakPolarHBondContact O-CB 3.5Å; M491-S495 PolarHBondContact O-N 3.48Å
492D89.5Confident89.2Confident69 Ų6996.2 Ų96.237%0.36951%0.51SS..Hα-helixtrans-65.8-38.8174.9-179.541.6000111.4Q488 C489 Q490 R496Q488-D492 PolarHBondContact O-N 3.43Å; C489-D492 PolarHBondContact O-N 2.95Å; Q490-D492 PolarHBondContact O-N 3.36Å; D492-R496 WeakPolarHBondContact O-CB 3.42Å; D492-R496 VanDerWaalsContact O-CG 3.23Å; D492-R496 WeakPolarHBondContact O-CG 3.24Å; D492-R496 PolarHBondContact O-N 3.24Å; D492-R496 IonicContact OD1-CZ 2.69Å; D492-R496 IonicContact OD1-NE 2.84Å; D492-R496 PolarHBondContact OD1-NE 3.07Å; D492-R496 IonicContact OD1-NH2 3.34Å; D492-R496 PolarHBondContact OD1-NH2 3.44Å; D492-R496 IonicContact OD2-CZ 2.69Å; D492-R496 IonicContact OD2-NE 3.51Å; D492-R496 PolarHBondContact OD2-NE 2.99Å; D492-R496 IonicContact OD2-NH1 3.95Å; D492-R496 IonicContact OD2-NH2 3.93Å; D492-R496 PolarHBondContact OD2-NH2 3.37Å
493F90.2Very high89.2Confident125 Ų12592.8 Ų92.855%0.54850%0.497SS..Hα-helixtrans-62.9-48.9174.2-176.5-93.9000111.7C489 Q490 S495 R496 L497C489-F493 WeakPolarHBondContact O-CB 3.46Å; C489-F493 PolarHBondContact O-N 3.2Å; Q490-F493 WeakPolarHBondContact O-CB 3.43Å; Q490-F493 PolarHBondContact O-N 3.46Å; F493-S495 VanDerWaalsContact C-N 3.34Å; F493-S495 PolarHBondContact O-N 2.82Å; F493-R496 PolarHBondContact O-N 2.9Å; F493-L497 HydrophobicContact CE1-CD2 4.48Å; F493-L497 WeakPolarHBondContact O-CB 2.91Å; F493-L497 PolarHBondContact O-N 2.9Å
494D86.2Confident89.1Confident74 Ų7493 Ų9340%0.39650%0.498SS..Hα-helixtrans-64.8-38.6180-65.6-24.6000111.5Q490 M491 L497 A498Q490-D494 PolarHBondContact NE2-OD1 3.13Å; Q490-D494 PolarHBondContact NE2-OD2 3.3Å; Q490-D494 VanDerWaalsContact O-CG 3.27Å; Q490-D494 PolarHBondContact O-N 3.2Å; M491-D494 PolarHBondContact O-N 2.9Å; D494-L497 PolarHBondContact O-N 2.86Å; D494-A498 WeakPolarHBondContact O-CB 3.29Å; D494-A498 PolarHBondContact O-N 3.46Å
495S89.8Confident89.1Confident78 Ų7894.9 Ų94.955%0.54550%0.496SS..Hα-helixtrans-63.2-44.2174.4-178.30000112.3M491 F493 A498 Y499M491-S495 VanDerWaalsContact O-CB 3.24Å; M491-S495 WeakPolarHBondContact O-CB 3.5Å; M491-S495 PolarHBondContact O-N 3.48Å; F493-S495 VanDerWaalsContact C-N 3.34Å; F493-S495 PolarHBondContact O-N 2.82Å; S495-A498 PolarHBondContact O-N 3.21Å; S495-Y499 WeakPolarHBondContact O-CB 3.3Å; S495-Y499 PolarHBondContact O-N 3.4Å
496R89.8Confident89.1Confident132 Ų13294.9 Ų94.950%0.49850%0.496SS..Hα-helixtrans-67.1-38.4176.3-72.9174.6-168.3-1714.2112.3D492 F493 Y499 L500D492-R496 WeakPolarHBondContact O-CB 3.42Å; D492-R496 VanDerWaalsContact O-CG 3.23Å; D492-R496 WeakPolarHBondContact O-CG 3.24Å; D492-R496 PolarHBondContact O-N 3.24Å; D492-R496 IonicContact OD1-CZ 2.69Å; D492-R496 IonicContact OD1-NE 2.84Å; D492-R496 PolarHBondContact OD1-NE 3.07Å; D492-R496 IonicContact OD1-NH2 3.34Å; D492-R496 PolarHBondContact OD1-NH2 3.44Å; D492-R496 IonicContact OD2-CZ 2.69Å; D492-R496 IonicContact OD2-NE 3.51Å; D492-R496 PolarHBondContact OD2-NE 2.99Å; D492-R496 IonicContact OD2-NH1 3.95Å; D492-R496 IonicContact OD2-NH2 3.93Å; D492-R496 PolarHBondContact OD2-NH2 3.37Å; F493-R496 PolarHBondContact O-N 2.9Å; R496-Y499 PolarHBondContact O-N 3.36Å; R496-L500 WeakPolarHBondContact O-CB 3.36Å; R496-L500 PolarHBondContact O-N 3.22Å
497L89.2Confident89.1Confident88 Ų8894.3 Ų94.346%0.46149%0.493SS..Hα-helixtrans-62.3-47.3175.5-172.669.4000110.2F493 D494 Y499 L500 S501F493-L497 HydrophobicContact CE1-CD2 4.48Å; F493-L497 WeakPolarHBondContact O-CB 2.91Å; F493-L497 PolarHBondContact O-N 2.9Å; D494-L497 PolarHBondContact O-N 2.86Å; L497-Y499 PolarHBondContact O-N 3.05Å; L497-L500 PolarHBondContact O-N 3.22Å; L497-S501 PolarHBondContact O-N 3.13Å; L497-S501 PolarHBondContact O-OG 3.23Å
498A88.2Confident88.9Confident55 Ų5592.8 Ų92.846%0.45549%0.488SS..Hα-helixtrans-60.1-45.5175.800000112.2D494 S495 L500 S501 V502D494-A498 WeakPolarHBondContact O-CB 3.29Å; D494-A498 PolarHBondContact O-N 3.46Å; S495-A498 PolarHBondContact O-N 3.21Å; A498-L500 VanDerWaalsContact C-N 3.34Å; A498-L500 PolarHBondContact O-N 2.88Å; A498-S501 PolarHBondContact O-N 2.94Å; A498-V502 WeakPolarHBondContact O-CG2 3.4Å; A498-V502 PolarHBondContact O-N 3.44Å
499Y90.4Very high88.8Confident169 Ų16993 Ų9366%0.66349%0.488SS*.Hα-helixtrans-60-43175.7178.2-92.7000112.2S495 R496 L497 V502 T503S495-Y499 WeakPolarHBondContact O-CB 3.3Å; S495-Y499 PolarHBondContact O-N 3.4Å; R496-Y499 PolarHBondContact O-N 3.36Å; L497-Y499 PolarHBondContact O-N 3.05Å; Y499-V502 PolarHBondContact O-N 2.91Å; Y499-T503 WeakPolarHBondContact CE1-OG1 3.39Å; Y499-T503 WeakPolarHBondContact O-CB 3.47Å; Y499-T503 PolarHBondContact O-N 3.41Å; Y499-T503 PolarHBondContact O-OG1 2.93Å
