A0A096NMP1_PAPAN Loading...

TBC1 domain family member 21

AlphaFold DB (G7P929), UniProt , Accession A0A096NMP1, Species PAPAN (Papio anubis, Olive baboon), Gene TBC1D21, Length 336 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
1M32.8Very low56.7Low235 Ų23592.2 Ų92.2100%1.15851%0.512SS*.  096.10-77.2179.2-163.600106.8
2T37.9Very low58.3Low87 Ų8784.6 Ų84.653%0.53447%0.47SS..  trans-12685.8174.422.20000106.5
3T38.5Very low60.2Low119 Ų11985.8 Ų85.873%0.7346%0.463SS*.  trans-53143.5169.645.20000110.2S5T3-S5 PolarHBondContact O-N 3.11Å
4L49.4Very low61.7Low73 Ų7387.9 Ų87.938%0.38247%0.468SS..  trans-39109.2168-70.9163000110.2I323 K332 L336L4-I323 HydrophobicContact CD2-CB 3.76Å; L4-I323 HydrophobicContact CD2-CG2 3.7Å; L4-K332 HydrophobicContact CD1-CD 3.92Å; L4-K332 HydrophobicContact CD1-CG 4.22Å; L4-L336 HydrophobicContact CD1-CD1 4.14Å; L4-L336 HydrophobicContact CD2-CD1 3.28Å; L4-L336 HydrophobicContact CD2-CD2 4.39Å; L4-L336 HydrophobicContact CD2-CG 4.46Å; L4-L336 HydrophobicContact CG-CD1 3.43Å; L4-L336 VanDerWaalsContact CG-CD1 3.43Å
5S54.1Low63.2Low29 Ų2982.1 Ų82.120%0.20344%0.438CS..  trans-121.8141.5167.973.50000108.5T3 E7 N8 S9T3-S5 PolarHBondContact O-N 3.11Å; S5-E7 PolarHBondContact O-N 3.42Å; S5-E7 VanDerWaalsContact O-N 3.11Å; S5-N8 WeakPolarHBondContact O-CB 3.45Å; S5-N8 PolarHBondContact O-N 3.01Å; S5-N8 VanDerWaalsContact OG-CG 3.24Å; S5-N8 PolarHBondContact OG-N 3.01Å; S5-N8 VanDerWaalsContact OG-N 3.13Å; S5-N8 PolarHBondContact OG-ND2 3.2Å; S5-N8 PolarHBondContact OG-OD1 3.41Å; S5-S9 PolarHBondContact O-N 3.24Å
6P58.1Low64.3Low114 Ų11477.1 Ų77.174%0.7441%0.411SS*.Hα-helixtrans-52.7-27.9168.4-27.135.4000112.6S9 L10P6-S9 WeakPolarHBondContact O-CB 3.42Å; P6-S9 PolarHBondContact O-N 2.93Å; P6-L10 PolarHBondContact O-N 2.82Å
7E61.1Low65.4Low153 Ų15376.1 Ų76.172%0.71541%0.412SS*.Hα-helixtrans-63.3-39.5175.1-60.3177.1166.100112.3S5 S9 L10 S11S5-E7 PolarHBondContact O-N 3.42Å; S5-E7 VanDerWaalsContact O-N 3.11Å; E7-S9 VanDerWaalsContact C-N 3.27Å; E7-S9 PolarHBondContact O-N 3.15Å; E7-L10 PolarHBondContact O-N 2.97Å; E7-S11 WeakPolarHBondContact O-CB 3.21Å; E7-S11 PolarHBondContact O-N 3.5Å
8N66.3Low66.3Low48 Ų4873.9 Ų73.926%0.25740%0.398SS..Hα-helixtrans-65.9-31.8174.9-67.2-17.6000111.8S5 A12 I323S5-N8 WeakPolarHBondContact O-CB 3.45Å; S5-N8 PolarHBondContact O-N 3.01Å; S5-N8 VanDerWaalsContact OG-CG 3.24Å; S5-N8 PolarHBondContact OG-N 3.01Å; S5-N8 VanDerWaalsContact OG-N 3.13Å; S5-N8 PolarHBondContact OG-ND2 3.2Å; S5-N8 PolarHBondContact OG-OD1 3.41Å; N8-A12 WeakPolarHBondContact O-CB 3.33Å; N8-A12 PolarHBondContact O-N 3.4Å; N8-I323 HydrophobicContact CB-CD1 4.15Å
9S71.9Confident67Low3 Ų370.1 Ų70.12%0.02138%0.377CS..Hα-helixtrans-72.7-46.9177.2-170.60000112.3S5 P6 E7 S11 A12 R13 A320 I323 Q324S5-S9 PolarHBondContact O-N 3.24Å; P6-S9 WeakPolarHBondContact O-CB 3.42Å; P6-S9 PolarHBondContact O-N 2.93Å; E7-S9 VanDerWaalsContact C-N 3.27Å; E7-S9 PolarHBondContact O-N 3.15Å; S9-S11 VanDerWaalsContact C-N 3.32Å; S9-S11 PolarHBondContact O-N 2.89Å; S9-A12 PolarHBondContact O-N 3.48Å; S9-R13 PolarHBondContact O-N 3Å; S9-A320 PolarHBondContact OG-O 3.38Å; S9-I323 VanDerWaalsContact CB-CD1 3.42Å; S9-Q324 WeakPolarHBondContact OG-CG 3.38Å; S9-Q324 PolarHBondContact OG-NE2 2.93Å
10L73.5Confident67.7Low101 Ų10171.6 Ų71.653%0.52938%0.384SS..Hα-helixtrans-61.8-45176-172.566.8000110.4P6 E7 R13 Q14P6-L10 PolarHBondContact O-N 2.82Å; E7-L10 PolarHBondContact O-N 2.97Å; L10-R13 PolarHBondContact O-N 3.4Å; L10-Q14 HydrophobicContact CG-CG 4.48Å; L10-Q14 WeakPolarHBondContact O-CB 3.45Å; L10-Q14 WeakPolarHBondContact O-CG 3.15Å; L10-Q14 PolarHBondContact O-N 2.88Å
11S80.3Confident68.1Low52 Ų5272 Ų7236%0.36439%0.389SS..Hα-helixtrans-57.8-49.9176.5177.20000111.7E7 S9 R13 Q14 S15E7-S11 WeakPolarHBondContact O-CB 3.21Å; E7-S11 PolarHBondContact O-N 3.5Å; S9-S11 VanDerWaalsContact C-N 3.32Å; S9-S11 PolarHBondContact O-N 2.89Å; S11-R13 PolarHBondContact O-N 3.35Å; S11-Q14 WeakPolarHBondContact O-CB 3.36Å; S11-Q14 PolarHBondContact O-N 3.06Å; S11-Q14 VanDerWaalsContact O-N 3.15Å; S11-S15 PolarHBondContact O-N 3.34Å; S11-S15 PolarHBondContact O-OG 3.41Å
12A76.3Confident69.7Low1 Ų167 Ų671%0.00836%0.361CS..Hα-helixtrans-62.7-39.9178.900000113.6N8 S9 A16 P266 Y319 A320N8-A12 WeakPolarHBondContact O-CB 3.33Å; N8-A12 PolarHBondContact O-N 3.4Å; S9-A12 PolarHBondContact O-N 3.48Å; A12-A16 WeakPolarHBondContact O-CB 3.47Å; A12-A16 PolarHBondContact O-N 3.41Å; A12-P266 HydrophobicContact CB-CB 4.37Å; A12-Y319 HydrophobicContact CB-CD1 3.64Å; A12-Y319 HydrophobicContact CB-CE1 4.2Å; A12-A320 HydrophobicContact CB-CB 3.91Å
13R82.5Confident71.1Confident101 Ų10170.6 Ų70.638%0.38137%0.365SS..Hα-helixtrans-66.1-39.2173.3-70.2-168174.2154.82.7112.2S9 L10 S11 A16 S17 A320 Q324S9-R13 PolarHBondContact O-N 3Å; L10-R13 PolarHBondContact O-N 3.4Å; S11-R13 PolarHBondContact O-N 3.35Å; R13-A16 PolarHBondContact O-N 3.13Å; R13-S17 WeakPolarHBondContact O-CB 3.4Å; R13-S17 PolarHBondContact O-N 3.2Å; R13-A320 HydrophobicContact CB-CB 4.47Å; R13-A320 HydrophobicContact CG-CB 3.38Å; R13-Q324 VanDerWaalsContact NH2-CD 3.27Å
14Q81.7Confident73Confident115 Ų11570.6 Ų70.654%0.53736%0.355SS..Hα-helixtrans-62.5-47176.9-76.7172.2-12.800110.7L10 S11 S17 F18L10-Q14 HydrophobicContact CG-CG 4.48Å; L10-Q14 WeakPolarHBondContact O-CB 3.45Å; L10-Q14 WeakPolarHBondContact O-CG 3.15Å; L10-Q14 PolarHBondContact O-N 2.88Å; S11-Q14 WeakPolarHBondContact O-CB 3.36Å; S11-Q14 PolarHBondContact O-N 3.06Å; S11-Q14 VanDerWaalsContact O-N 3.15Å; Q14-S17 PolarHBondContact O-N 3.48Å; Q14-F18 VanDerWaalsContact O-CB 3.29Å; Q14-F18 WeakPolarHBondContact O-CB 2.9Å; Q14-F18 PolarHBondContact O-N 2.9Å
15S83.4Confident75Confident1 Ų171.6 Ų71.61%0.00737%0.366CS..Hα-helixtrans-62.4-43.2175.2-58.10000111.6S11 S17 F18 I19 E55S11-S15 PolarHBondContact O-N 3.34Å; S11-S15 PolarHBondContact O-OG 3.41Å; S15-S17 PolarHBondContact O-N 3.18Å; S15-F18 PolarHBondContact O-N 2.95Å; S15-F18 VanDerWaalsContact O-N 3.17Å; S15-I19 WeakPolarHBondContact O-CD1 3.48Å; S15-I19 WeakPolarHBondContact O-CG1 3.36Å; S15-I19 PolarHBondContact O-N 2.93Å; S15-E55 WeakPolarHBondContact CB-OE1 3.45Å; S15-E55 PolarHBondContact OG-OE1 3.28Å
16A81.8Confident76.9Confident2 Ų273 Ų732%0.01737%0.374CS..Hα-helixtrans-57.4-47.1175.400000112.6A12 R13 F18 L20 S313 C316 V317A12-A16 WeakPolarHBondContact O-CB 3.47Å; A12-A16 PolarHBondContact O-N 3.41Å; R13-A16 PolarHBondContact O-N 3.13Å; A16-F18 VanDerWaalsContact C-N 3.35Å; A16-L20 PolarHBondContact O-N 2.82Å; A16-S313 WeakPolarHBondContact CA-OG 3.29Å; A16-S313 PolarHBondContact O-OG 3.08Å; A16-C316 HydrophobicContact CB-CB 3.74Å; A16-V317 HydrophobicContact CB-CG2 3.7Å
17S82.8Confident78.8Confident60 Ų6067.5 Ų67.542%0.4234%0.339SS..Hα-helixtrans-65.5-38.4176.4-179.10000112R13 Q14 S15 V21R13-S17 WeakPolarHBondContact O-CB 3.4Å; R13-S17 PolarHBondContact O-N 3.2Å; Q14-S17 PolarHBondContact O-N 3.48Å; S15-S17 PolarHBondContact O-N 3.18Å; S17-V21 VanDerWaalsContact O-CG2 3.27Å; S17-V21 WeakPolarHBondContact O-CG2 3.38Å; S17-V21 PolarHBondContact O-N 3.43Å
18F80.6Confident80.5Confident36 Ų3663.4 Ų63.416%0.15832%0.321CS..Hα-helixtrans-63.9-45.9179.6-172.4-80000111.7Q14 S15 A16 L20 V21 K22 R23 K24 E55 R56Q14-F18 VanDerWaalsContact O-CB 3.29Å; Q14-F18 WeakPolarHBondContact O-CB 2.9Å; Q14-F18 PolarHBondContact O-N 2.9Å; S15-F18 PolarHBondContact O-N 2.95Å; S15-F18 VanDerWaalsContact O-N 3.17Å; A16-F18 VanDerWaalsContact C-N 3.35Å; F18-L20 VanDerWaalsContact C-N 3.34Å; F18-L20 PolarHBondContact O-N 3.42Å; F18-V21 PolarHBondContact O-N 2.97Å; F18-K22 PolarHBondContact O-N 2.74Å; F18-R23 HydrophobicContact CD2-CB 4.36Å; F18-R23 HydrophobicContact CE2-CB 3.82Å; F18-R23 HydrophobicContact CZ-CB 3.93Å; F18-K24 HydrophobicContact CZ-CB 4.04Å; F18-K24 HydrophobicContact CZ-CD 4.23Å; F18-K24 HydrophobicContact CZ-CG 4.02Å; F18-E55 HydrophobicContact CD1-CB 3.74Å; F18-E55 HydrophobicContact CD1-CG 4.31Å; F18-E55 HydrophobicContact CE1-CB 4.14Å; F18-E55 HydrophobicContact CG-CB 4.47Å; F18-R56 HydrophobicContact CE1-CG 3.62Å; F18-R56 HydrophobicContact CZ-CG 4.33Å
19I80.9Confident82Confident2 Ų264.7 Ų64.71%0.0133%0.325CS..Hα-helixtrans-55.1-49.2179.4-69.7162000110.3S15 V21 K22 L54 E55 D309 I312S15-I19 WeakPolarHBondContact O-CD1 3.48Å; S15-I19 WeakPolarHBondContact O-CG1 3.36Å; S15-I19 PolarHBondContact O-N 2.93Å; I19-V21 PolarHBondContact O-N 3.31Å; I19-K22 PolarHBondContact O-N 3.31Å; I19-L54 HydrophobicContact CD1-CD1 4.48Å; I19-E55 WeakPolarHBondContact CG1-O 3.46Å; I19-D309 HydrophobicContact CG2-CB 3.49Å; I19-D309 VanDerWaalsContact CG2-CB 3.49Å; I19-D309 VanDerWaalsContact CG2-O 3.22Å; I19-D309 WeakPolarHBondContact CG2-O 2.95Å; I19-I312 HydrophobicContact CD1-CG2 3.82Å
20L80.6Confident83.2Confident99 Ų9969.8 Ų69.852%0.51836%0.356SS..Hα-helixtrans-69.7-33.9-177-68.1175.7000113.8A16 F18 K22 E310 S313A16-L20 PolarHBondContact O-N 2.82Å; F18-L20 VanDerWaalsContact C-N 3.34Å; F18-L20 PolarHBondContact O-N 3.42Å; L20-K22 PolarHBondContact O-N 3.42Å; L20-E310 HydrophobicContact CD2-CG 4.21Å; L20-S313 WeakPolarHBondContact CD1-OG 3.46Å; L20-S313 WeakPolarHBondContact CG-OG 3.29Å
21V76.1Confident84.3Confident80 Ų8067.3 Ų67.349%0.48534%0.341SS..Hα-helixtrans-79.9-4.2-178.6-175.40000111.3S17 F18 I19 R23S17-V21 VanDerWaalsContact O-CG2 3.27Å; S17-V21 WeakPolarHBondContact O-CG2 3.38Å; S17-V21 PolarHBondContact O-N 3.43Å; F18-V21 PolarHBondContact O-N 2.97Å; I19-V21 PolarHBondContact O-N 3.31Å; V21-R23 HydrophobicContact CB-CG 3.82Å; V21-R23 HydrophobicContact CG1-CG 3.5Å; V21-R23 VanDerWaalsContact CG1-CG 3.5Å; V21-R23 PolarHBondContact O-N 3.22Å
22K66.9Low85.2Confident132 Ų13264.8 Ų64.857%0.57432%0.324SS*.THydrogen-bonded Turntrans40.845.4-179.2-66.8-170.2177.8-178.80112.5F18 I19 L20 K24 D307F18-K22 PolarHBondContact O-N 2.74Å; I19-K22 PolarHBondContact O-N 3.31Å; L20-K22 PolarHBondContact O-N 3.42Å; K22-K24 PolarHBondContact O-N 3.39Å; K22-D307 IonicContact NZ-OD2 2.62Å
23R65.9Low86.1Confident161 Ų16168.2 Ų68.261%0.60834%0.342SS*.  trans-65.4-23.4-169-69.5-177.7-179.7-177.21.8113.6F18 V21F18-R23 HydrophobicContact CD2-CB 4.36Å; F18-R23 HydrophobicContact CE2-CB 3.82Å; F18-R23 HydrophobicContact CZ-CB 3.93Å; V21-R23 HydrophobicContact CB-CG 3.82Å; V21-R23 HydrophobicContact CG1-CG 3.5Å; V21-R23 VanDerWaalsContact CG1-CG 3.5Å; V21-R23 PolarHBondContact O-N 3.22Å
24K79.6Confident86.8Confident120 Ų12066.7 Ų66.752%0.52235%0.347SS..SBendtrans-139.4147.8178.6-69.3-172.7178.1-177.70110.6F18 K22F18-K24 HydrophobicContact CZ-CB 4.04Å; F18-K24 HydrophobicContact CZ-CD 4.23Å; F18-K24 HydrophobicContact CZ-CG 4.02Å; K22-K24 PolarHBondContact O-N 3.39Å
25P90.7Very high87.6Confident93 Ų9361.4 Ų61.460%0.60432%0.322SS*.  trans-64.6165.2175.429.4-36000111.6R56P25-R56 VanDerWaalsContact O-CZ 3.24Å; P25-R56 PolarHBondContact O-NE 3.41Å; P25-R56 PolarHBondContact O-NH2 2.91Å
26P94.9Very high88.2Confident58 Ų5862.6 Ų62.638%0.37733%0.327SS..  trans-52155.8170.1-2534.5000112.3D28 R56 H59P26-D28 PolarHBondContact O-N 3.45Å; P26-D28 VanDerWaalsContact O-N 3.09Å; P26-R56 WeakPolarHBondContact CA-O 3.46Å; P26-H59 HydrophobicContact CB-CB 4.47Å
27I97.4Very high88.9Confident0 Ų065.7 Ų65.70%034%0.344CS..BIsolated β-bridgetrans-65.3113.5179.1-56.5171.9000108.5E31 W32 F35 N52 I53 G57 L58 H59I27-E31 HydrophobicContact CG2-CB 4.19Å; I27-E31 HydrophobicContact CG2-CG 4.16Å; I27-W32 HydrophobicContact CG2-CB 4.23Å; I27-W32 HydrophobicContact CG2-CE3 4.44Å; I27-F35 HydrophobicContact CD1-CE2 4.38Å; I27-F35 HydrophobicContact CG2-CE2 4.08Å; I27-F35 HydrophobicContact CG2-CZ 4.32Å; I27-N52 HydrophobicContact CD1-CB 3.73Å; I27-I53 HydrophobicContact CD1-CG1 3.77Å; I27-G57 PolarHBondContact N-O 2.83Å; I27-L58 HydrophobicContact CB-CD2 4.09Å; I27-L58 HydrophobicContact CD1-CD2 4.17Å; I27-H59 WeakPolarHBondContact O-CB 3.27Å; I27-H59 PolarHBondContact O-N 3.06Å
28D97.2Very high89.6Confident66 Ų6672.1 Ų72.135%0.35337%0.367SS..  trans-87.8177178.275.520.4000112.1P26 T30 E31 W32 H59P26-D28 PolarHBondContact O-N 3.45Å; P26-D28 VanDerWaalsContact O-N 3.09Å; D28-T30 VanDerWaalsContact C-N 3.32Å; D28-T30 PolarHBondContact O-N 2.86Å; D28-T30 WeakPolarHBondContact OD1-CB 3.4Å; D28-T30 PolarHBondContact OD1-N 2.84Å; D28-E31 PolarHBondContact O-N 3.17Å; D28-E31 PolarHBondContact OD1-N 3.42Å; D28-W32 VanDerWaalsContact O-CB 3.32Å; D28-W32 WeakPolarHBondContact O-CB 3.35Å; D28-W32 PolarHBondContact O-N 3.14Å; D28-H59 HydrophobicContact CB-CB 4.43Å
29K96.9Very high90.3Very high76 Ų7675.4 Ų75.433%0.3339%0.386SS..Hα-helixtrans-63.9-38.2-175.9-176.555.2174.7159.10112.3W32 D33 V62 E65K29-W32 PolarHBondContact O-N 3.17Å; K29-D33 VanDerWaalsContact CE-OD1 3.26Å; K29-D33 WeakPolarHBondContact CE-OD1 3.17Å; K29-D33 WeakPolarHBondContact CE-OD2 3.38Å; K29-D33 IonicContact NZ-OD1 2.66Å; K29-D33 PolarHBondContact NZ-OD1 3.4Å; K29-D33 IonicContact NZ-OD2 3.37Å; K29-D33 PolarHBondContact NZ-OD2 2.93Å; K29-D33 WeakPolarHBondContact O-CB 3.38Å; K29-D33 PolarHBondContact O-N 3.19Å; K29-V62 VanDerWaalsContact CA-CG2 3.44Å; K29-V62 HydrophobicContact CB-CG2 3.99Å; K29-V62 HydrophobicContact CD-CG2 4.37Å; K29-V62 VanDerWaalsContact N-CG2 3.28Å; K29-E65 IonicContact NZ-OE1 3.25Å; K29-E65 IonicContact NZ-OE2 2.66Å; K29-E65 PolarHBondContact NZ-OE2 2.69Å
30T97.1Very high91Very high110 Ų11075.6 Ų75.668%0.67539%0.388SS*.Hα-helixtrans-64.4-46.1179.5-47.90000110.8D28 S34D28-T30 VanDerWaalsContact C-N 3.32Å; D28-T30 PolarHBondContact O-N 2.86Å; D28-T30 WeakPolarHBondContact OD1-CB 3.4Å; D28-T30 PolarHBondContact OD1-N 2.84Å; T30-S34 PolarHBondContact O-N 3.34Å
31E97.3Very high91.7Very high48 Ų4874.2 Ų74.222%0.22438%0.379CS..Hα-helixtrans-67.8-42.8177.8-176.2172.7-176.500111.6I27 D28 D33 S34 F35 R56I27-E31 HydrophobicContact CG2-CB 4.19Å; I27-E31 HydrophobicContact CG2-CG 4.16Å; D28-E31 PolarHBondContact O-N 3.17Å; D28-E31 PolarHBondContact OD1-N 3.42Å; E31-D33 PolarHBondContact O-N 2.93Å; E31-S34 WeakPolarHBondContact O-CB 3.44Å; E31-S34 PolarHBondContact O-N 2.94Å; E31-S34 VanDerWaalsContact O-N 3.17Å; E31-S34 PolarHBondContact O-OG 2.94Å; E31-F35 HydrophobicContact CG-CE1 3.89Å; E31-F35 HydrophobicContact CG-CZ 3.82Å; E31-F35 WeakPolarHBondContact O-CD1 3.44Å; E31-R56 IonicContact OE1-CZ 3.86Å; E31-R56 IonicContact OE1-NH1 3.9Å; E31-R56 PolarHBondContact OE1-NH1 2.75Å; E31-R56 IonicContact OE1-NH2 2.64Å; E31-R56 IonicContact OE2-CZ 3.15Å; E31-R56 VanDerWaalsContact OE2-CZ 3.25Å; E31-R56 IonicContact OE2-NH1 2.75Å; E31-R56 PolarHBondContact OE2-NH1 2.94Å; E31-R56 IonicContact OE2-NH2 2.75Å; E31-R56 PolarHBondContact OE2-NH2 3.4Å
32W97.8Very high92.6Very high0 Ų072.4 Ų72.40%037%0.367CS..Hα-helixtrans-58-46.8176.5-179.6-97.9000112.2I27 D28 K29 S34 F35 F36 I49 I53 V62 E65 A66 F69I27-W32 HydrophobicContact CG2-CB 4.23Å; I27-W32 HydrophobicContact CG2-CE3 4.44Å; D28-W32 VanDerWaalsContact O-CB 3.32Å; D28-W32 WeakPolarHBondContact O-CB 3.35Å; D28-W32 PolarHBondContact O-N 3.14Å; K29-W32 PolarHBondContact O-N 3.17Å; W32-S34 PolarHBondContact O-N 3.17Å; W32-F35 HydrophobicContact CD2-CD2 4.49Å; W32-F35 AromaticContact CE3-CD2 3.91Å; W32-F35 HydrophobicContact CE3-CD2 3.91Å; W32-F35 HydrophobicContact CE3-CE2 4.08Å; W32-F35 HydrophobicContact CZ3-CD2 4.31Å; W32-F35 VanDerWaalsContact O-CB 3.29Å; W32-F35 WeakPolarHBondContact O-CB 3.29Å; W32-F35 PolarHBondContact O-N 2.62Å; W32-F36 AromaticContact CD1-CE2 3.95Å; W32-F36 HydrophobicContact CD2-CE2 4.32Å; W32-F36 AromaticContact CE2-CE2 3.7Å; W32-F36 HydrophobicContact CG-CE2 4.46Å; W32-F36 HydrophobicContact CZ2-CE2 4.05Å; W32-F36 AromaticContact CZ2-CZ 3.88Å; W32-F36 HydrophobicContact CZ2-CZ 3.88Å; W32-F36 AromaticContact NE1-CE2 3.48Å; W32-F36 WeakPolarHBondContact O-CD2 3.43Å; W32-F36 WeakPolarHBondContact O-CE2 3.47Å; W32-I49 HydrophobicContact CH2-CG2 4.36Å; W32-I49 HydrophobicContact CZ3-CG2 3.82Å; W32-I53 HydrophobicContact CZ3-CD1 4.34Å; W32-V62 HydrophobicContact CB-CG1 3.67Å; W32-V62 HydrophobicContact CB-CG2 4.19Å; W32-V62 HydrophobicContact CD2-CG1 3.54Å; W32-V62 HydrophobicContact CE3-CG1 3.9Å; W32-V62 HydrophobicContact CG-CG1 3.41Å; W32-V62 VanDerWaalsContact CG-CG1 3.41Å; W32-E65 VanDerWaalsContact NE1-CD 3.26Å; W32-E65 PolarHBondContact NE1-OE1 3.14Å; W32-A66 HydrophobicContact CD2-CB 4.44Å; W32-A66 HydrophobicContact CE3-CB 4.19Å; W32-A66 HydrophobicContact CH2-CB 3.43Å; W32-A66 VanDerWaalsContact CH2-CB 3.43Å; W32-A66 HydrophobicContact CZ2-CB 3.72Å; W32-A66 HydrophobicContact CZ3-CB 3.69Å; W32-F69 HydrophobicContact CH2-CD2 4.43Å; W32-F69 AromaticContact CZ2-CD2 3.79Å; W32-F69 HydrophobicContact CZ2-CD2 3.79Å; W32-F69 HydrophobicContact CZ2-CE2 4.12Å
33D97.2Very high94Very high72 Ų7269.2 Ų69.239%0.38537%0.365SS..Hα-helixtrans-64-31.7179.4-68.5-15.9000111.5K29 E31 F35 F36K29-D33 VanDerWaalsContact CE-OD1 3.26Å; K29-D33 WeakPolarHBondContact CE-OD1 3.17Å; K29-D33 WeakPolarHBondContact CE-OD2 3.38Å; K29-D33 IonicContact NZ-OD1 2.66Å; K29-D33 PolarHBondContact NZ-OD1 3.4Å; K29-D33 IonicContact NZ-OD2 3.37Å; K29-D33 PolarHBondContact NZ-OD2 2.93Å; K29-D33 WeakPolarHBondContact O-CB 3.38Å; K29-D33 PolarHBondContact O-N 3.19Å; E31-D33 PolarHBondContact O-N 2.93Å; D33-F35 PolarHBondContact O-N 2.97Å; D33-F35 VanDerWaalsContact O-N 3.16Å; D33-F36 PolarHBondContact O-N 3.28Å; D33-F36 VanDerWaalsContact O-N 3.13Å
34S96.9Very high95.3Very high69 Ų6966.2 Ų66.248%0.48336%0.357SS..THydrogen-bonded Turntrans-66.6-12.117585.30000114.4T30 E31 W32T30-S34 PolarHBondContact O-N 3.34Å; E31-S34 WeakPolarHBondContact O-CB 3.44Å; E31-S34 PolarHBondContact O-N 2.94Å; E31-S34 VanDerWaalsContact O-N 3.17Å; E31-S34 PolarHBondContact O-OG 2.94Å; W32-S34 PolarHBondContact O-N 3.17Å
35F97.4Very high96.1Very high4 Ų464 Ų642%0.01836%0.356CS..THydrogen-bonded Turntrans-78.4-10.5174.7-60.3-19.6000113.1I27 E31 W32 D33 A43 K44 F48 I49I27-F35 HydrophobicContact CD1-CE2 4.38Å; I27-F35 HydrophobicContact CG2-CE2 4.08Å; I27-F35 HydrophobicContact CG2-CZ 4.32Å; E31-F35 HydrophobicContact CG-CE1 3.89Å; E31-F35 HydrophobicContact CG-CZ 3.82Å; E31-F35 WeakPolarHBondContact O-CD1 3.44Å; W32-F35 HydrophobicContact CD2-CD2 4.49Å; W32-F35 AromaticContact CE3-CD2 3.91Å; W32-F35 HydrophobicContact CE3-CD2 3.91Å; W32-F35 HydrophobicContact CE3-CE2 4.08Å; W32-F35 HydrophobicContact CZ3-CD2 4.31Å; W32-F35 VanDerWaalsContact O-CB 3.29Å; W32-F35 WeakPolarHBondContact O-CB 3.29Å; W32-F35 PolarHBondContact O-N 2.62Å; D33-F35 PolarHBondContact O-N 2.97Å; D33-F35 VanDerWaalsContact O-N 3.16Å; F35-A43 PolarHBondContact O-N 2.92Å; F35-K44 HydrophobicContact CB-CG 4.39Å; F35-K44 HydrophobicContact CD1-CB 4.49Å; F35-K44 HydrophobicContact CD1-CG 3.85Å; F35-K44 HydrophobicContact CG-CG 4.41Å; F35-K44 PolarHBondContact O-N 3.28Å; F35-F48 AromaticContact CE1-CE1 3.92Å; F35-F48 HydrophobicContact CE1-CE1 3.92Å; F35-F48 HydrophobicContact CZ-CE1 4.32Å; F35-I49 HydrophobicContact CB-CD1 4Å; F35-I49 HydrophobicContact CB-CG1 4.47Å; F35-I49 HydrophobicContact CD2-CD1 3.97Å; F35-I49 HydrophobicContact CD2-CG1 3.76Å; F35-I49 HydrophobicContact CD2-CG2 4.16Å; F35-I49 HydrophobicContact CE2-CG1 4.13Å; F35-I49 HydrophobicContact CE2-CG2 4.17Å; F35-I49 HydrophobicContact CG-CD1 4.17Å; F35-I49 HydrophobicContact CG-CG1 4.11Å
36F97.4Very high96.3Very high26 Ų2664.9 Ų64.911%0.11435%0.348CS..BIsolated β-bridgetrans-111151.6-178.3-57.5-89.1000111.9W32 D33 G40 H41 L42 F69W32-F36 AromaticContact CD1-CE2 3.95Å; W32-F36 HydrophobicContact CD2-CE2 4.32Å; W32-F36 AromaticContact CE2-CE2 3.7Å; W32-F36 HydrophobicContact CG-CE2 4.46Å; W32-F36 HydrophobicContact CZ2-CE2 4.05Å; W32-F36 AromaticContact CZ2-CZ 3.88Å; W32-F36 HydrophobicContact CZ2-CZ 3.88Å; W32-F36 AromaticContact NE1-CE2 3.48Å; W32-F36 WeakPolarHBondContact O-CD2 3.43Å; W32-F36 WeakPolarHBondContact O-CE2 3.47Å; D33-F36 PolarHBondContact O-N 3.28Å; D33-F36 VanDerWaalsContact O-N 3.13Å; F36-G40 WeakPolarHBondContact CD1-O 3.39Å; F36-H41 CarbonylContact C-O 3.45Å; F36-H41 WeakPolarHBondContact CA-O 3.48Å; F36-L42 HydrophobicContact CD1-CD2 3.91Å; F36-L42 HydrophobicContact CE1-CD2 3.54Å; F36-L42 HydrophobicContact CE1-CG 4.35Å; F36-L42 HydrophobicContact CZ-CD2 3.96Å; F36-F69 HydrophobicContact CE1-CE1 4.13Å; F36-F69 HydrophobicContact CE1-CE2 4.14Å; F36-F69 AromaticContact CE1-CZ 3.59Å; F36-F69 HydrophobicContact CE1-CZ 3.59Å; F36-F69 HydrophobicContact CZ-CE1 4.48Å; F36-F69 AromaticContact CZ-CE2 3.79Å; F36-F69 HydrophobicContact CZ-CE2 3.79Å; F36-F69 AromaticContact CZ-CZ 3.74Å; F36-F69 HydrophobicContact CZ-CZ 3.74Å
37D96.5Very high96.2Very high68 Ų6866.3 Ų66.336%0.36435%0.352SS..  trans-82.9179.7169.174.39.4000111.8N39 G40 H41D37-N39 PolarHBondContact O-N 3.4Å; D37-N39 VanDerWaalsContact O-N 3.16Å; D37-N39 WeakPolarHBondContact OD1-CA 3.49Å; D37-N39 WeakPolarHBondContact OD1-CB 3.37Å; D37-N39 PolarHBondContact OD1-N 2.99Å; D37-G40 PolarHBondContact O-N 3.43Å; D37-G40 PolarHBondContact OD1-N 3.1Å; D37-H41 PolarHBondContact N-O 3.49Å; D37-H41 PolarHBondContact OD1-N 3.01Å; D37-H41 IonicContact OD1-ND1 2.86Å; D37-H41 IonicContact OD2-ND1 3.81Å
38E95.9Very high96.1Very high194 Ų19470.6 Ų70.691%0.90737%0.371SS*.THydrogen-bonded Turntrans-61-23.2-179.6-61.6-180175.200113.8
39N95.6Very high96.1Very high106 Ų10667.5 Ų67.557%0.56735%0.354SS*.THydrogen-bonded Turntrans-92.5-1.7177-59.6-57.3000112.2D37 Q80D37-N39 PolarHBondContact O-N 3.4Å; D37-N39 VanDerWaalsContact O-N 3.16Å; D37-N39 WeakPolarHBondContact OD1-CA 3.49Å; D37-N39 WeakPolarHBondContact OD1-CB 3.37Å; D37-N39 PolarHBondContact OD1-N 2.99Å; N39-Q80 PolarHBondContact O-N 3.38Å
40G95.4Very high96Very high5 Ų564 Ų645%0.05234%0.339CS..SBendtrans78.416.5-176.900000114.7F36 D37 R83F36-G40 WeakPolarHBondContact CD1-O 3.39Å; D37-G40 PolarHBondContact O-N 3.43Å; D37-G40 PolarHBondContact OD1-N 3.1Å; G40-R83 VanDerWaalsContact O-CZ 3.29Å; G40-R83 PolarHBondContact O-NH1 2.95Å; G40-R83 PolarHBondContact O-NH2 2.87Å
41H96.6Very high95.9Very high70 Ų7060.1 Ų60.132%0.32432%0.315SS..  trans-81.2158168.2-60.6103.7000110.7F36 D37 A43 S79F36-H41 CarbonylContact C-O 3.45Å; F36-H41 WeakPolarHBondContact CA-O 3.48Å; D37-H41 PolarHBondContact N-O 3.49Å; D37-H41 PolarHBondContact OD1-N 3.01Å; D37-H41 IonicContact OD1-ND1 2.86Å; D37-H41 IonicContact OD2-ND1 3.81Å; H41-A43 PolarHBondContact O-N 3.27Å; H41-S79 WeakPolarHBondContact NE2-CB 3.47Å
42L95.1Very high95.8Very high42 Ų4258.6 Ų58.622%0.2231%0.309CS..BIsolated β-bridgetrans-66.7117.7176-80.3-171000112.4F36 K44 I49 W76F36-L42 HydrophobicContact CD1-CD2 3.91Å; F36-L42 HydrophobicContact CE1-CD2 3.54Å; F36-L42 HydrophobicContact CE1-CG 4.35Å; F36-L42 HydrophobicContact CZ-CD2 3.96Å; L42-K44 WeakPolarHBondContact CB-O 3.13Å; L42-I49 HydrophobicContact CD1-CD1 4.13Å; L42-I49 HydrophobicContact CD2-CD1 3.45Å; L42-I49 VanDerWaalsContact CD2-CD1 3.45Å; L42-I49 HydrophobicContact CG-CD1 4.42Å; L42-W76 HydrophobicContact CD1-CB 4.24Å; L42-W76 HydrophobicContact CD1-CD2 4.45Å; L42-W76 HydrophobicContact CD1-CE3 3.62Å; L42-W76 HydrophobicContact CD1-CZ3 4.34Å; L42-W76 HydrophobicContact CG-CE3 4.41Å
43A95.6Very high95.8Very high66 Ų6658.6 Ų58.655%0.54531%0.309SS..SBendtrans-83.3-22.6168.100000112.4F35 H41F35-A43 PolarHBondContact O-N 2.92Å; H41-A43 PolarHBondContact O-N 3.27Å
44K93.8Very high95.7Very high98 Ų9855.3 Ų55.343%0.42629%0.291SS..SBendtrans-107.2149.6174.6-57.8-60.2-178.6-174.90110.8F35 L42 F48 I49F35-K44 HydrophobicContact CB-CG 4.39Å; F35-K44 HydrophobicContact CD1-CB 4.49Å; F35-K44 HydrophobicContact CD1-CG 3.85Å; F35-K44 HydrophobicContact CG-CG 4.41Å; F35-K44 PolarHBondContact O-N 3.28Å; L42-K44 WeakPolarHBondContact CB-O 3.13Å; K44-F48 HydrophobicContact CB-CD1 3.84Å; K44-F48 HydrophobicContact CB-CE1 4.41Å; K44-F48 HydrophobicContact CD-CE1 4.46Å; K44-F48 HydrophobicContact CG-CD1 4.15Å; K44-F48 HydrophobicContact CG-CE1 4.22Å; K44-I49 HydrophobicContact CB-CD1 4.37Å; K44-I49 HydrophobicContact CB-CG1 4.25Å
45S95.1Very high95.6Very high74 Ų7453.7 Ų53.752%0.51728%0.276SS..  trans-64.6146.5177.573.70000110.9D47 F48 I49S45-D47 PolarHBondContact O-N 3.21Å; S45-F48 WeakPolarHBondContact O-CB 3.43Å; S45-F48 PolarHBondContact O-N 3.05Å; S45-F48 VanDerWaalsContact O-N 3.14Å; S45-F48 WeakPolarHBondContact OG-CB 3.37Å; S45-F48 PolarHBondContact OG-N 3.38Å; S45-F48 VanDerWaalsContact OG-N 3.14Å; S45-I49 PolarHBondContact O-N 3.36Å
46R94.6Very high95.5Very high111 Ų11154.3 Ų54.342%0.41928%0.278SS..Hα-helixtrans-52.8-39172.4176.4-178.7168.9-160.6-8.4111.5I49 C50 W76R46-I49 PolarHBondContact O-N 3.16Å; R46-C50 WeakPolarHBondContact O-CB 3.46Å; R46-C50 PolarHBondContact O-N 3.18Å; R46-C50 PolarHBondContact O-SG 3.05Å; R46-W76 HydrophobicContact CG-CD2 4.03Å; R46-W76 HydrophobicContact CG-CE3 4.43Å; R46-W76 HydrophobicContact CG-CG 4.35Å; R46-W76 HydrophobicContact CG-CZ2 4.32Å
47D93.9Very high95.4Very high88 Ų8853.1 Ų53.147%0.47127%0.273SS..Hα-helixtrans-59.9-48179.7-16473.7000112S45 I49 C50 V51 K265S45-D47 PolarHBondContact O-N 3.21Å; D47-I49 VanDerWaalsContact C-N 3.33Å; D47-I49 PolarHBondContact O-N 2.92Å; D47-C50 PolarHBondContact O-N 2.86Å; D47-V51 WeakPolarHBondContact O-CG2 3.27Å; D47-V51 PolarHBondContact O-N 3.17Å; D47-K265 WeakPolarHBondContact OD1-CE 3.32Å; D47-K265 IonicContact OD1-NZ 3.78Å; D47-K265 PolarHBondContact OD1-NZ 3.02Å; D47-K265 IonicContact OD2-NZ 2.66Å