500L90.2Very high88.7Confident90 Ų9094.8 Ų94.847%0.47149%0.486SS..Hα-helixtrans-63.8-44.3177.2-17962.8000111.1R496 L497 A498 V502 T503 L504R496-L500 WeakPolarHBondContact O-CB 3.36Å; R496-L500 PolarHBondContact O-N 3.22Å; L497-L500 PolarHBondContact O-N 3.22Å; A498-L500 VanDerWaalsContact C-N 3.34Å; A498-L500 PolarHBondContact O-N 2.88Å; L500-V502 PolarHBondContact O-N 3.47Å; L500-T503 PolarHBondContact O-N 2.92Å; L500-L504 HydrophobicContact CD1-CD1 4.23Å; L500-L504 HydrophobicContact CD1-CG 4.15Å; L500-L504 HydrophobicContact CG-CD1 3.99Å; L500-L504 HydrophobicContact CG-CG 4.34Å; L500-L504 WeakPolarHBondContact O-CB 3.5Å; L500-L504 VanDerWaalsContact O-CG 3.31Å; L500-L504 WeakPolarHBondContact O-CG 3.26Å; L500-L504 PolarHBondContact O-N 3.49Å
501S90.1Very high88.6Confident67 Ų6794.1 Ų94.147%0.46949%0.488SS..Hα-helixtrans-58.7-47.3176.4-67.10000112L497 A498 T503 L504 E505L497-S501 PolarHBondContact O-N 3.13Å; L497-S501 PolarHBondContact O-OG 3.23Å; A498-S501 PolarHBondContact O-N 2.94Å; S501-T503 VanDerWaalsContact C-N 3.32Å; S501-T503 PolarHBondContact O-N 3.4Å; S501-L504 PolarHBondContact O-N 2.81Å; S501-E505 WeakPolarHBondContact O-CB 3.46Å; S501-E505 PolarHBondContact O-N 2.94Å
502V89.5Confident88.4Confident95 Ų9594.1 Ų94.158%0.57649%0.487SS*.Hα-helixtrans-61.9-40.9176.2173.10000111.4A498 Y499 L500 E505 A506A498-V502 WeakPolarHBondContact O-CG2 3.4Å; A498-V502 PolarHBondContact O-N 3.44Å; Y499-V502 PolarHBondContact O-N 2.91Å; L500-V502 PolarHBondContact O-N 3.47Å; V502-E505 PolarHBondContact O-N 3.33Å; V502-A506 WeakPolarHBondContact O-CB 3.4Å; V502-A506 PolarHBondContact O-N 2.89Å
503T89.1Confident88.3Confident42 Ų4296.3 Ų96.326%0.25850%0.495SS..Hα-helixtrans-66.4-41178.9-56.90000111.7Y499 L500 S501 A506 N507Y499-T503 WeakPolarHBondContact CE1-OG1 3.39Å; Y499-T503 WeakPolarHBondContact O-CB 3.47Å; Y499-T503 PolarHBondContact O-N 3.41Å; Y499-T503 PolarHBondContact O-OG1 2.93Å; L500-T503 PolarHBondContact O-N 2.92Å; S501-T503 VanDerWaalsContact C-N 3.32Å; S501-T503 PolarHBondContact O-N 3.4Å; T503-A506 PolarHBondContact O-N 3.38Å; T503-N507 WeakPolarHBondContact O-CB 3.28Å; T503-N507 PolarHBondContact O-N 3.25Å; T503-N507 PolarHBondContact O-ND2 3.45Å
504L88.4Confident88Confident101 Ų10195.2 Ų95.253%0.52949%0.492SS..Hα-helixtrans-66.5-42.6177-72.4173.9000111.3L500 S501 N507 Q508L500-L504 HydrophobicContact CD1-CD1 4.23Å; L500-L504 HydrophobicContact CD1-CG 4.15Å; L500-L504 HydrophobicContact CG-CD1 3.99Å; L500-L504 HydrophobicContact CG-CG 4.34Å; L500-L504 WeakPolarHBondContact O-CB 3.5Å; L500-L504 VanDerWaalsContact O-CG 3.31Å; L500-L504 WeakPolarHBondContact O-CG 3.26Å; L500-L504 PolarHBondContact O-N 3.49Å; S501-L504 PolarHBondContact O-N 2.81Å; L504-N507 PolarHBondContact O-N 2.86Å; L504-Q508 WeakPolarHBondContact O-CB 3.31Å; L504-Q508 PolarHBondContact O-N 3.11Å
505E90Very high88.1Confident102 Ų10298 Ų9848%0.47750%0.501SS..Hα-helixtrans-62.6-44.3175.5-167.4-168.4151.500111.6S501 V502 Q508 K509S501-E505 WeakPolarHBondContact O-CB 3.46Å; S501-E505 PolarHBondContact O-N 2.94Å; V502-E505 PolarHBondContact O-N 3.33Å; E505-Q508 PolarHBondContact O-N 2.87Å; E505-K509 PolarHBondContact O-N 3.01Å; E505-K509 IonicContact OE1-NZ 3.48Å; E505-K509 PolarHBondContact OE1-NZ 3.47Å
506A87.3Confident87.8Confident53 Ų5396.6 Ų96.644%0.43849%0.489SS..Hα-helixtrans-63.6-42.1176.700000112.2V502 T503 K509 F510V502-A506 WeakPolarHBondContact O-CB 3.4Å; V502-A506 PolarHBondContact O-N 2.89Å; T503-A506 PolarHBondContact O-N 3.38Å; A506-K509 PolarHBondContact O-N 3.38Å; A506-F510 WeakPolarHBondContact O-CB 3.38Å; A506-F510 PolarHBondContact O-N 3.06Å
507N86.3Confident87.4Confident91 Ų9194 Ų9449%0.48748%0.482SS..Hα-helixtrans-65.6-39176.1-75.4-20.5000111.8T503 L504 F510 V511T503-N507 WeakPolarHBondContact O-CB 3.28Å; T503-N507 PolarHBondContact O-N 3.25Å; T503-N507 PolarHBondContact O-ND2 3.45Å; L504-N507 PolarHBondContact O-N 2.86Å; N507-F510 PolarHBondContact O-N 3.48Å; N507-V511 VanDerWaalsContact O-CG2 3.3Å; N507-V511 WeakPolarHBondContact O-CG2 3.3Å; N507-V511 PolarHBondContact O-N 2.85Å
508Q87.7Confident87Confident117 Ų11794 Ų9455%0.54748%0.48SS..Hα-helixtrans-62.4-49175.5179.6172-3.900110.9L504 E505 F510 V511 E512L504-Q508 WeakPolarHBondContact O-CB 3.31Å; L504-Q508 PolarHBondContact O-N 3.11Å; E505-Q508 PolarHBondContact O-N 2.87Å; Q508-F510 VanDerWaalsContact C-N 3.29Å; Q508-F510 PolarHBondContact O-N 3.09Å; Q508-V511 PolarHBondContact O-N 3.02Å; Q508-E512 HydrophobicContact CG-CG 4.48Å; Q508-E512 WeakPolarHBondContact CG-OE1 3.35Å; Q508-E512 PolarHBondContact NE2-OE1 3.05Å; Q508-E512 WeakPolarHBondContact O-CG 3.41Å; Q508-E512 PolarHBondContact O-N 2.87Å
509K87.1Confident86.6Confident122 Ų12295 Ų9553%0.5348%0.475SS..Hα-helixtrans-59-39.3175.6-77.3174.8171.2162.90112.4E505 A506 H513E505-K509 PolarHBondContact O-N 3.01Å; E505-K509 IonicContact OE1-NZ 3.48Å; E505-K509 PolarHBondContact OE1-NZ 3.47Å; A506-K509 PolarHBondContact O-N 3.38Å; K509-H513 WeakPolarHBondContact O-CB 3.36Å; K509-H513 PolarHBondContact O-N 3.13Å
510F86.2Confident86Confident125 Ų12590.9 Ų90.955%0.54846%0.462SS..Hα-helixtrans-64.2-45.4176.1-178.6-92.6000112A506 N507 Q508 H513 E514A506-F510 WeakPolarHBondContact O-CB 3.38Å; A506-F510 PolarHBondContact O-N 3.06Å; N507-F510 PolarHBondContact O-N 3.48Å; Q508-F510 VanDerWaalsContact C-N 3.29Å; Q508-F510 PolarHBondContact O-N 3.09Å; F510-H513 PolarHBondContact O-N 3.36Å; F510-E514 WeakPolarHBondContact O-CB 3.48Å; F510-E514 PolarHBondContact O-N 3.23Å
511V85.4Confident85.5Confident89 Ų8991.9 Ų91.954%0.53946%0.459SS..Hα-helixtrans-65.3-40.5178170.50000111.4N507 Q508 F515N507-V511 VanDerWaalsContact O-CG2 3.3Å; N507-V511 WeakPolarHBondContact O-CG2 3.3Å; N507-V511 PolarHBondContact O-N 2.85Å; Q508-V511 PolarHBondContact O-N 3.02Å; V511-F515 VanDerWaalsContact O-CB 3.24Å; V511-F515 WeakPolarHBondContact O-CB 3.48Å; V511-F515 PolarHBondContact O-N 3.37Å
512E86.7Confident85.1Confident93 Ų9392.1 Ų92.144%0.43545%0.454SS..Hα-helixtrans-62.7-43.9175.1-73.5170.8-173.800111.2Q508 F515 V516Q508-E512 HydrophobicContact CG-CG 4.48Å; Q508-E512 WeakPolarHBondContact CG-OE1 3.35Å; Q508-E512 PolarHBondContact NE2-OE1 3.05Å; Q508-E512 WeakPolarHBondContact O-CG 3.41Å; Q508-E512 PolarHBondContact O-N 2.87Å; E512-F515 PolarHBondContact O-N 2.65Å; E512-V516 WeakPolarHBondContact O-CG2 3.16Å; E512-V516 PolarHBondContact O-N 2.93Å
513H86.8Confident84.6Confident114 Ų11489.3 Ų89.353%0.52844%0.436SS..Hα-helixtrans-64.4-47.2176.2-174.6-89.4000112.5K509 F510 F515 V516 E517K509-H513 WeakPolarHBondContact O-CB 3.36Å; K509-H513 PolarHBondContact O-N 3.13Å; F510-H513 PolarHBondContact O-N 3.36Å; H513-F515 VanDerWaalsContact C-N 3.27Å; H513-F515 PolarHBondContact O-N 2.97Å; H513-V516 PolarHBondContact O-N 3.11Å; H513-E517 IonicContact CE1-OE1 3.06Å; H513-E517 PolarHBondContact CE1-OE1 2.96Å; H513-E517 IonicContact ND1-OE1 3.79Å; H513-E517 PolarHBondContact O-N 3.45Å
514E83.8Confident83.9Confident102 Ų10292.2 Ų92.248%0.47745%0.446SS..Hα-helixtrans-61.5-37.4177.2-171.5179.5-166.800111.4F510 E518F510-E514 WeakPolarHBondContact O-CB 3.48Å; F510-E514 PolarHBondContact O-N 3.23Å; E514-E518 WeakPolarHBondContact O-CB 3.35Å; E514-E518 PolarHBondContact O-N 3.22Å
515F87.4Confident83.3Confident134 Ų13495 Ų9559%0.58846%0.455SS*.Hα-helixtrans-64.5-45.6174.8-180-95.9000112.2V511 E512 H513 E518 Q519V511-F515 VanDerWaalsContact O-CB 3.24Å; V511-F515 WeakPolarHBondContact O-CB 3.48Å; V511-F515 PolarHBondContact O-N 3.37Å; E512-F515 PolarHBondContact O-N 2.65Å; H513-F515 VanDerWaalsContact C-N 3.27Å; H513-F515 PolarHBondContact O-N 2.97Å; F515-E518 PolarHBondContact O-N 2.87Å; F515-Q519 WeakPolarHBondContact O-CB 3.4Å; F515-Q519 PolarHBondContact O-N 2.93Å
516V84.3Confident82.7Confident48 Ų4897 Ų9729%0.29146%0.459SS..Hα-helixtrans-63.9-44.7177.61720000110.9E512 H513 E518 Q519 E520E512-V516 WeakPolarHBondContact O-CG2 3.16Å; E512-V516 PolarHBondContact O-N 2.93Å; H513-V516 PolarHBondContact O-N 3.11Å; V516-E518 PolarHBondContact O-N 3.18Å; V516-Q519 WeakPolarHBondContact O-CB 3.5Å; V516-Q519 PolarHBondContact O-N 3.2Å; V516-E520 WeakPolarHBondContact O-CG 3.22Å; V516-E520 PolarHBondContact O-N 3.29Å
517E81.3Confident82.3Confident76 Ų76100.9 Ų100.936%0.35547%0.466SS..Hα-helixtrans-61.5-42.9175.9-77.3-168.2177.500112.7H513 Q519 E520 R521H513-E517 IonicContact CE1-OE1 3.06Å; H513-E517 PolarHBondContact CE1-OE1 2.96Å; H513-E517 IonicContact ND1-OE1 3.79Å; H513-E517 PolarHBondContact O-N 3.45Å; E517-Q519 VanDerWaalsContact C-N 3.32Å; E517-E520 PolarHBondContact O-N 3.44Å; E517-R521 WeakPolarHBondContact O-CG 3.3Å; E517-R521 PolarHBondContact O-N 2.99Å; E517-R521 IonicContact OE2-CZ 3.06Å; E517-R521 IonicContact OE2-NH1 2.93Å; E517-R521 PolarHBondContact OE2-NH1 3.1Å
518E80.1Confident81.7Confident90 Ų90101.3 Ų101.342%0.42147%0.474SS..Hα-helixtrans-66.8-38.1178.3-171.562.2-159.800110.8E514 F515 V516 R521 I522E514-E518 WeakPolarHBondContact O-CB 3.35Å; E514-E518 PolarHBondContact O-N 3.22Å; F515-E518 PolarHBondContact O-N 2.87Å; V516-E518 PolarHBondContact O-N 3.18Å; E518-R521 PolarHBondContact O-N 3.14Å; E518-R521 IonicContact OE2-CZ 3.3Å; E518-R521 IonicContact OE2-NE 3.83Å; E518-R521 PolarHBondContact OE2-NE 3.08Å; E518-R521 IonicContact OE2-NH2 2.68Å; E518-R521 PolarHBondContact OE2-NH2 3.36Å; E518-I522 HydrophobicContact CG-CD1 4.09Å; E518-I522 WeakPolarHBondContact O-CB 3.4Å; E518-I522 VanDerWaalsContact O-CG1 3.22Å; E518-I522 WeakPolarHBondContact O-CG1 3.19Å; E518-I522 PolarHBondContact O-N 3.43Å
519Q79.7Confident80.8Confident74 Ų74103.5 Ų103.535%0.34649%0.489SS..Hα-helixtrans-60.6-45.6172.7-168.6-175.716.600111F515 V516 E517 I522 I523F515-Q519 WeakPolarHBondContact O-CB 3.4Å; F515-Q519 PolarHBondContact O-N 2.93Å; V516-Q519 WeakPolarHBondContact O-CB 3.5Å; V516-Q519 PolarHBondContact O-N 3.2Å; E517-Q519 VanDerWaalsContact C-N 3.32Å; Q519-I522 PolarHBondContact O-N 3.41Å; Q519-I523 HydrophobicContact CG-CD1 4.08Å; Q519-I523 VanDerWaalsContact O-CG1 3.25Å; Q519-I523 WeakPolarHBondContact O-CG1 3.37Å; Q519-I523 PolarHBondContact O-N 3.05Å