48F94.7Very high95.5Very high90 Ų9050.1 Ų50.140%0.39526%0.257SS..Hα-helixtrans-57.5-45.9176.1173.6-91.3000111.7F35 K44 S45 V51 N52F35-F48 AromaticContact CE1-CE1 3.92Å; F35-F48 HydrophobicContact CE1-CE1 3.92Å; F35-F48 HydrophobicContact CZ-CE1 4.32Å; K44-F48 HydrophobicContact CB-CD1 3.84Å; K44-F48 HydrophobicContact CB-CE1 4.41Å; K44-F48 HydrophobicContact CD-CE1 4.46Å; K44-F48 HydrophobicContact CG-CD1 4.15Å; K44-F48 HydrophobicContact CG-CE1 4.22Å; S45-F48 WeakPolarHBondContact O-CB 3.43Å; S45-F48 PolarHBondContact O-N 3.05Å; S45-F48 VanDerWaalsContact O-N 3.14Å; S45-F48 WeakPolarHBondContact OG-CB 3.37Å; S45-F48 PolarHBondContact OG-N 3.38Å; S45-F48 VanDerWaalsContact OG-N 3.14Å; F48-V51 PolarHBondContact O-N 3.4Å; F48-N52 WeakPolarHBondContact CZ-ND2 3.18Å; F48-N52 PolarHBondContact O-N 3.04Å; F48-N52 PolarHBondContact O-ND2 3.13Å
49I96.4Very high95.5Very high0 Ų044 Ų440%023%0.228CC..Hα-helixtrans-64.4-47.4179.6-61.9171000110.3W32 F35 L42 K44 S45 R46 D47 V51 N52 I53 W76W32-I49 HydrophobicContact CH2-CG2 4.36Å; W32-I49 HydrophobicContact CZ3-CG2 3.82Å; F35-I49 HydrophobicContact CB-CD1 4Å; F35-I49 HydrophobicContact CB-CG1 4.47Å; F35-I49 HydrophobicContact CD2-CD1 3.97Å; F35-I49 HydrophobicContact CD2-CG1 3.76Å; F35-I49 HydrophobicContact CD2-CG2 4.16Å; F35-I49 HydrophobicContact CE2-CG1 4.13Å; F35-I49 HydrophobicContact CE2-CG2 4.17Å; F35-I49 HydrophobicContact CG-CD1 4.17Å; F35-I49 HydrophobicContact CG-CG1 4.11Å; L42-I49 HydrophobicContact CD1-CD1 4.13Å; L42-I49 HydrophobicContact CD2-CD1 3.45Å; L42-I49 VanDerWaalsContact CD2-CD1 3.45Å; L42-I49 HydrophobicContact CG-CD1 4.42Å; K44-I49 HydrophobicContact CB-CD1 4.37Å; K44-I49 HydrophobicContact CB-CG1 4.25Å; S45-I49 PolarHBondContact O-N 3.36Å; R46-I49 PolarHBondContact O-N 3.16Å; D47-I49 VanDerWaalsContact C-N 3.33Å; D47-I49 PolarHBondContact O-N 2.92Å; I49-V51 VanDerWaalsContact C-N 3.33Å; I49-V51 PolarHBondContact O-N 3.18Å; I49-N52 PolarHBondContact O-N 3.31Å; I49-I53 HydrophobicContact CG2-CD1 3.87Å; I49-I53 HydrophobicContact CG2-CG1 4.46Å; I49-I53 WeakPolarHBondContact O-CG1 3.27Å; I49-I53 PolarHBondContact O-N 2.62Å; I49-W76 HydrophobicContact CD1-CZ3 4.34Å; I49-W76 HydrophobicContact CG2-CH2 4.4Å; I49-W76 HydrophobicContact CG2-CZ3 4.41Å
50C96.6Very high95.5Very high3 Ų342.1 Ų42.12%0.0222%0.222CC..Hα-helixtrans-61.8-37.9179.3-73.90000112.9R46 D47 I53 L54 T263 K265R46-C50 WeakPolarHBondContact O-CB 3.46Å; R46-C50 PolarHBondContact O-N 3.18Å; R46-C50 PolarHBondContact O-SG 3.05Å; D47-C50 PolarHBondContact O-N 2.86Å; C50-I53 PolarHBondContact O-N 3.45Å; C50-L54 PolarHBondContact O-N 2.7Å; C50-T263 HydrophobicContact CB-CG2 4.06Å; C50-K265 HydrophobicContact CB-CG 3.93Å
51V94.8Very high95.4Very high28 Ų2850.1 Ų50.117%0.1726%0.256CS..Hα-helixtrans-66.1-43.2174.3171.20000111D47 F48 I49 I53 L54 E55D47-V51 WeakPolarHBondContact O-CG2 3.27Å; D47-V51 PolarHBondContact O-N 3.17Å; F48-V51 PolarHBondContact O-N 3.4Å; I49-V51 VanDerWaalsContact C-N 3.33Å; I49-V51 PolarHBondContact O-N 3.18Å; V51-I53 VanDerWaalsContact C-N 3.3Å; V51-I53 PolarHBondContact O-N 2.66Å; V51-L54 WeakPolarHBondContact O-CB 3.31Å; V51-L54 PolarHBondContact O-N 3.16Å; V51-E55 HydrophobicContact CG1-CG 4.37Å; V51-E55 WeakPolarHBondContact O-CB 3.35Å; V51-E55 WeakPolarHBondContact O-CG 3.39Å; V51-E55 PolarHBondContact O-N 3.03Å
52N95.2Very high95.4Very high17 Ų1746.8 Ų46.89%0.09124%0.24CC..Hα-helixtrans-62.6-37.6175.8-81.9-92.8000112I27 F48 I49 E55 R56I27-N52 HydrophobicContact CD1-CB 3.73Å; F48-N52 WeakPolarHBondContact CZ-ND2 3.18Å; F48-N52 PolarHBondContact O-N 3.04Å; F48-N52 PolarHBondContact O-ND2 3.13Å; I49-N52 PolarHBondContact O-N 3.31Å; N52-E55 PolarHBondContact O-N 3.17Å; N52-R56 WeakPolarHBondContact O-CB 3.34Å; N52-R56 PolarHBondContact O-N 3.47Å
53I97.1Very high95.4Very high0 Ų045.5 Ų45.50%023%0.233CC..Hα-helixtrans-66.3-42.2175-66.7169.8000110.9I27 W32 I49 C50 V51 E55 G57 L58 L70 R256 E259 T263I27-I53 HydrophobicContact CD1-CG1 3.77Å; W32-I53 HydrophobicContact CZ3-CD1 4.34Å; I49-I53 HydrophobicContact CG2-CD1 3.87Å; I49-I53 HydrophobicContact CG2-CG1 4.46Å; I49-I53 WeakPolarHBondContact O-CG1 3.27Å; I49-I53 PolarHBondContact O-N 2.62Å; C50-I53 PolarHBondContact O-N 3.45Å; V51-I53 VanDerWaalsContact C-N 3.3Å; V51-I53 PolarHBondContact O-N 2.66Å; I53-E55 VanDerWaalsContact C-N 3.29Å; I53-E55 PolarHBondContact O-N 3.34Å; I53-G57 WeakPolarHBondContact O-CA 3.16Å; I53-G57 PolarHBondContact O-N 3.16Å; I53-L58 HydrophobicContact CD1-CD2 4.2Å; I53-L58 HydrophobicContact CG1-CD2 3.85Å; I53-L58 HydrophobicContact CG1-CG 4.36Å; I53-L58 HydrophobicContact CG2-CG 4.48Å; I53-L70 HydrophobicContact CD1-CD1 4.28Å; I53-L70 HydrophobicContact CD1-CD2 3.98Å; I53-L70 HydrophobicContact CD1-CG 4.48Å; I53-R256 PolarHBondContact O-NH1 3.03Å; I53-R256 VanDerWaalsContact O-NH1 3.08Å; I53-E259 HydrophobicContact CG2-CB 3.95Å; I53-T263 HydrophobicContact CB-CG2 3.89Å; I53-T263 HydrophobicContact CD1-CG2 4.47Å; I53-T263 HydrophobicContact CG2-CG2 3.66Å
54L95.9Very high95.4Very high3 Ų344.1 Ų44.12%0.01622%0.217CC..Hα-helixtrans-55.4-47.7172.7168.266.1000110.9I19 C50 V51 R256 V260 K265 P266 I312I19-L54 HydrophobicContact CD1-CD1 4.48Å; C50-L54 PolarHBondContact O-N 2.7Å; V51-L54 WeakPolarHBondContact O-CB 3.31Å; V51-L54 PolarHBondContact O-N 3.16Å; L54-R256 PolarHBondContact O-NH1 2.8Å; L54-R256 PolarHBondContact O-NH2 2.85Å; L54-V260 HydrophobicContact CD1-CB 4.46Å; L54-V260 HydrophobicContact CD1-CG1 3.47Å; L54-V260 VanDerWaalsContact CD1-CG1 3.47Å; L54-V260 HydrophobicContact CD1-CG2 4.13Å; L54-K265 HydrophobicContact CB-CB 4.3Å; L54-K265 HydrophobicContact CD2-CB 4.04Å; L54-P266 HydrophobicContact CD2-CB 4.49Å; L54-I312 HydrophobicContact CD1-CG2 3.78Å
55E94.3Very high95.5Very high35 Ų3542 Ų4216%0.16421%0.209CC..Hα-helixtrans-78.6-29-170.8-72.9178.6168.700114.7S15 F18 I19 V51 N52 I53S15-E55 WeakPolarHBondContact CB-OE1 3.45Å; S15-E55 PolarHBondContact OG-OE1 3.28Å; F18-E55 HydrophobicContact CD1-CB 3.74Å; F18-E55 HydrophobicContact CD1-CG 4.31Å; F18-E55 HydrophobicContact CE1-CB 4.14Å; F18-E55 HydrophobicContact CG-CB 4.47Å; I19-E55 WeakPolarHBondContact CG1-O 3.46Å; V51-E55 HydrophobicContact CG1-CG 4.37Å; V51-E55 WeakPolarHBondContact O-CB 3.35Å; V51-E55 WeakPolarHBondContact O-CG 3.39Å; V51-E55 PolarHBondContact O-N 3.03Å; N52-E55 PolarHBondContact O-N 3.17Å; I53-E55 VanDerWaalsContact C-N 3.29Å; I53-E55 PolarHBondContact O-N 3.34Å
56R94.3Very high95.7Very high17 Ų1738.4 Ų38.46%0.06418%0.184CC..Hα-helixtrans-129.5-18.8-166.9-62.9165.861.9-162.6-4.9114.5F18 P25 P26 E31 N52F18-R56 HydrophobicContact CE1-CG 3.62Å; F18-R56 HydrophobicContact CZ-CG 4.33Å; P25-R56 VanDerWaalsContact O-CZ 3.24Å; P25-R56 PolarHBondContact O-NE 3.41Å; P25-R56 PolarHBondContact O-NH2 2.91Å; P26-R56 WeakPolarHBondContact CA-O 3.46Å; E31-R56 IonicContact OE1-CZ 3.86Å; E31-R56 IonicContact OE1-NH1 3.9Å; E31-R56 PolarHBondContact OE1-NH1 2.75Å; E31-R56 IonicContact OE1-NH2 2.64Å; E31-R56 IonicContact OE2-CZ 3.15Å; E31-R56 VanDerWaalsContact OE2-CZ 3.25Å; E31-R56 IonicContact OE2-NH1 2.75Å; E31-R56 PolarHBondContact OE2-NH1 2.94Å; E31-R56 IonicContact OE2-NH2 2.75Å; E31-R56 PolarHBondContact OE2-NH2 3.4Å; N52-R56 WeakPolarHBondContact O-CB 3.34Å; N52-R56 PolarHBondContact O-N 3.47Å
57G95.9Very high95.8Very high1 Ų133.2 Ų33.21%0.0116%0.164CC..  trans65.3-174.8-169.200000113.4I27 I53I27-G57 PolarHBondContact N-O 2.83Å; I53-G57 WeakPolarHBondContact O-CA 3.16Å; I53-G57 PolarHBondContact O-N 3.16Å
58L97.6Very high96Very high5 Ų529.7 Ų29.73%0.02615%0.145CC..BIsolated β-bridgetrans-111.6142.1-179.2-60.7170.9000112.3I27 I53 V62 R63 A66 L70 E259I27-L58 HydrophobicContact CB-CD2 4.09Å; I27-L58 HydrophobicContact CD1-CD2 4.17Å; I53-L58 HydrophobicContact CD1-CD2 4.2Å; I53-L58 HydrophobicContact CG1-CD2 3.85Å; I53-L58 HydrophobicContact CG1-CG 4.36Å; I53-L58 HydrophobicContact CG2-CG 4.48Å; L58-V62 HydrophobicContact CD2-CG1 4.28Å; L58-R63 PolarHBondContact O-NH2 3.23Å; L58-R63 VanDerWaalsContact O-NH2 3.14Å; L58-A66 HydrophobicContact CD1-CB 3.44Å; L58-A66 VanDerWaalsContact CD1-CB 3.44Å; L58-A66 HydrophobicContact CD2-CB 4.13Å; L58-A66 HydrophobicContact CG-CB 4.44Å; L58-L70 HydrophobicContact CD1-CD1 4.4Å; L58-E259 HydrophobicContact CD1-CG 3.91Å; L58-E259 HydrophobicContact CG-CG 4.39Å; L58-E259 PolarHBondContact N-OE2 2.81Å
59H96.9Very high96.2Very high65 Ų6525.5 Ų25.530%0.30113%0.126SC..  trans-66.4143.5167.4-168.5-85.9000110.6P26 I27 D28 F61 V62 R63P26-H59 HydrophobicContact CB-CB 4.47Å; I27-H59 WeakPolarHBondContact O-CB 3.27Å; I27-H59 PolarHBondContact O-N 3.06Å; D28-H59 HydrophobicContact CB-CB 4.43Å; H59-F61 VanDerWaalsContact C-N 3.27Å; H59-F61 AromaticContact CE1-CD2 3.25Å; H59-F61 WeakPolarHBondContact CE1-CD2 3.41Å; H59-F61 AromaticContact CE1-CE2 3.73Å; H59-F61 AromaticContact ND1-CD2 3.5Å; H59-F61 WeakPolarHBondContact ND1-CD2 3.37Å; H59-F61 AromaticContact ND1-CG 3.96Å; H59-F61 PolarHBondContact ND1-N 2.93Å; H59-F61 PolarHBondContact O-N 2.84Å; H59-F61 VanDerWaalsContact O-N 3.11Å; H59-V62 PolarHBondContact O-N 2.93Å; H59-R63 PolarHBondContact O-N 2.96Å
60P94.6Very high96.3Very high67 Ų6725.7 Ų25.744%0.43513%0.127SC..Hα-helixtrans-49.9-40.4-178.5-32.235.9000115.1V62 R63P60-V62 PolarHBondContact O-N 3.37Å; P60-R63 WeakPolarHBondContact O-CB 3.46Å; P60-R63 PolarHBondContact O-N 2.79Å
61F94.1Very high96.3Very high173 Ų17325.8 Ų25.876%0.75913%0.128SC*.Hα-helixtrans-66.1-16.5178.1-65.2-51.6000115.4H59H59-F61 VanDerWaalsContact C-N 3.27Å; H59-F61 AromaticContact CE1-CD2 3.25Å; H59-F61 WeakPolarHBondContact CE1-CD2 3.41Å; H59-F61 AromaticContact CE1-CE2 3.73Å; H59-F61 AromaticContact ND1-CD2 3.5Å; H59-F61 WeakPolarHBondContact ND1-CD2 3.37Å; H59-F61 AromaticContact ND1-CG 3.96Å; H59-F61 PolarHBondContact ND1-N 2.93Å; H59-F61 PolarHBondContact O-N 2.84Å; H59-F61 VanDerWaalsContact O-N 3.11Å
62V96.7Very high96.4Very high0 Ų026.2 Ų26.20%014%0.138CC..Hα-helixtrans-100.6-24.9178.9-179.30000111.6K29 W32 L58 H59 P60 T64 E65 A66K29-V62 VanDerWaalsContact CA-CG2 3.44Å; K29-V62 HydrophobicContact CB-CG2 3.99Å; K29-V62 HydrophobicContact CD-CG2 4.37Å; K29-V62 VanDerWaalsContact N-CG2 3.28Å; W32-V62 HydrophobicContact CB-CG1 3.67Å; W32-V62 HydrophobicContact CB-CG2 4.19Å; W32-V62 HydrophobicContact CD2-CG1 3.54Å; W32-V62 HydrophobicContact CE3-CG1 3.9Å; W32-V62 HydrophobicContact CG-CG1 3.41Å; W32-V62 VanDerWaalsContact CG-CG1 3.41Å; L58-V62 HydrophobicContact CD2-CG1 4.28Å; H59-V62 PolarHBondContact O-N 2.93Å; P60-V62 PolarHBondContact O-N 3.37Å; V62-T64 PolarHBondContact O-N 3.41Å; V62-E65 PolarHBondContact O-N 2.94Å; V62-A66 HydrophobicContact CG1-CB 4.14Å; V62-A66 PolarHBondContact O-N 3.42Å
63R96.2Very high96.5Very high15 Ų1525.6 Ų25.66%0.05713%0.134CC..Hα-helixtrans-50-52.8-168.7-168.6172.7-71.1135.14.1112.6L58 H59 P60 E65 A66 W67 M175 D252 E259L58-R63 PolarHBondContact O-NH2 3.23Å; L58-R63 VanDerWaalsContact O-NH2 3.14Å; H59-R63 PolarHBondContact O-N 2.96Å; P60-R63 WeakPolarHBondContact O-CB 3.46Å; P60-R63 PolarHBondContact O-N 2.79Å; R63-E65 VanDerWaalsContact C-N 3.31Å; R63-E65 PolarHBondContact O-N 3.35Å; R63-A66 PolarHBondContact O-N 2.8Å; R63-W67 HydrophobicContact CG-CG 4.35Å; R63-W67 VanDerWaalsContact CG-NE1 3.34Å; R63-W67 VanDerWaalsContact O-CB 3.27Å; R63-W67 WeakPolarHBondContact O-CB 3.45Å; R63-W67 PolarHBondContact O-N 3.2Å; R63-M175 HydrophobicContact CG-CG 4.4Å; R63-M175 HydrophobicContact CG-SD 3.65Å; R63-D252 IonicContact CZ-OD1 3.03Å; R63-D252 IonicContact NH1-OD1 3.41Å; R63-D252 PolarHBondContact NH1-OD1 3.38Å; R63-D252 IonicContact NH2-OD1 3.44Å; R63-E259 WeakPolarHBondContact CG-OE1 3.11Å; R63-E259 IonicContact CZ-OE1 3.33Å; R63-E259 IonicContact NE-OE1 2.74Å; R63-E259 PolarHBondContact NE-OE1 3.23Å; R63-E259 IonicContact NH2-OE1 3.49Å
64T95.2Very high96.5Very high37 Ų3726 Ų2623%0.22714%0.136CC..Hα-helixtrans-57.2-43-179.5-60.30000112.8V62 K68 M175 V176V62-T64 PolarHBondContact O-N 3.41Å; T64-K68 WeakPolarHBondContact O-CG 3.46Å; T64-K68 PolarHBondContact O-N 2.89Å; T64-M175 PolarHBondContact OG1-O 3.19Å; T64-V176 HydrophobicContact CG2-CB 4.49Å; T64-V176 HydrophobicContact CG2-CG1 3.56Å
65E96.3Very high96.6Very high52 Ų5229 Ų2924%0.24316%0.157CC..Hα-helixtrans-70.8-48.6-179.9-172.6-175.4157.300111.7K29 W32 V62 R63 W67 K68 F69K29-E65 IonicContact NZ-OE1 3.25Å; K29-E65 IonicContact NZ-OE2 2.66Å; K29-E65 PolarHBondContact NZ-OE2 2.69Å; W32-E65 VanDerWaalsContact NE1-CD 3.26Å; W32-E65 PolarHBondContact NE1-OE1 3.14Å; V62-E65 PolarHBondContact O-N 2.94Å; R63-E65 VanDerWaalsContact C-N 3.31Å; R63-E65 PolarHBondContact O-N 3.35Å; E65-W67 VanDerWaalsContact C-N 3.3Å; E65-W67 PolarHBondContact O-N 2.94Å; E65-K68 WeakPolarHBondContact O-CB 3.21Å; E65-K68 PolarHBondContact O-N 3.4Å; E65-K68 VanDerWaalsContact O-N 3.15Å; E65-F69 WeakPolarHBondContact O-CD2 3.39Å
66A97.9Very high96.7Very high0 Ų029 Ų290%016%0.156CC..Hα-helixtrans-62.6-38.1178.900000112.2W32 L58 V62 R63 K68 F69 L70W32-A66 HydrophobicContact CD2-CB 4.44Å; W32-A66 HydrophobicContact CE3-CB 4.19Å; W32-A66 HydrophobicContact CH2-CB 3.43Å; W32-A66 VanDerWaalsContact CH2-CB 3.43Å; W32-A66 HydrophobicContact CZ2-CB 3.72Å; W32-A66 HydrophobicContact CZ3-CB 3.69Å; L58-A66 HydrophobicContact CD1-CB 3.44Å; L58-A66 VanDerWaalsContact CD1-CB 3.44Å; L58-A66 HydrophobicContact CD2-CB 4.13Å; L58-A66 HydrophobicContact CG-CB 4.44Å; V62-A66 HydrophobicContact CG1-CB 4.14Å; V62-A66 PolarHBondContact O-N 3.42Å; R63-A66 PolarHBondContact O-N 2.8Å; A66-K68 PolarHBondContact O-N 3.31Å; A66-F69 WeakPolarHBondContact O-CA 3.41Å; A66-F69 WeakPolarHBondContact O-CB 3.45Å; A66-F69 PolarHBondContact O-N 3.19Å; A66-L70 WeakPolarHBondContact O-CG 3.2Å; A66-L70 PolarHBondContact O-N 3.38Å
67W97.9Very high96.7Very high1 Ų136.2 Ų36.20%0.00419%0.19CC..Hα-helixtrans-62.9-30.6177.3-82.346.8000112.4R63 E65 F69 L70 T71 F172 M175 L185 F189 W255 W258 E259 L262R63-W67 HydrophobicContact CG-CG 4.35Å; R63-W67 VanDerWaalsContact CG-NE1 3.34Å; R63-W67 VanDerWaalsContact O-CB 3.27Å; R63-W67 WeakPolarHBondContact O-CB 3.45Å; R63-W67 PolarHBondContact O-N 3.2Å; E65-W67 VanDerWaalsContact C-N 3.3Å; E65-W67 PolarHBondContact O-N 2.94Å; W67-F69 VanDerWaalsContact C-N 3.28Å; W67-F69 PolarHBondContact O-N 3.07Å; W67-L70 PolarHBondContact O-N 2.94Å; W67-T71 WeakPolarHBondContact O-CB 3.41Å; W67-T71 VanDerWaalsContact O-CG2 3.25Å; W67-T71 WeakPolarHBondContact O-CG2 3.34Å; W67-T71 PolarHBondContact O-N 3.45Å; W67-T71 PolarHBondContact O-OG1 3.32Å; W67-F172 AromaticContact CE3-CE1 3.78Å; W67-F172 HydrophobicContact CE3-CE1 3.78Å; W67-F172 HydrophobicContact CE3-CZ 4.46Å; W67-F172 HydrophobicContact CZ3-CD1 4.44Å; W67-F172 AromaticContact CZ3-CE1 3.59Å; W67-F172 HydrophobicContact CZ3-CE1 3.59Å; W67-F172 AromaticContact CZ3-CZ 3.93Å; W67-F172 HydrophobicContact CZ3-CZ 3.93Å; W67-M175 HydrophobicContact CD2-CE 3.96Å; W67-M175 HydrophobicContact CD2-SD 3.88Å; W67-M175 HydrophobicContact CE3-CE 3.56Å; W67-M175 HydrophobicContact CE3-SD 4Å; W67-M175 HydrophobicContact CG-CE 4.44Å; W67-M175 HydrophobicContact CG-SD 4.28Å; W67-M175 HydrophobicContact CZ2-SD 4.46Å; W67-M175 HydrophobicContact CZ3-CE 3.98Å; W67-M175 HydrophobicContact CZ3-SD 4.32Å; W67-L185 HydrophobicContact CB-CD2 4.5Å; W67-F189 HydrophobicContact CZ3-CD2 4.42Å; W67-F189 HydrophobicContact CZ3-CE2 4.5Å; W67-W255 AromaticContact CH2-CD1 3.57Å; W67-W255 HydrophobicContact CH2-CG 4.43Å; W67-W255 HydrophobicContact CZ2-CB 4.1Å; W67-W255 AromaticContact CZ2-CD1 3.81Å; W67-W255 HydrophobicContact CZ2-CG 4.28Å; W67-W258 HydrophobicContact CH2-CB 3.72Å; W67-W258 HydrophobicContact CH2-CD2 4.29Å; W67-W258 AromaticContact CH2-CE3 3.59Å; W67-W258 HydrophobicContact CH2-CE3 3.59Å; W67-W258 HydrophobicContact CH2-CG 4.42Å; W67-W258 HydrophobicContact CH2-CZ3 4.49Å; W67-W258 HydrophobicContact CZ2-CB 4Å; W67-W258 AromaticContact CZ3-CE3 3.92Å; W67-W258 HydrophobicContact CZ3-CE3 3.92Å; W67-E259 HydrophobicContact CZ2-CG 4.06Å; W67-L262 HydrophobicContact CD2-CD1 4.21Å; W67-L262 HydrophobicContact CE3-CD1 4.16Å; W67-L262 HydrophobicContact CZ3-CD1 4.41Å
68K97.8Very high96.8Very high15 Ų1536.7 Ų36.77%0.06519%0.194CC..Hα-helixtrans-60.3-39.5171.5-69.7178.3179.7-173.40111.2T64 E65 A66 T71 G72 Y73 F74 D87 E181 L185T64-K68 WeakPolarHBondContact O-CG 3.46Å; T64-K68 PolarHBondContact O-N 2.89Å; E65-K68 WeakPolarHBondContact O-CB 3.21Å; E65-K68 PolarHBondContact O-N 3.4Å; E65-K68 VanDerWaalsContact O-N 3.15Å; A66-K68 PolarHBondContact O-N 3.31Å; K68-T71 PolarHBondContact O-OG1 3.38Å; K68-G72 PolarHBondContact O-N 3.29Å; K68-Y73 HydrophobicContact CB-CD1 3.67Å; K68-Y73 HydrophobicContact CB-CG 4.07Å; K68-Y73 HydrophobicContact CD-CD1 3.75Å; K68-Y73 HydrophobicContact CD-CE1 3.73Å; K68-Y73 HydrophobicContact CG-CD1 3.6Å; K68-Y73 HydrophobicContact CG-CE1 4.07Å; K68-Y73 HydrophobicContact CG-CG 3.97Å; K68-Y73 CarbonylContact O-C 3.08Å; K68-Y73 WeakPolarHBondContact O-CA 3.4Å; K68-Y73 VanDerWaalsContact O-CB 3.23Å; K68-Y73 WeakPolarHBondContact O-CB 3.22Å; K68-Y73 PolarHBondContact O-N 3.01Å; K68-F74 HydrophobicContact CB-CD2 3.39Å; K68-F74 HydrophobicContact CB-CE2 3.67Å; K68-F74 HydrophobicContact CB-CG 4.03Å; K68-F74 HydrophobicContact CB-CZ 4.49Å; K68-F74 HydrophobicContact CD-CD2 3.96Å; K68-F74 HydrophobicContact CD-CE1 4.5Å; K68-F74 HydrophobicContact CD-CE2 3.27Å; K68-F74 HydrophobicContact CD-CZ 3.59Å; K68-F74 HydrophobicContact CG-CD2 4.3Å; K68-F74 HydrophobicContact CG-CE2 4.09Å; K68-F74 PolarHBondContact O-N 3.4Å; K68-D87 IonicContact NZ-OD1 3.46Å; K68-D87 PolarHBondContact NZ-OD1 3.09Å; K68-D87 IonicContact NZ-OD2 3.53Å; K68-D87 PolarHBondContact NZ-OD2 3.06Å; K68-E181 WeakPolarHBondContact CE-OE1 3.38Å; K68-E181 IonicContact NZ-OE1 3.03Å; K68-E181 PolarHBondContact NZ-OE1 2.95Å; K68-L185 HydrophobicContact CG-CD2 3.97Å
69F98.2Very high96.8Very high1 Ų137.3 Ų37.30%0.00420%0.199CC..Hα-helixtrans-74-44174.4-69.9-86.2000113.2W32 F36 E65 A66 W67 T71 G72 F74 W76 R83W32-F69 HydrophobicContact CH2-CD2 4.43Å; W32-F69 AromaticContact CZ2-CD2 3.79Å; W32-F69 HydrophobicContact CZ2-CD2 3.79Å; W32-F69 HydrophobicContact CZ2-CE2 4.12Å; F36-F69 HydrophobicContact CE1-CE1 4.13Å; F36-F69 HydrophobicContact CE1-CE2 4.14Å; F36-F69 AromaticContact CE1-CZ 3.59Å; F36-F69 HydrophobicContact CE1-CZ 3.59Å; F36-F69 HydrophobicContact CZ-CE1 4.48Å; F36-F69 AromaticContact CZ-CE2 3.79Å; F36-F69 HydrophobicContact CZ-CE2 3.79Å; F36-F69 AromaticContact CZ-CZ 3.74Å; F36-F69 HydrophobicContact CZ-CZ 3.74Å; E65-F69 WeakPolarHBondContact O-CD2 3.39Å; A66-F69 WeakPolarHBondContact O-CA 3.41Å; A66-F69 WeakPolarHBondContact O-CB 3.45Å; A66-F69 PolarHBondContact O-N 3.19Å; W67-F69 VanDerWaalsContact C-N 3.28Å; W67-F69 PolarHBondContact O-N 3.07Å; F69-T71 VanDerWaalsContact C-N 3.35Å; F69-T71 PolarHBondContact O-N 3.35Å; F69-G72 PolarHBondContact O-N 3.49Å; F69-F74 HydrophobicContact CD1-CB 3.78Å; F69-F74 HydrophobicContact CD2-CB 4.5Å; F69-F74 HydrophobicContact CD2-CD2 4.16Å; F69-F74 HydrophobicContact CE1-CB 3.84Å; F69-F74 AromaticContact CE2-CD2 3.91Å; F69-F74 HydrophobicContact CE2-CD2 3.91Å; F69-F74 HydrophobicContact CG-CB 4.14Å; F69-F74 HydrophobicContact CZ-CB 4.26Å; F69-F74 HydrophobicContact CZ-CD2 4.14Å; F69-W76 HydrophobicContact CB-CD2 4.07Å; F69-W76 HydrophobicContact CB-CE3 3.91Å; F69-W76 HydrophobicContact CB-CH2 3.58Å; F69-W76 HydrophobicContact CB-CZ2 3.64Å; F69-W76 HydrophobicContact CB-CZ3 3.7Å; F69-W76 HydrophobicContact CD1-CD2 4.14Å; F69-W76 AromaticContact CD1-CE3 3.8Å; F69-W76 HydrophobicContact CD1-CE3 3.8Å; F69-W76 HydrophobicContact CD1-CZ3 4.24Å; F69-W76 HydrophobicContact CG-CE3 4.12Å; F69-W76 HydrophobicContact CG-CH2 4.46Å; F69-W76 HydrophobicContact CG-CZ3 4.11Å; F69-W76 PolarHBondContact O-NE1 3.22Å; F69-W76 VanDerWaalsContact O-NE1 3.15Å; F69-R83 VanDerWaalsContact CZ-CD 3.49Å
70L97.8Very high96.9Very high4 Ų439.3 Ų39.32%0.02121%0.208CC..Hα-helixtrans-62.3-40.5-176.8-69.7173.7000112.7I53 L58 A66 W67 G72 W76 L262 T263I53-L70 HydrophobicContact CD1-CD1 4.28Å; I53-L70 HydrophobicContact CD1-CD2 3.98Å; I53-L70 HydrophobicContact CD1-CG 4.48Å; L58-L70 HydrophobicContact CD1-CD1 4.4Å; A66-L70 WeakPolarHBondContact O-CG 3.2Å; A66-L70 PolarHBondContact O-N 3.38Å; W67-L70 PolarHBondContact O-N 2.94Å; L70-G72 VanDerWaalsContact C-N 3.32Å; L70-W76 HydrophobicContact CD2-CH2 4.3Å; L70-W76 HydrophobicContact CD2-CZ2 4.06Å; L70-L262 HydrophobicContact CB-CB 3.91Å; L70-L262 HydrophobicContact CB-CD1 4.23Å; L70-T263 HydrophobicContact CD2-CG2 3.84Å
71T96.9Very high97Very high5 Ų541.7 Ų41.73%0.03122%0.217CC..Hα-helixtrans-77.1-18.1178.459.50000113.1W67 K68 F69 Y73 L185 F189 L262W67-T71 WeakPolarHBondContact O-CB 3.41Å; W67-T71 VanDerWaalsContact O-CG2 3.25Å; W67-T71 WeakPolarHBondContact O-CG2 3.34Å; W67-T71 PolarHBondContact O-N 3.45Å; W67-T71 PolarHBondContact O-OG1 3.32Å; K68-T71 PolarHBondContact O-OG1 3.38Å; F69-T71 VanDerWaalsContact C-N 3.35Å; F69-T71 PolarHBondContact O-N 3.35Å; T71-Y73 PolarHBondContact OG1-N 2.92Å; T71-L185 HydrophobicContact CG2-CD2 4.49Å; T71-F189 HydrophobicContact CG2-CB 4.36Å; T71-L262 HydrophobicContact CG2-CD1 4.05Å; T71-L262 HydrophobicContact CG2-CD2 4.16Å
72G96.9Very high97.2Very high37 Ų3738.2 Ų38.238%0.38120%0.203SC..THydrogen-bonded Turntrans87.49.4-172.900000114K68 F69 L70 F74K68-G72 PolarHBondContact O-N 3.29Å; F69-G72 PolarHBondContact O-N 3.49Å; L70-G72 VanDerWaalsContact C-N 3.32Å; G72-F74 VanDerWaalsContact C-N 3.29Å; G72-F74 PolarHBondContact O-N 3.38Å
73Y97.2Very high97.3Very high4 Ų439.3 Ų39.32%0.01621%0.207CC..SBendtrans-54.7-48.8165.7-178.6-75.5000109.5K68 T71 V86 D87 R90 W184 L185 F188K68-Y73 HydrophobicContact CB-CD1 3.67Å; K68-Y73 HydrophobicContact CB-CG 4.07Å; K68-Y73 HydrophobicContact CD-CD1 3.75Å; K68-Y73 HydrophobicContact CD-CE1 3.73Å; K68-Y73 HydrophobicContact CG-CD1 3.6Å; K68-Y73 HydrophobicContact CG-CE1 4.07Å; K68-Y73 HydrophobicContact CG-CG 3.97Å; K68-Y73 CarbonylContact O-C 3.08Å; K68-Y73 WeakPolarHBondContact O-CA 3.4Å; K68-Y73 VanDerWaalsContact O-CB 3.23Å; K68-Y73 WeakPolarHBondContact O-CB 3.22Å; K68-Y73 PolarHBondContact O-N 3.01Å; T71-Y73 PolarHBondContact OG1-N 2.92Å; Y73-V86 HydrophobicContact CE1-CG1 4.46Å; Y73-D87 WeakPolarHBondContact CE1-OD1 3.29Å; Y73-D87 PolarHBondContact OH-OD1 2.95Å; Y73-R90 VanDerWaalsContact C-NH1 3.33Å; Y73-R90 VanDerWaalsContact CD2-NH1 3.33Å; Y73-R90 VanDerWaalsContact CZ-NH1 3.27Å; Y73-R90 PolarHBondContact O-NH1 3.42Å; Y73-R90 PolarHBondContact O-NH2 3.11Å; Y73-R90 WeakPolarHBondContact OH-CD 3.43Å; Y73-W184 HydrophobicContact CD2-CB 3.86Å; Y73-W184 HydrophobicContact CE2-CB 3.58Å; Y73-W184 HydrophobicContact CE2-CG 4.25Å; Y73-L185 HydrophobicContact CD2-CD2 4.49Å; Y73-F188 HydrophobicContact CD2-CD2 4.05Å; Y73-F188 HydrophobicContact CD2-CE2 4.31Å
74F97.8Very high97.4Very high9 Ų943.6 Ų43.64%0.03923%0.231CC..SBendtrans-100.3141.2167.6-65.4-37.7000111.2K68 F69 G72 R83 V86K68-F74 HydrophobicContact CB-CD2 3.39Å; K68-F74 HydrophobicContact CB-CE2 3.67Å; K68-F74 HydrophobicContact CB-CG 4.03Å; K68-F74 HydrophobicContact CB-CZ 4.49Å; K68-F74 HydrophobicContact CD-CD2 3.96Å; K68-F74 HydrophobicContact CD-CE1 4.5Å; K68-F74 HydrophobicContact CD-CE2 3.27Å; K68-F74 HydrophobicContact CD-CZ 3.59Å; K68-F74 HydrophobicContact CG-CD2 4.3Å; K68-F74 HydrophobicContact CG-CE2 4.09Å; K68-F74 PolarHBondContact O-N 3.4Å; F69-F74 HydrophobicContact CD1-CB 3.78Å; F69-F74 HydrophobicContact CD2-CB 4.5Å; F69-F74 HydrophobicContact CD2-CD2 4.16Å; F69-F74 HydrophobicContact CE1-CB 3.84Å; F69-F74 AromaticContact CE2-CD2 3.91Å; F69-F74 HydrophobicContact CE2-CD2 3.91Å; F69-F74 HydrophobicContact CG-CB 4.14Å; F69-F74 HydrophobicContact CZ-CB 4.26Å; F69-F74 HydrophobicContact CZ-CD2 4.14Å; G72-F74 VanDerWaalsContact C-N 3.29Å; G72-F74 PolarHBondContact O-N 3.38Å; F74-R83 HydrophobicContact CB-CG 4.3Å; F74-R83 HydrophobicContact CD1-CB 4.01Å; F74-R83 HydrophobicContact CD1-CG 3.64Å; F74-R83 VanDerWaalsContact CD2-CD 3.44Å; F74-R83 HydrophobicContact CD2-CG 4.08Å; F74-R83 HydrophobicContact CE1-CB 3.67Å; F74-R83 HydrophobicContact CE1-CG 3.84Å; F74-R83 HydrophobicContact CE2-CB 4.32Å; F74-R83 HydrophobicContact CE2-CG 4.26Å; F74-R83 HydrophobicContact CG-CB 4.48Å; F74-R83 HydrophobicContact CG-CG 3.77Å; F74-R83 HydrophobicContact CZ-CB 3.84Å; F74-R83 HydrophobicContact CZ-CG 4.15Å; F74-V86 HydrophobicContact CD1-CG1 4.15Å; F74-V86 HydrophobicContact CE1-CB 4.44Å; F74-V86 HydrophobicContact CE1-CG1 4.11Å
75S97.1Very high97.5Very high65 Ų6546.2 Ų46.246%0.45525%0.247SC..  trans-70.6135.9165.9177.40000109.2Q77 S78S75-Q77 PolarHBondContact O-N 3.11Å; S75-Q77 VanDerWaalsContact O-N 3.12Å; S75-Q77 PolarHBondContact OG-N 2.67Å; S75-S78 WeakPolarHBondContact O-CB 3.37Å; S75-S78 PolarHBondContact O-N 3.27Å; S75-S78 PolarHBondContact O-OG 2.88Å
76W96.5Very high97.6Very high36 Ų3646.1 Ų46.114%0.13625%0.25CC..THydrogen-bonded Turntrans-62.4-14.6171.8-66.897.1000113.6L42 R46 I49 F69 L70L42-W76 HydrophobicContact CD1-CB 4.24Å; L42-W76 HydrophobicContact CD1-CD2 4.45Å; L42-W76 HydrophobicContact CD1-CE3 3.62Å; L42-W76 HydrophobicContact CD1-CZ3 4.34Å; L42-W76 HydrophobicContact CG-CE3 4.41Å; R46-W76 HydrophobicContact CG-CD2 4.03Å; R46-W76 HydrophobicContact CG-CE3 4.43Å; R46-W76 HydrophobicContact CG-CG 4.35Å; R46-W76 HydrophobicContact CG-CZ2 4.32Å; I49-W76 HydrophobicContact CD1-CZ3 4.34Å; I49-W76 HydrophobicContact CG2-CH2 4.4Å; I49-W76 HydrophobicContact CG2-CZ3 4.41Å; F69-W76 HydrophobicContact CB-CD2 4.07Å; F69-W76 HydrophobicContact CB-CE3 3.91Å; F69-W76 HydrophobicContact CB-CH2 3.58Å; F69-W76 HydrophobicContact CB-CZ2 3.64Å; F69-W76 HydrophobicContact CB-CZ3 3.7Å; F69-W76 HydrophobicContact CD1-CD2 4.14Å; F69-W76 AromaticContact CD1-CE3 3.8Å; F69-W76 HydrophobicContact CD1-CE3 3.8Å; F69-W76 HydrophobicContact CD1-CZ3 4.24Å; F69-W76 HydrophobicContact CG-CE3 4.12Å; F69-W76 HydrophobicContact CG-CH2 4.46Å; F69-W76 HydrophobicContact CG-CZ3 4.11Å; F69-W76 PolarHBondContact O-NE1 3.22Å; F69-W76 VanDerWaalsContact O-NE1 3.15Å; L70-W76 HydrophobicContact CD2-CH2 4.3Å; L70-W76 HydrophobicContact CD2-CZ2 4.06Å