520E78.9Confident79.6Confident84 Ų8499.8 Ų99.839%0.39348%0.479SS..Hα-helixtrans-62.1-43.2175.1-75.9-172.9171.900112.3V516 E517 I522 I523 Q524V516-E520 WeakPolarHBondContact O-CG 3.22Å; V516-E520 PolarHBondContact O-N 3.29Å; E517-E520 PolarHBondContact O-N 3.44Å; E520-I522 VanDerWaalsContact C-N 3.34Å; E520-I522 PolarHBondContact O-N 2.94Å; E520-I523 PolarHBondContact O-N 3.35Å; E520-Q524 WeakPolarHBondContact O-CB 3.5Å; E520-Q524 WeakPolarHBondContact O-CG 3.46Å; E520-Q524 PolarHBondContact O-N 3.03Å
521R80.5Confident78.1Confident111 Ų111100 Ų10042%0.41949%0.486SS..Hα-helixtrans-59.6-43.9175.3-77.2-170.2-71.6-94.23.1111.8E517 E518 F525E517-R521 WeakPolarHBondContact O-CG 3.3Å; E517-R521 PolarHBondContact O-N 2.99Å; E517-R521 IonicContact OE2-CZ 3.06Å; E517-R521 IonicContact OE2-NH1 2.93Å; E517-R521 PolarHBondContact OE2-NH1 3.1Å; E518-R521 PolarHBondContact O-N 3.14Å; E518-R521 IonicContact OE2-CZ 3.3Å; E518-R521 IonicContact OE2-NE 3.83Å; E518-R521 PolarHBondContact OE2-NE 3.08Å; E518-R521 IonicContact OE2-NH2 2.68Å; E518-R521 PolarHBondContact OE2-NH2 3.36Å; R521-F525 VanDerWaalsContact O-CB 3.29Å; R521-F525 WeakPolarHBondContact O-CB 3.39Å; R521-F525 PolarHBondContact O-N 2.97Å
522I80.1Confident76.8Confident71 Ų7197.2 Ų97.236%0.36447%0.469SS..Hα-helixtrans-64.3-44.8177.4-70.5167.2000110.4E518 Q519 E520 F525 Y526E518-I522 HydrophobicContact CG-CD1 4.09Å; E518-I522 WeakPolarHBondContact O-CB 3.4Å; E518-I522 VanDerWaalsContact O-CG1 3.22Å; E518-I522 WeakPolarHBondContact O-CG1 3.19Å; E518-I522 PolarHBondContact O-N 3.43Å; Q519-I522 PolarHBondContact O-N 3.41Å; E520-I522 VanDerWaalsContact C-N 3.34Å; E520-I522 PolarHBondContact O-N 2.94Å; I522-F525 PolarHBondContact O-N 3.44Å; I522-Y526 HydrophobicContact CG2-CD2 3.84Å; I522-Y526 HydrophobicContact CG2-CE2 3.94Å; I522-Y526 VanDerWaalsContact O-CD2 3.27Å; I522-Y526 WeakPolarHBondContact O-CD2 3.45Å; I522-Y526 PolarHBondContact O-N 3.32Å
523I78.6Confident75.3Confident37 Ų3799.4 Ų99.419%0.1948%0.483CS..Hα-helixtrans-64.3-44.8179-68.7172.9000110.8Q519 E520 F525 Y526 F527 T532 I535Q519-I523 HydrophobicContact CG-CD1 4.08Å; Q519-I523 VanDerWaalsContact O-CG1 3.25Å; Q519-I523 WeakPolarHBondContact O-CG1 3.37Å; Q519-I523 PolarHBondContact O-N 3.05Å; E520-I523 PolarHBondContact O-N 3.35Å; I523-F525 VanDerWaalsContact C-N 3.31Å; I523-F525 PolarHBondContact O-N 3.02Å; I523-Y526 PolarHBondContact O-N 3.16Å; I523-F527 HydrophobicContact CG2-CD2 4.48Å; I523-F527 WeakPolarHBondContact O-CA 3.43Å; I523-F527 WeakPolarHBondContact O-CB 3.43Å; I523-F527 PolarHBondContact O-N 3.42Å; I523-T532 HydrophobicContact CG2-CG2 4.15Å; I523-I535 HydrophobicContact CD1-CD1 3.64Å; I523-I535 HydrophobicContact CG2-CD1 4.02Å
524Q75.7Confident73.2Confident102 Ų102100.7 Ų100.748%0.47749%0.494SS..Hα-helixtrans-62.6-37.1174.6-74.6-177.4900112.3E520 F527 P528 T532E520-Q524 WeakPolarHBondContact O-CB 3.5Å; E520-Q524 WeakPolarHBondContact O-CG 3.46Å; E520-Q524 PolarHBondContact O-N 3.03Å; Q524-F527 CarbonylContact O-C 3.58Å; Q524-P528 VanDerWaalsContact O-CA 3.24Å; Q524-P528 WeakPolarHBondContact O-CA 3.46Å; Q524-P528 VanDerWaalsContact O-N 3.16Å; Q524-T532 HydrophobicContact CG-CG2 4.36Å
525F76.5Confident71.4Confident160 Ų16099.4 Ų99.470%0.70249%0.49SS*.Hα-helixtrans-63.7-43177.8-179.6-96.8000112.3R521 I522 I523R521-F525 VanDerWaalsContact O-CB 3.29Å; R521-F525 WeakPolarHBondContact O-CB 3.39Å; R521-F525 PolarHBondContact O-N 2.97Å; I522-F525 PolarHBondContact O-N 3.44Å; I523-F525 VanDerWaalsContact C-N 3.31Å; I523-F525 PolarHBondContact O-N 3.02Å
526Y77.2Confident69.1Low144 Ų14498.4 Ų98.457%0.56550%0.497SS*.Hα-helixtrans-85.3-28.4179.2-73.1-71.4000113.6I522 I523I522-Y526 HydrophobicContact CG2-CD2 3.84Å; I522-Y526 HydrophobicContact CG2-CE2 3.94Å; I522-Y526 VanDerWaalsContact O-CD2 3.27Å; I522-Y526 WeakPolarHBondContact O-CD2 3.45Å; I522-Y526 PolarHBondContact O-N 3.32Å; I523-Y526 PolarHBondContact O-N 3.16Å
527F78.2Confident66.9Low134 Ų134100.3 Ų100.359%0.58851%0.512SS*.  trans-134.671.6-176.3-54-77.6000111.3I523 Q524 N529 S530I523-F527 HydrophobicContact CG2-CD2 4.48Å; I523-F527 WeakPolarHBondContact O-CA 3.43Å; I523-F527 WeakPolarHBondContact O-CB 3.43Å; I523-F527 PolarHBondContact O-N 3.42Å; Q524-F527 CarbonylContact O-C 3.58Å; F527-N529 PolarHBondContact O-N 2.95Å; F527-S530 WeakPolarHBondContact CB-OG 3.45Å; F527-S530 WeakPolarHBondContact O-CB 3.23Å; F527-S530 PolarHBondContact O-N 2.77Å; F527-S530 PolarHBondContact O-OG 3.08Å
528P73.1Confident64.8Low100 Ų100101.4 Ų101.465%0.64953%0.526SS*.THydrogen-bonded Turntrans-62.6-15-173.919.8-30.7000114.9Q524Q524-P528 VanDerWaalsContact O-CA 3.24Å; Q524-P528 WeakPolarHBondContact O-CA 3.46Å; Q524-P528 VanDerWaalsContact O-N 3.16Å
529N69.9Low62.7Low163 Ų163101 Ų10187%0.87253%0.533SS*.THydrogen-bonded Turntrans-106.87177-64-19.3000113.3F527 N531F527-N529 PolarHBondContact O-N 2.95Å; N529-N531 PolarHBondContact O-N 3.22Å
530S61.4Low60.3Low45 Ų45106.9 Ų106.932%0.31556%0.561SS.*  trans-72.8118.3173.260.30000108.9F527 T532F527-S530 WeakPolarHBondContact CB-OG 3.45Å; F527-S530 WeakPolarHBondContact O-CB 3.23Å; F527-S530 PolarHBondContact O-N 2.77Å; F527-S530 PolarHBondContact O-OG 3.08Å; S530-T532 VanDerWaalsContact C-N 3.33Å; S530-T532 PolarHBondContact O-N 2.87Å