77Q96.1Very high97.6Very high168 Ų16847.8 Ų47.879%0.78526%0.259SS*.THydrogen-bonded Turntrans-97.1-1.7177.3-60.9174.49.700112.8S75S75-Q77 PolarHBondContact O-N 3.11Å; S75-Q77 VanDerWaalsContact O-N 3.12Å; S75-Q77 PolarHBondContact OG-N 2.67Å
78S97.4Very high97.6Very high12 Ų1250.4 Ų50.48%0.08428%0.277CS..  trans-75.1148.4-17560.10000113.1S75 E82 R83S75-S78 WeakPolarHBondContact O-CB 3.37Å; S75-S78 PolarHBondContact O-N 3.27Å; S75-S78 PolarHBondContact O-OG 2.88Å; S78-E82 WeakPolarHBondContact CA-OE2 3.31Å; S78-R83 PolarHBondContact O-NH1 2.96Å; S78-R83 VanDerWaalsContact OG-CG 3.25Å; S78-R83 WeakPolarHBondContact OG-CG 3.32Å; S78-R83 PolarHBondContact OG-NH1 3.21Å
79S97.9Very high97.6Very high18 Ų1854.6 Ų54.613%0.12630%0.298CS..  trans-79.8170.6164.967.40000111.9H41 E82 R83H41-S79 WeakPolarHBondContact NE2-CB 3.47Å; S79-E82 PolarHBondContact N-OE2 2.7Å; S79-E82 VanDerWaalsContact OG-CG 3.3Å; S79-E82 WeakPolarHBondContact OG-CG 3.22Å; S79-E82 PolarHBondContact OG-N 2.83Å; S79-E82 PolarHBondContact OG-OE2 2.81Å; S79-R83 WeakPolarHBondContact O-CG 3.4Å; S79-R83 PolarHBondContact O-N 3.26Å; S79-R83 VanDerWaalsContact O-N 3.13Å; S79-R83 PolarHBondContact O-NH1 3.18Å
80Q97.6Very high97.6Very high107 Ų10756.1 Ų56.150%0.530%0.304SS..Hα-helixtrans-61.2-44174-172.3174.333.200112.4N39 E82 R83 L84N39-Q80 PolarHBondContact O-N 3.38Å; Q80-E82 VanDerWaalsContact C-N 3.35Å; Q80-E82 PolarHBondContact O-N 3.43Å; Q80-R83 WeakPolarHBondContact O-CB 3.2Å; Q80-R83 PolarHBondContact O-N 2.95Å; Q80-R83 VanDerWaalsContact O-N 3.13Å; Q80-L84 WeakPolarHBondContact O-CG 3.46Å; Q80-L84 PolarHBondContact O-N 3.24Å
81D97.9Very high97.6Very high116 Ų11662.2 Ų62.262%0.6233%0.326SS*.Hα-helixtrans-64.8-38.1-179.3-74-18.6000112.5R83 L84 T85D81-R83 VanDerWaalsContact C-N 3.34Å; D81-L84 PolarHBondContact O-N 3.19Å; D81-T85 PolarHBondContact O-N 3.1Å; D81-T85 PolarHBondContact O-OG1 3.48Å
82E98.3Very high97.6Very high101 Ų10168.4 Ų68.447%0.47235%0.353SS..Hα-helixtrans-63.5-41.7172.9-73.7174.6149.900111.2S78 S79 Q80 L84 T85 V86S78-E82 WeakPolarHBondContact CA-OE2 3.31Å; S79-E82 PolarHBondContact N-OE2 2.7Å; S79-E82 VanDerWaalsContact OG-CG 3.3Å; S79-E82 WeakPolarHBondContact OG-CG 3.22Å; S79-E82 PolarHBondContact OG-N 2.83Å; S79-E82 PolarHBondContact OG-OE2 2.81Å; Q80-E82 VanDerWaalsContact C-N 3.35Å; Q80-E82 PolarHBondContact O-N 3.43Å; E82-L84 PolarHBondContact O-N 3Å; E82-T85 WeakPolarHBondContact O-CB 3.4Å; E82-T85 PolarHBondContact O-N 2.89Å; E82-V86 WeakPolarHBondContact O-CB 3.41Å; E82-V86 VanDerWaalsContact O-CG2 3.29Å; E82-V86 WeakPolarHBondContact O-CG2 3.45Å; E82-V86 PolarHBondContact O-N 3.14Å
83R98Very high97.7Very high23 Ų2370 Ų709%0.08735%0.353CS..Hα-helixtrans-63.1-41.5176.4-71.2-169.6-65.1-87.810.6112.3G40 F69 F74 S78 S79 Q80 D81 T85 V86 D87G40-R83 VanDerWaalsContact O-CZ 3.29Å; G40-R83 PolarHBondContact O-NH1 2.95Å; G40-R83 PolarHBondContact O-NH2 2.87Å; F69-R83 VanDerWaalsContact CZ-CD 3.49Å; F74-R83 HydrophobicContact CB-CG 4.3Å; F74-R83 HydrophobicContact CD1-CB 4.01Å; F74-R83 HydrophobicContact CD1-CG 3.64Å; F74-R83 VanDerWaalsContact CD2-CD 3.44Å; F74-R83 HydrophobicContact CD2-CG 4.08Å; F74-R83 HydrophobicContact CE1-CB 3.67Å; F74-R83 HydrophobicContact CE1-CG 3.84Å; F74-R83 HydrophobicContact CE2-CB 4.32Å; F74-R83 HydrophobicContact CE2-CG 4.26Å; F74-R83 HydrophobicContact CG-CB 4.48Å; F74-R83 HydrophobicContact CG-CG 3.77Å; F74-R83 HydrophobicContact CZ-CB 3.84Å; F74-R83 HydrophobicContact CZ-CG 4.15Å; S78-R83 PolarHBondContact O-NH1 2.96Å; S78-R83 VanDerWaalsContact OG-CG 3.25Å; S78-R83 WeakPolarHBondContact OG-CG 3.32Å; S78-R83 PolarHBondContact OG-NH1 3.21Å; S79-R83 WeakPolarHBondContact O-CG 3.4Å; S79-R83 PolarHBondContact O-N 3.26Å; S79-R83 VanDerWaalsContact O-N 3.13Å; S79-R83 PolarHBondContact O-NH1 3.18Å; Q80-R83 WeakPolarHBondContact O-CB 3.2Å; Q80-R83 PolarHBondContact O-N 2.95Å; Q80-R83 VanDerWaalsContact O-N 3.13Å; D81-R83 VanDerWaalsContact C-N 3.34Å; R83-T85 VanDerWaalsContact C-N 3.31Å; R83-T85 PolarHBondContact O-N 3.41Å; R83-V86 PolarHBondContact O-N 3.39Å; R83-D87 PolarHBondContact O-N 3.48Å
84L97.9Very high97.7Very high104 Ų10470.7 Ų70.755%0.54536%0.355SS..Hα-helixtrans-61.5-40.8174.4-68.4175000111.8Q80 D81 E82 D87 S88Q80-L84 WeakPolarHBondContact O-CG 3.46Å; Q80-L84 PolarHBondContact O-N 3.24Å; D81-L84 PolarHBondContact O-N 3.19Å; E82-L84 PolarHBondContact O-N 3Å; L84-D87 PolarHBondContact O-N 2.66Å; L84-S88 WeakPolarHBondContact O-CB 3.45Å; L84-S88 PolarHBondContact O-N 2.77Å
85T98.2Very high97.7Very high92 Ų9276.6 Ų76.656%0.56438%0.381SS*.Hα-helixtrans-64.1-44.5175.8-60.70000111.3D81 E82 R83 S88 M89D81-T85 PolarHBondContact O-N 3.1Å; D81-T85 PolarHBondContact O-OG1 3.48Å; E82-T85 WeakPolarHBondContact O-CB 3.4Å; E82-T85 PolarHBondContact O-N 2.89Å; R83-T85 VanDerWaalsContact C-N 3.31Å; R83-T85 PolarHBondContact O-N 3.41Å; T85-S88 PolarHBondContact O-N 2.96Å; T85-M89 WeakPolarHBondContact O-CB 3.4Å; T85-M89 PolarHBondContact O-N 2.85Å
86V98Very high97.7Very high51 Ų5176 Ų7631%0.30938%0.38SS..Hα-helixtrans-61.9-45.3177.4165.10000111.4Y73 F74 E82 R83 M89 R90Y73-V86 HydrophobicContact CE1-CG1 4.46Å; F74-V86 HydrophobicContact CD1-CG1 4.15Å; F74-V86 HydrophobicContact CE1-CB 4.44Å; F74-V86 HydrophobicContact CE1-CG1 4.11Å; E82-V86 WeakPolarHBondContact O-CB 3.41Å; E82-V86 VanDerWaalsContact O-CG2 3.29Å; E82-V86 WeakPolarHBondContact O-CG2 3.45Å; E82-V86 PolarHBondContact O-N 3.14Å; R83-V86 PolarHBondContact O-N 3.39Å; V86-M89 PolarHBondContact O-N 3.43Å; V86-R90 WeakPolarHBondContact O-CB 3.18Å; V86-R90 WeakPolarHBondContact O-CG 3.26Å; V86-R90 PolarHBondContact O-N 3Å
87D97.4Very high97.7Very high35 Ų3575.9 Ų75.919%0.18738%0.382CS..Hα-helixtrans-60.2-46.4175.5-90.2-22000111.5K68 Y73 R83 L84 M89 R90 R91K68-D87 IonicContact NZ-OD1 3.46Å; K68-D87 PolarHBondContact NZ-OD1 3.09Å; K68-D87 IonicContact NZ-OD2 3.53Å; K68-D87 PolarHBondContact NZ-OD2 3.06Å; Y73-D87 WeakPolarHBondContact CE1-OD1 3.29Å; Y73-D87 PolarHBondContact OH-OD1 2.95Å; R83-D87 PolarHBondContact O-N 3.48Å; L84-D87 PolarHBondContact O-N 2.66Å; D87-M89 PolarHBondContact O-N 2.93Å; D87-R90 PolarHBondContact O-N 3.43Å; D87-R91 WeakPolarHBondContact O-CB 3.37Å; D87-R91 PolarHBondContact O-N 2.9Å
88S98.1Very high97.8Very high56 Ų5668.3 Ų68.339%0.39235%0.348SS..Hα-helixtrans-60-44.8177.2-175.80000111.9L84 T85 R91 K92L84-S88 WeakPolarHBondContact O-CB 3.45Å; L84-S88 PolarHBondContact O-N 2.77Å; T85-S88 PolarHBondContact O-N 2.96Å; S88-R91 PolarHBondContact O-N 2.75Å; S88-K92 WeakPolarHBondContact O-CG 3.44Å; S88-K92 PolarHBondContact O-N 2.84Å; S88-K92 VanDerWaalsContact O-N 3.1Å
89M98.3Very high97.7Very high103 Ų10372.4 Ų72.451%0.50737%0.365SS..Hα-helixtrans-63.7-47178.2-171.863.576.800111.4T85 V86 D87 R91 K92 N93T85-M89 WeakPolarHBondContact O-CB 3.4Å; T85-M89 PolarHBondContact O-N 2.85Å; V86-M89 PolarHBondContact O-N 3.43Å; D87-M89 PolarHBondContact O-N 2.93Å; M89-R91 VanDerWaalsContact C-N 3.35Å; M89-R91 PolarHBondContact O-N 2.75Å; M89-K92 PolarHBondContact O-N 2.81Å; M89-N93 WeakPolarHBondContact O-CB 3.34Å; M89-N93 VanDerWaalsContact O-CG 3.23Å; M89-N93 PolarHBondContact O-N 2.96Å; M89-N93 PolarHBondContact O-OD1 3.01Å
90R97.6Very high97.6Very high33 Ų3375.4 Ų75.413%0.12538%0.378CS..Hα-helixtrans-64.4-37.6179.7-82.3-171.7-178125.92.5113.1Y73 V86 D87 N93 Y94 W184 F188Y73-R90 VanDerWaalsContact C-NH1 3.33Å; Y73-R90 VanDerWaalsContact CD2-NH1 3.33Å; Y73-R90 VanDerWaalsContact CZ-NH1 3.27Å; Y73-R90 PolarHBondContact O-NH1 3.42Å; Y73-R90 PolarHBondContact O-NH2 3.11Å; Y73-R90 WeakPolarHBondContact OH-CD 3.43Å; V86-R90 WeakPolarHBondContact O-CB 3.18Å; V86-R90 WeakPolarHBondContact O-CG 3.26Å; V86-R90 PolarHBondContact O-N 3Å; D87-R90 PolarHBondContact O-N 3.43Å; R90-N93 PolarHBondContact O-N 2.95Å; R90-Y94 WeakPolarHBondContact O-CB 3.32Å; R90-Y94 PolarHBondContact O-N 3.08Å; R90-W184 HydrophobicContact CB-CG 4.33Å; R90-W184 HydrophobicContact CG-CD2 4.3Å; R90-W184 HydrophobicContact CG-CG 4.3Å; R90-W184 PolarHBondContact O-NE1 3.3Å; R90-F188 VanDerWaalsContact NH2-CE2 3.33Å
91R98.1Very high97.5Very high131 Ų13170.9 Ų70.949%0.49436%0.357SS..Hα-helixtrans-61-45.8172.4-173.8179.2-64.2-142.1-0.3111.5D87 S88 M89 K95 H180D87-R91 WeakPolarHBondContact O-CB 3.37Å; D87-R91 PolarHBondContact O-N 2.9Å; S88-R91 PolarHBondContact O-N 2.75Å; M89-R91 VanDerWaalsContact C-N 3.35Å; M89-R91 PolarHBondContact O-N 2.75Å; R91-K95 PolarHBondContact O-N 2.93Å; R91-K95 VanDerWaalsContact O-N 3.11Å; R91-H180 VanDerWaalsContact CZ-CE1 3.48Å; R91-H180 PolarHBondContact NE-CE1 3.43Å; R91-H180 PolarHBondContact NE-NE2 3.04Å; R91-H180 VanDerWaalsContact NE-NE2 3.19Å; R91-H180 PolarHBondContact NH2-CE1 3.48Å; R91-H180 VanDerWaalsContact NH2-CE1 3.3Å; R91-H180 PolarHBondContact NH2-NE2 2.85Å
92K98.4Very high97.3Very high136 Ų13671.2 Ų71.259%0.59136%0.355SS*.Hα-helixtrans-63.5-45.2176.3-70.3175.8-172.8176.50111.7S88 M89 K95 A96S88-K92 WeakPolarHBondContact O-CG 3.44Å; S88-K92 PolarHBondContact O-N 2.84Å; S88-K92 VanDerWaalsContact O-N 3.1Å; M89-K92 PolarHBondContact O-N 2.81Å; K92-K95 WeakPolarHBondContact O-CB 3.21Å; K92-K95 PolarHBondContact O-N 2.82Å; K92-A96 PolarHBondContact O-N 3.48Å
93N97.7Very high97.1Very high71 Ų7174.5 Ų74.538%0.3837%0.367SS..Hα-helixtrans-62.2-45178.9-70.2-7.4000111.6M89 R90 K95 A96 L97 W184M89-N93 WeakPolarHBondContact O-CB 3.34Å; M89-N93 VanDerWaalsContact O-CG 3.23Å; M89-N93 PolarHBondContact O-N 2.96Å; M89-N93 PolarHBondContact O-OD1 3.01Å; R90-N93 PolarHBondContact O-N 2.95Å; N93-K95 VanDerWaalsContact C-N 3.32Å; N93-K95 PolarHBondContact O-N 3.48Å; N93-A96 PolarHBondContact O-N 2.86Å; N93-L97 WeakPolarHBondContact O-CG 3.36Å; N93-L97 PolarHBondContact O-N 3.37Å; N93-W184 HydrophobicContact CB-CZ2 3.85Å
94Y97.8Very high96.8Very high17 Ų1775.8 Ų75.87%0.06738%0.375CS..Hα-helixtrans-59.9-42.5175.8177.9-101.1000112R90 A96 L97 C98 L151 D179 H180 F183R90-Y94 WeakPolarHBondContact O-CB 3.32Å; R90-Y94 PolarHBondContact O-N 3.08Å; Y94-A96 PolarHBondContact O-N 3.24Å; Y94-L97 PolarHBondContact O-N 3.42Å; Y94-C98 VanDerWaalsContact CE1-SG 3.51Å; Y94-C98 VanDerWaalsContact CZ-SG 3.53Å; Y94-C98 PolarHBondContact O-N 3.25Å; Y94-C98 PolarHBondContact O-SG 3.38Å; Y94-L151 HydrophobicContact CE2-CD1 3.66Å; Y94-D179 HydrophobicContact CE1-CB 3.81Å; Y94-H180 HydrophobicContact CD1-CB 3.55Å; Y94-H180 HydrophobicContact CD2-CB 4.43Å; Y94-H180 HydrophobicContact CE1-CB 4.33Å; Y94-H180 HydrophobicContact CG-CB 3.61Å; Y94-F183 HydrophobicContact CD2-CB 3.73Å; Y94-F183 AromaticContact CD2-CD1 3.65Å; Y94-F183 HydrophobicContact CD2-CD1 3.65Å; Y94-F183 HydrophobicContact CD2-CD2 4.41Å; Y94-F183 HydrophobicContact CD2-CE1 4.39Å; Y94-F183 AromaticContact CD2-CG 3.66Å; Y94-F183 HydrophobicContact CD2-CG 3.66Å; Y94-F183 HydrophobicContact CE2-CB 3.54Å; Y94-F183 HydrophobicContact CE2-CD1 4.18Å; Y94-F183 HydrophobicContact CE2-CD2 4.15Å; Y94-F183 AromaticContact CE2-CG 3.69Å; Y94-F183 HydrophobicContact CE2-CG 3.69Å
95K97.9Very high96.5Very high134 Ų13473 Ų7358%0.58336%0.36SS*.Hα-helixtrans-61.6-44175.6-174.1177.5-179.2178.10111.7R91 K92 N93 C98 Q99R91-K95 PolarHBondContact O-N 2.93Å; R91-K95 VanDerWaalsContact O-N 3.11Å; K92-K95 WeakPolarHBondContact O-CB 3.21Å; K92-K95 PolarHBondContact O-N 2.82Å; N93-K95 VanDerWaalsContact C-N 3.32Å; N93-K95 PolarHBondContact O-N 3.48Å; K95-C98 PolarHBondContact O-N 2.79Å; K95-Q99 WeakPolarHBondContact O-CG 3.35Å; K95-Q99 PolarHBondContact O-N 3.13Å
96A97.4Very high96.2Very high51 Ų5171.8 Ų71.842%0.42135%0.353SS..Hα-helixtrans-63.2-40.9176.300000111.9K92 N93 Y94 C98 Q99 M100K92-A96 PolarHBondContact O-N 3.48Å; N93-A96 PolarHBondContact O-N 2.86Å; Y94-A96 PolarHBondContact O-N 3.24Å; A96-C98 PolarHBondContact O-N 2.84Å; A96-Q99 PolarHBondContact O-N 2.66Å; A96-M100 WeakPolarHBondContact O-CB 3.34Å; A96-M100 PolarHBondContact O-N 3.4Å
97L96.5Very high95.7Very high34 Ų3474.2 Ų74.218%0.17836%0.364CS..Hα-helixtrans-60.8-43.2174.5-73.8172.3000111.9N93 Y94 M100 Y101 F183 W184N93-L97 WeakPolarHBondContact O-CG 3.36Å; N93-L97 PolarHBondContact O-N 3.37Å; Y94-L97 PolarHBondContact O-N 3.42Å; L97-M100 HydrophobicContact CD2-CE 4.19Å; L97-M100 PolarHBondContact O-N 3.12Å; L97-Y101 VanDerWaalsContact O-CB 3.31Å; L97-Y101 WeakPolarHBondContact O-CB 3.38Å; L97-Y101 PolarHBondContact O-N 3.09Å; L97-F183 HydrophobicContact CD1-CE1 3.91Å; L97-F183 HydrophobicContact CD1-CZ 4.04Å; L97-W184 HydrophobicContact CD1-CH2 4.22Å; L97-W184 HydrophobicContact CD1-CZ2 4.18Å
98C96.9Very high95.3Very high10 Ų1073.9 Ų73.97%0.06836%0.362CS..Hα-helixtrans-59.7-48.3175-66.10000111.6Y94 K95 A96 M100 Y101 E102 K147Y94-C98 VanDerWaalsContact CE1-SG 3.51Å; Y94-C98 VanDerWaalsContact CZ-SG 3.53Å; Y94-C98 PolarHBondContact O-N 3.25Å; Y94-C98 PolarHBondContact O-SG 3.38Å; K95-C98 PolarHBondContact O-N 2.79Å; A96-C98 PolarHBondContact O-N 2.84Å; C98-M100 VanDerWaalsContact C-N 3.33Å; C98-M100 PolarHBondContact O-N 3.15Å; C98-Y101 PolarHBondContact O-N 3.17Å; C98-E102 WeakPolarHBondContact O-CG 3.36Å; C98-E102 PolarHBondContact O-N 3.41Å; C98-K147 WeakPolarHBondContact SG-CE 3.23Å; C98-K147 PolarHBondContact SG-NZ 3.03Å; C98-K147 VanDerWaalsContact SG-NZ 3.38Å
99Q96.8Very high94.8Very high97 Ų9774.3 Ų74.345%0.45336%0.358SS..Hα-helixtrans-64.4-37.3179.5-70.5175.6-13.800112.5K95 A96 K103K95-Q99 WeakPolarHBondContact O-CG 3.35Å; K95-Q99 PolarHBondContact O-N 3.13Å; A96-Q99 PolarHBondContact O-N 2.66Å; Q99-K103 WeakPolarHBondContact O-CG 3.32Å; Q99-K103 PolarHBondContact O-N 3.19Å
100M95.6Very high94.3Very high81 Ų8175.9 Ų75.940%0.39937%0.368SS..Hα-helixtrans-63.9-49.8173.8-178-165.577.200110.1A96 L97 C98 E102 K103 I104 V154A96-M100 WeakPolarHBondContact O-CB 3.34Å; A96-M100 PolarHBondContact O-N 3.4Å; L97-M100 HydrophobicContact CD2-CE 4.19Å; L97-M100 PolarHBondContact O-N 3.12Å; C98-M100 VanDerWaalsContact C-N 3.33Å; C98-M100 PolarHBondContact O-N 3.15Å; M100-E102 PolarHBondContact O-N 3.42Å; M100-K103 PolarHBondContact O-N 3.31Å; M100-K103 VanDerWaalsContact O-N 3.1Å; M100-I104 HydrophobicContact CE-CD1 4.12Å; M100-I104 WeakPolarHBondContact O-CG1 3.36Å; M100-I104 PolarHBondContact O-N 2.62Å; M100-I104 VanDerWaalsContact O-N 3.09Å; M100-V154 HydrophobicContact CE-CG1 4.15Å
101Y94.5Very high93.7Very high13 Ų1380.3 Ų80.35%0.05139%0.394CS..Hα-helixtrans-57.2-47.3-179.3177.5-110.8000112.2L97 C98 K103 I104 Q105 L108 F115 L150 L151 V154L97-Y101 VanDerWaalsContact O-CB 3.31Å; L97-Y101 WeakPolarHBondContact O-CB 3.38Å; L97-Y101 PolarHBondContact O-N 3.09Å; C98-Y101 PolarHBondContact O-N 3.17Å; Y101-K103 PolarHBondContact O-N 3.45Å; Y101-I104 PolarHBondContact O-N 3.49Å; Y101-Q105 HydrophobicContact CE2-CB 4.39Å; Y101-Q105 VanDerWaalsContact O-CB 3.27Å; Y101-Q105 WeakPolarHBondContact O-CB 3.09Å; Y101-Q105 PolarHBondContact O-N 3.17Å; Y101-L108 HydrophobicContact CE2-CD1 4.43Å; Y101-F115 HydrophobicContact CE2-CE2 4.15Å; Y101-F115 HydrophobicContact CE2-CZ 4.18Å; Y101-L150 HydrophobicContact CE2-CB 4.44Å; Y101-L150 WeakPolarHBondContact OH-CD1 3.14Å; Y101-L151 VanDerWaalsContact CB-CD2 3.5Å; Y101-L151 HydrophobicContact CD1-CD2 4.19Å; Y101-L151 HydrophobicContact CD2-CD2 4.38Å; Y101-L151 HydrophobicContact CG-CD2 3.76Å; Y101-V154 HydrophobicContact CD2-CG2 3.93Å; Y101-V154 HydrophobicContact CE2-CG2 3.88Å
102E94.3Very high93.1Very high123 Ų12378.8 Ų78.858%0.57539%0.392SS*.Hα-helixtrans-55.1-36.4176.6-74.8169.4-172.200112.7C98 M100C98-E102 WeakPolarHBondContact O-CG 3.36Å; C98-E102 PolarHBondContact O-N 3.41Å; M100-E102 PolarHBondContact O-N 3.42Å
103K93.9Very high92.4Very high169 Ų16982.2 Ų82.274%0.73540%0.401SS*.Hα-helixtrans-76.9-37.3179.4-68.7175.9-176.6-178.10113.3Q99 M100 Y101Q99-K103 WeakPolarHBondContact O-CG 3.32Å; Q99-K103 PolarHBondContact O-N 3.19Å; M100-K103 PolarHBondContact O-N 3.31Å; M100-K103 VanDerWaalsContact O-N 3.1Å; Y101-K103 PolarHBondContact O-N 3.45Å
104I92Very high91.8Very high51 Ų5184 Ų8426%0.26241%0.411SS..Hα-helixtrans-90-19.1-175.467.8175000112.9M100 Y101 P106 L107 L108 V154M100-I104 HydrophobicContact CE-CD1 4.12Å; M100-I104 WeakPolarHBondContact O-CG1 3.36Å; M100-I104 PolarHBondContact O-N 2.62Å; M100-I104 VanDerWaalsContact O-N 3.09Å; Y101-I104 PolarHBondContact O-N 3.49Å; I104-P106 VanDerWaalsContact C-CD 3.5Å; I104-L107 WeakPolarHBondContact O-CA 3.22Å; I104-L107 WeakPolarHBondContact O-CB 3.3Å; I104-L107 PolarHBondContact O-N 3.04Å; I104-L108 HydrophobicContact CD1-CD1 4.03Å; I104-L108 HydrophobicContact CG1-CD1 4.02Å; I104-L108 HydrophobicContact CG1-CG 4.45Å; I104-L108 PolarHBondContact O-N 3.25Å; I104-V154 HydrophobicContact CD1-CG1 3.88Å
105Q91.3Very high91.5Very high45 Ų4583.3 Ų83.321%0.2141%0.408CS..Hα-helixtrans-51.1-46.3-177.3176.1179.13.100113.1Y101 L107 L108 E109Y101-Q105 HydrophobicContact CE2-CB 4.39Å; Y101-Q105 VanDerWaalsContact O-CB 3.27Å; Y101-Q105 WeakPolarHBondContact O-CB 3.09Å; Y101-Q105 PolarHBondContact O-N 3.17Å; Q105-L107 PolarHBondContact O-N 2.9Å; Q105-L108 PolarHBondContact O-N 3.27Å; Q105-L108 VanDerWaalsContact O-N 3.15Å; Q105-E109 HydrophobicContact CG-CG 4.33Å; Q105-E109 WeakPolarHBondContact CG-OE1 3.48Å; Q105-E109 PolarHBondContact NE2-OE1 3.05Å; Q105-E109 WeakPolarHBondContact O-CG 3.25Å; Q105-E109 PolarHBondContact O-N 3.47Å
106P90.8Very high91.1Very high67 Ų6780.3 Ų80.344%0.43540%0.398SS..Hα-helixtrans-61.9-31.4177.4-22.734.3000113.5I104 N110I104-P106 VanDerWaalsContact C-CD 3.5Å; P106-N110 WeakPolarHBondContact O-CB 3.48Å; P106-N110 PolarHBondContact O-N 2.97Å; P106-N110 PolarHBondContact O-ND2 3.4Å
107L89.3Confident90.8Very high101 Ų10183 Ų8353%0.52940%0.402SS..Hα-helixtrans-73.3-41.5176.1-62.5171.7000110.7I104 Q105 E109 N110 L111I104-L107 WeakPolarHBondContact O-CA 3.22Å; I104-L107 WeakPolarHBondContact O-CB 3.3Å; I104-L107 PolarHBondContact O-N 3.04Å; Q105-L107 PolarHBondContact O-N 2.9Å; L107-E109 VanDerWaalsContact C-N 3.35Å; L107-E109 PolarHBondContact O-N 3.46Å; L107-N110 PolarHBondContact O-N 2.72Å; L107-L111 VanDerWaalsContact O-CB 3.29Å; L107-L111 WeakPolarHBondContact O-CB 3.4Å; L107-L111 WeakPolarHBondContact O-CG 3.34Å; L107-L111 PolarHBondContact O-N 3.19Å
108L88.6Confident90.6Very high29 Ų2982.2 Ų82.215%0.15240%0.398CS..Hα-helixtrans-60.3-44.6175.9-66176.5000111.6Y101 I104 Q105 N110 H112 F115 V154Y101-L108 HydrophobicContact CE2-CD1 4.43Å; I104-L108 HydrophobicContact CD1-CD1 4.03Å; I104-L108 HydrophobicContact CG1-CD1 4.02Å; I104-L108 HydrophobicContact CG1-CG 4.45Å; I104-L108 PolarHBondContact O-N 3.25Å; Q105-L108 PolarHBondContact O-N 3.27Å; Q105-L108 VanDerWaalsContact O-N 3.15Å; L108-N110 VanDerWaalsContact C-N 3.3Å; L108-N110 PolarHBondContact O-N 3.5Å; L108-H112 WeakPolarHBondContact O-CB 3.46Å; L108-H112 PolarHBondContact O-N 2.88Å; L108-F115 HydrophobicContact CB-CB 4.38Å; L108-F115 HydrophobicContact CB-CD1 3.65Å; L108-F115 HydrophobicContact CB-CD2 4.13Å; L108-F115 HydrophobicContact CB-CE1 3.88Å; L108-F115 HydrophobicContact CB-CE2 4.33Å; L108-F115 HydrophobicContact CB-CG 3.78Å; L108-F115 HydrophobicContact CB-CZ 4.22Å; L108-F115 HydrophobicContact CD1-CD2 4Å; L108-F115 HydrophobicContact CD1-CE2 3.86Å; L108-F115 HydrophobicContact CD1-CG 4.49Å; L108-F115 HydrophobicContact CD1-CZ 4.25Å; L108-V154 HydrophobicContact CD1-CG2 3.84Å
109E88.1Confident90.5Very high65 Ų6585.4 Ų85.430%0.30441%0.409SS..Hα-helixtrans-64.6-31.8178.7-70.4174.1179.200113.1Q105 L107 F115 I116 R119Q105-E109 HydrophobicContact CG-CG 4.33Å; Q105-E109 WeakPolarHBondContact CG-OE1 3.48Å; Q105-E109 PolarHBondContact NE2-OE1 3.05Å; Q105-E109 WeakPolarHBondContact O-CG 3.25Å; Q105-E109 PolarHBondContact O-N 3.47Å; L107-E109 VanDerWaalsContact C-N 3.35Å; L107-E109 PolarHBondContact O-N 3.46Å; E109-F115 HydrophobicContact CG-CD1 4.25Å; E109-F115 HydrophobicContact CG-CE1 3.71Å; E109-I116 WeakPolarHBondContact O-CD1 3.47Å; E109-R119 IonicContact OE1-CZ 3.68Å; E109-R119 IonicContact OE1-NH1 2.88Å; E109-R119 PolarHBondContact OE1-NH1 3.28Å
110N87.2Confident90.4Very high135 Ų13584.9 Ų84.972%0.72241%0.409SS*.Hα-helixtrans-89.8-32.9-178.2-73.6-45.4000113.6P106 L107 L108P106-N110 WeakPolarHBondContact O-CB 3.48Å; P106-N110 PolarHBondContact O-N 2.97Å; P106-N110 PolarHBondContact O-ND2 3.4Å; L107-N110 PolarHBondContact O-N 2.72Å; L108-N110 VanDerWaalsContact C-N 3.3Å; L108-N110 PolarHBondContact O-N 3.5Å
111L84.5Confident90.3Very high126 Ų12684 Ų8466%0.6641%0.406SS*.Hα-helixtrans-109-19.4-167.6-58.6175.8000113.7L107L107-L111 VanDerWaalsContact O-CB 3.29Å; L107-L111 WeakPolarHBondContact O-CB 3.4Å; L107-L111 WeakPolarHBondContact O-CG 3.34Å; L107-L111 PolarHBondContact O-N 3.19Å
112H84.8Confident90.4Very high100 Ų10083.3 Ų83.346%0.46340%0.404SS..  trans-121.295.1-170.8-63.6-92000112.2L108 N114 F115 I116L108-H112 WeakPolarHBondContact O-CB 3.46Å; L108-H112 PolarHBondContact O-N 2.88Å; H112-N114 VanDerWaalsContact C-N 3.25Å; H112-N114 PolarHBondContact O-N 3.42Å; H112-F115 HydrophobicContact CB-CB 3.95Å; H112-F115 WeakPolarHBondContact O-CB 3.45Å; H112-F115 PolarHBondContact O-N 3.45Å; H112-I116 PolarHBondContact O-N 3.17Å
113R83.9Confident90.5Very high207 Ų20778.9 Ų78.978%0.78139%0.388SS*.Hα-helixtrans-52.8-41.9177.1-171.4179.4-177.5178.70.9112.9F115 I116 E117R113-F115 VanDerWaalsContact C-N 3.26Å; R113-F115 PolarHBondContact O-N 3.27Å; R113-I116 PolarHBondContact O-N 2.99Å; R113-E117 PolarHBondContact O-N 3.46Å; R113-E117 VanDerWaalsContact O-N 3.07Å
114N86.9Confident90.5Very high109 Ų10977.6 Ų77.658%0.58338%0.378SS*.Hα-helixtrans-62.8-32.2-180-63.25.9000112.4H112 T118H112-N114 VanDerWaalsContact C-N 3.25Å; H112-N114 PolarHBondContact O-N 3.42Å; N114-T118 VanDerWaalsContact O-CB 3.29Å; N114-T118 WeakPolarHBondContact O-CB 3.47Å; N114-T118 PolarHBondContact O-N 3.13Å; N114-T118 PolarHBondContact O-OG1 2.98Å
115F90.2Very high90.7Very high2 Ų275.7 Ų75.71%0.00937%0.368CS..Hα-helixtrans-68-44.5176.4173.2-96.7000111.1Y101 L108 E109 H112 R113 E117 T118 R119 L150 Y153 V154Y101-F115 HydrophobicContact CE2-CE2 4.15Å; Y101-F115 HydrophobicContact CE2-CZ 4.18Å; L108-F115 HydrophobicContact CB-CB 4.38Å; L108-F115 HydrophobicContact CB-CD1 3.65Å; L108-F115 HydrophobicContact CB-CD2 4.13Å; L108-F115 HydrophobicContact CB-CE1 3.88Å; L108-F115 HydrophobicContact CB-CE2 4.33Å; L108-F115 HydrophobicContact CB-CG 3.78Å; L108-F115 HydrophobicContact CB-CZ 4.22Å; L108-F115 HydrophobicContact CD1-CD2 4Å; L108-F115 HydrophobicContact CD1-CE2 3.86Å; L108-F115 HydrophobicContact CD1-CG 4.49Å; L108-F115 HydrophobicContact CD1-CZ 4.25Å; E109-F115 HydrophobicContact CG-CD1 4.25Å; E109-F115 HydrophobicContact CG-CE1 3.71Å; H112-F115 HydrophobicContact CB-CB 3.95Å; H112-F115 WeakPolarHBondContact O-CB 3.45Å; H112-F115 PolarHBondContact O-N 3.45Å; R113-F115 VanDerWaalsContact C-N 3.26Å; R113-F115 PolarHBondContact O-N 3.27Å; F115-E117 VanDerWaalsContact C-N 3.34Å; F115-E117 PolarHBondContact O-N 3.41Å; F115-T118 PolarHBondContact O-N 3.21Å; F115-R119 WeakPolarHBondContact O-CB 3.17Å; F115-R119 PolarHBondContact O-N 3.34Å; F115-L150 HydrophobicContact CE2-CD2 4.16Å; F115-L150 HydrophobicContact CZ-CD2 4.42Å; F115-Y153 HydrophobicContact CB-CE1 4.26Å; F115-Y153 AromaticContact CD2-CD1 3.99Å; F115-Y153 HydrophobicContact CD2-CD1 3.99Å; F115-Y153 AromaticContact CD2-CE1 3.83Å; F115-Y153 HydrophobicContact CD2-CE1 3.83Å; F115-V154 HydrophobicContact CE2-CG2 4.21Å
116I90.3Very high90.9Very high72 Ų7274 Ų7437%0.36936%0.361SS..Hα-helixtrans-61.2-46.1177.6-56.3173.6000110.4E109 H112 R113 R119 N120E109-I116 WeakPolarHBondContact O-CD1 3.47Å; H112-I116 PolarHBondContact O-N 3.17Å; R113-I116 PolarHBondContact O-N 2.99Å; I116-R119 PolarHBondContact O-N 3.27Å; I116-N120 WeakPolarHBondContact O-CB 3.42Å; I116-N120 PolarHBondContact O-N 3.28Å; I116-N120 PolarHBondContact O-ND2 3.46Å
117E91.4Very high91Very high107 Ų10777.9 Ų77.950%0.537%0.373SS..Hα-helixtrans-60.8-47.5177.9-176.5170.8-175.800111.6R113 F115 R119 N120 N121R113-E117 PolarHBondContact O-N 3.46Å; R113-E117 VanDerWaalsContact O-N 3.07Å; F115-E117 VanDerWaalsContact C-N 3.34Å; F115-E117 PolarHBondContact O-N 3.41Å; E117-R119 PolarHBondContact O-N 3.5Å; E117-N120 PolarHBondContact O-N 3.47Å; E117-N121 PolarHBondContact O-N 3.04Å; E117-N121 PolarHBondContact O-ND2 3.11Å
118T92.4Very high91.1Very high17 Ų1778.7 Ų78.710%0.10437%0.372CS..Hα-helixtrans-59.3-46.1177-62.20000111.7N114 F115 N120 N121 I122 Y153 Y161N114-T118 VanDerWaalsContact O-CB 3.29Å; N114-T118 WeakPolarHBondContact O-CB 3.47Å; N114-T118 PolarHBondContact O-N 3.13Å; N114-T118 PolarHBondContact O-OG1 2.98Å; F115-T118 PolarHBondContact O-N 3.21Å; T118-N120 VanDerWaalsContact C-N 3.34Å; T118-N120 PolarHBondContact O-N 3.1Å; T118-N121 PolarHBondContact O-N 3.36Å; T118-I122 HydrophobicContact CG2-CD1 3.85Å; T118-I122 HydrophobicContact CG2-CG1 4.49Å; T118-I122 WeakPolarHBondContact O-CG1 3.48Å; T118-I122 PolarHBondContact O-N 3.03Å; T118-Y153 HydrophobicContact CG2-CD1 4.3Å; T118-Y153 HydrophobicContact CG2-CD2 3.75Å; T118-Y153 HydrophobicContact CG2-CE2 3.99Å; T118-Y153 HydrophobicContact CG2-CG 3.9Å; T118-Y161 HydrophobicContact CG2-CG 4.37Å