531N54.6Low57.9Low129 Ų129112.5 Ų112.569%0.6958%0.58SS**  trans-67.195.1170.5-126.6-5000106.9N529 N533 N534N529-N531 PolarHBondContact O-N 3.22Å; N531-N533 PolarHBondContact O-N 3.35Å; N531-N533 VanDerWaalsContact O-N 3.12Å; N531-N534 PolarHBondContact O-N 3.05Å
532T57.9Low55.3Low30 Ų30116 Ų11618%0.18460%0.601CS.*G310 helixtrans-66.5-10.6-176.150.10000113.1I523 Q524 S530 N534 I535I523-T532 HydrophobicContact CG2-CG2 4.15Å; Q524-T532 HydrophobicContact CG-CG2 4.36Å; S530-T532 VanDerWaalsContact C-N 3.33Å; S530-T532 PolarHBondContact O-N 2.87Å; T532-N534 PolarHBondContact O-N 3.22Å; T532-I535 HydrophobicContact CG2-CD1 4.22Å; T532-I535 PolarHBondContact O-N 2.87Å
533N54.4Low52.9Low139 Ų139117.7 Ų117.774%0.74362%0.619SS**G310 helixtrans-57.1-17.3173.6-69.8-8.6000114.7N531N531-N533 PolarHBondContact O-N 3.35Å; N531-N533 VanDerWaalsContact O-N 3.12Å
534N43.7Very low50.5Low141 Ų141124.3 Ų124.375%0.75465%0.649SS**G310 helixtrans-106.75.1-177.9-76-5.1000114.6N531 T532 P536N531-N534 PolarHBondContact O-N 3.05Å; T532-N534 PolarHBondContact O-N 3.22Å; N534-P536 VanDerWaalsContact O-CD 3.29Å; N534-P536 WeakPolarHBondContact O-CD 3.41Å
535I45.7Very low48.2Very low75 Ų75125.6 Ų125.639%0.38566%0.664SS.*SBendtrans-82.4113.9172.4-60165.8000106.6I523 T532 S537I523-I535 HydrophobicContact CD1-CD1 3.64Å; I523-I535 HydrophobicContact CG2-CD1 4.02Å; T532-I535 HydrophobicContact CG2-CD1 4.22Å; T532-I535 PolarHBondContact O-N 2.87Å; I535-S537 PolarHBondContact O-N 2.8Å
536P40.2Very low46Very low113 Ų113127.5 Ų127.573%0.73467%0.672SS**  trans-63.2114.8178.5-1327.3000107.9N534 P538N534-P536 VanDerWaalsContact O-CD 3.29Å; N534-P536 WeakPolarHBondContact O-CD 3.41Å; P536-P538 WeakPolarHBondContact O-CD 3.38Å
537S38.2Very low43.5Very low88 Ų88128.7 Ų128.762%0.61568%0.683SS**  trans-52.4124169.1-48.30000108I535 S539I535-S537 PolarHBondContact O-N 2.8Å; S537-S539 PolarHBondContact O-N 3.37Å
538P35.3Very low41.2Very low99 Ų99131 Ų13164%0.64369%0.693SS**SBendtrans-74.883.5176.229.3-30.5000108.5P536P536-P538 WeakPolarHBondContact O-CD 3.38Å
539S37.9Very low38.9Very low81 Ų81133 Ų13357%0.56670%0.698SS**  trans171.175.9149.944.30000111.2S537 Y541S537-S539 PolarHBondContact O-N 3.37Å; S539-Y541 PolarHBondContact O-N 3.44Å
540Q27.7Very low37.1Very low199 Ų199133.2 Ų133.293%0.9369%0.693SS**  trans-70.165.1138.4-81.7-178.1-23.800108.2Q542Q540-Q542 VanDerWaalsContact C-N 3.33Å; Q540-Q542 PolarHBondContact O-N 3.21Å
541Y29.9Very low35.6Very low202 Ų202135.9 Ų135.979%0.79271%0.712SS**  trans-74.4105.4147-96.7-85.4000104S539 S543S539-Y541 PolarHBondContact O-N 3.44Å; Y541-S543 PolarHBondContact O-N 3.46Å
542Q24.2Very low34.3Very low184 Ų184135.1 Ų135.186%0.8672%0.717SS**  trans-49.494.4164.3-78.3177.7-24.500106.9Q540 E544Q540-Q542 VanDerWaalsContact C-N 3.33Å; Q540-Q542 PolarHBondContact O-N 3.21Å; Q542-E544 VanDerWaalsContact C-N 3.3Å; Q542-E544 PolarHBondContact O-N 3.42Å
543S30.5Very low33Very low106 Ų106141 Ų14174%0.74175%0.747SS**  trans-67.1103.7163.5-66.20000103.7Y541 T545Y541-S543 PolarHBondContact O-N 3.46Å; S543-T545 PolarHBondContact O-N 2.98Å
544E28.3Very low31.6Very low177 Ų177142.6 Ų142.683%0.82775%0.75SS**  trans-43.6113.2163.5-77.9-178158.600106.8Q542 F546Q542-E544 VanDerWaalsContact C-N 3.3Å; Q542-E544 PolarHBondContact O-N 3.42Å; E544-F546 VanDerWaalsContact C-N 3.35Å; E544-F546 PolarHBondContact O-N 2.92Å
545T27.9Very low31Very low128 Ų128143.4 Ų143.479%0.78575%0.753SS**  trans-66.7100.1-176.9-11.40000105.1S543 Q547S543-T545 PolarHBondContact O-N 2.98Å; T545-Q547 PolarHBondContact O-N 3.22Å
546F30.1Very low29.9Very low200 Ų200146.1 Ų146.188%0.87777%0.768SS**  trans-63.393.6150.8-89.2-81.6000105.6E544 K548E544-F546 VanDerWaalsContact C-N 3.35Å; E544-F546 PolarHBondContact O-N 2.92Å; F546-K548 PolarHBondContact O-N 3.43Å
547Q25.3Very low29.3Very low169 Ų169147.8 Ų147.879%0.7977%0.771SS**  trans-48113.2165.1-76.8-163.5-17.100108.2T545T545-Q547 PolarHBondContact O-N 3.22Å
548K29.5Very low28.7Very low183 Ų183150 Ų15080%0.79678%0.776SS**  trans-150.8103.2143.5-134.8172.9-176.9176.90109.8F546 H550F546-K548 PolarHBondContact O-N 3.43Å; K548-H550 PolarHBondContact O-N 2.84Å; K548-H550 VanDerWaalsContact O-N 3.14Å
549D24.2Very low28.5Very low141 Ų141153 Ų15375%0.75479%0.786SS**  trans-46.3109.6168.6-57-60.7000111.1
550H32.8Very low27.9Very low168 Ų168155.1 Ų155.178%0.77880%0.796SS**  trans-133.780.1147.4-78.5-50.6000108K548 S552K548-H550 PolarHBondContact O-N 2.84Å; K548-H550 VanDerWaalsContact O-N 3.14Å; H550-S552 PolarHBondContact O-N 2.88Å
551S30.1Very low27.9Very low101 Ų101154.3 Ų154.371%0.70679%0.792SS**  trans-1.2108.4145.948.30000114.8N553S551-N553 PolarHBondContact O-N 3.19Å
552S27.3Very low27.8Very low113 Ų113152.6 Ų152.679%0.7979%0.794SS**  trans-42.6107.7158.8-26.20000110.7H550H550-S552 PolarHBondContact O-N 2.88Å
553N29.8Very low28.1Very low154 Ų154152.5 Ų152.582%0.82480%0.797SS**  trans-95.9100.2151.2-91.1-14.1000106.6S551 I555S551-N553 PolarHBondContact O-N 3.19Å; N553-I555 PolarHBondContact O-N 3.13Å; N553-I555 VanDerWaalsContact O-N 3.15Å