119R93.6Very high91.2Very high77 Ų7778.1 Ų78.129%0.29137%0.369SS..Hα-helixtrans-61-43.1177-176.6-179.2-177.7-171.57.8111.9E109 F115 I116 E117 N121 I122 A123 E146 L150E109-R119 IonicContact OE1-CZ 3.68Å; E109-R119 IonicContact OE1-NH1 2.88Å; E109-R119 PolarHBondContact OE1-NH1 3.28Å; F115-R119 WeakPolarHBondContact O-CB 3.17Å; F115-R119 PolarHBondContact O-N 3.34Å; I116-R119 PolarHBondContact O-N 3.27Å; E117-R119 PolarHBondContact O-N 3.5Å; R119-N121 VanDerWaalsContact C-N 3.31Å; R119-N121 PolarHBondContact O-N 3.37Å; R119-I122 PolarHBondContact O-N 2.96Å; R119-A123 WeakPolarHBondContact O-CB 3.38Å; R119-A123 PolarHBondContact O-N 2.99Å; R119-E146 IonicContact NE-OE1 2.62Å; R119-L150 HydrophobicContact CB-CD2 3.93Å; R119-L150 HydrophobicContact CG-CD1 4.28Å; R119-L150 HydrophobicContact CG-CD2 4.03Å
120N94.3Very high91Very high87 Ų8784.9 Ų84.947%0.46539%0.393SS..Hα-helixtrans-64.1-37.8177.2-71.3-22.2000111.9I116 E117 T118 R124I116-N120 WeakPolarHBondContact O-CB 3.42Å; I116-N120 PolarHBondContact O-N 3.28Å; I116-N120 PolarHBondContact O-ND2 3.46Å; E117-N120 PolarHBondContact O-N 3.47Å; T118-N120 VanDerWaalsContact C-N 3.34Å; T118-N120 PolarHBondContact O-N 3.1Å; N120-R124 VanDerWaalsContact O-CB 3.32Å; N120-R124 WeakPolarHBondContact O-CB 3.34Å; N120-R124 PolarHBondContact O-N 3.46Å
121N95Very high90.8Very high61 Ų6180.7 Ų80.733%0.32637%0.371SS..Hα-helixtrans-65.5-46.7175.5-68.1-18.9000111.2E117 T118 R119 A123 R124 D125 Y161E117-N121 PolarHBondContact O-N 3.04Å; E117-N121 PolarHBondContact O-ND2 3.11Å; T118-N121 PolarHBondContact O-N 3.36Å; R119-N121 VanDerWaalsContact C-N 3.31Å; R119-N121 PolarHBondContact O-N 3.37Å; N121-A123 PolarHBondContact O-N 3.11Å; N121-R124 PolarHBondContact O-N 3.22Å; N121-D125 WeakPolarHBondContact O-CB 3.4Å; N121-D125 PolarHBondContact O-N 2.98Å; N121-Y161 HydrophobicContact CB-CD1 4.14Å; N121-Y161 HydrophobicContact CB-CE1 4.18Å
122I95.9Very high91Very high0 Ų080.5 Ų80.50%037%0.365CS..Hα-helixtrans-56.6-50.2173.7-71.3164.3000110.7T118 R119 R124 D125 I126 E146 L149 L150 Y161T118-I122 HydrophobicContact CG2-CD1 3.85Å; T118-I122 HydrophobicContact CG2-CG1 4.49Å; T118-I122 WeakPolarHBondContact O-CG1 3.48Å; T118-I122 PolarHBondContact O-N 3.03Å; R119-I122 PolarHBondContact O-N 2.96Å; I122-R124 PolarHBondContact O-N 3.45Å; I122-D125 PolarHBondContact O-N 3.09Å; I122-I126 HydrophobicContact CG2-CD1 3.64Å; I122-I126 HydrophobicContact CG2-CG1 4.31Å; I122-I126 WeakPolarHBondContact O-CG1 3.49Å; I122-I126 PolarHBondContact O-N 3.38Å; I122-E146 HydrophobicContact CG2-CG 4.15Å; I122-L149 HydrophobicContact CD1-CB 3.89Å; I122-L149 HydrophobicContact CG1-CB 4.26Å; I122-L149 HydrophobicContact CG1-CD1 4.49Å; I122-L149 HydrophobicContact CG2-CB 4.12Å; I122-L149 HydrophobicContact CG2-CD1 3.73Å; I122-L150 HydrophobicContact CD1-CD2 3.74Å; I122-L150 HydrophobicContact CD1-CG 4.19Å; I122-Y161 HydrophobicContact CD1-CD2 4.05Å; I122-Y161 HydrophobicContact CD1-CE2 4.46Å; I122-Y161 HydrophobicContact CD1-CG 4.31Å; I122-Y161 HydrophobicContact CG1-CD1 4.06Å; I122-Y161 HydrophobicContact CG1-CD2 3.53Å; I122-Y161 HydrophobicContact CG1-CE1 4.08Å; I122-Y161 HydrophobicContact CG1-CE2 3.55Å; I122-Y161 HydrophobicContact CG1-CG 3.8Å
123A95.7Very high90.9Very high29 Ų2978 Ų7824%0.2436%0.355CS..Hα-helixtrans-61.2-44.6-178.200000112.1R119 N121 D125 I126 Q127R119-A123 WeakPolarHBondContact O-CB 3.38Å; R119-A123 PolarHBondContact O-N 2.99Å; N121-A123 PolarHBondContact O-N 3.11Å; A123-D125 VanDerWaalsContact C-N 3.28Å; A123-D125 PolarHBondContact O-N 3.1Å; A123-I126 PolarHBondContact O-N 3.43Å; A123-Q127 VanDerWaalsContact O-CG 3.27Å; A123-Q127 WeakPolarHBondContact O-CG 3.47Å; A123-Q127 PolarHBondContact O-N 3.36Å
124R95.6Very high91Very high143 Ų14374.9 Ų74.954%0.5436%0.361SS..Hα-helixtrans-61.1-37.7177.4-172.9-165.5-52-95.2-0.4112.2N120 N121 I122N120-R124 VanDerWaalsContact O-CB 3.32Å; N120-R124 WeakPolarHBondContact O-CB 3.34Å; N120-R124 PolarHBondContact O-N 3.46Å; N121-R124 PolarHBondContact O-N 3.22Å; I122-R124 PolarHBondContact O-N 3.45Å
125D95.4Very high91.1Very high10 Ų1076.8 Ų76.85%0.05337%0.371CS..Hα-helixtrans-75.1-44.3-180-84.8-9.4000112.2N121 I122 A123 Q127 K128 Y161 H166N121-D125 WeakPolarHBondContact O-CB 3.4Å; N121-D125 PolarHBondContact O-N 2.98Å; I122-D125 PolarHBondContact O-N 3.09Å; A123-D125 VanDerWaalsContact C-N 3.28Å; A123-D125 PolarHBondContact O-N 3.1Å; D125-Q127 PolarHBondContact O-N 2.83Å; D125-K128 WeakPolarHBondContact O-CB 3.4Å; D125-K128 PolarHBondContact O-N 2.91Å; D125-K128 IonicContact OD1-NZ 3.54Å; D125-K128 PolarHBondContact OD1-NZ 2.99Å; D125-Y161 WeakPolarHBondContact CB-OH 3.25Å; D125-Y161 PolarHBondContact OD2-OH 3.01Å; D125-H166 VanDerWaalsContact CB-CE1 3.46Å; D125-H166 WeakPolarHBondContact CB-CE1 3.44Å; D125-H166 WeakPolarHBondContact CB-ND1 3.48Å; D125-H166 IonicContact OD2-CE1 3.54Å; D125-H166 PolarHBondContact OD2-CE1 2.93Å; D125-H166 IonicContact OD2-ND1 3.55Å
126I95.4Very high90.9Very high10 Ų1078.7 Ų78.75%0.05139%0.391CS..Hα-helixtrans-58.8-36.8174.7-71.7176.2000111.4I122 A123 K128 L129 K142 L145 E146 L149 H166I122-I126 HydrophobicContact CG2-CD1 3.64Å; I122-I126 HydrophobicContact CG2-CG1 4.31Å; I122-I126 WeakPolarHBondContact O-CG1 3.49Å; I122-I126 PolarHBondContact O-N 3.38Å; A123-I126 PolarHBondContact O-N 3.43Å; I126-K128 PolarHBondContact O-N 3.35Å; I126-L129 WeakPolarHBondContact O-CB 3.5Å; I126-L129 PolarHBondContact O-N 3.44Å; I126-K142 HydrophobicContact CG2-CB 3.59Å; I126-K142 HydrophobicContact CG2-CD 3.92Å; I126-K142 HydrophobicContact CG2-CG 3.6Å; I126-K142 VanDerWaalsContact O-CE 3.24Å; I126-K142 WeakPolarHBondContact O-CE 3.44Å; I126-L145 HydrophobicContact CD1-CB 4Å; I126-E146 VanDerWaalsContact CD1-CA 3.45Å; I126-E146 HydrophobicContact CD1-CB 3.6Å; I126-E146 HydrophobicContact CD1-CG 4.32Å; I126-L149 HydrophobicContact CD1-CD1 4.1Å; I126-L149 HydrophobicContact CG1-CD1 4.43Å; I126-H166 HydrophobicContact CG1-CB 4.12Å
127Q92.8Very high90.7Very high148 Ų14879.7 Ų79.769%0.69240%0.397SS*.Hα-helixtrans-58.2-28.9177.4-79.7173.50.400113.5A123 D125 L129A123-Q127 VanDerWaalsContact O-CG 3.27Å; A123-Q127 WeakPolarHBondContact O-CG 3.47Å; A123-Q127 PolarHBondContact O-N 3.36Å; D125-Q127 PolarHBondContact O-N 2.83Å; Q127-L129 VanDerWaalsContact C-N 3.32Å
128K90.5Very high90.5Very high119 Ų11979.6 Ų79.652%0.51740%0.404SS..THydrogen-bonded Turntrans-80-13-180-59.1167.1-168.91600113D125 I126D125-K128 WeakPolarHBondContact O-CB 3.4Å; D125-K128 PolarHBondContact O-N 2.91Å; D125-K128 IonicContact OD1-NZ 3.54Å; D125-K128 PolarHBondContact OD1-NZ 2.99Å; I126-K128 PolarHBondContact O-N 3.35Å
129L90.5Very high90.1Very high17 Ų1782.7 Ų82.79%0.08942%0.419CS..SBendtrans-72.7133.4179.5-65.9177.8000111.1I126 Q127 D131 K142 L145 H166 E167 M170I126-L129 WeakPolarHBondContact O-CB 3.5Å; I126-L129 PolarHBondContact O-N 3.44Å; Q127-L129 VanDerWaalsContact C-N 3.32Å; L129-D131 PolarHBondContact O-N 3.31Å; L129-K142 VanDerWaalsContact O-CE 3.22Å; L129-K142 WeakPolarHBondContact O-CE 3.43Å; L129-K142 PolarHBondContact O-NZ 3.46Å; L129-L145 HydrophobicContact CD1-CD1 3.55Å; L129-H166 HydrophobicContact CD1-CB 4.44Å; L129-E167 HydrophobicContact CD2-CG 3.94Å; L129-M170 HydrophobicContact CD1-CB 4.47Å; L129-M170 HydrophobicContact CD1-SD 4.44Å; L129-M170 HydrophobicContact CD2-SD 4.02Å
130Y84.8Confident89.9Confident206 Ų20679.1 Ų79.181%0.80841%0.406SS*.  trans-71.4113.4164.7-67.3-83.7000108.6
131D83.8Confident89.8Confident47 Ų4778 Ų7825%0.25140%0.4SS..  trans-103.42.1-175.853.9-10.9000113.6L129 V138 L139 I140 K142L129-D131 PolarHBondContact O-N 3.31Å; D131-V138 CarbonylContact O-C 3.57Å; D131-V138 WeakPolarHBondContact O-CA 3.43Å; D131-L139 PolarHBondContact O-N 3.31Å; D131-I140 HydrophobicContact CB-CB 4.39Å; D131-I140 PolarHBondContact O-N 2.64Å; D131-K142 HydrophobicContact CB-CD 4.14Å; D131-K142 HydrophobicContact CB-CG 4.27Å; D131-K142 IonicContact OD1-NZ 3.64Å; D131-K142 PolarHBondContact OD1-NZ 3.49Å; D131-K142 WeakPolarHBondContact OD2-CD 3.24Å; D131-K142 WeakPolarHBondContact OD2-CE 3.34Å; D131-K142 IonicContact OD2-NZ 3.64Å; D131-K142 PolarHBondContact OD2-NZ 3.33Å
132K87.3Confident89.7Confident122 Ų12277.4 Ų77.453%0.5340%0.395SS..BIsolated β-bridgetrans-127.8144.6-178.1-63.9178.8-177.2-176.90111.6N137K132-N137 CarbonylContact C-O 3.54Å; K132-N137 WeakPolarHBondContact CA-O 3.46Å
133D84.2Confident89.6Confident48 Ų4885.3 Ų85.326%0.25743%0.429SS..  trans-72.3172.3169.476.23.8000111.2L135 G136 N137D133-L135 PolarHBondContact O-N 2.96Å; D133-L135 VanDerWaalsContact OD1-C 3.24Å; D133-L135 VanDerWaalsContact OD1-CA 3.27Å; D133-L135 WeakPolarHBondContact OD1-CA 3.27Å; D133-L135 WeakPolarHBondContact OD1-CB 3.5Å; D133-L135 PolarHBondContact OD1-N 3.07Å; D133-G136 PolarHBondContact O-N 2.97Å; D133-G136 PolarHBondContact OD1-N 3.46Å; D133-N137 PolarHBondContact N-O 2.94Å; D133-N137 PolarHBondContact OD1-N 2.99Å; D133-N137 WeakPolarHBondContact OD2-CB 3.48Å; D133-N137 PolarHBondContact OD2-ND2 2.91Å
134P86.1Confident89.5Confident141 Ų14187.2 Ų87.292%0.91643%0.43SS*.THydrogen-bonded Turntrans-59.1-17.6176.6-26.736.6000114.8
135L87.6Confident89.5Confident149 Ų14980.4 Ų80.478%0.7840%0.404SS*.THydrogen-bonded Turntrans-91.6-4177.5-57.2176.3000112.3D133D133-L135 PolarHBondContact O-N 2.96Å; D133-L135 VanDerWaalsContact OD1-C 3.24Å; D133-L135 VanDerWaalsContact OD1-CA 3.27Å; D133-L135 WeakPolarHBondContact OD1-CA 3.27Å; D133-L135 WeakPolarHBondContact OD1-CB 3.5Å; D133-L135 PolarHBondContact OD1-N 3.07Å
136G85.8Confident89.5Confident42 Ų4282.3 Ų82.343%0.43341%0.413SS..  trans85.75.4-179.700000114.8D133D133-G136 PolarHBondContact O-N 2.97Å; D133-G136 PolarHBondContact OD1-N 3.46Å
137N86.8Confident89.5Confident93 Ų9385 Ų8550%0.49742%0.424SS..  trans-70.7138.2175.1-56.3-56.3000109.8K132 D133 L139K132-N137 CarbonylContact C-O 3.54Å; K132-N137 WeakPolarHBondContact CA-O 3.46Å; D133-N137 PolarHBondContact N-O 2.94Å; D133-N137 PolarHBondContact OD1-N 2.99Å; D133-N137 WeakPolarHBondContact OD2-CB 3.48Å; D133-N137 PolarHBondContact OD2-ND2 2.91Å; N137-L139 PolarHBondContact O-N 3.37Å
138V86.5Confident89.7Confident105 Ų10578 Ų7864%0.63639%0.391SS*.BIsolated β-bridgetrans-65.8111.7175.8179.90000108.5D131 I140D131-V138 CarbonylContact O-C 3.57Å; D131-V138 WeakPolarHBondContact O-CA 3.43Å; V138-I140 WeakPolarHBondContact CG1-O 3.33Å
139L84.9Confident89.9Confident82 Ų8272.4 Ų72.443%0.42937%0.367SS..  trans-85.4-35.5177-177.765.8000110.8D131 N137 L174D131-L139 PolarHBondContact O-N 3.31Å; N137-L139 PolarHBondContact O-N 3.37Å; L139-L174 HydrophobicContact CD1-CD2 3.69Å; L139-L174 HydrophobicContact CD2-CD2 4.29Å; L139-L174 HydrophobicContact CG-CD2 3.77Å
140I89.1Confident90.1Very high2 Ų271.9 Ų71.91%0.0136%0.364CS..  trans-132.2131.4-172.7-56.1-64.3000111D131 V138 K142 L145 M170 L174D131-I140 HydrophobicContact CB-CB 4.39Å; D131-I140 PolarHBondContact O-N 2.64Å; V138-I140 WeakPolarHBondContact CG1-O 3.33Å; I140-K142 PolarHBondContact O-N 2.9Å; I140-L145 HydrophobicContact CG2-CD1 3.5Å; I140-L145 HydrophobicContact CG2-CG 3.99Å; I140-M170 HydrophobicContact CD1-CG 3.44Å; I140-M170 VanDerWaalsContact CD1-CG 3.44Å; I140-M170 HydrophobicContact CD1-SD 4.43Å; I140-M170 HydrophobicContact CG1-CG 3.74Å; I140-M170 HydrophobicContact CG1-SD 4.26Å; I140-M170 HydrophobicContact CG2-CG 4.21Å; I140-L174 HydrophobicContact CD1-CD1 4Å; I140-L174 HydrophobicContact CD1-CD2 3.45Å; I140-L174 VanDerWaalsContact CD1-CD2 3.45Å; I140-L174 HydrophobicContact CD1-CG 3.48Å; I140-L174 VanDerWaalsContact CD1-CG 3.48Å
141D92Very high90.6Very high63 Ų6362.1 Ų62.134%0.33733%0.326SS..  trans-86.4101.7168.5-172.6-27.5000110.4K143 R144 L145 Q173D141-K143 VanDerWaalsContact C-N 3.28Å; D141-K143 PolarHBondContact O-N 3.22Å; D141-K143 WeakPolarHBondContact OD1-CA 3.22Å; D141-K143 WeakPolarHBondContact OD1-CB 3.37Å; D141-K143 PolarHBondContact OD1-N 3.14Å; D141-R144 HydrophobicContact CB-CB 3.96Å; D141-R144 HydrophobicContact CB-CG 3.9Å; D141-R144 VanDerWaalsContact CG-CG 3.44Å; D141-R144 PolarHBondContact O-N 3.11Å; D141-R144 PolarHBondContact OD1-N 3.35Å; D141-R144 WeakPolarHBondContact OD2-CD 3.23Å; D141-R144 VanDerWaalsContact OD2-CG 3.32Å; D141-R144 WeakPolarHBondContact OD2-CG 3.5Å; D141-L145 PolarHBondContact O-N 3.21Å; D141-L145 VanDerWaalsContact O-N 3.1Å; D141-Q173 PolarHBondContact O-NE2 3.34Å
142K93.9Very high91.1Very high50 Ų5060.6 Ų60.622%0.21732%0.319CS..Hα-helixtrans-60.6-32.1177.8-74.3179.3165.11540113.4I126 L129 D131 I140 L145 E146I126-K142 HydrophobicContact CG2-CB 3.59Å; I126-K142 HydrophobicContact CG2-CD 3.92Å; I126-K142 HydrophobicContact CG2-CG 3.6Å; I126-K142 VanDerWaalsContact O-CE 3.24Å; I126-K142 WeakPolarHBondContact O-CE 3.44Å; L129-K142 VanDerWaalsContact O-CE 3.22Å; L129-K142 WeakPolarHBondContact O-CE 3.43Å; L129-K142 PolarHBondContact O-NZ 3.46Å; D131-K142 HydrophobicContact CB-CD 4.14Å; D131-K142 HydrophobicContact CB-CG 4.27Å; D131-K142 IonicContact OD1-NZ 3.64Å; D131-K142 PolarHBondContact OD1-NZ 3.49Å; D131-K142 WeakPolarHBondContact OD2-CD 3.24Å; D131-K142 WeakPolarHBondContact OD2-CE 3.34Å; D131-K142 IonicContact OD2-NZ 3.64Å; D131-K142 PolarHBondContact OD2-NZ 3.33Å; I140-K142 PolarHBondContact O-N 2.9Å; K142-L145 PolarHBondContact O-N 2.95Å; K142-E146 PolarHBondContact O-N 3.31Å
143K93.3Very high91.2Very high166 Ų16656.1 Ų56.172%0.72230%0.299SS*.Hα-helixtrans-71.9-38.9178.4-65.7-177.1179.1178.90110.7D141 L145 E146 K147D141-K143 VanDerWaalsContact C-N 3.28Å; D141-K143 PolarHBondContact O-N 3.22Å; D141-K143 WeakPolarHBondContact OD1-CA 3.22Å; D141-K143 WeakPolarHBondContact OD1-CB 3.37Å; D141-K143 PolarHBondContact OD1-N 3.14Å; K143-L145 VanDerWaalsContact C-N 3.35Å; K143-E146 PolarHBondContact O-N 3.23Å; K143-K147 WeakPolarHBondContact O-CB 3.5Å; K143-K147 PolarHBondContact O-N 3.02Å
144R93.4Very high91.5Very high68 Ų6855 Ų5526%0.25729%0.294SS..Hα-helixtrans-61.8-43.1173.1-70174.665.2-165.70.8110.9D141 K147 I148 E177 D179D141-R144 HydrophobicContact CB-CB 3.96Å; D141-R144 HydrophobicContact CB-CG 3.9Å; D141-R144 VanDerWaalsContact CG-CG 3.44Å; D141-R144 PolarHBondContact O-N 3.11Å; D141-R144 PolarHBondContact OD1-N 3.35Å; D141-R144 WeakPolarHBondContact OD2-CD 3.23Å; D141-R144 VanDerWaalsContact OD2-CG 3.32Å; D141-R144 WeakPolarHBondContact OD2-CG 3.5Å; R144-K147 PolarHBondContact O-N 2.86Å; R144-I148 WeakPolarHBondContact O-CG1 3.27Å; R144-I148 PolarHBondContact O-N 3.43Å; R144-E177 PolarHBondContact NH2-O 3.44Å; R144-D179 IonicContact CZ-OD1 3.06Å; R144-D179 VanDerWaalsContact NE-CG 3.34Å; R144-D179 IonicContact NE-OD1 3.43Å; R144-D179 PolarHBondContact NE-OD1 3.01Å; R144-D179 IonicContact NE-OD2 2.62Å; R144-D179 PolarHBondContact NE-OD2 3.12Å; R144-D179 IonicContact NH2-OD1 2.84Å; R144-D179 PolarHBondContact NH2-OD1 2.91Å
145L95.1Very high91.6Very high0 Ų051.1 Ų51.10%027%0.27CS..Hα-helixtrans-59-50.9174-67.8-174.3000112.5I126 L129 I140 D141 K142 K143 K147 I148 L149 V169 M170 Q173I126-L145 HydrophobicContact CD1-CB 4Å; L129-L145 HydrophobicContact CD1-CD1 3.55Å; I140-L145 HydrophobicContact CG2-CD1 3.5Å; I140-L145 HydrophobicContact CG2-CG 3.99Å; D141-L145 PolarHBondContact O-N 3.21Å; D141-L145 VanDerWaalsContact O-N 3.1Å; K142-L145 PolarHBondContact O-N 2.95Å; K143-L145 VanDerWaalsContact C-N 3.35Å; L145-K147 VanDerWaalsContact C-N 3.29Å; L145-K147 PolarHBondContact O-N 2.82Å; L145-I148 PolarHBondContact O-N 3.38Å; L145-L149 WeakPolarHBondContact O-CG 3.36Å; L145-L149 PolarHBondContact O-N 2.85Å; L145-V169 HydrophobicContact CD2-CB 3.91Å; L145-V169 HydrophobicContact CD2-CG1 3.44Å; L145-V169 VanDerWaalsContact CD2-CG1 3.44Å; L145-M170 HydrophobicContact CD1-CB 4.14Å; L145-M170 HydrophobicContact CD2-CB 4.46Å; L145-Q173 HydrophobicContact CD2-CB 4.3Å
146E95.7Very high91.3Very high50 Ų5047.8 Ų47.823%0.23425%0.253CS..Hα-helixtrans-56.7-46.6179.7-173.8-178.1179.900110.7R119 I122 I126 K142 K143 I148 L149 L150R119-E146 IonicContact NE-OE1 2.62Å; I122-E146 HydrophobicContact CG2-CG 4.15Å; I126-E146 VanDerWaalsContact CD1-CA 3.45Å; I126-E146 HydrophobicContact CD1-CB 3.6Å; I126-E146 HydrophobicContact CD1-CG 4.32Å; K142-E146 PolarHBondContact O-N 3.31Å; K143-E146 PolarHBondContact O-N 3.23Å; E146-I148 PolarHBondContact O-N 3.26Å; E146-L149 PolarHBondContact O-N 2.94Å; E146-L150 HydrophobicContact CG-CD1 3.72Å; E146-L150 HydrophobicContact CG-CG 4.39Å; E146-L150 WeakPolarHBondContact O-CB 3.48Å; E146-L150 VanDerWaalsContact O-CG 3.28Å; E146-L150 WeakPolarHBondContact O-CG 3.25Å; E146-L150 PolarHBondContact O-N 2.99Å
147K95.6Very high90.7Very high67 Ų6749.9 Ų49.929%0.29126%0.257SS..Hα-helixtrans-59.3-46.4177.8-178179.4175.9-177.40112.3C98 K143 R144 L145 L150 L151C98-K147 WeakPolarHBondContact SG-CE 3.23Å; C98-K147 PolarHBondContact SG-NZ 3.03Å; C98-K147 VanDerWaalsContact SG-NZ 3.38Å; K143-K147 WeakPolarHBondContact O-CB 3.5Å; K143-K147 PolarHBondContact O-N 3.02Å; R144-K147 PolarHBondContact O-N 2.86Å; L145-K147 VanDerWaalsContact C-N 3.29Å; L145-K147 PolarHBondContact O-N 2.82Å; K147-L150 PolarHBondContact O-N 3.01Å; K147-L151 HydrophobicContact CG-CD1 4.04Å; K147-L151 HydrophobicContact CG-CG 4.48Å; K147-L151 WeakPolarHBondContact O-CB 3.47Å; K147-L151 VanDerWaalsContact O-CG 3.26Å; K147-L151 WeakPolarHBondContact O-CG 3.44Å; K147-L151 PolarHBondContact O-N 3.39Å
148I96.1Very high89.9Confident0 Ų053.3 Ų53.30%027%0.27CS..Hα-helixtrans-63.6-43.5-179.5-71.2167.4000111R144 L145 E146 L151 S152 V169 T182 F183 F186R144-I148 WeakPolarHBondContact O-CG1 3.27Å; R144-I148 PolarHBondContact O-N 3.43Å; L145-I148 PolarHBondContact O-N 3.38Å; E146-I148 PolarHBondContact O-N 3.26Å; I148-L151 PolarHBondContact O-N 3.16Å; I148-S152 WeakPolarHBondContact O-CB 3.4Å; I148-S152 PolarHBondContact O-N 2.87Å; I148-V169 HydrophobicContact CB-CG1 4.02Å; I148-V169 HydrophobicContact CD1-CG1 4.12Å; I148-V169 HydrophobicContact CG2-CG1 3.63Å; I148-V169 HydrophobicContact CG2-CG2 4.18Å; I148-T182 HydrophobicContact CD1-CG2 3.55Å; I148-F183 HydrophobicContact CG1-CB 4.49Å; I148-F183 HydrophobicContact CG2-CB 4.44Å; I148-F183 HydrophobicContact CG2-CD2 4.26Å; I148-F186 HydrophobicContact CG2-CD1 4.4Å
149L95.9Very high89.1Confident3 Ų350.4 Ų50.42%0.01626%0.257CS..Hα-helixtrans-66.2-42.4179.1-68.6167000112.2I122 I126 L145 E146 S152 Y153 Y161 F165 H166 V169 F186I122-L149 HydrophobicContact CD1-CB 3.89Å; I122-L149 HydrophobicContact CG1-CB 4.26Å; I122-L149 HydrophobicContact CG1-CD1 4.49Å; I122-L149 HydrophobicContact CG2-CB 4.12Å; I122-L149 HydrophobicContact CG2-CD1 3.73Å; I126-L149 HydrophobicContact CD1-CD1 4.1Å; I126-L149 HydrophobicContact CG1-CD1 4.43Å; L145-L149 WeakPolarHBondContact O-CG 3.36Å; L145-L149 PolarHBondContact O-N 2.85Å; E146-L149 PolarHBondContact O-N 2.94Å; L149-S152 WeakPolarHBondContact O-CB 3.44Å; L149-S152 PolarHBondContact O-N 3.23Å; L149-Y153 PolarHBondContact O-N 3.45Å; L149-Y161 HydrophobicContact CD1-CE2 4.33Å; L149-Y161 HydrophobicContact CD2-CE2 4.19Å; L149-F165 HydrophobicContact CD2-CB 3.72Å; L149-H166 HydrophobicContact CD1-CB 3.82Å; L149-V169 HydrophobicContact CD2-CG2 3.68Å; L149-V169 HydrophobicContact CG-CG2 4.26Å; L149-F186 HydrophobicContact CD2-CE1 4.36Å; L149-F186 HydrophobicContact CD2-CZ 4.42Å
150L94.6Very high88.9Confident5 Ų553 Ų533%0.02627%0.267CS..Hα-helixtrans-65.9-40.9176.7-70.1170.3000111.7Y101 F115 R119 I122 E146 K147 S152 Y153 V154Y101-L150 HydrophobicContact CE2-CB 4.44Å; Y101-L150 WeakPolarHBondContact OH-CD1 3.14Å; F115-L150 HydrophobicContact CE2-CD2 4.16Å; F115-L150 HydrophobicContact CZ-CD2 4.42Å; R119-L150 HydrophobicContact CB-CD2 3.93Å; R119-L150 HydrophobicContact CG-CD1 4.28Å; R119-L150 HydrophobicContact CG-CD2 4.03Å; I122-L150 HydrophobicContact CD1-CD2 3.74Å; I122-L150 HydrophobicContact CD1-CG 4.19Å; E146-L150 HydrophobicContact CG-CD1 3.72Å; E146-L150 HydrophobicContact CG-CG 4.39Å; E146-L150 WeakPolarHBondContact O-CB 3.48Å; E146-L150 VanDerWaalsContact O-CG 3.28Å; E146-L150 WeakPolarHBondContact O-CG 3.25Å; E146-L150 PolarHBondContact O-N 2.99Å; K147-L150 PolarHBondContact O-N 3.01Å; L150-S152 VanDerWaalsContact C-N 3.33Å; L150-S152 PolarHBondContact O-N 2.97Å; L150-Y153 PolarHBondContact O-N 3.38Å; L150-V154 WeakPolarHBondContact O-CG2 3.29Å; L150-V154 PolarHBondContact O-N 3.4Å
151L95.1Very high89Confident2 Ų254.6 Ų54.61%0.0127%0.273CS..Hα-helixtrans-61.8-42.1173-74.6173.7000111.5Y94 Y101 K147 I148 Y153 V154 C155 F183Y94-L151 HydrophobicContact CE2-CD1 3.66Å; Y101-L151 VanDerWaalsContact CB-CD2 3.5Å; Y101-L151 HydrophobicContact CD1-CD2 4.19Å; Y101-L151 HydrophobicContact CD2-CD2 4.38Å; Y101-L151 HydrophobicContact CG-CD2 3.76Å; K147-L151 HydrophobicContact CG-CD1 4.04Å; K147-L151 HydrophobicContact CG-CG 4.48Å; K147-L151 WeakPolarHBondContact O-CB 3.47Å; K147-L151 VanDerWaalsContact O-CG 3.26Å; K147-L151 WeakPolarHBondContact O-CG 3.44Å; K147-L151 PolarHBondContact O-N 3.39Å; I148-L151 PolarHBondContact O-N 3.16Å; L151-Y153 VanDerWaalsContact C-N 3.35Å; L151-Y153 PolarHBondContact O-N 3.13Å; L151-V154 PolarHBondContact O-N 3.5Å; L151-C155 WeakPolarHBondContact O-CB 3.45Å; L151-C155 PolarHBondContact O-N 2.97Å; L151-C155 PolarHBondContact O-SG 3.4Å; L151-F183 HydrophobicContact CB-CD2 4.14Å; L151-F183 HydrophobicContact CB-CE2 3.72Å
152S93.4Very high88.9Confident14 Ų1452.6 Ų52.610%0.09826%0.262CS..Hα-helixtrans-58.6-46.8176-172.10000111.4I148 L149 L150 C155 N156 Q187I148-S152 WeakPolarHBondContact O-CB 3.4Å; I148-S152 PolarHBondContact O-N 2.87Å; L149-S152 WeakPolarHBondContact O-CB 3.44Å; L149-S152 PolarHBondContact O-N 3.23Å; L150-S152 VanDerWaalsContact C-N 3.33Å; L150-S152 PolarHBondContact O-N 2.97Å; S152-C155 PolarHBondContact O-N 3.3Å; S152-N156 PolarHBondContact O-N 2.69Å; S152-Q187 PolarHBondContact OG-NE2 3.06Å
153Y91.1Very high88.7Confident28 Ų2854.9 Ų54.911%0.1127%0.273CS..Hα-helixtrans-61.5-44.3177.3175.2-101.2000112.2F115 T118 L149 L150 L151 C155 N156 T157F115-Y153 HydrophobicContact CB-CE1 4.26Å; F115-Y153 AromaticContact CD2-CD1 3.99Å; F115-Y153 HydrophobicContact CD2-CD1 3.99Å; F115-Y153 AromaticContact CD2-CE1 3.83Å; F115-Y153 HydrophobicContact CD2-CE1 3.83Å; T118-Y153 HydrophobicContact CG2-CD1 4.3Å; T118-Y153 HydrophobicContact CG2-CD2 3.75Å; T118-Y153 HydrophobicContact CG2-CE2 3.99Å; T118-Y153 HydrophobicContact CG2-CG 3.9Å; L149-Y153 PolarHBondContact O-N 3.45Å; L150-Y153 PolarHBondContact O-N 3.38Å; L151-Y153 VanDerWaalsContact C-N 3.35Å; L151-Y153 PolarHBondContact O-N 3.13Å; Y153-C155 VanDerWaalsContact C-N 3.33Å; Y153-C155 PolarHBondContact O-N 3.15Å; Y153-N156 CarbonylContact O-C 3.51Å; Y153-N156 PolarHBondContact O-N 2.96Å; Y153-T157 WeakPolarHBondContact O-CA 3.44Å; Y153-T157 PolarHBondContact O-N 2.91Å
154V90.1Very high88.5Confident24 Ų2447 Ų4715%0.14524%0.239CC..Hα-helixtrans-68.7-32.5-179.3169.90000112.2M100 Y101 I104 L108 F115 L150 L151 N156M100-V154 HydrophobicContact CE-CG1 4.15Å; Y101-V154 HydrophobicContact CD2-CG2 3.93Å; Y101-V154 HydrophobicContact CE2-CG2 3.88Å; I104-V154 HydrophobicContact CD1-CG1 3.88Å; L108-V154 HydrophobicContact CD1-CG2 3.84Å; F115-V154 HydrophobicContact CE2-CG2 4.21Å; L150-V154 WeakPolarHBondContact O-CG2 3.29Å; L150-V154 PolarHBondContact O-N 3.4Å; L151-V154 PolarHBondContact O-N 3.5Å; V154-N156 VanDerWaalsContact C-N 3.28Å; V154-N156 PolarHBondContact O-N 3.39Å
155C88.1Confident88.6Confident61 Ų6144.4 Ų44.441%0.41223%0.229SC..Hα-helixtrans-72.3-23.4176.9-67.20000112.8L151 S152 Y153L151-C155 WeakPolarHBondContact O-CB 3.45Å; L151-C155 PolarHBondContact O-N 2.97Å; L151-C155 PolarHBondContact O-SG 3.4Å; S152-C155 PolarHBondContact O-N 3.3Å; Y153-C155 VanDerWaalsContact C-N 3.33Å; Y153-C155 PolarHBondContact O-N 3.15Å
156N81.8Confident88.6Confident79 Ų7944.5 Ų44.542%0.42223%0.23SC..  trans-146.784.1177-174.5-0.8000110.5S152 Y153 V154 Q158 A159S152-N156 PolarHBondContact O-N 2.69Å; Y153-N156 CarbonylContact O-C 3.51Å; Y153-N156 PolarHBondContact O-N 2.96Å; V154-N156 VanDerWaalsContact C-N 3.28Å; V154-N156 PolarHBondContact O-N 3.39Å; N156-Q158 PolarHBondContact O-N 3.39Å; N156-Q158 VanDerWaalsContact O-N 3.13Å; N156-Q158 PolarHBondContact OD1-N 2.84Å; N156-A159 HydrophobicContact CB-CB 4.04Å; N156-A159 WeakPolarHBondContact ND2-CB 3.36Å; N156-A159 WeakPolarHBondContact O-CB 3.5Å; N156-A159 PolarHBondContact O-N 3.45Å; N156-A159 PolarHBondContact OD1-N 2.98Å
157T71.3Confident88.5Confident85 Ų8543.7 Ų43.752%0.52123%0.226SC..THydrogen-bonded Turntrans-68.7-11.6-178.661.30000113.6Y153Y153-T157 WeakPolarHBondContact O-CA 3.44Å; Y153-T157 PolarHBondContact O-N 2.91Å
158Q70.6Confident88.4Confident166 Ų16640.5 Ų40.578%0.77621%0.212SC*.THydrogen-bonded Turntrans-81.6-23.1172-56.8-59.7-32.100111.5N156 E160N156-Q158 PolarHBondContact O-N 3.39Å; N156-Q158 VanDerWaalsContact O-N 3.13Å; N156-Q158 PolarHBondContact OD1-N 2.84Å; Q158-E160 PolarHBondContact O-N 3.2Å
159A69.5Low88.4Confident44 Ų4440.5 Ų40.536%0.36421%0.212SC..SBendtrans-81.8103.4169.300000108.8N156N156-A159 HydrophobicContact CB-CB 4.04Å; N156-A159 WeakPolarHBondContact ND2-CB 3.36Å; N156-A159 WeakPolarHBondContact O-CB 3.5Å; N156-A159 PolarHBondContact O-N 3.45Å; N156-A159 PolarHBondContact OD1-N 2.98Å
160E81.1Confident88.4Confident136 Ų13641.3 Ų41.364%0.63622%0.216SC*.PPolyproline II helixtrans-64.2144173.5-64.1-177.9153.500110.5Q158 Q162Q158-E160 PolarHBondContact O-N 3.2Å; E160-Q162 PolarHBondContact O-N 2.97Å