554E24.6Very low27.8Very low172 Ų172157.9 Ų157.980%0.80480%0.801SS**  trans-48111.4159.5-70.7174.4142.500109.2
555I31Very low27.6Very low158 Ų158155.7 Ų155.781%0.8180%0.795SS**  trans-113.691.8153.4-62.2178.2000105.6N553 N557N553-I555 PolarHBondContact O-N 3.13Å; N553-I555 VanDerWaalsContact O-N 3.15Å; I555-N557 PolarHBondContact O-N 2.84Å
556N23Very low27.5Very low132 Ų132157.1 Ų157.171%0.70680%0.798SS**  trans-42.7127.5153.5-78.2-32.1000109.6
557N27.9Very low27.3Very low149 Ų149153.5 Ų153.580%0.79779%0.792SS**  -161.5113.4127.5-111.6-15.9000111.5I555 N559I555-N557 PolarHBondContact O-N 2.84Å; N557-N559 PolarHBondContact O-N 2.96Å
558D26.1Very low27.5Very low133 Ų133152.1 Ų152.171%0.71179%0.791SS**  trans-35.5119.8151.9-67.4-52.1000111.8
559N29.6Very low27.4Very low163 Ų163150.8 Ų150.887%0.87279%0.792SS**  trans-151.450.5151.4-94.8-26.2000109.3N557N557-N559 PolarHBondContact O-N 2.96Å
560T26.9Very low27.6Very low126 Ų126151 Ų15177%0.77379%0.792SS**  trans-93.479.6157.218.50000107.7
561Q28Very low27.4Very low181 Ų181151.5 Ų151.585%0.84679%0.794SS**  trans-171.7135.7147.7-106.4168.764.600111
562M26.5Very low27.4Very low166 Ų166157.2 Ų157.282%0.81880%0.802SS**  trans88.955.7170-52.6-64.6-79.200118.7
563I30.1Very low27.3Very low182 Ų182155.1 Ų155.193%0.93379%0.788SS**  trans-134.783.2135-53.5-177.7000108.1
564R24.1Very low27.9Very low220 Ų220152.8 Ų152.883%0.8378%0.781SS**  trans-104.6127.1168.9-158-178.8-167.9-177.45.3106.6
565N25.1Very low28.4Very low130 Ų130150.8 Ų150.870%0.69577%0.771SS**  trans70.595.5166.1-54.4-15.2000117.3
566N26.5Very low28.5Very low158 Ų158150.6 Ų150.685%0.84577%0.772SS**  -168.2107.2114.2-91.4-14.7000109.7D568N566-D568 PolarHBondContact O-N 3.26Å
567T25.7Very low28.9Very low124 Ų124151.6 Ų151.676%0.76177%0.77SS**  trans-56.5119150.2390000108.5
568D27.9Very low29.2Very low141 Ų141153.3 Ų153.375%0.75477%0.766SS**SBendtrans155.5120.2136.5-74.3-18.2000108.9N566N566-D568 PolarHBondContact O-N 3.26Å
569N27.2Very low29.9Very low155 Ų155150.8 Ų150.883%0.82976%0.756SS**  trans73.774.1167.7-52.5-34.8000118.5
570I30Very low30.5Very low146 Ų146147.2 Ų147.275%0.74974%0.741SS**  trans-13686.6141.1-54.9-179000108.6Y572I570-Y572 PolarHBondContact O-N 2.96Å
571E28Very low31.1Very low177 Ų177145.9 Ų145.983%0.82773%0.728SS**  trans-51.6124.8148.1-88.8-179.6140.200108.6
572Y29.8Very low31.6Very low221 Ų221140.4 Ų140.487%0.86771%0.71SS**  trans48.673.5161.5-66.2-86.8000116.9I570I570-Y572 PolarHBondContact O-N 2.96Å
573S26.6Very low32.3Very low70 Ų70135.9 Ų135.949%0.4970%0.695SS.*  trans-90.7119.8154.1-1680000110.4E575S573-E575 VanDerWaalsContact C-N 3.26Å; S573-E575 PolarHBondContact O-N 3.21Å; S573-E575 VanDerWaalsContact O-N 3.14Å
574P42.4Very low33Very low105 Ų105131.3 Ų131.368%0.68267%0.671SS**  trans-86.534.9-171.536.2-35.6000113.7
575E34.2Very low34.1Very low130 Ų130129.7 Ų129.761%0.60767%0.665SS**G310 helixtrans-86.3-13.1-171.8-81.9172.9150.700115.5S573 F577S573-E575 VanDerWaalsContact C-N 3.26Å; S573-E575 PolarHBondContact O-N 3.21Å; S573-E575 VanDerWaalsContact O-N 3.14Å; E575-F577 PolarHBondContact O-N 3.05Å
576N32.5Very low34.9Very low154 Ų154131.1 Ų131.182%0.82467%0.665SS**G310 helixtrans-82.3-3.7176.6-87.7-8000115.8
577F31.2Very low35.6Very low153 Ų153131 Ų13167%0.67166%0.657SS**G310 helixtrans-102.8-5.2175.8-78-77.3000114.6E575 L581E575-F577 PolarHBondContact O-N 3.05Å; F577-L581 HydrophobicContact CB-CD1 4.31Å; F577-L581 PolarHBondContact O-N 3.34Å
578R35.5Very low36.7Very low184 Ų184131.9 Ų131.969%0.69465%0.653SS**Hα-helixtrans-69.3-37.2-177.7-94.3-172.6171.3-176.8-0.4115.2S582R578-S582 VanDerWaalsContact O-CB 3.31Å; R578-S582 WeakPolarHBondContact O-CB 3.46Å; R578-S582 PolarHBondContact O-N 2.91Å; R578-S582 VanDerWaalsContact O-N 3.14Å; R578-S582 PolarHBondContact O-OG 3.48Å
579P41.1Very low37.9Very low80 Ų80133 Ų13352%0.51965%0.651SS.*Hα-helixtrans-67.6-39.1-178.4-20.232.1000112.6S582 S583P579-S582 PolarHBondContact O-OG 3.32Å; P579-S583 WeakPolarHBondContact O-CB 3.41Å; P579-S583 PolarHBondContact O-N 3.47Å; P579-S583 PolarHBondContact O-OG 3.34Å
580V41.7Very low38.9Very low89 Ų89132 Ų13254%0.53964%0.636SS.*Hα-helixtrans-72.6-45.6-177.4-178.80000111.1S582 S583 I584V580-S582 PolarHBondContact O-N 2.92Å; V580-S583 PolarHBondContact O-N 2.68Å; V580-I584 HydrophobicContact CG1-CD1 3.66Å; V580-I584 WeakPolarHBondContact O-CB 3.45Å; V580-I584 WeakPolarHBondContact O-CD1 3.4Å; V580-I584 WeakPolarHBondContact O-CG1 3.4Å; V580-I584 PolarHBondContact O-N 3.26Å
581L40Very low39.7Very low98 Ų98127 Ų12751%0.51361%0.613SS.*Hα-helixtrans-70.3-32.2-179.7-78.3163.6000113.7F577 R585F577-L581 HydrophobicContact CB-CD1 4.31Å; F577-L581 PolarHBondContact O-N 3.34Å; L581-R585 WeakPolarHBondContact O-CB 3.47Å; L581-R585 PolarHBondContact O-N 2.83Å