161Y90.6Very high88.4Confident36 Ų3641.1 Ų41.114%0.14122%0.215CC..PPolyproline II helixtrans-64120.7169.9169.2-100.3000109.3T118 N121 I122 D125 L149 F165 H166T118-Y161 HydrophobicContact CG2-CG 4.37Å; N121-Y161 HydrophobicContact CB-CD1 4.14Å; N121-Y161 HydrophobicContact CB-CE1 4.18Å; I122-Y161 HydrophobicContact CD1-CD2 4.05Å; I122-Y161 HydrophobicContact CD1-CE2 4.46Å; I122-Y161 HydrophobicContact CD1-CG 4.31Å; I122-Y161 HydrophobicContact CG1-CD1 4.06Å; I122-Y161 HydrophobicContact CG1-CD2 3.53Å; I122-Y161 HydrophobicContact CG1-CE1 4.08Å; I122-Y161 HydrophobicContact CG1-CE2 3.55Å; I122-Y161 HydrophobicContact CG1-CG 3.8Å; D125-Y161 WeakPolarHBondContact CB-OH 3.25Å; D125-Y161 PolarHBondContact OD2-OH 3.01Å; L149-Y161 HydrophobicContact CD1-CE2 4.33Å; L149-Y161 HydrophobicContact CD2-CE2 4.19Å; Y161-F165 HydrophobicContact CD2-CB 4.3Å; Y161-F165 HydrophobicContact CD2-CD2 4.34Å; Y161-F165 HydrophobicContact CE2-CB 3.92Å; Y161-H166 PolarHBondContact OH-ND1 2.66Å
162Q91.1Very high88.5Confident20 Ų2041.1 Ų41.19%0.09322%0.215CC..PPolyproline II helixtrans-99.7135175.4-172.1178-71.500110.2E160 G164 F165 C197 I199 C241E160-Q162 PolarHBondContact O-N 2.97Å; Q162-G164 PolarHBondContact O-N 3.31Å; Q162-F165 HydrophobicContact CB-CD1 4.15Å; Q162-F165 HydrophobicContact CB-CD2 4.34Å; Q162-F165 HydrophobicContact CB-CE1 3.81Å; Q162-F165 HydrophobicContact CB-CE2 4.02Å; Q162-F165 HydrophobicContact CB-CG 4.41Å; Q162-F165 HydrophobicContact CB-CZ 3.74Å; Q162-F165 WeakPolarHBondContact O-CB 3.34Å; Q162-F165 WeakPolarHBondContact O-CG 3.23Å; Q162-F165 PolarHBondContact O-N 3.49Å; Q162-F165 VanDerWaalsContact O-N 3.14Å; Q162-C197 PolarHBondContact NE2-O 3.39Å; Q162-I199 VanDerWaalsContact OE1-CB 3.25Å; Q162-I199 VanDerWaalsContact OE1-CG2 3.3Å; Q162-C241 PolarHBondContact NE2-O 3.38Å
163Q89.3Confident88.5Confident99 Ų9941.4 Ų41.446%0.46322%0.215SC..THydrogen-bonded Turntrans-55.3129170.3-173.3-179.88.400109.7F242Q163-F242 HydrophobicContact CG-CZ 4.4Å
164G89.8Confident88.6Confident0 Ų042.5 Ų42.50%022%0.222CC..THydrogen-bonded Turntrans110.2-19.8-174.600000114.7Q162 H166 E167 M168Q162-G164 PolarHBondContact O-N 3.31Å; G164-H166 PolarHBondContact N-CE1 3.49Å; G164-H166 PolarHBondContact N-ND1 3.47Å; G164-H166 PolarHBondContact O-N 2.75Å; G164-E167 WeakPolarHBondContact O-CB 3.3Å; G164-E167 PolarHBondContact O-N 3.46Å; G164-E167 VanDerWaalsContact O-N 3.11Å; G164-M168 PolarHBondContact O-N 3.47Å
165F94.4Very high88.7Confident13 Ų1342.6 Ų42.66%0.05722%0.221CC..Hα-helixtrans-61.9-33.1175-73.71000112.5L149 Y161 Q162 E167 M168 V169 F186 L190L149-F165 HydrophobicContact CD2-CB 3.72Å; Y161-F165 HydrophobicContact CD2-CB 4.3Å; Y161-F165 HydrophobicContact CD2-CD2 4.34Å; Y161-F165 HydrophobicContact CE2-CB 3.92Å; Q162-F165 HydrophobicContact CB-CD1 4.15Å; Q162-F165 HydrophobicContact CB-CD2 4.34Å; Q162-F165 HydrophobicContact CB-CE1 3.81Å; Q162-F165 HydrophobicContact CB-CE2 4.02Å; Q162-F165 HydrophobicContact CB-CG 4.41Å; Q162-F165 HydrophobicContact CB-CZ 3.74Å; Q162-F165 WeakPolarHBondContact O-CB 3.34Å; Q162-F165 WeakPolarHBondContact O-CG 3.23Å; Q162-F165 PolarHBondContact O-N 3.49Å; Q162-F165 VanDerWaalsContact O-N 3.14Å; F165-E167 PolarHBondContact O-N 2.8Å; F165-M168 HydrophobicContact CD1-SD 4.06Å; F165-M168 HydrophobicContact CE1-SD 4.46Å; F165-M168 PolarHBondContact O-N 2.93Å; F165-V169 VanDerWaalsContact O-CG2 3.3Å; F165-V169 WeakPolarHBondContact O-CG2 3.22Å; F165-V169 PolarHBondContact O-N 3.17Å; F165-F186 HydrophobicContact CB-CZ 3.97Å; F165-F186 HydrophobicContact CD1-CZ 4.47Å; F165-F186 HydrophobicContact CD2-CZ 4.06Å; F165-F186 AromaticContact CG-CZ 3.93Å; F165-F186 HydrophobicContact CG-CZ 3.93Å; F165-L190 HydrophobicContact CD1-CD2 4.37Å; F165-L190 HydrophobicContact CE1-CD2 3.73Å; F165-L190 HydrophobicContact CE2-CD1 4.06Å; F165-L190 HydrophobicContact CZ-CD1 4.11Å; F165-L190 HydrophobicContact CZ-CD2 3.85Å
166H94.5Very high88.9Confident3 Ų340 Ų401%0.01420%0.204CC..Hα-helixtrans-62.5-39173.860.3-77.2000113.3D125 I126 L129 L149 Y161 G164 M170D125-H166 VanDerWaalsContact CB-CE1 3.46Å; D125-H166 WeakPolarHBondContact CB-CE1 3.44Å; D125-H166 WeakPolarHBondContact CB-ND1 3.48Å; D125-H166 IonicContact OD2-CE1 3.54Å; D125-H166 PolarHBondContact OD2-CE1 2.93Å; D125-H166 IonicContact OD2-ND1 3.55Å; I126-H166 HydrophobicContact CG1-CB 4.12Å; L129-H166 HydrophobicContact CD1-CB 4.44Å; L149-H166 HydrophobicContact CD1-CB 3.82Å; Y161-H166 PolarHBondContact OH-ND1 2.66Å; G164-H166 PolarHBondContact N-CE1 3.49Å; G164-H166 PolarHBondContact N-ND1 3.47Å; G164-H166 PolarHBondContact O-N 2.75Å; H166-M170 WeakPolarHBondContact O-CB 3.42Å; H166-M170 PolarHBondContact O-N 3.34Å
167E93.8Very high89.3Confident33 Ų3343.5 Ų43.515%0.15422%0.217CC..Hα-helixtrans-68.2-40.2173.8-70171.4174.400110.7L129 G164 F165 M170 L171 F242 Q245 R246L129-E167 HydrophobicContact CD2-CG 3.94Å; G164-E167 WeakPolarHBondContact O-CB 3.3Å; G164-E167 PolarHBondContact O-N 3.46Å; G164-E167 VanDerWaalsContact O-N 3.11Å; F165-E167 PolarHBondContact O-N 2.8Å; E167-M170 WeakPolarHBondContact O-CB 3.27Å; E167-M170 PolarHBondContact O-N 2.88Å; E167-L171 PolarHBondContact O-N 3.5Å; E167-L171 VanDerWaalsContact O-N 3.16Å; E167-F242 WeakPolarHBondContact OE2-CD1 3.35Å; E167-F242 WeakPolarHBondContact OE2-CE1 3.23Å; E167-Q245 PolarHBondContact OE2-NE2 3.16Å; E167-R246 IonicContact OE1-CZ 3.85Å; E167-R246 IonicContact OE1-NE 2.67Å; E167-R246 PolarHBondContact OE1-NE 3.01Å; E167-R246 IonicContact OE1-NH2 3.83Å; E167-R246 PolarHBondContact OE1-NH2 3.49Å; E167-R246 IonicContact OE2-CZ 3.69Å; E167-R246 IonicContact OE2-NE 3.86Å; E167-R246 PolarHBondContact OE2-NE 3.43Å; E167-R246 IonicContact OE2-NH2 2.7Å; E167-R246 PolarHBondContact OE2-NH2 2.85Å
168M95.1Very high90.3Very high0 Ų042.7 Ų42.70%021%0.208CC..Hα-helixtrans-63.5-48.2175.7-65-177.9178.100111.8G164 F165 M170 L171 F172 F186 F189 C197 C241 C243 W258G164-M168 PolarHBondContact O-N 3.47Å; F165-M168 HydrophobicContact CD1-SD 4.06Å; F165-M168 HydrophobicContact CE1-SD 4.46Å; F165-M168 PolarHBondContact O-N 2.93Å; M168-M170 VanDerWaalsContact C-N 3.26Å; M168-M170 PolarHBondContact O-N 3.29Å; M168-L171 WeakPolarHBondContact O-CB 3.47Å; M168-L171 PolarHBondContact O-N 3.02Å; M168-L171 VanDerWaalsContact O-N 3.11Å; M168-F172 WeakPolarHBondContact O-CD2 3.16Å; M168-F172 PolarHBondContact O-N 3.45Å; M168-F172 VanDerWaalsContact O-N 3.11Å; M168-F186 HydrophobicContact CB-CE2 4.15Å; M168-F189 HydrophobicContact SD-CE1 4.44Å; M168-C197 HydrophobicContact CE-CB 4.43Å; M168-C241 WeakPolarHBondContact CE-O 3.24Å; M168-C243 HydrophobicContact CE-CB 4.04Å; M168-C243 VanDerWaalsContact CE-SG 3.59Å; M168-W258 HydrophobicContact CB-CH2 4.14Å; M168-W258 HydrophobicContact CG-CH2 3.88Å; M168-W258 HydrophobicContact CG-CZ2 4.39Å
169V95.9Very high91.5Very high0 Ų036.6 Ų36.60%018%0.18CC..Hα-helixtrans-64.6-32.7178.6-177.70000111.2L145 I148 L149 F165 L171 F172 Q173 T182 F186L145-V169 HydrophobicContact CD2-CB 3.91Å; L145-V169 HydrophobicContact CD2-CG1 3.44Å; L145-V169 VanDerWaalsContact CD2-CG1 3.44Å; I148-V169 HydrophobicContact CB-CG1 4.02Å; I148-V169 HydrophobicContact CD1-CG1 4.12Å; I148-V169 HydrophobicContact CG2-CG1 3.63Å; I148-V169 HydrophobicContact CG2-CG2 4.18Å; L149-V169 HydrophobicContact CD2-CG2 3.68Å; L149-V169 HydrophobicContact CG-CG2 4.26Å; F165-V169 VanDerWaalsContact O-CG2 3.3Å; F165-V169 WeakPolarHBondContact O-CG2 3.22Å; F165-V169 PolarHBondContact O-N 3.17Å; V169-L171 VanDerWaalsContact C-N 3.34Å; V169-L171 PolarHBondContact O-N 2.89Å; V169-F172 PolarHBondContact O-N 3.38Å; V169-Q173 PolarHBondContact O-N 2.97Å; V169-T182 HydrophobicContact CG1-CG2 4.11Å; V169-F186 HydrophobicContact CG2-CB 4.49Å; V169-F186 HydrophobicContact CG2-CD1 3.67Å; V169-F186 HydrophobicContact CG2-CD2 3.75Å; V169-F186 HydrophobicContact CG2-CE1 3.7Å; V169-F186 HydrophobicContact CG2-CE2 3.77Å; V169-F186 HydrophobicContact CG2-CG 3.7Å; V169-F186 HydrophobicContact CG2-CZ 3.73Å
170M95.2Very high92.7Very high19 Ų1935.1 Ų35.19%0.09417%0.166CC..Hα-helixtrans-57.2-46.6170.9-177-165.373.800111.4L129 I140 L145 H166 E167 M168 F172 Q173 L174 F251L129-M170 HydrophobicContact CD1-CB 4.47Å; L129-M170 HydrophobicContact CD1-SD 4.44Å; L129-M170 HydrophobicContact CD2-SD 4.02Å; I140-M170 HydrophobicContact CD1-CG 3.44Å; I140-M170 VanDerWaalsContact CD1-CG 3.44Å; I140-M170 HydrophobicContact CD1-SD 4.43Å; I140-M170 HydrophobicContact CG1-CG 3.74Å; I140-M170 HydrophobicContact CG1-SD 4.26Å; I140-M170 HydrophobicContact CG2-CG 4.21Å; L145-M170 HydrophobicContact CD1-CB 4.14Å; L145-M170 HydrophobicContact CD2-CB 4.46Å; H166-M170 WeakPolarHBondContact O-CB 3.42Å; H166-M170 PolarHBondContact O-N 3.34Å; E167-M170 WeakPolarHBondContact O-CB 3.27Å; E167-M170 PolarHBondContact O-N 2.88Å; M168-M170 VanDerWaalsContact C-N 3.26Å; M168-M170 PolarHBondContact O-N 3.29Å; M170-F172 VanDerWaalsContact C-N 3.33Å; M170-F172 PolarHBondContact O-N 3.25Å; M170-Q173 PolarHBondContact O-N 2.82Å; M170-Q173 VanDerWaalsContact O-N 3.15Å; M170-L174 HydrophobicContact CG-CD1 4.49Å; M170-L174 WeakPolarHBondContact O-CG 3.4Å; M170-L174 PolarHBondContact O-N 2.87Å; M170-F251 HydrophobicContact CE-CE1 3.75Å; M170-F251 HydrophobicContact CE-CZ 3.77Å
171L95.3Very high93.5Very high2 Ų229.7 Ų29.71%0.0114%0.141CC..Hα-helixtrans-63-37.8176.5-68.2170.6000112.4E167 M168 V169 M175 Q245 F251 V254 W255 W258E167-L171 PolarHBondContact O-N 3.5Å; E167-L171 VanDerWaalsContact O-N 3.16Å; M168-L171 WeakPolarHBondContact O-CB 3.47Å; M168-L171 PolarHBondContact O-N 3.02Å; M168-L171 VanDerWaalsContact O-N 3.11Å; V169-L171 VanDerWaalsContact C-N 3.34Å; V169-L171 PolarHBondContact O-N 2.89Å; L171-M175 WeakPolarHBondContact O-CB 3.44Å; L171-M175 PolarHBondContact O-N 2.93Å; L171-Q245 HydrophobicContact CD1-CB 4.43Å; L171-F251 HydrophobicContact CD2-CB 3.98Å; L171-F251 HydrophobicContact CD2-CD1 3.36Å; L171-F251 HydrophobicContact CD2-CE1 3.92Å; L171-F251 HydrophobicContact CD2-CG 3.74Å; L171-V254 HydrophobicContact CD1-CB 4.46Å; L171-V254 HydrophobicContact CD1-CG1 3.68Å; L171-W255 HydrophobicContact CD2-CZ2 4.22Å; L171-W255 WeakPolarHBondContact O-CZ2 3.38Å; L171-W258 HydrophobicContact CB-CH2 4.44Å; L171-W258 HydrophobicContact CB-CZ3 4.41Å; L171-W258 HydrophobicContact CD1-CH2 3.41Å; L171-W258 VanDerWaalsContact CD1-CH2 3.41Å; L171-W258 HydrophobicContact CD1-CZ2 3.85Å; L171-W258 HydrophobicContact CD1-CZ3 4.05Å
172F95.8Very high93.8Very high1 Ų128 Ų280%0.00413%0.134CC..Hα-helixtrans-65.7-40.4172.6-72-75.2000112.1W67 M168 V169 M170 L174 M175 V176 T182 L185 F186 F189 W258W67-F172 AromaticContact CE3-CE1 3.78Å; W67-F172 HydrophobicContact CE3-CE1 3.78Å; W67-F172 HydrophobicContact CE3-CZ 4.46Å; W67-F172 HydrophobicContact CZ3-CD1 4.44Å; W67-F172 AromaticContact CZ3-CE1 3.59Å; W67-F172 HydrophobicContact CZ3-CE1 3.59Å; W67-F172 AromaticContact CZ3-CZ 3.93Å; W67-F172 HydrophobicContact CZ3-CZ 3.93Å; M168-F172 WeakPolarHBondContact O-CD2 3.16Å; M168-F172 PolarHBondContact O-N 3.45Å; M168-F172 VanDerWaalsContact O-N 3.11Å; V169-F172 PolarHBondContact O-N 3.38Å; M170-F172 VanDerWaalsContact C-N 3.33Å; M170-F172 PolarHBondContact O-N 3.25Å; F172-L174 VanDerWaalsContact C-N 3.3Å; F172-L174 PolarHBondContact O-N 3.49Å; F172-M175 HydrophobicContact CD1-CE 3.65Å; F172-M175 HydrophobicContact CE1-CE 4.05Å; F172-M175 PolarHBondContact O-N 2.89Å; F172-M175 VanDerWaalsContact O-N 3.16Å; F172-V176 WeakPolarHBondContact O-CG2 3.17Å; F172-V176 PolarHBondContact O-N 3.1Å; F172-T182 HydrophobicContact CB-CG2 3.63Å; F172-L185 HydrophobicContact CD1-CB 3.87Å; F172-L185 HydrophobicContact CE1-CB 3.95Å; F172-F186 HydrophobicContact CD2-CB 4.08Å; F172-F186 HydrophobicContact CD2-CD2 4.06Å; F172-F186 HydrophobicContact CE2-CB 4.29Å; F172-F186 AromaticContact CE2-CD2 3.89Å; F172-F186 HydrophobicContact CE2-CD2 3.89Å; F172-F189 HydrophobicContact CE1-CB 4.37Å; F172-F189 HydrophobicContact CE2-CB 4.3Å; F172-F189 HydrophobicContact CE2-CD1 4.34Å; F172-F189 HydrophobicContact CE2-CG 4.22Å; F172-F189 HydrophobicContact CZ-CB 3.59Å; F172-F189 HydrophobicContact CZ-CD1 4.13Å; F172-F189 AromaticContact CZ-CD2 3.81Å; F172-F189 HydrophobicContact CZ-CD2 3.81Å; F172-F189 AromaticContact CZ-CG 3.58Å; F172-F189 HydrophobicContact CZ-CG 3.58Å; F172-W258 HydrophobicContact CE2-CZ3 4.13Å; F172-W258 HydrophobicContact CZ-CZ3 4.3Å
173Q94.1Very high94.1Very high20 Ų2027.1 Ų27.19%0.09313%0.13CC..Hα-helixtrans-65.6-33.8179.4-166.2-177.8136.100112.3D141 L145 V169 M170 M175 V176 T182D141-Q173 PolarHBondContact O-NE2 3.34Å; L145-Q173 HydrophobicContact CD2-CB 4.3Å; V169-Q173 PolarHBondContact O-N 2.97Å; M170-Q173 PolarHBondContact O-N 2.82Å; M170-Q173 VanDerWaalsContact O-N 3.15Å; Q173-M175 VanDerWaalsContact C-N 3.31Å; Q173-V176 VanDerWaalsContact O-O 3.08Å; Q173-T182 HydrophobicContact CB-CG2 4.35Å
174L93.2Very high94.5Very high51 Ų5124.5 Ų24.527%0.26712%0.116SC..Hα-helixtrans-69.5-29.9173.8-72.8171.6000112.9L139 I140 M170 F172 F251 W255L139-L174 HydrophobicContact CD1-CD2 3.69Å; L139-L174 HydrophobicContact CD2-CD2 4.29Å; L139-L174 HydrophobicContact CG-CD2 3.77Å; I140-L174 HydrophobicContact CD1-CD1 4Å; I140-L174 HydrophobicContact CD1-CD2 3.45Å; I140-L174 VanDerWaalsContact CD1-CD2 3.45Å; I140-L174 HydrophobicContact CD1-CG 3.48Å; I140-L174 VanDerWaalsContact CD1-CG 3.48Å; M170-L174 HydrophobicContact CG-CD1 4.49Å; M170-L174 WeakPolarHBondContact O-CG 3.4Å; M170-L174 PolarHBondContact O-N 2.87Å; F172-L174 VanDerWaalsContact C-N 3.3Å; F172-L174 PolarHBondContact O-N 3.49Å; L174-F251 HydrophobicContact CD1-CD2 3.6Å; L174-F251 HydrophobicContact CD1-CE2 3.4Å; L174-F251 VanDerWaalsContact CD1-CE2 3.4Å; L174-F251 HydrophobicContact CD1-CG 4.35Å; L174-F251 HydrophobicContact CD1-CZ 4.01Å; L174-W255 HydrophobicContact CB-CH2 4Å; L174-W255 HydrophobicContact CB-CZ2 3.9Å
175M93Very high94.8Very high26 Ų2624.5 Ų24.513%0.12812%0.116CC..Hα-helixtrans-86.4-32.4-177.5-176.2178.96300112.8R63 T64 W67 L171 F172 Q173 L185 W255R63-M175 HydrophobicContact CG-CG 4.4Å; R63-M175 HydrophobicContact CG-SD 3.65Å; T64-M175 PolarHBondContact OG1-O 3.19Å; W67-M175 HydrophobicContact CD2-CE 3.96Å; W67-M175 HydrophobicContact CD2-SD 3.88Å; W67-M175 HydrophobicContact CE3-CE 3.56Å; W67-M175 HydrophobicContact CE3-SD 4Å; W67-M175 HydrophobicContact CG-CE 4.44Å; W67-M175 HydrophobicContact CG-SD 4.28Å; W67-M175 HydrophobicContact CZ2-SD 4.46Å; W67-M175 HydrophobicContact CZ3-CE 3.98Å; W67-M175 HydrophobicContact CZ3-SD 4.32Å; L171-M175 WeakPolarHBondContact O-CB 3.44Å; L171-M175 PolarHBondContact O-N 2.93Å; F172-M175 HydrophobicContact CD1-CE 3.65Å; F172-M175 HydrophobicContact CE1-CE 4.05Å; F172-M175 PolarHBondContact O-N 2.89Å; F172-M175 VanDerWaalsContact O-N 3.16Å; Q173-M175 VanDerWaalsContact C-N 3.31Å; M175-L185 HydrophobicContact CE-CD1 4.23Å; M175-W255 HydrophobicContact CB-CZ2 4.15Å
176V92.2Very high94.9Very high6 Ų623.9 Ų23.94%0.03611%0.113CC..  trans-126.3138-172.9-53.80000113T64 F172 Q173 E181 T182 L185T64-V176 HydrophobicContact CG2-CB 4.49Å; T64-V176 HydrophobicContact CG2-CG1 3.56Å; F172-V176 WeakPolarHBondContact O-CG2 3.17Å; F172-V176 PolarHBondContact O-N 3.1Å; Q173-V176 VanDerWaalsContact O-O 3.08Å; V176-E181 HydrophobicContact CB-CB 4.38Å; V176-E181 HydrophobicContact CG2-CB 4.23Å; V176-T182 HydrophobicContact CG2-CG2 4.37Å; V176-T182 WeakPolarHBondContact CG2-OG1 3.5Å; V176-L185 HydrophobicContact CG1-CD1 3.63Å
177E88.6Confident95Very high153 Ų15325.6 Ų25.672%0.71512%0.121SC*.SBendtrans-71.8-43.2-174.3-169.6-177.1157.600112.2R144R144-E177 PolarHBondContact NH2-O 3.44Å
178H93.4Very high95.1Very high68 Ų6825.9 Ų25.932%0.31512%0.122SC..SBendtrans-100.1137.4-167.8-56.5-42.7000114.2H180 E181 T182H178-H180 VanDerWaalsContact C-N 3.34Å; H178-H180 WeakPolarHBondContact CB-CE1 3.28Å; H178-H180 WeakPolarHBondContact CB-ND1 3.35Å; H178-H180 AromaticContact CD2-CE1 3.81Å; H178-H180 AromaticContact CG-CE1 3.81Å; H178-H180 PolarHBondContact O-N 3.25Å; H178-E181 HydrophobicContact CB-CG 4.47Å; H178-E181 IonicContact CD2-OE2 3.07Å; H178-E181 PolarHBondContact CD2-OE2 3.42Å; H178-E181 VanDerWaalsContact CD2-OE2 3.23Å; H178-E181 IonicContact CG-OE2 2.7Å; H178-E181 WeakPolarHBondContact O-CB 3.46Å; H178-E181 PolarHBondContact O-N 3.2Å; H178-T182 PolarHBondContact O-N 3.15Å; H178-T182 PolarHBondContact O-OG1 2.9Å
179D94.8Very high95.1Very high38 Ų3826 Ų2620%0.20312%0.122CC..Hα-helixtrans-54.6-41.8-178.9-82.4-22.2000115.5Y94 R144 E181 T182 F183Y94-D179 HydrophobicContact CE1-CB 3.81Å; R144-D179 IonicContact CZ-OD1 3.06Å; R144-D179 VanDerWaalsContact NE-CG 3.34Å; R144-D179 IonicContact NE-OD1 3.43Å; R144-D179 PolarHBondContact NE-OD1 3.01Å; R144-D179 IonicContact NE-OD2 2.62Å; R144-D179 PolarHBondContact NE-OD2 3.12Å; R144-D179 IonicContact NH2-OD1 2.84Å; R144-D179 PolarHBondContact NH2-OD1 2.91Å; D179-E181 VanDerWaalsContact C-N 3.26Å; D179-E181 PolarHBondContact O-N 3.16Å; D179-T182 PolarHBondContact O-N 3.04Å; D179-F183 WeakPolarHBondContact O-CB 3.2Å; D179-F183 PolarHBondContact O-N 3.37Å
180H96.3Very high95Very high13 Ų1327 Ų276%0.0613%0.128CC..Hα-helixtrans-63.6-37.5-179.864.7-73.8000111R91 Y94 H178 W184R91-H180 VanDerWaalsContact CZ-CE1 3.48Å; R91-H180 PolarHBondContact NE-CE1 3.43Å; R91-H180 PolarHBondContact NE-NE2 3.04Å; R91-H180 VanDerWaalsContact NE-NE2 3.19Å; R91-H180 PolarHBondContact NH2-CE1 3.48Å; R91-H180 VanDerWaalsContact NH2-CE1 3.3Å; R91-H180 PolarHBondContact NH2-NE2 2.85Å; Y94-H180 HydrophobicContact CD1-CB 3.55Å; Y94-H180 HydrophobicContact CD2-CB 4.43Å; Y94-H180 HydrophobicContact CE1-CB 4.33Å; Y94-H180 HydrophobicContact CG-CB 3.61Å; H178-H180 VanDerWaalsContact C-N 3.34Å; H178-H180 WeakPolarHBondContact CB-CE1 3.28Å; H178-H180 WeakPolarHBondContact CB-ND1 3.35Å; H178-H180 AromaticContact CD2-CE1 3.81Å; H178-H180 AromaticContact CG-CE1 3.81Å; H178-H180 PolarHBondContact O-N 3.25Å; H180-W184 WeakPolarHBondContact O-CB 3.34Å; H180-W184 PolarHBondContact O-N 3.18Å
181E96.2Very high94.9Very high22 Ų2232.1 Ų32.110%0.10315%0.151CC..Hα-helixtrans-70.7-43.5176.5-64.2-177.293.900110.9K68 V176 H178 D179 F183 W184 L185K68-E181 WeakPolarHBondContact CE-OE1 3.38Å; K68-E181 IonicContact NZ-OE1 3.03Å; K68-E181 PolarHBondContact NZ-OE1 2.95Å; V176-E181 HydrophobicContact CB-CB 4.38Å; V176-E181 HydrophobicContact CG2-CB 4.23Å; H178-E181 HydrophobicContact CB-CG 4.47Å; H178-E181 IonicContact CD2-OE2 3.07Å; H178-E181 PolarHBondContact CD2-OE2 3.42Å; H178-E181 VanDerWaalsContact CD2-OE2 3.23Å; H178-E181 IonicContact CG-OE2 2.7Å; H178-E181 WeakPolarHBondContact O-CB 3.46Å; H178-E181 PolarHBondContact O-N 3.2Å; D179-E181 VanDerWaalsContact C-N 3.26Å; D179-E181 PolarHBondContact O-N 3.16Å; E181-F183 VanDerWaalsContact C-N 3.33Å; E181-F183 PolarHBondContact O-N 3.37Å; E181-W184 PolarHBondContact O-N 2.97Å; E181-L185 VanDerWaalsContact O-CB 3.24Å; E181-L185 WeakPolarHBondContact O-CB 3.41Å; E181-L185 WeakPolarHBondContact O-CG 3.15Å; E181-L185 PolarHBondContact O-N 3.32Å
182T97.2Very high94.8Very high0 Ų036.6 Ų36.60%017%0.171CC..Hα-helixtrans-55.8-49.1174.6-44.70000110.8I148 V169 F172 Q173 V176 H178 D179 F186I148-T182 HydrophobicContact CD1-CG2 3.55Å; V169-T182 HydrophobicContact CG1-CG2 4.11Å; F172-T182 HydrophobicContact CB-CG2 3.63Å; Q173-T182 HydrophobicContact CB-CG2 4.35Å; V176-T182 HydrophobicContact CG2-CG2 4.37Å; V176-T182 WeakPolarHBondContact CG2-OG1 3.5Å; H178-T182 PolarHBondContact O-N 3.15Å; H178-T182 PolarHBondContact O-OG1 2.9Å; D179-T182 PolarHBondContact O-N 3.04Å; T182-F186 VanDerWaalsContact O-CB 3.24Å; T182-F186 WeakPolarHBondContact O-CB 3.38Å; T182-F186 PolarHBondContact O-N 3.46Å
183F97.5Very high94.6Very high2 Ų237.1 Ų37.11%0.00917%0.174CC..Hα-helixtrans-59.8-54.3179.3172.9-96.5000111.5Y94 L97 I148 L151 D179 E181 F186 Q187Y94-F183 HydrophobicContact CD2-CB 3.73Å; Y94-F183 AromaticContact CD2-CD1 3.65Å; Y94-F183 HydrophobicContact CD2-CD1 3.65Å; Y94-F183 HydrophobicContact CD2-CD2 4.41Å; Y94-F183 HydrophobicContact CD2-CE1 4.39Å; Y94-F183 AromaticContact CD2-CG 3.66Å; Y94-F183 HydrophobicContact CD2-CG 3.66Å; Y94-F183 HydrophobicContact CE2-CB 3.54Å; Y94-F183 HydrophobicContact CE2-CD1 4.18Å; Y94-F183 HydrophobicContact CE2-CD2 4.15Å; Y94-F183 AromaticContact CE2-CG 3.69Å; Y94-F183 HydrophobicContact CE2-CG 3.69Å; L97-F183 HydrophobicContact CD1-CE1 3.91Å; L97-F183 HydrophobicContact CD1-CZ 4.04Å; I148-F183 HydrophobicContact CG1-CB 4.49Å; I148-F183 HydrophobicContact CG2-CB 4.44Å; I148-F183 HydrophobicContact CG2-CD2 4.26Å; L151-F183 HydrophobicContact CB-CD2 4.14Å; L151-F183 HydrophobicContact CB-CE2 3.72Å; D179-F183 WeakPolarHBondContact O-CB 3.2Å; D179-F183 PolarHBondContact O-N 3.37Å; E181-F183 VanDerWaalsContact C-N 3.33Å; E181-F183 PolarHBondContact O-N 3.37Å; F183-F186 PolarHBondContact O-N 2.76Å; F183-Q187 HydrophobicContact CD1-CG 4.34Å; F183-Q187 HydrophobicContact CE1-CG 3.93Å; F183-Q187 HydrophobicContact CE2-CG 4.15Å; F183-Q187 HydrophobicContact CZ-CG 3.82Å; F183-Q187 WeakPolarHBondContact O-CG 3.5Å; F183-Q187 PolarHBondContact O-N 2.99Å
184W97.5Very high94.5Very high44 Ų4439.4 Ų39.417%0.16719%0.185CC..Hα-helixtrans-68.6-42.7-175.4-73120.4000112.5Y73 R90 N93 L97 H180 E181 F186 Q187 F188Y73-W184 HydrophobicContact CD2-CB 3.86Å; Y73-W184 HydrophobicContact CE2-CB 3.58Å; Y73-W184 HydrophobicContact CE2-CG 4.25Å; R90-W184 HydrophobicContact CB-CG 4.33Å; R90-W184 HydrophobicContact CG-CD2 4.3Å; R90-W184 HydrophobicContact CG-CG 4.3Å; R90-W184 PolarHBondContact O-NE1 3.3Å; N93-W184 HydrophobicContact CB-CZ2 3.85Å; L97-W184 HydrophobicContact CD1-CH2 4.22Å; L97-W184 HydrophobicContact CD1-CZ2 4.18Å; H180-W184 WeakPolarHBondContact O-CB 3.34Å; H180-W184 PolarHBondContact O-N 3.18Å; E181-W184 PolarHBondContact O-N 2.97Å; W184-F186 VanDerWaalsContact C-N 3.26Å; W184-F186 PolarHBondContact O-N 3.38Å; W184-Q187 HydrophobicContact CE3-CG 4.5Å; W184-Q187 PolarHBondContact O-N 3.39Å; W184-Q187 VanDerWaalsContact O-N 3.16Å; W184-F188 HydrophobicContact CB-CD2 4.47Å; W184-F188 HydrophobicContact CE3-CE2 4.21Å; W184-F188 VanDerWaalsContact O-CD2 3.22Å; W184-F188 WeakPolarHBondContact O-CD2 3.43Å; W184-F188 PolarHBondContact O-N 3.01Å
185L97.5Very high94.4Very high0 Ų041.3 Ų41.30%019%0.192CC..Hα-helixtrans-59.5-40.6175.4-76.4171000111.2W67 K68 T71 Y73 F172 M175 V176 E181 F188 F189W67-L185 HydrophobicContact CB-CD2 4.5Å; K68-L185 HydrophobicContact CG-CD2 3.97Å; T71-L185 HydrophobicContact CG2-CD2 4.49Å; Y73-L185 HydrophobicContact CD2-CD2 4.49Å; F172-L185 HydrophobicContact CD1-CB 3.87Å; F172-L185 HydrophobicContact CE1-CB 3.95Å; M175-L185 HydrophobicContact CE-CD1 4.23Å; V176-L185 HydrophobicContact CG1-CD1 3.63Å; E181-L185 VanDerWaalsContact O-CB 3.24Å; E181-L185 WeakPolarHBondContact O-CB 3.41Å; E181-L185 WeakPolarHBondContact O-CG 3.15Å; E181-L185 PolarHBondContact O-N 3.32Å; L185-F188 PolarHBondContact O-N 3.06Å; L185-F189 WeakPolarHBondContact O-CB 3.19Å; L185-F189 PolarHBondContact O-N 2.99Å
186F96.5Very high94.3Very high0 Ų040.5 Ų40.50%019%0.189CC..Hα-helixtrans-62.5-44.8174176.9-120.3000112.3I148 L149 F165 M168 V169 F172 T182 F183 W184 F189 L190I148-F186 HydrophobicContact CG2-CD1 4.4Å; L149-F186 HydrophobicContact CD2-CE1 4.36Å; L149-F186 HydrophobicContact CD2-CZ 4.42Å; F165-F186 HydrophobicContact CB-CZ 3.97Å; F165-F186 HydrophobicContact CD1-CZ 4.47Å; F165-F186 HydrophobicContact CD2-CZ 4.06Å; F165-F186 AromaticContact CG-CZ 3.93Å; F165-F186 HydrophobicContact CG-CZ 3.93Å; M168-F186 HydrophobicContact CB-CE2 4.15Å; V169-F186 HydrophobicContact CG2-CB 4.49Å; V169-F186 HydrophobicContact CG2-CD1 3.67Å; V169-F186 HydrophobicContact CG2-CD2 3.75Å; V169-F186 HydrophobicContact CG2-CE1 3.7Å; V169-F186 HydrophobicContact CG2-CE2 3.77Å; V169-F186 HydrophobicContact CG2-CG 3.7Å; V169-F186 HydrophobicContact CG2-CZ 3.73Å; F172-F186 HydrophobicContact CD2-CB 4.08Å; F172-F186 HydrophobicContact CD2-CD2 4.06Å; F172-F186 HydrophobicContact CE2-CB 4.29Å; F172-F186 AromaticContact CE2-CD2 3.89Å; F172-F186 HydrophobicContact CE2-CD2 3.89Å; T182-F186 VanDerWaalsContact O-CB 3.24Å; T182-F186 WeakPolarHBondContact O-CB 3.38Å; T182-F186 PolarHBondContact O-N 3.46Å; F183-F186 PolarHBondContact O-N 2.76Å; W184-F186 VanDerWaalsContact C-N 3.26Å; W184-F186 PolarHBondContact O-N 3.38Å; F186-F189 PolarHBondContact O-N 3.11Å; F186-L190 HydrophobicContact CD1-CD1 4.42Å; F186-L190 HydrophobicContact CD2-CD1 4.44Å; F186-L190 HydrophobicContact CD2-CG 4.2Å; F186-L190 HydrophobicContact CE1-CD1 3.76Å; F186-L190 HydrophobicContact CE2-CD1 3.78Å; F186-L190 HydrophobicContact CE2-CD2 4.01Å; F186-L190 HydrophobicContact CE2-CG 3.75Å; F186-L190 HydrophobicContact CZ-CD1 3.4Å; F186-L190 VanDerWaalsContact CZ-CD1 3.4Å; F186-L190 HydrophobicContact CZ-CD2 4.33Å; F186-L190 HydrophobicContact CZ-CG 3.94Å; F186-L190 WeakPolarHBondContact O-CG 3.38Å; F186-L190 PolarHBondContact O-N 3.32Å
187Q95.5Very high94.2Very high39 Ų3940.2 Ų40.218%0.18219%0.187CC..Hα-helixtrans-60.6-48.8176.3-65.8-47.9-77.100112.1S152 F183 W184 F189 L190 Q191S152-Q187 PolarHBondContact OG-NE2 3.06Å; F183-Q187 HydrophobicContact CD1-CG 4.34Å; F183-Q187 HydrophobicContact CE1-CG 3.93Å; F183-Q187 HydrophobicContact CE2-CG 4.15Å; F183-Q187 HydrophobicContact CZ-CG 3.82Å; F183-Q187 WeakPolarHBondContact O-CG 3.5Å; F183-Q187 PolarHBondContact O-N 2.99Å; W184-Q187 HydrophobicContact CE3-CG 4.5Å; W184-Q187 PolarHBondContact O-N 3.39Å; W184-Q187 VanDerWaalsContact O-N 3.16Å; Q187-F189 VanDerWaalsContact C-N 3.33Å; Q187-F189 PolarHBondContact O-N 3.45Å; Q187-L190 PolarHBondContact O-N 3.02Å; Q187-Q191 WeakPolarHBondContact O-CB 3.3Å; Q187-Q191 PolarHBondContact O-N 3.22Å
188F96.4Very high94.3Very high39 Ų3934.4 Ų34.417%0.17116%0.162CC..Hα-helixtrans-67.1-35179.5-81.5-75.5000111.9Y73 R90 W184 L185 K192Y73-F188 HydrophobicContact CD2-CD2 4.05Å; Y73-F188 HydrophobicContact CD2-CE2 4.31Å; R90-F188 VanDerWaalsContact NH2-CE2 3.33Å; W184-F188 HydrophobicContact CB-CD2 4.47Å; W184-F188 HydrophobicContact CE3-CE2 4.21Å; W184-F188 VanDerWaalsContact O-CD2 3.22Å; W184-F188 WeakPolarHBondContact O-CD2 3.43Å; W184-F188 PolarHBondContact O-N 3.01Å; L185-F188 PolarHBondContact O-N 3.06Å; F188-K192 WeakPolarHBondContact O-CB 3.45Å; F188-K192 PolarHBondContact O-N 3.23Å
189F95.8Very high94.2Very high2 Ų234.7 Ų34.71%0.00917%0.165CC..Hα-helixtrans-61.3-53.4173.3-177.7-90.6000110.9W67 T71 M168 F172 L185 F186 Q187 Q191 K192 T193 W258 L262W67-F189 HydrophobicContact CZ3-CD2 4.42Å; W67-F189 HydrophobicContact CZ3-CE2 4.5Å; T71-F189 HydrophobicContact CG2-CB 4.36Å; M168-F189 HydrophobicContact SD-CE1 4.44Å; F172-F189 HydrophobicContact CE1-CB 4.37Å; F172-F189 HydrophobicContact CE2-CB 4.3Å; F172-F189 HydrophobicContact CE2-CD1 4.34Å; F172-F189 HydrophobicContact CE2-CG 4.22Å; F172-F189 HydrophobicContact CZ-CB 3.59Å; F172-F189 HydrophobicContact CZ-CD1 4.13Å; F172-F189 AromaticContact CZ-CD2 3.81Å; F172-F189 HydrophobicContact CZ-CD2 3.81Å; F172-F189 AromaticContact CZ-CG 3.58Å; F172-F189 HydrophobicContact CZ-CG 3.58Å; L185-F189 WeakPolarHBondContact O-CB 3.19Å; L185-F189 PolarHBondContact O-N 2.99Å; F186-F189 PolarHBondContact O-N 3.11Å; Q187-F189 VanDerWaalsContact C-N 3.33Å; Q187-F189 PolarHBondContact O-N 3.45Å; F189-Q191 VanDerWaalsContact C-N 3.3Å; F189-Q191 PolarHBondContact O-N 3.03Å; F189-K192 WeakPolarHBondContact O-CA 3.47Å; F189-K192 WeakPolarHBondContact O-CB 3.48Å; F189-K192 PolarHBondContact O-N 3.4Å; F189-T193 HydrophobicContact CD2-CG2 4.42Å; F189-T193 HydrophobicContact CE1-CG2 4.24Å; F189-T193 HydrophobicContact CE2-CG2 4.15Å; F189-T193 HydrophobicContact CZ-CG2 4.05Å; F189-T193 PolarHBondContact O-N 3.41Å; F189-T193 PolarHBondContact O-OG1 3.33Å; F189-W258 HydrophobicContact CD2-CE3 4.49Å; F189-W258 HydrophobicContact CE1-CE3 4.36Å; F189-W258 HydrophobicContact CE1-CZ3 4.42Å; F189-W258 HydrophobicContact CE2-CB 4.33Å; F189-W258 HydrophobicContact CE2-CD2 4.01Å; F189-W258 AromaticContact CE2-CE3 3.63Å; F189-W258 HydrophobicContact CE2-CE3 3.63Å; F189-W258 HydrophobicContact CE2-CG 4.29Å; F189-W258 HydrophobicContact CE2-CZ3 4.36Å; F189-W258 AromaticContact CZ-CD2 3.73Å; F189-W258 HydrophobicContact CZ-CD2 3.73Å; F189-W258 AromaticContact CZ-CE3 3.54Å; F189-W258 HydrophobicContact CZ-CE3 3.54Å; F189-W258 HydrophobicContact CZ-CG 4.22Å; F189-W258 HydrophobicContact CZ-CZ3 4.03Å; F189-L262 HydrophobicContact CD2-CD1 4.06Å; F189-L262 HydrophobicContact CD2-CD2 3.8Å; F189-L262 HydrophobicContact CD2-CG 4.29Å; F189-L262 HydrophobicContact CE2-CD1 4.13Å; F189-L262 HydrophobicContact CE2-CD2 4.01Å; F189-L262 HydrophobicContact CE2-CG 4.17Å
190L93.1Very high93.8Very high22 Ų2238.7 Ų38.712%0.11519%0.187CC..Hα-helixtrans-57.4-43.5178.3-74-176.4000112.1F165 F186 Q187 K192 T193 E194F165-L190 HydrophobicContact CD1-CD2 4.37Å; F165-L190 HydrophobicContact CE1-CD2 3.73Å; F165-L190 HydrophobicContact CE2-CD1 4.06Å; F165-L190 HydrophobicContact CZ-CD1 4.11Å; F165-L190 HydrophobicContact CZ-CD2 3.85Å; F186-L190 HydrophobicContact CD1-CD1 4.42Å; F186-L190 HydrophobicContact CD2-CD1 4.44Å; F186-L190 HydrophobicContact CD2-CG 4.2Å; F186-L190 HydrophobicContact CE1-CD1 3.76Å; F186-L190 HydrophobicContact CE2-CD1 3.78Å; F186-L190 HydrophobicContact CE2-CD2 4.01Å; F186-L190 HydrophobicContact CE2-CG 3.75Å; F186-L190 HydrophobicContact CZ-CD1 3.4Å; F186-L190 VanDerWaalsContact CZ-CD1 3.4Å; F186-L190 HydrophobicContact CZ-CD2 4.33Å; F186-L190 HydrophobicContact CZ-CG 3.94Å; F186-L190 WeakPolarHBondContact O-CG 3.38Å; F186-L190 PolarHBondContact O-N 3.32Å; Q187-L190 PolarHBondContact O-N 3.02Å; L190-K192 VanDerWaalsContact C-N 3.31Å; L190-K192 PolarHBondContact O-N 3.45Å; L190-T193 CarbonylContact O-C 3.56Å; L190-T193 PolarHBondContact O-N 3.45Å; L190-E194 WeakPolarHBondContact O-CA 3.5Å; L190-E194 WeakPolarHBondContact O-CB 3.43Å; L190-E194 PolarHBondContact O-N 2.89Å
191Q92.4Very high93.4Very high126 Ų12642 Ų4259%0.58920%0.204SC*.Hα-helixtrans-61.6-42175.9-173.9-1799.100111.5Q187 F189 T193Q187-Q191 WeakPolarHBondContact O-CB 3.3Å; Q187-Q191 PolarHBondContact O-N 3.22Å; F189-Q191 VanDerWaalsContact C-N 3.3Å; F189-Q191 PolarHBondContact O-N 3.03Å; Q191-T193 VanDerWaalsContact C-N 3.33Å; Q191-T193 PolarHBondContact O-N 3.48Å
192K93.4Very high93.1Very high96 Ų9641 Ų4142%0.41720%0.2SC..Hα-helixtrans-68.6-32.7-179.7-173.164.1170.5-1700112.5F188 F189 L190 L262F188-K192 WeakPolarHBondContact O-CB 3.45Å; F188-K192 PolarHBondContact O-N 3.23Å; F189-K192 WeakPolarHBondContact O-CA 3.47Å; F189-K192 WeakPolarHBondContact O-CB 3.48Å; F189-K192 PolarHBondContact O-N 3.4Å; L190-K192 VanDerWaalsContact C-N 3.31Å; L190-K192 PolarHBondContact O-N 3.45Å; K192-L262 HydrophobicContact CB-CD2 4.19Å; K192-L262 HydrophobicContact CG-CD2 3.68Å
193T93.1Very high93Very high12 Ų1241.2 Ų41.27%0.07420%0.201CC..Hα-helixtrans-112.115.3-172.765.80000113.6F189 L190 Q191 H195 S196 C197 L262F189-T193 HydrophobicContact CD2-CG2 4.42Å; F189-T193 HydrophobicContact CE1-CG2 4.24Å; F189-T193 HydrophobicContact CE2-CG2 4.15Å; F189-T193 HydrophobicContact CZ-CG2 4.05Å; F189-T193 PolarHBondContact O-N 3.41Å; F189-T193 PolarHBondContact O-OG1 3.33Å; L190-T193 CarbonylContact O-C 3.56Å; L190-T193 PolarHBondContact O-N 3.45Å; Q191-T193 VanDerWaalsContact C-N 3.33Å; Q191-T193 PolarHBondContact O-N 3.48Å; T193-H195 VanDerWaalsContact C-N 3.29Å; T193-H195 PolarHBondContact O-N 2.92Å; T193-S196 WeakPolarHBondContact O-CA 3.42Å; T193-S196 VanDerWaalsContact O-CB 3.28Å; T193-S196 WeakPolarHBondContact O-CB 3.26Å; T193-S196 PolarHBondContact O-N 3Å; T193-C197 PolarHBondContact O-N 3.46Å; T193-C197 PolarHBondContact O-SG 3.48Å; T193-C197 VanDerWaalsContact O-SG 3.38Å; T193-C197 PolarHBondContact OG1-SG 2.52Å; T193-L262 HydrophobicContact CG2-CD2 4.02Å
194E91.1Very high92.9Very high69 Ų6944.5 Ų44.532%0.32222%0.224SC..Hα-helixtrans-58.6-39.3-174.865.7-176.1166.900113L190 S196 V198 I201L190-E194 WeakPolarHBondContact O-CA 3.5Å; L190-E194 WeakPolarHBondContact O-CB 3.43Å; L190-E194 PolarHBondContact O-N 2.89Å; E194-S196 PolarHBondContact O-N 3.27Å; E194-V198 HydrophobicContact CB-CG2 4.19Å; E194-V198 WeakPolarHBondContact O-CB 3.45Å; E194-V198 PolarHBondContact O-N 3Å; E194-I201 HydrophobicContact CB-CD1 4.12Å; E194-I201 HydrophobicContact CB-CG2 4.38Å; E194-I201 HydrophobicContact CG-CG2 4.28Å
195H91.2Very high92.8Very high90 Ų9048.5 Ų48.542%0.41724%0.243SC..Hα-helixtrans-73.4-6175-61.4-58.7000113.8T193 G202 N206T193-H195 VanDerWaalsContact C-N 3.29Å; T193-H195 PolarHBondContact O-N 2.92Å; H195-G202 WeakPolarHBondContact O-CA 3.48Å; H195-N206 PolarHBondContact O-ND2 3.48Å
196S90.9Very high92.8Very high10 Ų1048.6 Ų48.67%0.0724%0.243CC..Hα-helixtrans-97.2-60.7172.8-173.90000110.6T193 E194 N206 Q271T193-S196 WeakPolarHBondContact O-CA 3.42Å; T193-S196 VanDerWaalsContact O-CB 3.28Å; T193-S196 WeakPolarHBondContact O-CB 3.26Å; T193-S196 PolarHBondContact O-N 3Å; E194-S196 PolarHBondContact O-N 3.27Å; S196-N206 WeakPolarHBondContact CA-ND2 3.41Å; S196-N206 PolarHBondContact O-ND2 2.83Å; S196-Q271 WeakPolarHBondContact OG-CG 3.34Å
197C90.9Very high92.9Very high0 Ų048.8 Ų48.80%025%0.245CC..Hα-helixtrans-112.5-6.2-159.766.20000116.6Q162 M168 T193 F240 C243Q162-C197 PolarHBondContact NE2-O 3.39Å; M168-C197 HydrophobicContact CE-CB 4.43Å; T193-C197 PolarHBondContact O-N 3.46Å; T193-C197 PolarHBondContact O-SG 3.48Å; T193-C197 VanDerWaalsContact O-SG 3.38Å; T193-C197 PolarHBondContact OG1-SG 2.52Å; C197-F240 VanDerWaalsContact CA-O 3.23Å; C197-F240 WeakPolarHBondContact CA-O 3.36Å; C197-F240 WeakPolarHBondContact CB-O 3.38Å; C197-C243 WeakPolarHBondContact CB-SG 3.43Å
198V90.7Very high92.9Very high30 Ų3050.3 Ų50.318%0.18225%0.254CS..  trans-89.5120.3178.4178.90000109.1E194 N200 I201 G202 V203E194-V198 HydrophobicContact CB-CG2 4.19Å; E194-V198 WeakPolarHBondContact O-CB 3.45Å; E194-V198 PolarHBondContact O-N 3Å; V198-N200 VanDerWaalsContact C-N 3.31Å; V198-N200 PolarHBondContact O-N 3.37Å; V198-I201 HydrophobicContact CB-CB 4.11Å; V198-I201 HydrophobicContact CB-CD1 4.1Å; V198-I201 HydrophobicContact CB-CG1 4.24Å; V198-I201 HydrophobicContact CG1-CB 4.17Å; V198-I201 HydrophobicContact CG1-CD1 3.72Å; V198-I201 HydrophobicContact CG1-CG1 3.8Å; V198-I201 PolarHBondContact O-N 2.66Å; V198-G202 PolarHBondContact O-N 3.38Å; V198-V203 PolarHBondContact O-N 3.24Å
199I89.6Confident93Very high75 Ų7549.7 Ų49.739%0.38525%0.252SS..Iπ-helixtrans-55.3-43.9-169.7-166.5168000113Q162 I201Q162-I199 VanDerWaalsContact OE1-CB 3.25Å; Q162-I199 VanDerWaalsContact OE1-CG2 3.3Å; I199-I201 VanDerWaalsContact C-N 3.3Å; I199-I201 PolarHBondContact O-N 3.37Å
200N86.5Confident93.1Very high122 Ų12249.6 Ų49.665%0.65225%0.251SS*.Iπ-helixtrans-84.31.5-177.2-64.3-27.9000113.8V198V198-N200 VanDerWaalsContact C-N 3.31Å; V198-N200 PolarHBondContact O-N 3.37Å
201I89.1Confident93.2Very high82 Ų8250.2 Ų50.242%0.42126%0.257SS..Iπ-helixtrans-121.6-58-177-59.4177.3000111.1E194 V198 I199E194-I201 HydrophobicContact CB-CD1 4.12Å; E194-I201 HydrophobicContact CB-CG2 4.38Å; E194-I201 HydrophobicContact CG-CG2 4.28Å; V198-I201 HydrophobicContact CB-CB 4.11Å; V198-I201 HydrophobicContact CB-CD1 4.1Å; V198-I201 HydrophobicContact CB-CG1 4.24Å; V198-I201 HydrophobicContact CG1-CB 4.17Å; V198-I201 HydrophobicContact CG1-CD1 3.72Å; V198-I201 HydrophobicContact CG1-CG1 3.8Å; V198-I201 PolarHBondContact O-N 2.66Å; I199-I201 VanDerWaalsContact C-N 3.3Å; I199-I201 PolarHBondContact O-N 3.37Å
202G90.4Very high93.5Very high2 Ų246.4 Ų46.42%0.02124%0.243CC..Iπ-helixtrans-107-39-167.700000114.9H195 V198 S204 K205 N206H195-G202 WeakPolarHBondContact O-CA 3.48Å; V198-G202 PolarHBondContact O-N 3.38Å; G202-S204 PolarHBondContact O-N 2.94Å; G202-K205 PolarHBondContact O-N 3.11Å; G202-N206 PolarHBondContact O-N 3.49Å; G202-N206 PolarHBondContact O-ND2 3.05Å; G202-N206 VanDerWaalsContact O-ND2 3.12Å
203V94.8Very high93.6Very high3 Ų341.9 Ų41.92%0.01822%0.223CC..Iπ-helixtrans-62.5-47.2-161.3175.10000112.5V198 K205 N206 L207 F237 F240V198-V203 PolarHBondContact O-N 3.24Å; V203-K205 VanDerWaalsContact C-N 3.34Å; V203-K205 PolarHBondContact O-N 3.18Å; V203-N206 PolarHBondContact O-N 3.14Å; V203-N206 VanDerWaalsContact O-N 3.16Å; V203-L207 HydrophobicContact CG1-CD1 3.77Å; V203-L207 HydrophobicContact CG1-CG 4.46Å; V203-L207 WeakPolarHBondContact O-CG 3.37Å; V203-L207 PolarHBondContact O-N 2.92Å; V203-F237 HydrophobicContact CG1-CB 3.83Å; V203-F240 HydrophobicContact CB-CB 4.47Å; V203-F240 HydrophobicContact CG1-CB 4.14Å; V203-F240 HydrophobicContact CG2-CB 3.92Å
204S94.9Very high93.8Very high72 Ų7241.3 Ų41.350%0.50322%0.22SC..Hα-helixtrans-56.7-47.8177.8-169.10000111.7G202 N206 L207 D208G202-S204 PolarHBondContact O-N 2.94Å; S204-N206 VanDerWaalsContact C-N 3.31Å; S204-N206 PolarHBondContact O-N 2.92Å; S204-L207 PolarHBondContact O-N 3.1Å; S204-D208 VanDerWaalsContact O-CG 3.27Å; S204-D208 PolarHBondContact O-N 3.44Å
205K95.8Very high94.1Very high128 Ų12842.2 Ų42.256%0.55723%0.23SC*.Hα-helixtrans-63.2-38.8179.6-172.9176.9-1781800111.6G202 V203 L207 D208 M209 F334G202-K205 PolarHBondContact O-N 3.11Å; V203-K205 VanDerWaalsContact C-N 3.34Å; V203-K205 PolarHBondContact O-N 3.18Å; K205-L207 VanDerWaalsContact C-N 3.34Å; K205-D208 PolarHBondContact O-N 2.88Å; K205-M209 HydrophobicContact CG-CG 4.47Å; K205-M209 WeakPolarHBondContact O-CB 3Å; K205-M209 VanDerWaalsContact O-CG 3.23Å; K205-M209 WeakPolarHBondContact O-CG 3.37Å; K205-M209 PolarHBondContact O-N 2.9Å; K205-F334 HydrophobicContact CD-CE2 4.25Å; K205-F334 HydrophobicContact CG-CE2 4.18Å
206N97.4Very high94.4Very high1 Ų141 Ų411%0.00522%0.223CC..Hα-helixtrans-63.7-39.3176.9-69.7-41.9000111.9H195 S196 G202 V203 S204 M209 L210 F240 Q271 V272 F334H195-N206 PolarHBondContact O-ND2 3.48Å; S196-N206 WeakPolarHBondContact CA-ND2 3.41Å; S196-N206 PolarHBondContact O-ND2 2.83Å; G202-N206 PolarHBondContact O-N 3.49Å; G202-N206 PolarHBondContact O-ND2 3.05Å; G202-N206 VanDerWaalsContact O-ND2 3.12Å; V203-N206 PolarHBondContact O-N 3.14Å; V203-N206 VanDerWaalsContact O-N 3.16Å; S204-N206 VanDerWaalsContact C-N 3.31Å; S204-N206 PolarHBondContact O-N 2.92Å; N206-M209 PolarHBondContact O-N 3.35Å; N206-L210 WeakPolarHBondContact O-CB 3.28Å; N206-L210 PolarHBondContact O-N 2.81Å; N206-F240 HydrophobicContact CB-CD1 3.83Å; N206-F240 HydrophobicContact CB-CD2 4.31Å; N206-F240 HydrophobicContact CB-CE1 3.69Å; N206-F240 HydrophobicContact CB-CE2 4.17Å; N206-F240 HydrophobicContact CB-CG 4.14Å; N206-F240 HydrophobicContact CB-CZ 3.86Å; N206-Q271 PolarHBondContact OD1-NE2 2.74Å; N206-Q271 VanDerWaalsContact OD1-NE2 3.1Å; N206-V272 HydrophobicContact CB-CG2 3.95Å; N206-F334 WeakPolarHBondContact OD1-CZ 3.08Å
207L97.4Very high94.6Very high5 Ų542.2 Ų42.23%0.02623%0.229CC..Hα-helixtrans-71-37.7178.3-65.4160.3000112.5V203 S204 K205 M209 L210 S211 V233 L236 F237 F240V203-L207 HydrophobicContact CG1-CD1 3.77Å; V203-L207 HydrophobicContact CG1-CG 4.46Å; V203-L207 WeakPolarHBondContact O-CG 3.37Å; V203-L207 PolarHBondContact O-N 2.92Å; S204-L207 PolarHBondContact O-N 3.1Å; K205-L207 VanDerWaalsContact C-N 3.34Å; L207-M209 VanDerWaalsContact C-N 3.34Å; L207-L210 PolarHBondContact O-N 2.78Å; L207-S211 PolarHBondContact O-N 3.38Å; L207-S211 PolarHBondContact O-OG 3.21Å; L207-V233 HydrophobicContact CD2-CG1 4.4Å; L207-V233 WeakPolarHBondContact CD2-O 3.48Å; L207-L236 HydrophobicContact CD2-CB 4.12Å; L207-F237 HydrophobicContact CD1-CB 3.68Å; L207-F240 HydrophobicContact CD2-CD2 3.87Å; L207-F240 HydrophobicContact CD2-CE2 3.61Å; L207-F240 HydrophobicContact CG-CD2 4.1Å; L207-F240 HydrophobicContact CG-CE2 4.05Å
208D96.3Very high94.9Very high70 Ų7042.8 Ų42.837%0.37423%0.232SC..Hα-helixtrans-64.5-41.2173.9-64.8-24.1000111.2S204 K205 S211 T212 Q234S204-D208 VanDerWaalsContact O-CG 3.27Å; S204-D208 PolarHBondContact O-N 3.44Å; K205-D208 PolarHBondContact O-N 2.88Å; D208-S211 PolarHBondContact O-N 2.93Å; D208-T212 PolarHBondContact O-N 3.38Å; D208-T212 PolarHBondContact O-OG1 3.27Å; D208-Q234 PolarHBondContact OD1-NE2 3.23Å
209M97.4Very high95.2Very high27 Ų2745.5 Ų45.513%0.13325%0.25CS..Hα-helixtrans-70.5-34.6175.3-66.4-648600112.7K205 N206 L207 T212 L213 V272 L331 F334K205-M209 HydrophobicContact CG-CG 4.47Å; K205-M209 WeakPolarHBondContact O-CB 3Å; K205-M209 VanDerWaalsContact O-CG 3.23Å; K205-M209 WeakPolarHBondContact O-CG 3.37Å; K205-M209 PolarHBondContact O-N 2.9Å; N206-M209 PolarHBondContact O-N 3.35Å; L207-M209 VanDerWaalsContact C-N 3.34Å; M209-T212 PolarHBondContact O-N 3.08Å; M209-L213 WeakPolarHBondContact O-CB 3.19Å; M209-L213 PolarHBondContact O-N 2.8Å; M209-V272 HydrophobicContact CB-CG1 4.45Å; M209-L331 HydrophobicContact SD-CD2 4.4Å; M209-F334 HydrophobicContact CB-CD1 3.99Å; M209-F334 HydrophobicContact CB-CD2 4.48Å; M209-F334 HydrophobicContact CB-CE1 3.81Å; M209-F334 HydrophobicContact CB-CE2 4.33Å; M209-F334 HydrophobicContact CB-CG 4.31Å; M209-F334 HydrophobicContact CB-CZ 3.98Å; M209-F334 HydrophobicContact CG-CB 4.46Å; M209-F334 HydrophobicContact CG-CD1 3.93Å; M209-F334 HydrophobicContact CG-CD2 3.61Å; M209-F334 HydrophobicContact CG-CE1 3.99Å; M209-F334 HydrophobicContact CG-CE2 3.68Å; M209-F334 HydrophobicContact CG-CG 3.72Å; M209-F334 HydrophobicContact CG-CZ 3.86Å; M209-F334 HydrophobicContact SD-CB 4.06Å; M209-F334 HydrophobicContact SD-CD1 4.49Å; M209-F334 HydrophobicContact SD-CD2 4.13Å; M209-F334 HydrophobicContact SD-CG 3.97Å
210L98Very high95.5Very high0 Ų046.3 Ų46.30%025%0.254CS..Hα-helixtrans-61.7-45.7170.8-178.258.3000110.9N206 L207 T212 L213 I214 V233 L236 F240 V272 A275 L279N206-L210 WeakPolarHBondContact O-CB 3.28Å; N206-L210 PolarHBondContact O-N 2.81Å; L207-L210 PolarHBondContact O-N 2.78Å; L210-T212 VanDerWaalsContact C-N 3.33Å; L210-T212 PolarHBondContact O-N 3Å; L210-L213 PolarHBondContact O-N 3.23Å; L210-I214 HydrophobicContact CD1-CD1 4.07Å; L210-I214 HydrophobicContact CD1-CG1 4.26Å; L210-I214 HydrophobicContact CG-CD1 3.88Å; L210-I214 WeakPolarHBondContact O-CD1 3.42Å; L210-I214 VanDerWaalsContact O-CG1 3.22Å; L210-I214 WeakPolarHBondContact O-CG1 3.48Å; L210-I214 PolarHBondContact O-N 3.33Å; L210-V233 HydrophobicContact CB-CG1 4.37Å; L210-V233 HydrophobicContact CD2-CG1 4.04Å; L210-V233 HydrophobicContact CG-CG1 4.2Å; L210-L236 HydrophobicContact CD2-CD1 4.09Å; L210-F240 HydrophobicContact CD2-CE2 4.35Å; L210-F240 HydrophobicContact CD2-CZ 4.38Å; L210-V272 HydrophobicContact CB-CG1 4.09Å; L210-V272 HydrophobicContact CD1-CG1 4.29Å; L210-A275 HydrophobicContact CD1-CB 4.11Å; L210-A275 HydrophobicContact CD2-CB 3.93Å; L210-L279 HydrophobicContact CD1-CD1 4.16Å; L210-L279 HydrophobicContact CD2-CD1 4.23Å; L210-L279 HydrophobicContact CG-CD1 4.4Å
211S97.1Very high96.1Very high34 Ų3440.5 Ų40.524%0.23822%0.223CC..Hα-helixtrans-60-44176-58.70000111.8L207 D208 T215 V233L207-S211 PolarHBondContact O-N 3.38Å; L207-S211 PolarHBondContact O-OG 3.21Å; D208-S211 PolarHBondContact O-N 2.93Å; S211-T215 WeakPolarHBondContact O-CB 3.32Å; S211-T215 PolarHBondContact O-N 3.01Å; S211-T215 PolarHBondContact O-OG1 2.94Å; S211-V233 WeakPolarHBondContact OG-CB 3.39Å; S211-V233 VanDerWaalsContact OG-CG1 3.3Å; S211-V233 WeakPolarHBondContact OG-CG1 3.02Å
212T96.9Very high96.4Very high47 Ų4737.4 Ų37.429%0.28821%0.209SC..Hα-helixtrans-64.2-42.2177.8-57.10000111.1D208 M209 L210 T215 F216 L331D208-T212 PolarHBondContact O-N 3.38Å; D208-T212 PolarHBondContact O-OG1 3.27Å; M209-T212 PolarHBondContact O-N 3.08Å; L210-T212 VanDerWaalsContact C-N 3.33Å; L210-T212 PolarHBondContact O-N 3Å; T212-T215 PolarHBondContact O-N 3.4Å; T212-F216 PolarHBondContact O-N 3.48Å; T212-F216 VanDerWaalsContact O-N 3.1Å; T212-L331 HydrophobicContact CG2-CD1 4.11Å; T212-L331 HydrophobicContact CG2-CD2 3.83Å; T212-L331 HydrophobicContact CG2-CG 3.83Å
213L97.3Very high96.8Very high0 Ų044.3 Ų44.30%024%0.241CC..Hα-helixtrans-64.8-46.7178.6179.863.7000111.9M209 L210 T215 F216 L217 V272 L273 Y276 L322 L331 F335M209-L213 WeakPolarHBondContact O-CB 3.19Å; M209-L213 PolarHBondContact O-N 2.8Å; L210-L213 PolarHBondContact O-N 3.23Å; L213-T215 VanDerWaalsContact C-N 3.34Å; L213-T215 PolarHBondContact O-N 2.96Å; L213-F216 PolarHBondContact O-N 3.37Å; L213-L217 HydrophobicContact CD1-CD1 3.55Å; L213-L217 HydrophobicContact CD1-CG 3.94Å; L213-L217 HydrophobicContact CG-CD1 4.04Å; L213-L217 PolarHBondContact O-N 3.07Å; L213-V272 HydrophobicContact CD2-CG1 4.06Å; L213-L273 HydrophobicContact CD2-CD2 3.98Å; L213-Y276 HydrophobicContact CD2-CD2 4.38Å; L213-Y276 HydrophobicContact CD2-CG 3.99Å; L213-Y276 HydrophobicContact CG-CD2 4.38Å; L213-Y276 HydrophobicContact CG-CG 4.41Å; L213-L322 HydrophobicContact CD1-CD1 3.7Å; L213-L322 HydrophobicContact CD1-CD2 3.61Å; L213-L322 HydrophobicContact CD1-CG 4.21Å; L213-L331 HydrophobicContact CB-CD2 4.33Å; L213-L331 HydrophobicContact CD1-CD1 4.36Å; L213-F335 HydrophobicContact CD2-CZ 4.27Å
214I97.3Very high96.9Very high1 Ų145.5 Ų45.51%0.00525%0.246CC..Hα-helixtrans-59.2-46.9175.9-65.5159.9000110.1L210 F216 L217 D218 F221 A222 L225 V233 Y276 L279L210-I214 HydrophobicContact CD1-CD1 4.07Å; L210-I214 HydrophobicContact CD1-CG1 4.26Å; L210-I214 HydrophobicContact CG-CD1 3.88Å; L210-I214 WeakPolarHBondContact O-CD1 3.42Å; L210-I214 VanDerWaalsContact O-CG1 3.22Å; L210-I214 WeakPolarHBondContact O-CG1 3.48Å; L210-I214 PolarHBondContact O-N 3.33Å; I214-F216 PolarHBondContact O-N 3.27Å; I214-L217 PolarHBondContact O-N 3.28Å; I214-D218 CarbonylContact O-C 3.42Å; I214-D218 VanDerWaalsContact O-C 3.26Å; I214-D218 WeakPolarHBondContact O-CA 3.42Å; I214-D218 PolarHBondContact O-N 3.21Å; I214-F221 HydrophobicContact CG2-CB 4.47Å; I214-F221 HydrophobicContact CG2-CD1 3.81Å; I214-A222 HydrophobicContact CG2-CB 3.97Å; I214-L225 HydrophobicContact CD1-CD1 4.01Å; I214-L225 HydrophobicContact CG2-CD1 4.3Å; I214-V233 HydrophobicContact CD1-CG2 4.28Å; I214-Y276 HydrophobicContact CG1-CD2 3.73Å; I214-Y276 HydrophobicContact CG1-CE2 4.04Å; I214-L279 HydrophobicContact CD1-CD1 3.57Å; I214-L279 HydrophobicContact CG1-CD1 4.26Å
215T96.8Very high96.9Very high87 Ų8742.5 Ų42.553%0.53422%0.224SC..Hα-helixtrans-56.2-38.4177.6-55.50000112.4S211 T212 L213S211-T215 WeakPolarHBondContact O-CB 3.32Å; S211-T215 PolarHBondContact O-N 3.01Å; S211-T215 PolarHBondContact O-OG1 2.94Å; T212-T215 PolarHBondContact O-N 3.4Å; L213-T215 VanDerWaalsContact C-N 3.34Å; L213-T215 PolarHBondContact O-N 2.96Å
216F96.4Very high96.9Very high64 Ų6444.7 Ų44.728%0.28123%0.234SC..Hα-helixtrans-78.1-43.8-178.6-179.9-108.7000113.3T212 L213 I214 L322 K325 V327 P328 L331T212-F216 PolarHBondContact O-N 3.48Å; T212-F216 VanDerWaalsContact O-N 3.1Å; L213-F216 PolarHBondContact O-N 3.37Å; I214-F216 PolarHBondContact O-N 3.27Å; F216-L322 HydrophobicContact CD1-CD2 3.98Å; F216-L322 HydrophobicContact CE1-CD2 4.03Å; F216-K325 HydrophobicContact CE1-CB 4.19Å; F216-K325 HydrophobicContact CE1-CD 3.97Å; F216-K325 HydrophobicContact CZ-CB 4.04Å; F216-K325 HydrophobicContact CZ-CD 4.34Å; F216-V327 HydrophobicContact CE1-CG2 4.11Å; F216-V327 HydrophobicContact CZ-CG2 4.36Å; F216-P328 HydrophobicContact CD2-CG 3.94Å; F216-P328 HydrophobicContact CE2-CG 4.23Å; F216-L331 HydrophobicContact CB-CD1 4.14Å; F216-L331 HydrophobicContact CD1-CD1 4.36Å; F216-L331 HydrophobicContact CG-CD1 4.34Å
217L96.1Very high96.8Very high36 Ų3647.9 Ų47.919%0.18827%0.267CS..Hα-helixtrans-87.5-29.8-174-69.6-177.4000113.6L213 I214 Y276 V318 L322 K325L213-L217 HydrophobicContact CD1-CD1 3.55Å; L213-L217 HydrophobicContact CD1-CG 3.94Å; L213-L217 HydrophobicContact CG-CD1 4.04Å; L213-L217 PolarHBondContact O-N 3.07Å; I214-L217 PolarHBondContact O-N 3.28Å; L217-Y276 HydrophobicContact CB-CE2 4.28Å; L217-Y276 VanDerWaalsContact CB-OH 3.31Å; L217-Y276 WeakPolarHBondContact CB-OH 3.45Å; L217-Y276 HydrophobicContact CD1-CD1 4.22Å; L217-Y276 HydrophobicContact CD1-CE1 3.64Å; L217-Y276 HydrophobicContact CD1-CE2 4.4Å; L217-V318 HydrophobicContact CD1-CG1 3.76Å; L217-L322 HydrophobicContact CD1-CD1 4.48Å; L217-L322 HydrophobicContact CD1-CD2 3.98Å; L217-L322 HydrophobicContact CD1-CG 4.18Å; L217-L322 HydrophobicContact CD2-CD2 3.72Å; L217-L322 HydrophobicContact CD2-CG 4.33Å; L217-L322 HydrophobicContact CG-CD2 3.99Å; L217-K325 HydrophobicContact CD2-CD 4.11Å
218D96.7Very high96.7Very high12 Ų1251.8 Ų51.86%0.06428%0.284CS..  trans-145.373.7-171.3-167-8.1000111.6I214 M220 F221 A222 Q280 R283I214-D218 CarbonylContact O-C 3.42Å; I214-D218 VanDerWaalsContact O-C 3.26Å; I214-D218 WeakPolarHBondContact O-CA 3.42Å; I214-D218 PolarHBondContact O-N 3.21Å; D218-M220 PolarHBondContact O-N 3.27Å; D218-F221 HydrophobicContact CB-CB 4.07Å; D218-F221 PolarHBondContact O-N 3.25Å; D218-F221 VanDerWaalsContact O-N 3.14Å; D218-F221 WeakPolarHBondContact OD1-CB 3.5Å; D218-F221 PolarHBondContact OD1-N 3.28Å; D218-F221 VanDerWaalsContact OD2-CB 3.22Å; D218-F221 WeakPolarHBondContact OD2-CB 3.4Å; D218-A222 PolarHBondContact O-N 3.05Å; D218-Q280 PolarHBondContact OD2-NE2 3.34Å; D218-Q280 VanDerWaalsContact OD2-NE2 3.11Å; D218-R283 IonicContact OD1-CZ 3.58Å; D218-R283 IonicContact OD1-NE 3.96Å; D218-R283 IonicContact OD1-NH2 3.39Å; D218-R283 PolarHBondContact OD1-NH2 3.16Å; D218-R283 WeakPolarHBondContact OD2-CD 3.5Å; D218-R283 IonicContact OD2-CZ 3.71Å; D218-R283 IonicContact OD2-NE 3.01Å; D218-R283 PolarHBondContact OD2-NE 3.33Å; D218-R283 IonicContact OD2-NH2 3.02Å
219P96.6Very high96.3Very high87 Ų8750 Ų5057%0.56528%0.282SS*.Hα-helixtrans-59.2-32.9-174.6-25.534.5000114A222 E223P219-A222 WeakPolarHBondContact O-CB 3.44Å; P219-A222 PolarHBondContact O-N 2.93Å; P219-E223 PolarHBondContact O-N 3.08Å
220M97.2Very high95.5Very high93 Ų9353.7 Ų53.746%0.45832%0.317SS..Hα-helixtrans-68.1-43.5178.2177.9-92-84.900111.3D218 A222 E223 H224 L287D218-M220 PolarHBondContact O-N 3.27Å; M220-A222 VanDerWaalsContact C-N 3.31Å; M220-A222 PolarHBondContact O-N 3.39Å; M220-E223 PolarHBondContact O-N 3.44Å; M220-H224 PolarHBondContact O-N 3.02Å; M220-H224 VanDerWaalsContact O-N 3.07Å; M220-L287 HydrophobicContact CE-CD1 3.51Å; M220-L287 HydrophobicContact SD-CD1 3.45Å; M220-L287 WeakPolarHBondContact SD-CD1 3.13Å; M220-L287 HydrophobicContact SD-CD2 3.55Å; M220-L287 VanDerWaalsContact SD-CD2 3.55Å; M220-L287 HydrophobicContact SD-CG 4.15Å