582S37.8Very low40.8Very low66 Ų66121.6 Ų121.646%0.46259%0.59SS.*Hα-helixtrans-75.6-32.2178.159.50000112.7R578 P579 V580 K586R578-S582 VanDerWaalsContact O-CB 3.31Å; R578-S582 WeakPolarHBondContact O-CB 3.46Å; R578-S582 PolarHBondContact O-N 2.91Å; R578-S582 VanDerWaalsContact O-N 3.14Å; R578-S582 PolarHBondContact O-OG 3.48Å; P579-S582 PolarHBondContact O-OG 3.32Å; V580-S582 PolarHBondContact O-N 2.92Å; S582-K586 PolarHBondContact O-N 3.47Å; S582-K586 VanDerWaalsContact O-N 3.16Å
583S41Very low42.1Very low71 Ų71119.7 Ų119.750%0.49759%0.589SS.*Hα-helixtrans-71.3-41.5173.7-57.20000111.5P579 V580 K586 F587P579-S583 WeakPolarHBondContact O-CB 3.41Å; P579-S583 PolarHBondContact O-N 3.47Å; P579-S583 PolarHBondContact O-OG 3.34Å; V580-S583 PolarHBondContact O-N 2.68Å; S583-K586 PolarHBondContact O-N 2.93Å; S583-F587 PolarHBondContact O-N 2.89Å; S583-F587 VanDerWaalsContact O-N 3.08Å
584I45.9Very low43.3Very low85 Ų85123.7 Ų123.744%0.43660%0.599SS.*Hα-helixtrans-64.1-45176.2-67.1166.4000111.1V580 K586 F587 E588V580-I584 HydrophobicContact CG1-CD1 3.66Å; V580-I584 WeakPolarHBondContact O-CB 3.45Å; V580-I584 WeakPolarHBondContact O-CD1 3.4Å; V580-I584 WeakPolarHBondContact O-CG1 3.4Å; V580-I584 PolarHBondContact O-N 3.26Å; I584-K586 VanDerWaalsContact C-N 3.3Å; I584-K586 PolarHBondContact O-N 3.29Å; I584-F587 PolarHBondContact O-N 2.87Å; I584-E588 PolarHBondContact O-N 3.37Å; I584-E588 VanDerWaalsContact O-N 3.11Å
585R46.8Very low43.6Very low187 Ų187121.2 Ų121.271%0.70659%0.593SS**Hα-helixtrans-66.3-28.3176.4-82.8-171-167.3178.55.4114L581L581-R585 WeakPolarHBondContact O-CB 3.47Å; L581-R585 PolarHBondContact O-N 2.83Å
586K42.3Very low44.3Very low159 Ų159121.4 Ų121.469%0.69159%0.593SS**Hα-helixtrans-73.3-34173.9-91.9-175.6175.7179.90111.7S582 S583 I584 Y590S582-K586 PolarHBondContact O-N 3.47Å; S582-K586 VanDerWaalsContact O-N 3.16Å; S583-K586 PolarHBondContact O-N 2.93Å; I584-K586 VanDerWaalsContact C-N 3.3Å; I584-K586 PolarHBondContact O-N 3.29Å; K586-Y590 WeakPolarHBondContact O-CD2 3.27Å
587F39.4Very low45Very low157 Ų157123 Ų12369%0.68959%0.593SS**Hα-helixtrans-68.2-49.7176.6-110.2-88.3000111.9S583 I584 K589 Y590 T591S583-F587 PolarHBondContact O-N 2.89Å; S583-F587 VanDerWaalsContact O-N 3.08Å; I584-F587 PolarHBondContact O-N 2.87Å; F587-K589 PolarHBondContact O-N 3.1Å; F587-K589 VanDerWaalsContact O-N 3.16Å; F587-Y590 PolarHBondContact O-N 3.38Å; F587-T591 PolarHBondContact O-OG1 3.11Å
588E50.5Low45.9Very low141 Ų141119.9 Ų119.966%0.65958%0.582SS**Hα-helixtrans-61.8-27.7-179.1-72.6179.8157.600113.8I584 Y590I584-E588 PolarHBondContact O-N 3.37Å; I584-E588 VanDerWaalsContact O-N 3.11Å; E588-Y590 VanDerWaalsContact C-N 3.33Å; E588-Y590 PolarHBondContact O-N 3.47Å
589K52.7Low46.3Very low164 Ų164117.9 Ų117.971%0.71358%0.584SS**THydrogen-bonded Turntrans-79.3-13.6-173.8-146.5179.3-176.3-174.50114.2F587F587-K589 PolarHBondContact O-N 3.1Å; F587-K589 VanDerWaalsContact O-N 3.16Å
590Y48.3Very low46Very low135 Ų135118.7 Ų118.753%0.52959%0.59SS.*SBendtrans-126.810.6-175.1-64.5-73.5000114.1K586 F587 E588 K597 I598K586-Y590 WeakPolarHBondContact O-CD2 3.27Å; F587-Y590 PolarHBondContact O-N 3.38Å; E588-Y590 VanDerWaalsContact C-N 3.33Å; E588-Y590 PolarHBondContact O-N 3.47Å; Y590-K597 CarbonylContact O-C 3.49Å; Y590-K597 WeakPolarHBondContact O-CA 3.48Å; Y590-I598 PolarHBondContact O-N 3.08Å
591T46.2Very low45.6Very low41 Ų41120.7 Ų120.725%0.25260%0.596SS.*BIsolated β-bridgetrans-133.9142.1176.755.40000112.5F587 E596F587-T591 PolarHBondContact O-OG1 3.11Å; T591-E596 VanDerWaalsContact CA-O 3.25Å; T591-E596 WeakPolarHBondContact CA-O 3.32Å
592N51.6Low45.2Very low64 Ų64122.2 Ų122.234%0.34261%0.609SS.*  trans-80.2-177175.865.57.7000112.4H594 G595 E596 I598N592-H594 PolarHBondContact O-N 3.46Å; N592-H594 PolarHBondContact OD1-N 2.66Å; N592-G595 PolarHBondContact O-N 2.93Å; N592-G595 PolarHBondContact OD1-N 3.16Å; N592-E596 PolarHBondContact N-O 3.3Å; N592-E596 PolarHBondContact OD1-N 2.9Å; N592-I598 HydrophobicContact CB-CD1 4.09Å; N592-I598 HydrophobicContact CB-CG1 4.27Å
593E57.2Low44.8Very low181 Ų181127.1 Ų127.185%0.84662%0.623SS**THydrogen-bonded Turntrans-60.5-3.5178.764-169.4159.400115.3
594H50.2Low44.2Very low153 Ų153133.5 Ų133.571%0.70864%0.642SS**THydrogen-bonded Turntrans-118.36.8174.3-60-36.6000113.3N592N592-H594 PolarHBondContact O-N 3.46Å; N592-H594 PolarHBondContact OD1-N 2.66Å
595G49.1Very low43.6Very low53 Ų53135.4 Ų135.455%0.54666%0.657SS.*  trans82.510.2175.300000115.5N592N592-G595 PolarHBondContact O-N 2.93Å; N592-G595 PolarHBondContact OD1-N 3.16Å
596E49.7Very low42.8Very low134 Ų134132.5 Ų132.563%0.62666%0.663SS**  trans-90.1143.3-178.1-64-174.6153.500112.8T591 N592 I598T591-E596 VanDerWaalsContact CA-O 3.25Å; T591-E596 WeakPolarHBondContact CA-O 3.32Å; N592-E596 PolarHBondContact N-O 3.3Å; N592-E596 PolarHBondContact OD1-N 2.9Å; E596-I598 PolarHBondContact O-N 3.44Å
597K46.1Very low42.2Very low189 Ų189130 Ų13082%0.82267%0.665SS**BIsolated β-bridgetrans-68.9114.8-171-151.8178-172179.80111.6Y590 I599Y590-K597 CarbonylContact O-C 3.49Å; Y590-K597 WeakPolarHBondContact O-CA 3.48Å; K597-I599 PolarHBondContact O-N 2.7Å