221F97.4Very high95.1Very high0 Ų055.9 Ų55.90%034%0.34CS..Hα-helixtrans-66.1-37.1174.5-166.9-121.4000111.7I214 D218 E223 H224 L225 L279 R283 V286 L287I214-F221 HydrophobicContact CG2-CB 4.47Å; I214-F221 HydrophobicContact CG2-CD1 3.81Å; D218-F221 HydrophobicContact CB-CB 4.07Å; D218-F221 PolarHBondContact O-N 3.25Å; D218-F221 VanDerWaalsContact O-N 3.14Å; D218-F221 WeakPolarHBondContact OD1-CB 3.5Å; D218-F221 PolarHBondContact OD1-N 3.28Å; D218-F221 VanDerWaalsContact OD2-CB 3.22Å; D218-F221 WeakPolarHBondContact OD2-CB 3.4Å; F221-E223 VanDerWaalsContact C-N 3.34Å; F221-E223 PolarHBondContact O-N 2.94Å; F221-H224 WeakPolarHBondContact O-CB 3.34Å; F221-H224 PolarHBondContact O-N 3.15Å; F221-L225 HydrophobicContact CD1-CD1 3.92Å; F221-L225 HydrophobicContact CD1-CG 4.45Å; F221-L225 HydrophobicContact CE1-CD1 3.72Å; F221-L225 HydrophobicContact CE1-CG 4.28Å; F221-L225 HydrophobicContact CZ-CD1 4.3Å; F221-L225 HydrophobicContact CZ-CD2 4.35Å; F221-L225 HydrophobicContact CZ-CG 4.44Å; F221-L225 WeakPolarHBondContact O-CG 3.34Å; F221-L225 PolarHBondContact O-N 3.46Å; F221-L279 HydrophobicContact CE1-CB 4.06Å; F221-L279 HydrophobicContact CE1-CD1 4.36Å; F221-L279 HydrophobicContact CE1-CD2 4.32Å; F221-L279 HydrophobicContact CE1-CG 4.5Å; F221-L279 HydrophobicContact CZ-CD2 4.42Å; F221-R283 HydrophobicContact CD2-CG 3.92Å; F221-R283 HydrophobicContact CE2-CG 4.1Å; F221-R283 HydrophobicContact CG-CG 4.39Å; F221-V286 HydrophobicContact CE2-CB 3.96Å; F221-V286 HydrophobicContact CE2-CG1 3.46Å; F221-V286 VanDerWaalsContact CE2-CG1 3.46Å; F221-V286 HydrophobicContact CZ-CB 4.43Å; F221-V286 HydrophobicContact CZ-CG1 3.92Å; F221-L287 HydrophobicContact CD2-CD1 4.48Å; F221-L287 HydrophobicContact CD2-CD2 3.98Å; F221-L287 HydrophobicContact CD2-CG 4.11Å; F221-L287 HydrophobicContact CE2-CG 4.5Å
222A97.2Very high94.9Very high16 Ų1654.6 Ų54.613%0.13233%0.331CS..Hα-helixtrans-59.8-43.1173.900000112.3I214 D218 P219 M220 L225 K226I214-A222 HydrophobicContact CG2-CB 3.97Å; D218-A222 PolarHBondContact O-N 3.05Å; P219-A222 WeakPolarHBondContact O-CB 3.44Å; P219-A222 PolarHBondContact O-N 2.93Å; M220-A222 VanDerWaalsContact C-N 3.31Å; M220-A222 PolarHBondContact O-N 3.39Å; A222-L225 PolarHBondContact O-N 3.02Å; A222-K226 WeakPolarHBondContact O-CB 2.99Å; A222-K226 PolarHBondContact O-N 3.3Å
223E96.9Very high94.8Very high147 Ų14753 Ų5369%0.68732%0.321SS*.Hα-helixtrans-64.4-43.1177.1-174.7170.8-155.700111.9P219 M220 F221 K226 G227P219-E223 PolarHBondContact O-N 3.08Å; M220-E223 PolarHBondContact O-N 3.44Å; F221-E223 VanDerWaalsContact C-N 3.34Å; F221-E223 PolarHBondContact O-N 2.94Å; E223-K226 PolarHBondContact O-N 3.28Å; E223-G227 PolarHBondContact O-N 3.44Å
224H97.2Very high94.7Very high29 Ų2956.1 Ų56.113%0.13434%0.336CS..Hα-helixtrans-56.3-52.4173.4173.273.4000111.8M220 F221 K226 G227 K228 L287 M291M220-H224 PolarHBondContact O-N 3.02Å; M220-H224 VanDerWaalsContact O-N 3.07Å; F221-H224 WeakPolarHBondContact O-CB 3.34Å; F221-H224 PolarHBondContact O-N 3.15Å; H224-K226 VanDerWaalsContact C-N 3.3Å; H224-K226 PolarHBondContact O-N 3.44Å; H224-G227 WeakPolarHBondContact O-CA 3.38Å; H224-G227 PolarHBondContact O-N 2.64Å; H224-K228 VanDerWaalsContact CE1-CE 3.42Å; H224-K228 WeakPolarHBondContact CE1-CE 3.27Å; H224-K228 PolarHBondContact O-N 3.31Å; H224-K228 VanDerWaalsContact O-N 3.15Å; H224-L287 HydrophobicContact CB-CD2 3.66Å; H224-M291 PolarHBondContact NE2-O 3.21Å
225L96.4Very high94.5Very high8 Ų857 Ų574%0.04234%0.342CS..Hα-helixtrans-61.8-39.1179.8-67.5176.2000111.9I214 F221 A222 G227 K228 G229 A232 V233 I296I214-L225 HydrophobicContact CD1-CD1 4.01Å; I214-L225 HydrophobicContact CG2-CD1 4.3Å; F221-L225 HydrophobicContact CD1-CD1 3.92Å; F221-L225 HydrophobicContact CD1-CG 4.45Å; F221-L225 HydrophobicContact CE1-CD1 3.72Å; F221-L225 HydrophobicContact CE1-CG 4.28Å; F221-L225 HydrophobicContact CZ-CD1 4.3Å; F221-L225 HydrophobicContact CZ-CD2 4.35Å; F221-L225 HydrophobicContact CZ-CG 4.44Å; F221-L225 WeakPolarHBondContact O-CG 3.34Å; F221-L225 PolarHBondContact O-N 3.46Å; A222-L225 PolarHBondContact O-N 3.02Å; L225-G227 VanDerWaalsContact C-N 3.3Å; L225-G227 PolarHBondContact O-N 3.25Å; L225-K228 WeakPolarHBondContact O-CB 3.49Å; L225-K228 PolarHBondContact O-N 2.88Å; L225-K228 VanDerWaalsContact O-N 3.11Å; L225-G229 PolarHBondContact O-N 3.26Å; L225-A232 HydrophobicContact CB-CB 4.39Å; L225-A232 HydrophobicContact CD2-CB 4.29Å; L225-A232 WeakPolarHBondContact O-CB 3.23Å; L225-V233 HydrophobicContact CD1-CG2 3.93Å; L225-I296 HydrophobicContact CD2-CD1 3.5Å; L225-I296 VanDerWaalsContact CD2-CD1 3.5Å
226K94.9Very high94.5Very high175 Ų17552.9 Ų52.976%0.76132%0.316SS*.Hα-helixtrans-62-39.2173.8-172.8-179.5179-176.30111.6A222 E223 H224 K228 G229A222-K226 WeakPolarHBondContact O-CB 2.99Å; A222-K226 PolarHBondContact O-N 3.3Å; E223-K226 PolarHBondContact O-N 3.28Å; H224-K226 VanDerWaalsContact C-N 3.3Å; H224-K226 PolarHBondContact O-N 3.44Å; K226-K228 PolarHBondContact O-N 2.88Å; K226-G229 PolarHBondContact O-N 3.28Å
227G95Very high94.4Very high68 Ų6854.2 Ų54.270%0.70132%0.322SS*.Hα-helixtrans-63.1-24.5174.300000114E223 H224 L225 G229E223-G227 PolarHBondContact O-N 3.44Å; H224-G227 WeakPolarHBondContact O-CA 3.38Å; H224-G227 PolarHBondContact O-N 2.64Å; L225-G227 VanDerWaalsContact C-N 3.3Å; L225-G227 PolarHBondContact O-N 3.25Å; G227-G229 VanDerWaalsContact C-N 3.31Å
228K95.1Very high94.3Very high87 Ų8753.8 Ų53.838%0.37832%0.321SS..THydrogen-bonded Turntrans-83.7-3.9173.6-60.9-69163.3-176.80114H224 L225 K226 A232 S290 M291H224-K228 VanDerWaalsContact CE1-CE 3.42Å; H224-K228 WeakPolarHBondContact CE1-CE 3.27Å; H224-K228 PolarHBondContact O-N 3.31Å; H224-K228 VanDerWaalsContact O-N 3.15Å; L225-K228 WeakPolarHBondContact O-CB 3.49Å; L225-K228 PolarHBondContact O-N 2.88Å; L225-K228 VanDerWaalsContact O-N 3.11Å; K226-K228 PolarHBondContact O-N 2.88Å; K228-A232 HydrophobicContact CB-CB 4.03Å; K228-S290 WeakPolarHBondContact CE-O 3.27Å; K228-S290 VanDerWaalsContact CE-OG 3.26Å; K228-S290 WeakPolarHBondContact CE-OG 3.11Å; K228-S290 PolarHBondContact NZ-O 2.95Å; K228-S290 PolarHBondContact NZ-OG 3.29Å; K228-M291 WeakPolarHBondContact CG-O 3.17Å
229G89.1Confident94.2Very high33 Ų3353.6 Ų53.634%0.3432%0.32SS..  trans102.6159.6178.600000113.1L225 K226 G227 G231 A232L225-G229 PolarHBondContact O-N 3.26Å; K226-G229 PolarHBondContact O-N 3.28Å; G227-G229 VanDerWaalsContact C-N 3.31Å; G229-G231 PolarHBondContact O-N 3.16Å; G229-A232 WeakPolarHBondContact O-CB 3.1Å; G229-A232 PolarHBondContact O-N 3.02Å
230A79.1Confident94.1Very high104 Ų10449.5 Ų49.586%0.8629%0.293SS*.THydrogen-bonded Turntrans-59.9-18.3-175.200000114.2
231G89.5Confident94Very high46 Ų4645.2 Ų45.247%0.47427%0.272SS..THydrogen-bonded Turntrans-83-7.2177.900000115.3G229 V233 Q234 S235G229-G231 PolarHBondContact O-N 3.16Å; G231-V233 PolarHBondContact O-N 2.9Å; G231-Q234 PolarHBondContact O-N 3.3Å; G231-Q234 VanDerWaalsContact O-N 3.11Å; G231-S235 PolarHBondContact O-N 2.94Å
232A93Very high93.7Very high6 Ų645.9 Ų45.95%0.0528%0.275CS..THydrogen-bonded Turntrans-63.3-41.3-171.600000113.7L225 K228 G229 S235 G293L225-A232 HydrophobicContact CB-CB 4.39Å; L225-A232 HydrophobicContact CD2-CB 4.29Å; L225-A232 WeakPolarHBondContact O-CB 3.23Å; K228-A232 HydrophobicContact CB-CB 4.03Å; G229-A232 WeakPolarHBondContact O-CB 3.1Å; G229-A232 PolarHBondContact O-N 3.02Å; A232-S235 PolarHBondContact O-OG 3.16Å; A232-G293 WeakPolarHBondContact O-CA 3.49Å
233V95.2Very high93.6Very high13 Ų1345.1 Ų45.18%0.07927%0.269CS..THydrogen-bonded Turntrans-77-35.4172.1179.50000110.4L207 L210 S211 I214 L225 G231 S235 L236L207-V233 HydrophobicContact CD2-CG1 4.4Å; L207-V233 WeakPolarHBondContact CD2-O 3.48Å; L210-V233 HydrophobicContact CB-CG1 4.37Å; L210-V233 HydrophobicContact CD2-CG1 4.04Å; L210-V233 HydrophobicContact CG-CG1 4.2Å; S211-V233 WeakPolarHBondContact OG-CB 3.39Å; S211-V233 VanDerWaalsContact OG-CG1 3.3Å; S211-V233 WeakPolarHBondContact OG-CG1 3.02Å; I214-V233 HydrophobicContact CD1-CG2 4.28Å; L225-V233 HydrophobicContact CD1-CG2 3.93Å; G231-V233 PolarHBondContact O-N 2.9Å; V233-S235 VanDerWaalsContact C-N 3.28Å; V233-S235 PolarHBondContact O-N 3.4Å; V233-L236 HydrophobicContact CG1-CD1 4.43Å; V233-L236 WeakPolarHBondContact O-CB 3.29Å; V233-L236 VanDerWaalsContact O-CG 3.29Å; V233-L236 WeakPolarHBondContact O-CG 3.42Å; V233-L236 PolarHBondContact O-N 3.11Å
234Q94.7Very high93.5Very high67 Ų6738.2 Ų38.231%0.31324%0.237SC..G310 helixtrans-67.9-26.7-175.4-56.6-58.20.900113.6D208 G231 L236 F237D208-Q234 PolarHBondContact OD1-NE2 3.23Å; G231-Q234 PolarHBondContact O-N 3.3Å; G231-Q234 VanDerWaalsContact O-N 3.11Å; Q234-L236 PolarHBondContact O-N 3.25Å; Q234-L236 VanDerWaalsContact O-N 3.16Å; Q234-F237 WeakPolarHBondContact O-CD1 3.47Å; Q234-F237 PolarHBondContact O-N 3.23Å
235S94.6Very high93.2Very high19 Ų1937.5 Ų37.513%0.13323%0.234CC..G310 helixtrans-62.3-18.1171.370.90000112.7G231 A232 V233 F237 P238 G293 L297G231-S235 PolarHBondContact O-N 2.94Å; A232-S235 PolarHBondContact O-OG 3.16Å; V233-S235 VanDerWaalsContact C-N 3.28Å; V233-S235 PolarHBondContact O-N 3.4Å; S235-F237 PolarHBondContact O-N 3.35Å; S235-P238 WeakPolarHBondContact O-CD 3.34Å; S235-G293 WeakPolarHBondContact OG-CA 3.39Å; S235-G293 PolarHBondContact OG-O 3.37Å; S235-L297 VanDerWaalsContact O-CD1 3.28Å; S235-L297 WeakPolarHBondContact O-CD1 3.39Å
236L95.5Very high92.9Very high1 Ų142.4 Ų42.41%0.00525%0.251CS..G310 helixtrans-781.4179.7-51.2177.5000113.4L207 L210 V233 Q234 P238 W239 L279 I296 L297L207-L236 HydrophobicContact CD2-CB 4.12Å; L210-L236 HydrophobicContact CD2-CD1 4.09Å; V233-L236 HydrophobicContact CG1-CD1 4.43Å; V233-L236 WeakPolarHBondContact O-CB 3.29Å; V233-L236 VanDerWaalsContact O-CG 3.29Å; V233-L236 WeakPolarHBondContact O-CG 3.42Å; V233-L236 PolarHBondContact O-N 3.11Å; Q234-L236 PolarHBondContact O-N 3.25Å; Q234-L236 VanDerWaalsContact O-N 3.16Å; L236-P238 WeakPolarHBondContact O-CD 3.36Å; L236-P238 VanDerWaalsContact O-N 3.08Å; L236-W239 HydrophobicContact CB-CD2 4.47Å; L236-W239 HydrophobicContact CB-CE3 4.12Å; L236-W239 HydrophobicContact CB-CZ3 4.36Å; L236-W239 HydrophobicContact CD1-CE3 4.42Å; L236-W239 HydrophobicContact CD1-CH2 4.23Å; L236-W239 HydrophobicContact CD1-CZ3 3.86Å; L236-W239 HydrophobicContact CD2-CH2 3.99Å; L236-W239 HydrophobicContact CD2-CZ2 4.14Å; L236-W239 HydrophobicContact CD2-CZ3 4.25Å; L236-W239 HydrophobicContact CG-CZ3 4.39Å; L236-W239 WeakPolarHBondContact O-CB 3.47Å; L236-W239 PolarHBondContact O-N 3.36Å; L236-W239 VanDerWaalsContact O-N 3.08Å; L236-L279 HydrophobicContact CD1-CD1 4.11Å; L236-L279 HydrophobicContact CD1-CD2 3.93Å; L236-L279 HydrophobicContact CD1-CG 4.44Å; L236-I296 HydrophobicContact CD2-CB 4.34Å; L236-I296 HydrophobicContact CD2-CG2 3.83Å; L236-L297 HydrophobicContact CD2-CD2 3.84Å; L236-L297 HydrophobicContact CD2-CG 3.96Å
237F94.9Very high92.7Very high92 Ų9234.2 Ų34.240%0.40422%0.216SC..Hα-helixtrans-48.2-32.9176.283.4-90.6000115.2V203 L207 Q234 S235 W239 F240 C241V203-F237 HydrophobicContact CG1-CB 3.83Å; L207-F237 HydrophobicContact CD1-CB 3.68Å; Q234-F237 WeakPolarHBondContact O-CD1 3.47Å; Q234-F237 PolarHBondContact O-N 3.23Å; S235-F237 PolarHBondContact O-N 3.35Å; F237-W239 PolarHBondContact O-N 3.45Å; F237-F240 PolarHBondContact O-N 3.19Å; F237-F240 VanDerWaalsContact O-N 3.16Å; F237-C241 PolarHBondContact O-N 3.41Å
238P94.1Very high92.6Very high26 Ų2631.6 Ų31.617%0.16919%0.186CC..Hα-helixtrans-58.5-36178.9-27.739.5000112.6S235 L236 F240 C241 F242 L297S235-P238 WeakPolarHBondContact O-CD 3.34Å; L236-P238 WeakPolarHBondContact O-CD 3.36Å; L236-P238 VanDerWaalsContact O-N 3.08Å; P238-F240 VanDerWaalsContact C-N 3.26Å; P238-F240 PolarHBondContact O-N 3.07Å; P238-C241 PolarHBondContact O-N 2.85Å; P238-F242 HydrophobicContact CB-CD2 3.87Å; P238-F242 HydrophobicContact CB-CE2 3.96Å; P238-F242 WeakPolarHBondContact O-CB 3.48Å; P238-F242 WeakPolarHBondContact O-CD2 2.98Å; P238-F242 PolarHBondContact O-N 2.93Å; P238-L297 HydrophobicContact CG-CD1 4.05Å
239W94.8Very high92.3Very high9 Ų934.3 Ų34.33%0.03420%0.198CC..Hα-helixtrans-55.8-44.4178.4-69.7-12.9000112L236 F237 C243 F244 A275 M278 L279 I296 L297 C300L236-W239 HydrophobicContact CB-CD2 4.47Å; L236-W239 HydrophobicContact CB-CE3 4.12Å; L236-W239 HydrophobicContact CB-CZ3 4.36Å; L236-W239 HydrophobicContact CD1-CE3 4.42Å; L236-W239 HydrophobicContact CD1-CH2 4.23Å; L236-W239 HydrophobicContact CD1-CZ3 3.86Å; L236-W239 HydrophobicContact CD2-CH2 3.99Å; L236-W239 HydrophobicContact CD2-CZ2 4.14Å; L236-W239 HydrophobicContact CD2-CZ3 4.25Å; L236-W239 HydrophobicContact CG-CZ3 4.39Å; L236-W239 WeakPolarHBondContact O-CB 3.47Å; L236-W239 PolarHBondContact O-N 3.36Å; L236-W239 VanDerWaalsContact O-N 3.08Å; F237-W239 PolarHBondContact O-N 3.45Å; W239-C243 PolarHBondContact O-N 3.44Å; W239-F244 HydrophobicContact CB-CD1 3.83Å; W239-F244 HydrophobicContact CB-CE1 3.66Å; W239-F244 HydrophobicContact CB-CZ 4.33Å; W239-F244 HydrophobicContact CE3-CE1 4.45Å; W239-F244 HydrophobicContact CG-CD1 4.28Å; W239-F244 HydrophobicContact CG-CE1 4.28Å; W239-F244 PolarHBondContact O-N 3.49Å; W239-A275 HydrophobicContact CE3-CB 3.99Å; W239-A275 HydrophobicContact CZ3-CB 4.29Å; W239-M278 HydrophobicContact CH2-CB 4.27Å; W239-M278 HydrophobicContact CZ2-CE 4.14Å; W239-M278 HydrophobicContact CZ3-CB 4.42Å; W239-L279 HydrophobicContact CH2-CD2 3.75Å; W239-L279 HydrophobicContact CH2-CG 4Å; W239-L279 HydrophobicContact CZ3-CD2 4.11Å; W239-L279 HydrophobicContact CZ3-CG 3.96Å; W239-I296 HydrophobicContact CH2-CG2 4.24Å; W239-I296 HydrophobicContact CZ2-CG2 4.49Å; W239-L297 HydrophobicContact CD2-CD2 4.32Å; W239-L297 HydrophobicContact CG-CD2 4.38Å; W239-L297 HydrophobicContact CZ2-CD2 4.09Å; W239-L297 VanDerWaalsContact NE1-CD2 3.31Å; W239-C300 HydrophobicContact CZ2-CB 3.75Å; W239-C300 VanDerWaalsContact CZ2-SG 3.51Å
240F95.3Very high92.4Very high0 Ų035 Ų350%020%0.197CC..Hα-helixtrans-73.4-46178-61.3-72.4000111.9C197 V203 N206 L207 L210 F237 P238 F242 C243 F244 Q271 V272 A275C197-F240 VanDerWaalsContact CA-O 3.23Å; C197-F240 WeakPolarHBondContact CA-O 3.36Å; C197-F240 WeakPolarHBondContact CB-O 3.38Å; V203-F240 HydrophobicContact CB-CB 4.47Å; V203-F240 HydrophobicContact CG1-CB 4.14Å; V203-F240 HydrophobicContact CG2-CB 3.92Å; N206-F240 HydrophobicContact CB-CD1 3.83Å; N206-F240 HydrophobicContact CB-CD2 4.31Å; N206-F240 HydrophobicContact CB-CE1 3.69Å; N206-F240 HydrophobicContact CB-CE2 4.17Å; N206-F240 HydrophobicContact CB-CG 4.14Å; N206-F240 HydrophobicContact CB-CZ 3.86Å; L207-F240 HydrophobicContact CD2-CD2 3.87Å; L207-F240 HydrophobicContact CD2-CE2 3.61Å; L207-F240 HydrophobicContact CG-CD2 4.1Å; L207-F240 HydrophobicContact CG-CE2 4.05Å; L210-F240 HydrophobicContact CD2-CE2 4.35Å; L210-F240 HydrophobicContact CD2-CZ 4.38Å; F237-F240 PolarHBondContact O-N 3.19Å; F237-F240 VanDerWaalsContact O-N 3.16Å; P238-F240 VanDerWaalsContact C-N 3.26Å; P238-F240 PolarHBondContact O-N 3.07Å; F240-F242 PolarHBondContact O-N 3.33Å; F240-C243 PolarHBondContact O-N 3.24Å; F240-F244 HydrophobicContact CD1-CE2 4.29Å; F240-F244 AromaticContact CD1-CZ 3.99Å; F240-F244 HydrophobicContact CD1-CZ 3.99Å; F240-F244 HydrophobicContact CE1-CE2 4.46Å; F240-F244 AromaticContact CE1-CZ 3.84Å; F240-F244 HydrophobicContact CE1-CZ 3.84Å; F240-F244 HydrophobicContact CZ-CZ 4.49Å; F240-Q271 HydrophobicContact CD1-CB 4.43Å; F240-Q271 HydrophobicContact CD1-CG 4.12Å; F240-Q271 HydrophobicContact CE1-CB 4.25Å; F240-Q271 HydrophobicContact CE1-CG 3.95Å; F240-V272 HydrophobicContact CE1-CG2 4.24Å; F240-V272 HydrophobicContact CZ-CG2 4.4Å; F240-A275 HydrophobicContact CE1-CB 4.27Å; F240-A275 HydrophobicContact CE2-CB 4.45Å; F240-A275 HydrophobicContact CZ-CB 3.71Å
241C93.3Very high93Very high4 Ų434 Ų343%0.02717%0.174CC..Hα-helixtrans-58.1-33.7-179.9-73.80000113.5Q162 M168 F237 P238Q162-C241 PolarHBondContact NE2-O 3.38Å; M168-C241 WeakPolarHBondContact CE-O 3.24Å; F237-C241 PolarHBondContact O-N 3.41Å; P238-C241 PolarHBondContact O-N 2.85Å
242F92.3Very high93.3Very high13 Ų1335.4 Ų35.46%0.05717%0.17CC..THydrogen-bonded Turntrans-99.810.7-179.2-65.7-72000113Q163 E167 P238 F240 F244 Q245 R246Q163-F242 HydrophobicContact CG-CZ 4.4Å; E167-F242 WeakPolarHBondContact OE2-CD1 3.35Å; E167-F242 WeakPolarHBondContact OE2-CE1 3.23Å; P238-F242 HydrophobicContact CB-CD2 3.87Å; P238-F242 HydrophobicContact CB-CE2 3.96Å; P238-F242 WeakPolarHBondContact O-CB 3.48Å; P238-F242 WeakPolarHBondContact O-CD2 2.98Å; P238-F242 PolarHBondContact O-N 2.93Å; F240-F242 PolarHBondContact O-N 3.33Å; F242-F244 PolarHBondContact O-N 3.03Å; F242-F244 VanDerWaalsContact O-N 3.1Å; F242-Q245 HydrophobicContact CB-CG 4.05Å; F242-Q245 VanDerWaalsContact CD1-NE2 3.29Å; F242-Q245 WeakPolarHBondContact O-CB 3.15Å; F242-Q245 WeakPolarHBondContact O-CG 3.06Å; F242-Q245 PolarHBondContact O-N 3.42Å; F242-R246 VanDerWaalsContact CE1-CZ 3.46Å; F242-R246 HydrophobicContact CG-CG 4.48Å
243C94.5Very high93.4Very high1 Ų136.9 Ų36.91%0.00718%0.177CC..THydrogen-bonded Turntrans45.741.8-173.6-67.70000112.7M168 C197 W239 F240 Q245 W258M168-C243 HydrophobicContact CE-CB 4.04Å; M168-C243 VanDerWaalsContact CE-SG 3.59Å; C197-C243 WeakPolarHBondContact CB-SG 3.43Å; W239-C243 PolarHBondContact O-N 3.44Å; F240-C243 PolarHBondContact O-N 3.24Å; C243-Q245 PolarHBondContact O-N 3.11Å; C243-W258 HydrophobicContact CB-CZ2 3.88Å; C243-W258 PolarHBondContact O-NE1 3.34Å
244F94.4Very high93.5Very high2 Ų236.5 Ų36.51%0.00918%0.175CC..THydrogen-bonded Turntrans59.910.1-177.9-52.8-92.9000115.5W239 F240 F242 R246 A247 F248 L257 Q271 V274 A275 M278W239-F244 HydrophobicContact CB-CD1 3.83Å; W239-F244 HydrophobicContact CB-CE1 3.66Å; W239-F244 HydrophobicContact CB-CZ 4.33Å; W239-F244 HydrophobicContact CE3-CE1 4.45Å; W239-F244 HydrophobicContact CG-CD1 4.28Å; W239-F244 HydrophobicContact CG-CE1 4.28Å; W239-F244 PolarHBondContact O-N 3.49Å; F240-F244 HydrophobicContact CD1-CE2 4.29Å; F240-F244 AromaticContact CD1-CZ 3.99Å; F240-F244 HydrophobicContact CD1-CZ 3.99Å; F240-F244 HydrophobicContact CE1-CE2 4.46Å; F240-F244 AromaticContact CE1-CZ 3.84Å; F240-F244 HydrophobicContact CE1-CZ 3.84Å; F240-F244 HydrophobicContact CZ-CZ 4.49Å; F242-F244 PolarHBondContact O-N 3.03Å; F242-F244 VanDerWaalsContact O-N 3.1Å; F244-R246 PolarHBondContact O-N 3.11Å; F244-R246 VanDerWaalsContact O-N 3.08Å; F244-A247 WeakPolarHBondContact O-CB 3.3Å; F244-A247 PolarHBondContact O-N 3.19Å; F244-F248 HydrophobicContact CB-CE2 4.37Å; F244-F248 WeakPolarHBondContact O-CD2 3.46Å; F244-L257 HydrophobicContact CB-CD2 3.7Å; F244-L257 HydrophobicContact CD2-CD2 4.17Å; F244-L257 HydrophobicContact CG-CD2 4.12Å; F244-Q271 HydrophobicContact CE2-CB 3.88Å; F244-Q271 HydrophobicContact CZ-CB 4.33Å; F244-Q271 VanDerWaalsContact CZ-O 3.27Å; F244-Q271 WeakPolarHBondContact CZ-O 3.44Å; F244-V274 HydrophobicContact CD1-CG1 3.99Å; F244-V274 HydrophobicContact CD2-CG1 4.38Å; F244-V274 HydrophobicContact CE1-CG1 3.97Å; F244-V274 HydrophobicContact CE2-CG1 4.41Å; F244-V274 HydrophobicContact CG-CG1 4.2Å; F244-V274 HydrophobicContact CZ-CB 4.37Å; F244-V274 HydrophobicContact CZ-CG1 4.21Å; F244-A275 HydrophobicContact CE1-CB 3.9Å; F244-A275 HydrophobicContact CZ-CB 4.04Å; F244-M278 HydrophobicContact CD1-SD 3.68Å; F244-M278 HydrophobicContact CE1-SD 4.18Å
245Q92Very high93.6Very high14 Ų1434.3 Ų34.37%0.06516%0.164CC..G310 helixtrans-58.1-33.8-174.279-164.3-22.400113.1E167 L171 F242 C243 A247 F248 V254 W258E167-Q245 PolarHBondContact OE2-NE2 3.16Å; L171-Q245 HydrophobicContact CD1-CB 4.43Å; F242-Q245 HydrophobicContact CB-CG 4.05Å; F242-Q245 VanDerWaalsContact CD1-NE2 3.29Å; F242-Q245 WeakPolarHBondContact O-CB 3.15Å; F242-Q245 WeakPolarHBondContact O-CG 3.06Å; F242-Q245 PolarHBondContact O-N 3.42Å; C243-Q245 PolarHBondContact O-N 3.11Å; Q245-A247 PolarHBondContact O-N 3.43Å; Q245-F248 PolarHBondContact O-N 3.1Å; Q245-V254 HydrophobicContact CB-CG1 3.72Å; Q245-V254 HydrophobicContact CB-CG2 4.15Å; Q245-W258 HydrophobicContact CB-CZ2 4.12Å
246R90.1Very high93.7Very high110 Ų11034.3 Ų34.342%0.41516%0.161SC..G310 helixtrans-76.6-9.7-179-66.2-177.4174.3-168.6-5.8113.7E167 F242 F244 F248E167-R246 IonicContact OE1-CZ 3.85Å; E167-R246 IonicContact OE1-NE 2.67Å; E167-R246 PolarHBondContact OE1-NE 3.01Å; E167-R246 IonicContact OE1-NH2 3.83Å; E167-R246 PolarHBondContact OE1-NH2 3.49Å; E167-R246 IonicContact OE2-CZ 3.69Å; E167-R246 IonicContact OE2-NE 3.86Å; E167-R246 PolarHBondContact OE2-NE 3.43Å; E167-R246 IonicContact OE2-NH2 2.7Å; E167-R246 PolarHBondContact OE2-NH2 2.85Å; F242-R246 VanDerWaalsContact CE1-CZ 3.46Å; F242-R246 HydrophobicContact CG-CG 4.48Å; F244-R246 PolarHBondContact O-N 3.11Å; F244-R246 VanDerWaalsContact O-N 3.08Å; R246-F248 VanDerWaalsContact C-N 3.28Å
247A90.3Very high93.9Very high3 Ų334.3 Ų34.33%0.02516%0.161CC..G310 helixtrans-72.7-25173.700000111.9F244 Q245 M278 L306F244-A247 WeakPolarHBondContact O-CB 3.3Å; F244-A247 PolarHBondContact O-N 3.19Å; Q245-A247 PolarHBondContact O-N 3.43Å; A247-M278 HydrophobicContact CB-CE 3.53Å; A247-M278 HydrophobicContact CB-SD 4.14Å; A247-L306 HydrophobicContact CB-CD2 3.9Å
248F92.4Very high94Very high14 Ų1430 Ų306%0.06114%0.142CC..  trans-106.2151.4-173.7-57.2-76.5000112.2F244 Q245 R246 D253 V254 L257 L306 A308 L311F244-F248 HydrophobicContact CB-CE2 4.37Å; F244-F248 WeakPolarHBondContact O-CD2 3.46Å; Q245-F248 PolarHBondContact O-N 3.1Å; R246-F248 VanDerWaalsContact C-N 3.28Å; F248-D253 HydrophobicContact CB-CB 3.86Å; F248-D253 HydrophobicContact CD1-CB 3.51Å; F248-D253 HydrophobicContact CE1-CB 4.17Å; F248-D253 HydrophobicContact CG-CB 3.75Å; F248-V254 HydrophobicContact CB-CG2 3.87Å; F248-V254 HydrophobicContact CD2-CG2 4.02Å; F248-V254 HydrophobicContact CG-CG2 4.33Å; F248-L257 HydrophobicContact CE2-CB 4.18Å; F248-L257 HydrophobicContact CE2-CD2 3.6Å; F248-L257 HydrophobicContact CZ-CB 4.25Å; F248-L257 HydrophobicContact CZ-CD2 3.92Å; F248-L306 HydrophobicContact CD1-CD2 4.25Å; F248-L306 HydrophobicContact CD1-CG 4.23Å; F248-L306 WeakPolarHBondContact CD1-O 3.38Å; F248-L306 HydrophobicContact CE1-CD2 4.01Å; F248-L306 HydrophobicContact CE1-CG 3.97Å; F248-A308 HydrophobicContact CE1-CB 3.91Å; F248-A308 HydrophobicContact CZ-CB 4.26Å; F248-L311 HydrophobicContact CE1-CD2 4.34Å; F248-L311 HydrophobicContact CZ-CD2 3.88Å
249K88.8Confident94.2Very high144 Ų14428.8 Ų28.863%0.62613%0.134SC*.SBendtrans-93.1-24.1174-55.8-57.3179.8-162.20112.9N301K249-N301 PolarHBondContact NZ-O 2.89Å
250S91.2Very high94.3Very high47 Ų4728.3 Ų28.333%0.32913%0.132SC..SBendtrans-104.4142.3178.9-178.30000111.7D252 D253 V254S250-D252 VanDerWaalsContact C-N 3.27Å; S250-D252 PolarHBondContact O-N 2.88Å; S250-D252 PolarHBondContact OG-N 2.89Å; S250-D253 WeakPolarHBondContact CB-OD2 3.37Å; S250-D253 PolarHBondContact O-N 3.03Å; S250-V254 PolarHBondContact O-N 3.34Å
251F92.9Very high94.4Very high83 Ų8329.7 Ų29.736%0.36414%0.139SC..Hα-helixtrans-66.5-30.8171.6-59.9-36.6000112.4M170 L171 L174 D253 V254 W255M170-F251 HydrophobicContact CE-CE1 3.75Å; M170-F251 HydrophobicContact CE-CZ 3.77Å; L171-F251 HydrophobicContact CD2-CB 3.98Å; L171-F251 HydrophobicContact CD2-CD1 3.36Å; L171-F251 HydrophobicContact CD2-CE1 3.92Å; L171-F251 HydrophobicContact CD2-CG 3.74Å; L174-F251 HydrophobicContact CD1-CD2 3.6Å; L174-F251 HydrophobicContact CD1-CE2 3.4Å; L174-F251 VanDerWaalsContact CD1-CE2 3.4Å; L174-F251 HydrophobicContact CD1-CG 4.35Å; L174-F251 HydrophobicContact CD1-CZ 4.01Å; F251-D253 VanDerWaalsContact C-N 3.32Å; F251-D253 PolarHBondContact O-N 2.97Å; F251-V254 PolarHBondContact O-N 3.04Å; F251-W255 HydrophobicContact CB-CE3 4.07Å; F251-W255 HydrophobicContact CB-CH2 3.8Å; F251-W255 HydrophobicContact CB-CZ2 4.26Å; F251-W255 HydrophobicContact CB-CZ3 3.69Å; F251-W255 VanDerWaalsContact O-CE3 3.3Å; F251-W255 PolarHBondContact O-N 3.43Å
252D94.7Very high94.6Very high76 Ų7629.6 Ų29.641%0.40614%0.139SC..Hα-helixtrans-64.4-37.1177-77-55.7000112.1R63 S250 W255 R256R63-D252 IonicContact CZ-OD1 3.03Å; R63-D252 IonicContact NH1-OD1 3.41Å; R63-D252 PolarHBondContact NH1-OD1 3.38Å; R63-D252 IonicContact NH2-OD1 3.44Å; S250-D252 VanDerWaalsContact C-N 3.27Å; S250-D252 PolarHBondContact O-N 2.88Å; S250-D252 PolarHBondContact OG-N 2.89Å; D252-W255 PolarHBondContact O-N 3.16Å; D252-R256 WeakPolarHBondContact O-CB 3.22Å; D252-R256 PolarHBondContact O-N 3.26Å
253D95.7Very high94.7Very high37 Ų3729.4 Ų29.420%0.19814%0.138CC..Hα-helixtrans-66.5-39.1174.5-72.6-48000112F248 S250 F251 R256 L257 A308F248-D253 HydrophobicContact CB-CB 3.86Å; F248-D253 HydrophobicContact CD1-CB 3.51Å; F248-D253 HydrophobicContact CE1-CB 4.17Å; F248-D253 HydrophobicContact CG-CB 3.75Å; S250-D253 WeakPolarHBondContact CB-OD2 3.37Å; S250-D253 PolarHBondContact O-N 3.03Å; F251-D253 VanDerWaalsContact C-N 3.32Å; F251-D253 PolarHBondContact O-N 2.97Å; D253-R256 PolarHBondContact O-N 3.04Å; D253-L257 PolarHBondContact O-N 3.26Å; D253-A308 HydrophobicContact CB-CB 3.86Å; D253-A308 WeakPolarHBondContact O-CB 3.31Å; D253-A308 WeakPolarHBondContact OD1-CB 3.26Å; D253-A308 PolarHBondContact OD1-N 3.23Å
254V96.7Very high94.6Very high4 Ų430.7 Ų30.72%0.02415%0.152CC..Hα-helixtrans-62.2-50.6175-177.50000110.5L171 Q245 F248 S250 F251 R256 L257 W258L171-V254 HydrophobicContact CD1-CB 4.46Å; L171-V254 HydrophobicContact CD1-CG1 3.68Å; Q245-V254 HydrophobicContact CB-CG1 3.72Å; Q245-V254 HydrophobicContact CB-CG2 4.15Å; F248-V254 HydrophobicContact CB-CG2 3.87Å; F248-V254 HydrophobicContact CD2-CG2 4.02Å; F248-V254 HydrophobicContact CG-CG2 4.33Å; S250-V254 PolarHBondContact O-N 3.34Å; F251-V254 PolarHBondContact O-N 3.04Å; V254-R256 VanDerWaalsContact C-N 3.3Å; V254-R256 PolarHBondContact O-N 2.84Å; V254-L257 PolarHBondContact O-N 3.21Å; V254-W258 HydrophobicContact CG1-CD2 4.08Å; V254-W258 VanDerWaalsContact CG1-CE2 3.47Å; V254-W258 HydrophobicContact CG1-CG 4.44Å; V254-W258 HydrophobicContact CG1-CH2 4.38Å; V254-W258 HydrophobicContact CG1-CZ2 3.66Å; V254-W258 VanDerWaalsContact O-CD1 3.24Å; V254-W258 PolarHBondContact O-N 3.28Å