598I49.9Very low41.8Very low86 Ų86127.8 Ų127.844%0.44167%0.669SS.*  trans-81.5110.7-179.9-55.4174.4000109.5Y590 N592 E596 P600Y590-I598 PolarHBondContact O-N 3.08Å; N592-I598 HydrophobicContact CB-CD1 4.09Å; N592-I598 HydrophobicContact CB-CG1 4.27Å; E596-I598 PolarHBondContact O-N 3.44Å; I598-P600 WeakPolarHBondContact O-CD 3.46Å
599I44.7Very low40.7Very low142 Ų142125.9 Ų125.973%0.72867%0.671SS**  trans-77.4118167.5-58.2175.6000107.7K597 I601K597-I599 PolarHBondContact O-N 2.7Å; I599-I601 PolarHBondContact O-N 2.84Å
600P34.2Very low39.4Very low98 Ų98127.4 Ų127.464%0.63668%0.678SS**  trans-71.7104.9-17526-30.9000110.9I598 T602I598-P600 WeakPolarHBondContact O-CD 3.46Å; P600-T602 PolarHBondContact O-N 2.81Å
601I33.9Very low38.4Very low130 Ų130129.5 Ų129.567%0.66769%0.69SS**  trans-80.2106.8170.9-58175.9000107.9I599 F603I599-I601 PolarHBondContact O-N 2.84Å; I601-F603 HydrophobicContact CB-CE2 4.12Å; I601-F603 HydrophobicContact CG2-CD2 3.95Å; I601-F603 HydrophobicContact CG2-CE1 4.33Å; I601-F603 HydrophobicContact CG2-CE2 3.45Å; I601-F603 VanDerWaalsContact CG2-CE2 3.45Å; I601-F603 HydrophobicContact CG2-CZ 3.67Å; I601-F603 PolarHBondContact O-N 2.98Å
602T31.4Very low37.3Very low130 Ų130134.7 Ų134.780%0.79872%0.716SS**  trans-80101.917440.60000110.2P600 K604P600-T602 PolarHBondContact O-N 2.81Å; T602-K604 PolarHBondContact O-N 3.3Å
603F30.8Very low36.3Very low169 Ų169136.2 Ų136.274%0.74173%0.732SS**  trans-80112.3166.3-69.2-82.3000109.1I601 T605I601-F603 HydrophobicContact CB-CE2 4.12Å; I601-F603 HydrophobicContact CG2-CD2 3.95Å; I601-F603 HydrophobicContact CG2-CE1 4.33Å; I601-F603 HydrophobicContact CG2-CE2 3.45Å; I601-F603 VanDerWaalsContact CG2-CE2 3.45Å; I601-F603 HydrophobicContact CG2-CZ 3.67Å; I601-F603 PolarHBondContact O-N 2.98Å; F603-T605 PolarHBondContact O-N 2.82Å
604K27.1Very low34.7Very low206 Ų206133.5 Ų133.590%0.89673%0.733SS**  trans-65.599.1165.6-73.6-178.2178178.70107.9T602T602-K604 PolarHBondContact O-N 3.3Å
605T33.6Very low33.5Very low125 Ų125129.4 Ų129.477%0.76773%0.732SS**  trans-75.2126.716942.80000109.2F603 S607F603-T605 PolarHBondContact O-N 2.82Å; T605-S607 PolarHBondContact O-N 3.1Å
606P30.1Very low32.6Very low126 Ų126132.8 Ų132.882%0.81875%0.748SS**  trans-65.6130.5172.2-16.530.2000110.1
607S30.6Very low31.4Very low106 Ų106136.1 Ų136.174%0.74176%0.763SS**  trans-33.2133.6169.41570000114.9T605T605-S607 PolarHBondContact O-N 3.1Å
608S29.1Very low30.6Very low111 Ų111132.7 Ų132.778%0.77676%0.763SS**  trans-12.5123.7161.557.80000118
609S27.7Very low29.4Very low100 Ų100131.8 Ų131.870%0.69978%0.775SS**  trans-127.6115.8145.563.80000109.2F611S609-F611 PolarHBondContact O-N 3.25Å; S609-F611 VanDerWaalsContact O-N 3.15Å
610K26.7Very low28.7Very low196 Ų196133 Ų13385%0.85278%0.779SS**  trans-58.1109.3169.7-72.3172.4174.6175.10109.2N612K610-N612 VanDerWaalsContact C-N 3.34Å; K610-N612 PolarHBondContact O-N 3.03Å
611F26.7Very low28.4Very low180 Ų180136.2 Ų136.279%0.78979%0.79SS**  trans-8485.8162.8-113.1-90.5000108.4S609S609-F611 PolarHBondContact O-N 3.25Å; S609-F611 VanDerWaalsContact O-N 3.15Å
612N23.5Very low28.2Very low150 Ų150137.3 Ų137.380%0.80280%0.797SS**  trans-80.1109.2154.3-85-7.4000106.6K610K610-N612 VanDerWaalsContact C-N 3.34Å; K610-N612 PolarHBondContact O-N 3.03Å
613S30.5Very low27.9Very low96 Ų96141 Ų14167%0.67180%0.796SS**  trans-130.577.1161.160.10000108.8
614S24.2Very low27.5Very low123 Ų123140.4 Ų140.486%0.8680%0.795SS**  trans-57.3126.8145.448.40000108.7
615G24.7Very low28.2Very low68 Ų68141.8 Ų141.870%0.70181%0.813SS**  trans130.581.3164.900000114.6
616S29.2Very low27.9Very low124 Ų124142.7 Ų142.787%0.86782%0.815SS**  trans-157.959.1143.8-74.10000108.5S618S616-S618 PolarHBondContact O-N 3.34Å
617Q24.7Very low27.8Very low203 Ų203143.5 Ų143.595%0.94982%0.815SS**  trans-76.297.9145.9-85.8-174.3-26.500106.1
618S29Very low27.6Very low117 Ų117145.6 Ų145.682%0.81882%0.819SS**  trans-131.1104.7157.1-163.10000103.2S616S616-S618 PolarHBondContact O-N 3.34Å
619G24.6Very low27.5Very low67 Ų67147.6 Ų147.669%0.69182%0.822SS**  cis100.46549.800000108.1
620M30.1Very low27.5Very low167 Ų167150.6 Ų150.682%0.82383%0.829SS**  trans-12673.1152.8-86.6-163.676.200107.8L622M620-L622 HydrophobicContact CE-CD1 3.7Å
621L28Very low27.6Very low166 Ų166147.6 Ų147.687%0.86983%0.828SS**  trans-82.295.3154.2-104.4155.1000106R623L621-R623 PolarHBondContact O-N 3.29Å
622L31.2Very low27.7Very low153 Ų153145.3 Ų145.380%0.80183%0.831SS**  trans-84.3105.3158.1-96.5157.6000106.7M620M620-L622 HydrophobicContact CE-CD1 3.7Å
623R24.3Very low28Very low208 Ų208144.9 Ų144.979%0.78583%0.833SS**  trans-79.8152.2177.6-166.6176.4-179.6-128.61.1109.5L621L621-R623 PolarHBondContact O-N 3.29Å
624Q21.7Very low27.8Very low156 Ų156149 Ų14973%0.72985%0.846SS**  trans-23.5133.9163.8-66.3158.7-45.800114.8
625D41.6Very low28.1Very low236 Ų236151.4 Ų151.4100%1.26285%0.845SS**  -154.9082.2-79.1-35.5000111

Retrieved 625 of 625 residues in 391.1 ms (Link to these results)

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