255W97.8Very high94.6Very high22 Ų2233 Ų338%0.08316%0.162CC..Hα-helixtrans-61.7-40.2177.7-70.5-43.2000111.7W67 L171 L174 M175 F251 D252 L257 W258 E259W67-W255 AromaticContact CH2-CD1 3.57Å; W67-W255 HydrophobicContact CH2-CG 4.43Å; W67-W255 HydrophobicContact CZ2-CB 4.1Å; W67-W255 AromaticContact CZ2-CD1 3.81Å; W67-W255 HydrophobicContact CZ2-CG 4.28Å; L171-W255 HydrophobicContact CD2-CZ2 4.22Å; L171-W255 WeakPolarHBondContact O-CZ2 3.38Å; L174-W255 HydrophobicContact CB-CH2 4Å; L174-W255 HydrophobicContact CB-CZ2 3.9Å; M175-W255 HydrophobicContact CB-CZ2 4.15Å; F251-W255 HydrophobicContact CB-CE3 4.07Å; F251-W255 HydrophobicContact CB-CH2 3.8Å; F251-W255 HydrophobicContact CB-CZ2 4.26Å; F251-W255 HydrophobicContact CB-CZ3 3.69Å; F251-W255 VanDerWaalsContact O-CE3 3.3Å; F251-W255 PolarHBondContact O-N 3.43Å; D252-W255 PolarHBondContact O-N 3.16Å; W255-L257 PolarHBondContact O-N 2.71Å; W255-W258 PolarHBondContact O-N 3.01Å; W255-E259 WeakPolarHBondContact O-CB 3.37Å; W255-E259 VanDerWaalsContact O-CG 3.23Å; W255-E259 WeakPolarHBondContact O-CG 3.24Å; W255-E259 PolarHBondContact O-N 2.97Å
256R97.3Very high94.6Very high19 Ų1933.6 Ų33.67%0.07217%0.167CC..Hα-helixtrans-58.8-44.5177.1175.561.8-175107.23.2112.1I53 L54 D252 D253 V254 A308 D309 I312I53-R256 PolarHBondContact O-NH1 3.03Å; I53-R256 VanDerWaalsContact O-NH1 3.08Å; L54-R256 PolarHBondContact O-NH1 2.8Å; L54-R256 PolarHBondContact O-NH2 2.85Å; D252-R256 WeakPolarHBondContact O-CB 3.22Å; D252-R256 PolarHBondContact O-N 3.26Å; D253-R256 PolarHBondContact O-N 3.04Å; V254-R256 VanDerWaalsContact C-N 3.3Å; V254-R256 PolarHBondContact O-N 2.84Å; R256-A308 HydrophobicContact CB-CB 3.97Å; R256-A308 HydrophobicContact CG-CB 3.74Å; R256-D309 IonicContact CZ-OD1 3.23Å; R256-D309 IonicContact NE-OD1 3.6Å; R256-D309 PolarHBondContact NE-OD1 3.06Å; R256-D309 IonicContact NH2-OD1 3.76Å; R256-D309 PolarHBondContact NH2-OD1 2.98Å; R256-I312 HydrophobicContact CG-CD1 4.05Å
257L97.9Very high94.7Very high1 Ų128.6 Ų28.61%0.00515%0.149CC..Hα-helixtrans-66.7-44.6174.6179.464.5000111.6F244 F248 D253 V254 W255 E259 V260 L261 V274 I312F244-L257 HydrophobicContact CB-CD2 3.7Å; F244-L257 HydrophobicContact CD2-CD2 4.17Å; F244-L257 HydrophobicContact CG-CD2 4.12Å; F248-L257 HydrophobicContact CE2-CB 4.18Å; F248-L257 HydrophobicContact CE2-CD2 3.6Å; F248-L257 HydrophobicContact CZ-CB 4.25Å; F248-L257 HydrophobicContact CZ-CD2 3.92Å; D253-L257 PolarHBondContact O-N 3.26Å; V254-L257 PolarHBondContact O-N 3.21Å; W255-L257 PolarHBondContact O-N 2.71Å; L257-E259 VanDerWaalsContact C-N 3.3Å; L257-E259 PolarHBondContact O-N 3.01Å; L257-V260 WeakPolarHBondContact O-CB 3.38Å; L257-V260 PolarHBondContact O-N 3.19Å; L257-V260 VanDerWaalsContact O-N 3.09Å; L257-L261 HydrophobicContact CD1-CG 4.41Å; L257-L261 HydrophobicContact CD2-CD1 4.47Å; L257-L261 HydrophobicContact CG-CD1 4.11Å; L257-L261 HydrophobicContact CG-CG 4.29Å; L257-L261 WeakPolarHBondContact O-CG 3.48Å; L257-L261 PolarHBondContact O-N 2.95Å; L257-V274 HydrophobicContact CD1-CG1 4.36Å; L257-V274 HydrophobicContact CD1-CG2 4.03Å; L257-V274 HydrophobicContact CD2-CG1 4.23Å; L257-I312 HydrophobicContact CD1-CD1 4.43Å; L257-I312 HydrophobicContact CD1-CG1 3.88Å
258W98.1Very high94.6Very high1 Ų137.2 Ų37.20%0.00418%0.181CC..Hα-helixtrans-64-36-178.4-71.213.7000112.3W67 M168 L171 F172 F189 C243 Q245 V254 W255 V260 L261 L262W67-W258 HydrophobicContact CH2-CB 3.72Å; W67-W258 HydrophobicContact CH2-CD2 4.29Å; W67-W258 AromaticContact CH2-CE3 3.59Å; W67-W258 HydrophobicContact CH2-CE3 3.59Å; W67-W258 HydrophobicContact CH2-CG 4.42Å; W67-W258 HydrophobicContact CH2-CZ3 4.49Å; W67-W258 HydrophobicContact CZ2-CB 4Å; W67-W258 AromaticContact CZ3-CE3 3.92Å; W67-W258 HydrophobicContact CZ3-CE3 3.92Å; M168-W258 HydrophobicContact CB-CH2 4.14Å; M168-W258 HydrophobicContact CG-CH2 3.88Å; M168-W258 HydrophobicContact CG-CZ2 4.39Å; L171-W258 HydrophobicContact CB-CH2 4.44Å; L171-W258 HydrophobicContact CB-CZ3 4.41Å; L171-W258 HydrophobicContact CD1-CH2 3.41Å; L171-W258 VanDerWaalsContact CD1-CH2 3.41Å; L171-W258 HydrophobicContact CD1-CZ2 3.85Å; L171-W258 HydrophobicContact CD1-CZ3 4.05Å; F172-W258 HydrophobicContact CE2-CZ3 4.13Å; F172-W258 HydrophobicContact CZ-CZ3 4.3Å; F189-W258 HydrophobicContact CD2-CE3 4.49Å; F189-W258 HydrophobicContact CE1-CE3 4.36Å; F189-W258 HydrophobicContact CE1-CZ3 4.42Å; F189-W258 HydrophobicContact CE2-CB 4.33Å; F189-W258 HydrophobicContact CE2-CD2 4.01Å; F189-W258 AromaticContact CE2-CE3 3.63Å; F189-W258 HydrophobicContact CE2-CE3 3.63Å; F189-W258 HydrophobicContact CE2-CG 4.29Å; F189-W258 HydrophobicContact CE2-CZ3 4.36Å; F189-W258 AromaticContact CZ-CD2 3.73Å; F189-W258 HydrophobicContact CZ-CD2 3.73Å; F189-W258 AromaticContact CZ-CE3 3.54Å; F189-W258 HydrophobicContact CZ-CE3 3.54Å; F189-W258 HydrophobicContact CZ-CG 4.22Å; F189-W258 HydrophobicContact CZ-CZ3 4.03Å; C243-W258 HydrophobicContact CB-CZ2 3.88Å; C243-W258 PolarHBondContact O-NE1 3.34Å; Q245-W258 HydrophobicContact CB-CZ2 4.12Å; V254-W258 HydrophobicContact CG1-CD2 4.08Å; V254-W258 VanDerWaalsContact CG1-CE2 3.47Å; V254-W258 HydrophobicContact CG1-CG 4.44Å; V254-W258 HydrophobicContact CG1-CH2 4.38Å; V254-W258 HydrophobicContact CG1-CZ2 3.66Å; V254-W258 VanDerWaalsContact O-CD1 3.24Å; V254-W258 PolarHBondContact O-N 3.28Å; W255-W258 PolarHBondContact O-N 3.01Å; W258-V260 VanDerWaalsContact C-N 3.3Å; W258-V260 PolarHBondContact O-N 3.15Å; W258-L261 PolarHBondContact O-N 2.88Å; W258-L262 WeakPolarHBondContact O-CB 3.19Å; W258-L262 WeakPolarHBondContact O-CG 3.01Å; W258-L262 PolarHBondContact O-N 3.02Å
259E98Very high94.7Very high0 Ų037.5 Ų37.50%018%0.183CC..Hα-helixtrans-52.3-50170.5-76.6164.8-172.200110.6I53 L58 R63 W67 W255 L257 L262 T263I53-E259 HydrophobicContact CG2-CB 3.95Å; L58-E259 HydrophobicContact CD1-CG 3.91Å; L58-E259 HydrophobicContact CG-CG 4.39Å; L58-E259 PolarHBondContact N-OE2 2.81Å; R63-E259 WeakPolarHBondContact CG-OE1 3.11Å; R63-E259 IonicContact CZ-OE1 3.33Å; R63-E259 IonicContact NE-OE1 2.74Å; R63-E259 PolarHBondContact NE-OE1 3.23Å; R63-E259 IonicContact NH2-OE1 3.49Å; W67-E259 HydrophobicContact CZ2-CG 4.06Å; W255-E259 WeakPolarHBondContact O-CB 3.37Å; W255-E259 VanDerWaalsContact O-CG 3.23Å; W255-E259 WeakPolarHBondContact O-CG 3.24Å; W255-E259 PolarHBondContact O-N 2.97Å; L257-E259 VanDerWaalsContact C-N 3.3Å; L257-E259 PolarHBondContact O-N 3.01Å; E259-L262 PolarHBondContact O-N 3.44Å; E259-T263 WeakPolarHBondContact O-CG2 3.28Å; E259-T263 PolarHBondContact O-N 3.44Å; E259-T263 VanDerWaalsContact O-N 3.17Å
260V97.4Very high95Very high0 Ų030.8 Ų30.80%015%0.154CC..Hα-helixtrans-63.6-48.3177.7179.80000111.8L54 L257 W258 L262 T263 G264 K265 F270 I312L54-V260 HydrophobicContact CD1-CB 4.46Å; L54-V260 HydrophobicContact CD1-CG1 3.47Å; L54-V260 VanDerWaalsContact CD1-CG1 3.47Å; L54-V260 HydrophobicContact CD1-CG2 4.13Å; L257-V260 WeakPolarHBondContact O-CB 3.38Å; L257-V260 PolarHBondContact O-N 3.19Å; L257-V260 VanDerWaalsContact O-N 3.09Å; W258-V260 VanDerWaalsContact C-N 3.3Å; W258-V260 PolarHBondContact O-N 3.15Å; V260-L262 PolarHBondContact O-N 3.37Å; V260-T263 PolarHBondContact O-N 2.94Å; V260-T263 PolarHBondContact O-OG1 3.11Å; V260-G264 PolarHBondContact O-N 3.41Å; V260-K265 WeakPolarHBondContact CG1-O 3.5Å; V260-F270 HydrophobicContact CG1-CD1 3.84Å; V260-F270 HydrophobicContact CG1-CE1 3.76Å; V260-I312 HydrophobicContact CG1-CG2 4.37Å; V260-I312 HydrophobicContact CG2-CD1 3.72Å; V260-I312 HydrophobicContact CG2-CG1 4.29Å; V260-I312 HydrophobicContact CG2-CG2 4.19Å
261L96.9Very high95.3Very high28 Ų2829 Ų2915%0.14714%0.141CC..Hα-helixtrans-57.5-39.2179.7-65.3177.5000111.7L257 W258 T263 G264 F270 Q271L257-L261 HydrophobicContact CD1-CG 4.41Å; L257-L261 HydrophobicContact CD2-CD1 4.47Å; L257-L261 HydrophobicContact CG-CD1 4.11Å; L257-L261 HydrophobicContact CG-CG 4.29Å; L257-L261 WeakPolarHBondContact O-CG 3.48Å; L257-L261 PolarHBondContact O-N 2.95Å; W258-L261 PolarHBondContact O-N 2.88Å; L261-T263 PolarHBondContact O-N 3.24Å; L261-G264 PolarHBondContact O-N 2.88Å; L261-F270 HydrophobicContact CD2-CB 4.37Å; L261-F270 HydrophobicContact CD2-CD1 4.14Å; L261-Q271 HydrophobicContact CD2-CB 4.16Å
262L97Very high95.5Very high3 Ų325 Ų252%0.01612%0.123CC..Hα-helixtrans-71-27.8178.4-68.6168.7000113.5W67 L70 T71 F189 K192 T193 W258 E259 V260 G264W67-L262 HydrophobicContact CD2-CD1 4.21Å; W67-L262 HydrophobicContact CE3-CD1 4.16Å; W67-L262 HydrophobicContact CZ3-CD1 4.41Å; L70-L262 HydrophobicContact CB-CB 3.91Å; L70-L262 HydrophobicContact CB-CD1 4.23Å; T71-L262 HydrophobicContact CG2-CD1 4.05Å; T71-L262 HydrophobicContact CG2-CD2 4.16Å; F189-L262 HydrophobicContact CD2-CD1 4.06Å; F189-L262 HydrophobicContact CD2-CD2 3.8Å; F189-L262 HydrophobicContact CD2-CG 4.29Å; F189-L262 HydrophobicContact CE2-CD1 4.13Å; F189-L262 HydrophobicContact CE2-CD2 4.01Å; F189-L262 HydrophobicContact CE2-CG 4.17Å; K192-L262 HydrophobicContact CB-CD2 4.19Å; K192-L262 HydrophobicContact CG-CD2 3.68Å; T193-L262 HydrophobicContact CG2-CD2 4.02Å; W258-L262 WeakPolarHBondContact O-CB 3.19Å; W258-L262 WeakPolarHBondContact O-CG 3.01Å; W258-L262 PolarHBondContact O-N 3.02Å; E259-L262 PolarHBondContact O-N 3.44Å; V260-L262 PolarHBondContact O-N 3.37Å; L262-G264 PolarHBondContact O-N 3.35Å
263T95.8Very high95.7Very high8 Ų821.4 Ų21.45%0.04910%0.104CC..Hα-helixtrans-66.4-29174.666.90000112.4C50 I53 L70 E259 V260 L261 K265C50-T263 HydrophobicContact CB-CG2 4.06Å; I53-T263 HydrophobicContact CB-CG2 3.89Å; I53-T263 HydrophobicContact CD1-CG2 4.47Å; I53-T263 HydrophobicContact CG2-CG2 3.66Å; L70-T263 HydrophobicContact CD2-CG2 3.84Å; E259-T263 WeakPolarHBondContact O-CG2 3.28Å; E259-T263 PolarHBondContact O-N 3.44Å; E259-T263 VanDerWaalsContact O-N 3.17Å; V260-T263 PolarHBondContact O-N 2.94Å; V260-T263 PolarHBondContact O-OG1 3.11Å; L261-T263 PolarHBondContact O-N 3.24Å; T263-K265 WeakPolarHBondContact OG1-CB 3.43Å; T263-K265 PolarHBondContact OG1-N 2.87Å; T263-K265 VanDerWaalsContact OG1-N 3.11Å
264G92.4Very high95.8Very high29 Ų2919.7 Ų19.730%0.2999%0.094SC..THydrogen-bonded Turntrans68.225.1-169.500000113V260 L261 L262 C267V260-G264 PolarHBondContact O-N 3.41Å; L261-G264 PolarHBondContact O-N 2.88Å; L262-G264 PolarHBondContact O-N 3.35Å; G264-C267 CarbonylContact C-O 3.56Å; G264-C267 CarbonylContact O-C 3.25Å; G264-C267 VanDerWaalsContact O-C 3.25Å
265K92.9Very high95.9Very high50 Ų5019.5 Ų19.522%0.2179%0.093CC..  trans-109.1150.7175.8-65-64-169.3171.80111D47 C50 L54 V260 T263D47-K265 WeakPolarHBondContact OD1-CE 3.32Å; D47-K265 IonicContact OD1-NZ 3.78Å; D47-K265 PolarHBondContact OD1-NZ 3.02Å; D47-K265 IonicContact OD2-NZ 2.66Å; C50-K265 HydrophobicContact CB-CG 3.93Å; L54-K265 HydrophobicContact CB-CB 4.3Å; L54-K265 HydrophobicContact CD2-CB 4.04Å; V260-K265 WeakPolarHBondContact CG1-O 3.5Å; T263-K265 WeakPolarHBondContact OG1-CB 3.43Å; T263-K265 PolarHBondContact OG1-N 2.87Å; T263-K265 VanDerWaalsContact OG1-N 3.11Å
266P93.3Very high95.9Very high27 Ų2719.1 Ų19.118%0.1759%0.092CC..SBendcis-69.8-13.1-10.231.1-37.1000113.3A12 L54 F270 Y319A12-P266 HydrophobicContact CB-CB 4.37Å; L54-P266 HydrophobicContact CD2-CB 4.49Å; P266-F270 HydrophobicContact CG-CD2 4.02Å; P266-F270 HydrophobicContact CG-CE2 3.9Å; P266-Y319 HydrophobicContact CB-CD1 3.76Å; P266-Y319 HydrophobicContact CB-CE1 3.87Å; P266-Y319 HydrophobicContact CG-CD1 3.68Å; P266-Y319 HydrophobicContact CG-CE1 4.24Å; P266-Y319 HydrophobicContact CG-CG 4.05Å
267C92.1Very high95.9Very high5 Ų518.4 Ų18.43%0.0349%0.09CC..  trans-141.1162.6-179.863.80000112.5G264 N269 L273 Y319 F335G264-C267 CarbonylContact C-O 3.56Å; G264-C267 CarbonylContact O-C 3.25Å; G264-C267 VanDerWaalsContact O-C 3.25Å; C267-N269 PolarHBondContact O-N 3.48Å; C267-L273 VanDerWaalsContact SG-CD1 3.55Å; C267-Y319 HydrophobicContact CB-CD2 4.04Å; C267-Y319 HydrophobicContact CB-CE2 3.54Å; C267-F335 WeakPolarHBondContact CB-O 3.44Å
268R87.3Confident95.8Very high183 Ų18318.3 Ų18.369%0.6919%0.09SC*.THydrogen-bonded Turntrans-61.3-41.4-175.1-176.6177.8178.8-179.7-0.3113.8
269N93.9Very high95.7Very high21 Ų2118.3 Ų18.311%0.1129%0.089CC..THydrogen-bonded Turntrans-107.343.8-174.9-69.5-49.9000112.5C267 Q271 V272 F334 F335C267-N269 PolarHBondContact O-N 3.48Å; N269-Q271 PolarHBondContact O-N 3.29Å; N269-Q271 VanDerWaalsContact O-N 3.11Å; N269-Q271 PolarHBondContact OD1-NE2 3.03Å; N269-Q271 VanDerWaalsContact OD1-NE2 3.09Å; N269-V272 PolarHBondContact O-N 3.11Å; N269-F334 HydrophobicContact CB-CD1 3.87Å; N269-F334 HydrophobicContact CB-CE1 3.32Å; N269-F334 HydrophobicContact CB-CE2 4.27Å; N269-F334 HydrophobicContact CB-CZ 3.56Å; N269-F334 PolarHBondContact ND2-O 3.4Å; N269-F335 HydrophobicContact CB-CD1 4.28Å; N269-F335 HydrophobicContact CB-CE1 4.4Å; N269-F335 VanDerWaalsContact O-CE1 3.32Å; N269-F335 WeakPolarHBondContact O-CE1 3.29Å
270F96.2Very high95.6Very high3 Ų321.4 Ų21.41%0.01310%0.104CC..Hα-helixtrans-57.1-27-176.2-169.9-120.8000113.7V260 L261 P266 V272 L273 V274 I312 A315V260-F270 HydrophobicContact CG1-CD1 3.84Å; V260-F270 HydrophobicContact CG1-CE1 3.76Å; L261-F270 HydrophobicContact CD2-CB 4.37Å; L261-F270 HydrophobicContact CD2-CD1 4.14Å; P266-F270 HydrophobicContact CG-CD2 4.02Å; P266-F270 HydrophobicContact CG-CE2 3.9Å; F270-V272 PolarHBondContact O-N 3.41Å; F270-V272 VanDerWaalsContact O-N 3.11Å; F270-L273 HydrophobicContact CD2-CB 4.24Å; F270-L273 HydrophobicContact CD2-CD1 3.77Å; F270-L273 HydrophobicContact CE2-CB 4.41Å; F270-L273 HydrophobicContact CE2-CD1 4.26Å; F270-L273 WeakPolarHBondContact O-CB 3.43Å; F270-L273 PolarHBondContact O-N 3.2Å; F270-V274 HydrophobicContact CD1-CG2 3.81Å; F270-V274 HydrophobicContact CE1-CG2 3.76Å; F270-V274 HydrophobicContact CG-CG2 4.48Å; F270-V274 HydrophobicContact CZ-CG2 4.39Å; F270-V274 PolarHBondContact O-N 2.91Å; F270-I312 HydrophobicContact CE1-CG2 4.26Å; F270-I312 HydrophobicContact CZ-CG2 4.31Å; F270-A315 HydrophobicContact CE1-CB 4.2Å; F270-A315 HydrophobicContact CE2-CB 3.6Å; F270-A315 HydrophobicContact CZ-CB 3.38Å
271Q97.1Very high95.5Very high9 Ų925 Ų254%0.04212%0.122CC..Hα-helixtrans-53.2-32.9177.267.5-79.42.300114.3S196 N206 F240 F244 L261 N269 V274 A275S196-Q271 WeakPolarHBondContact OG-CG 3.34Å; N206-Q271 PolarHBondContact OD1-NE2 2.74Å; N206-Q271 VanDerWaalsContact OD1-NE2 3.1Å; F240-Q271 HydrophobicContact CD1-CB 4.43Å; F240-Q271 HydrophobicContact CD1-CG 4.12Å; F240-Q271 HydrophobicContact CE1-CB 4.25Å; F240-Q271 HydrophobicContact CE1-CG 3.95Å; F244-Q271 HydrophobicContact CE2-CB 3.88Å; F244-Q271 HydrophobicContact CZ-CB 4.33Å; F244-Q271 VanDerWaalsContact CZ-O 3.27Å; F244-Q271 WeakPolarHBondContact CZ-O 3.44Å; L261-Q271 HydrophobicContact CD2-CB 4.16Å; N269-Q271 PolarHBondContact O-N 3.29Å; N269-Q271 VanDerWaalsContact O-N 3.11Å; N269-Q271 PolarHBondContact OD1-NE2 3.03Å; N269-Q271 VanDerWaalsContact OD1-NE2 3.09Å; Q271-V274 PolarHBondContact O-N 3.28Å; Q271-A275 PolarHBondContact O-N 3.33Å
272V98.1Very high95.4Very high0 Ų023.9 Ų23.90%012%0.116CC..Hα-helixtrans-74-32.3179.6175.40000111.1N206 M209 L210 L213 F240 N269 F270 A275 Y276 F334 F335N206-V272 HydrophobicContact CB-CG2 3.95Å; M209-V272 HydrophobicContact CB-CG1 4.45Å; L210-V272 HydrophobicContact CB-CG1 4.09Å; L210-V272 HydrophobicContact CD1-CG1 4.29Å; L213-V272 HydrophobicContact CD2-CG1 4.06Å; F240-V272 HydrophobicContact CE1-CG2 4.24Å; F240-V272 HydrophobicContact CZ-CG2 4.4Å; N269-V272 PolarHBondContact O-N 3.11Å; F270-V272 PolarHBondContact O-N 3.41Å; F270-V272 VanDerWaalsContact O-N 3.11Å; V272-A275 PolarHBondContact O-N 3.44Å; V272-Y276 WeakPolarHBondContact O-CB 3.35Å; V272-Y276 PolarHBondContact O-N 3.42Å; V272-F334 HydrophobicContact CB-CE1 4.08Å; V272-F334 HydrophobicContact CG2-CE1 3.57Å; V272-F334 HydrophobicContact CG2-CZ 3.84Å; V272-F335 HydrophobicContact CB-CE1 4.09Å; V272-F335 HydrophobicContact CB-CZ 3.99Å; V272-F335 HydrophobicContact CG1-CZ 3.93Å
273L98Very high95.3Very high0 Ų026.3 Ų26.30%013%0.125CC..Hα-helixtrans-72.5-35.3174.9-61.3163.5000111.4L213 C267 F270 Y276 S277 A315 V318 Y319 L322 F335L213-L273 HydrophobicContact CD2-CD2 3.98Å; C267-L273 VanDerWaalsContact SG-CD1 3.55Å; F270-L273 HydrophobicContact CD2-CB 4.24Å; F270-L273 HydrophobicContact CD2-CD1 3.77Å; F270-L273 HydrophobicContact CE2-CB 4.41Å; F270-L273 HydrophobicContact CE2-CD1 4.26Å; F270-L273 WeakPolarHBondContact O-CB 3.43Å; F270-L273 PolarHBondContact O-N 3.2Å; L273-Y276 PolarHBondContact O-N 2.86Å; L273-S277 WeakPolarHBondContact O-CB 3.38Å; L273-S277 PolarHBondContact O-N 3.44Å; L273-S277 PolarHBondContact O-OG 3.14Å; L273-A315 HydrophobicContact CB-CB 4.1Å; L273-V318 HydrophobicContact CD2-CB 4.41Å; L273-V318 HydrophobicContact CD2-CG1 3.7Å; L273-Y319 HydrophobicContact CD1-CD2 3.91Å; L273-Y319 HydrophobicContact CD1-CG 4.2Å; L273-L322 HydrophobicContact CD2-CD1 3.4Å; L273-L322 VanDerWaalsContact CD2-CD1 3.4Å; L273-F335 HydrophobicContact CD1-CD1 4.13Å; L273-F335 HydrophobicContact CD1-CE1 3.97Å; L273-F335 HydrophobicContact CD2-CE1 4.14Å; L273-F335 HydrophobicContact CD2-CZ 4.02Å; L273-F335 HydrophobicContact CG-CD1 4.32Å; L273-F335 HydrophobicContact CG-CE1 3.67Å; L273-F335 HydrophobicContact CG-CZ 4.02Å
274V98Very high95.4Very high0 Ų032.6 Ų32.60%015%0.154CC..Hα-helixtrans-59.8-50.4170.51750000110F244 L257 F270 Q271 Y276 S277 M278 L311 A315F244-V274 HydrophobicContact CD1-CG1 3.99Å; F244-V274 HydrophobicContact CD2-CG1 4.38Å; F244-V274 HydrophobicContact CE1-CG1 3.97Å; F244-V274 HydrophobicContact CE2-CG1 4.41Å; F244-V274 HydrophobicContact CG-CG1 4.2Å; F244-V274 HydrophobicContact CZ-CB 4.37Å; F244-V274 HydrophobicContact CZ-CG1 4.21Å; L257-V274 HydrophobicContact CD1-CG1 4.36Å; L257-V274 HydrophobicContact CD1-CG2 4.03Å; L257-V274 HydrophobicContact CD2-CG1 4.23Å; F270-V274 HydrophobicContact CD1-CG2 3.81Å; F270-V274 HydrophobicContact CE1-CG2 3.76Å; F270-V274 HydrophobicContact CG-CG2 4.48Å; F270-V274 HydrophobicContact CZ-CG2 4.39Å; F270-V274 PolarHBondContact O-N 2.91Å; Q271-V274 PolarHBondContact O-N 3.28Å; V274-Y276 PolarHBondContact O-N 3.5Å; V274-S277 PolarHBondContact O-N 3.48Å; V274-M278 WeakPolarHBondContact O-CG 3.43Å; V274-M278 PolarHBondContact O-N 3.25Å; V274-L311 HydrophobicContact CG1-CD1 4.45Å; V274-L311 HydrophobicContact CG1-CD2 3.83Å; V274-L311 HydrophobicContact CG1-CG 4.14Å; V274-A315 HydrophobicContact CG2-CB 4.18Å
275A97.8Very high95.5Very high0 Ų035 Ų350%016%0.157CC..Hα-helixtrans-59.5-44.1177.100000112.7L210 W239 F240 F244 Q271 V272 S277 M278 L279L210-A275 HydrophobicContact CD1-CB 4.11Å; L210-A275 HydrophobicContact CD2-CB 3.93Å; W239-A275 HydrophobicContact CE3-CB 3.99Å; W239-A275 HydrophobicContact CZ3-CB 4.29Å; F240-A275 HydrophobicContact CE1-CB 4.27Å; F240-A275 HydrophobicContact CE2-CB 4.45Å; F240-A275 HydrophobicContact CZ-CB 3.71Å; F244-A275 HydrophobicContact CE1-CB 3.9Å; F244-A275 HydrophobicContact CZ-CB 4.04Å; Q271-A275 PolarHBondContact O-N 3.33Å; V272-A275 PolarHBondContact O-N 3.44Å; A275-S277 PolarHBondContact O-N 2.92Å; A275-M278 PolarHBondContact O-N 3.49Å; A275-L279 WeakPolarHBondContact O-CG 3.38Å; A275-L279 PolarHBondContact O-N 3.27Å; A275-L279 VanDerWaalsContact O-N 3.1Å
276Y98.1Very high95.7Very high14 Ų1432.6 Ų32.66%0.05515%0.147CC..Hα-helixtrans-62.6-41.8175.7178.3-100000112.2L213 I214 L217 V272 L273 V274 M278 L279 Q280 V318L213-Y276 HydrophobicContact CD2-CD2 4.38Å; L213-Y276 HydrophobicContact CD2-CG 3.99Å; L213-Y276 HydrophobicContact CG-CD2 4.38Å; L213-Y276 HydrophobicContact CG-CG 4.41Å; I214-Y276 HydrophobicContact CG1-CD2 3.73Å; I214-Y276 HydrophobicContact CG1-CE2 4.04Å; L217-Y276 HydrophobicContact CB-CE2 4.28Å; L217-Y276 VanDerWaalsContact CB-OH 3.31Å; L217-Y276 WeakPolarHBondContact CB-OH 3.45Å; L217-Y276 HydrophobicContact CD1-CD1 4.22Å; L217-Y276 HydrophobicContact CD1-CE1 3.64Å; L217-Y276 HydrophobicContact CD1-CE2 4.4Å; V272-Y276 WeakPolarHBondContact O-CB 3.35Å; V272-Y276 PolarHBondContact O-N 3.42Å; L273-Y276 PolarHBondContact O-N 2.86Å; V274-Y276 PolarHBondContact O-N 3.5Å; Y276-M278 VanDerWaalsContact C-N 3.34Å; Y276-M278 PolarHBondContact O-N 3.26Å; Y276-L279 WeakPolarHBondContact O-CB 3.5Å; Y276-L279 PolarHBondContact O-N 3.12Å; Y276-L279 VanDerWaalsContact O-N 3.13Å; Y276-Q280 HydrophobicContact CD1-CG 4.12Å; Y276-Q280 HydrophobicContact CE1-CG 3.66Å; Y276-Q280 HydrophobicContact CE2-CG 4.35Å; Y276-Q280 WeakPolarHBondContact O-CG 3.3Å; Y276-Q280 PolarHBondContact O-N 3.39Å; Y276-Q280 PolarHBondContact OH-NE2 3.2Å; Y276-V318 HydrophobicContact CD1-CB 4.47Å; Y276-V318 HydrophobicContact CD1-CG1 3.71Å; Y276-V318 HydrophobicContact CD1-CG2 3.95Å; Y276-V318 HydrophobicContact CE1-CG1 3.93Å; Y276-V318 HydrophobicContact CE1-CG2 4.03Å
277S97.6Very high95.9Very high4 Ų433.4 Ų33.43%0.02815%0.149CC..Hα-helixtrans-64.7-39.1179-56.90000111.8L273 V274 A275 L279 Q280 M281 A315L273-S277 WeakPolarHBondContact O-CB 3.38Å; L273-S277 PolarHBondContact O-N 3.44Å; L273-S277 PolarHBondContact O-OG 3.14Å; V274-S277 PolarHBondContact O-N 3.48Å; A275-S277 PolarHBondContact O-N 2.92Å; S277-L279 VanDerWaalsContact C-N 3.33Å; S277-L279 PolarHBondContact O-N 2.94Å; S277-Q280 PolarHBondContact O-N 3.31Å; S277-M281 WeakPolarHBondContact O-CG 3.38Å; S277-M281 PolarHBondContact O-N 3.13Å; S277-M281 VanDerWaalsContact O-N 3.17Å; S277-A315 WeakPolarHBondContact OG-CA 3.4Å; S277-A315 PolarHBondContact OG-N 3.18Å
278M96Very high96.1Very high0 Ų040.7 Ų40.70%018%0.183CC..Hα-helixtrans-61-40.5171.5-70.7-177.466.500112.3W239 F244 A247 V274 A275 Y276 Q280 M281 C300 L306 L311W239-M278 HydrophobicContact CH2-CB 4.27Å; W239-M278 HydrophobicContact CZ2-CE 4.14Å; W239-M278 HydrophobicContact CZ3-CB 4.42Å; F244-M278 HydrophobicContact CD1-SD 3.68Å; F244-M278 HydrophobicContact CE1-SD 4.18Å; A247-M278 HydrophobicContact CB-CE 3.53Å; A247-M278 HydrophobicContact CB-SD 4.14Å; V274-M278 WeakPolarHBondContact O-CG 3.43Å; V274-M278 PolarHBondContact O-N 3.25Å; A275-M278 PolarHBondContact O-N 3.49Å; Y276-M278 VanDerWaalsContact C-N 3.34Å; Y276-M278 PolarHBondContact O-N 3.26Å; M278-Q280 VanDerWaalsContact C-N 3.31Å; M278-Q280 PolarHBondContact O-N 3.48Å; M278-M281 WeakPolarHBondContact O-CB 3.48Å; M278-M281 PolarHBondContact O-N 2.86Å; M278-C300 HydrophobicContact CE-CB 4.07Å; M278-L306 HydrophobicContact CE-CD2 4.4Å; M278-L311 HydrophobicContact CG-CD1 3.77Å; M278-L311 HydrophobicContact CG-CD2 3.8Å; M278-L311 HydrophobicContact CG-CG 4.48Å; M278-L311 HydrophobicContact SD-CD2 4.18Å
279L96.5Very high96.5Very high0 Ų037.6 Ų37.60%018%0.176CC..Hα-helixtrans-63.1-39175.3-71.4170000112L210 I214 F221 L236 W239 A275 Y276 S277 M281 V282 R283 I296L210-L279 HydrophobicContact CD1-CD1 4.16Å; L210-L279 HydrophobicContact CD2-CD1 4.23Å; L210-L279 HydrophobicContact CG-CD1 4.4Å; I214-L279 HydrophobicContact CD1-CD1 3.57Å; I214-L279 HydrophobicContact CG1-CD1 4.26Å; F221-L279 HydrophobicContact CE1-CB 4.06Å; F221-L279 HydrophobicContact CE1-CD1 4.36Å; F221-L279 HydrophobicContact CE1-CD2 4.32Å; F221-L279 HydrophobicContact CE1-CG 4.5Å; F221-L279 HydrophobicContact CZ-CD2 4.42Å; L236-L279 HydrophobicContact CD1-CD1 4.11Å; L236-L279 HydrophobicContact CD1-CD2 3.93Å; L236-L279 HydrophobicContact CD1-CG 4.44Å; W239-L279 HydrophobicContact CH2-CD2 3.75Å; W239-L279 HydrophobicContact CH2-CG 4Å; W239-L279 HydrophobicContact CZ3-CD2 4.11Å; W239-L279 HydrophobicContact CZ3-CG 3.96Å; A275-L279 WeakPolarHBondContact O-CG 3.38Å; A275-L279 PolarHBondContact O-N 3.27Å; A275-L279 VanDerWaalsContact O-N 3.1Å; Y276-L279 WeakPolarHBondContact O-CB 3.5Å; Y276-L279 PolarHBondContact O-N 3.12Å; Y276-L279 VanDerWaalsContact O-N 3.13Å; S277-L279 VanDerWaalsContact C-N 3.33Å; S277-L279 PolarHBondContact O-N 2.94Å; L279-M281 VanDerWaalsContact C-N 3.28Å; L279-M281 PolarHBondContact O-N 2.84Å; L279-V282 WeakPolarHBondContact O-CG2 3.36Å; L279-V282 PolarHBondContact O-N 3.45Å; L279-R283 WeakPolarHBondContact O-CA 3.35Å; L279-R283 WeakPolarHBondContact O-CB 3.45Å; L279-R283 PolarHBondContact O-N 3.07Å; L279-I296 HydrophobicContact CD2-CG2 3.51Å
280Q96Very high96.6Very high65 Ų6539.4 Ų39.430%0.30419%0.19SC..Hα-helixtrans-63.5-34.1177.5-68.1-59.5-52.800112.2D218 Y276 S277 M278 V282 R283D218-Q280 PolarHBondContact OD2-NE2 3.34Å; D218-Q280 VanDerWaalsContact OD2-NE2 3.11Å; Y276-Q280 HydrophobicContact CD1-CG 4.12Å; Y276-Q280 HydrophobicContact CE1-CG 3.66Å; Y276-Q280 HydrophobicContact CE2-CG 4.35Å; Y276-Q280 WeakPolarHBondContact O-CG 3.3Å; Y276-Q280 PolarHBondContact O-N 3.39Å; Y276-Q280 PolarHBondContact OH-NE2 3.2Å; S277-Q280 PolarHBondContact O-N 3.31Å; M278-Q280 VanDerWaalsContact C-N 3.31Å; M278-Q280 PolarHBondContact O-N 3.48Å; Q280-V282 VanDerWaalsContact C-N 3.28Å; Q280-V282 PolarHBondContact O-N 3.18Å; Q280-R283 WeakPolarHBondContact O-CB 3.39Å; Q280-R283 PolarHBondContact O-N 2.76Å
281M94.3Very high96.6Very high76 Ų7639.9 Ų39.937%0.37419%0.193SC..Hα-helixtrans-63.8-30177.2-67.5168.4166.900113.6S277 M278 L279 L303 L306 L311S277-M281 WeakPolarHBondContact O-CG 3.38Å; S277-M281 PolarHBondContact O-N 3.13Å; S277-M281 VanDerWaalsContact O-N 3.17Å; M278-M281 WeakPolarHBondContact O-CB 3.48Å; M278-M281 PolarHBondContact O-N 2.86Å; L279-M281 VanDerWaalsContact C-N 3.28Å; L279-M281 PolarHBondContact O-N 2.84Å; M281-L303 HydrophobicContact CB-CD1 4.44Å; M281-L303 HydrophobicContact SD-CD1 4.44Å; M281-L306 HydrophobicContact CE-CD1 3.76Å; M281-L306 HydrophobicContact SD-CD1 3.52Å; M281-L306 VanDerWaalsContact SD-CD1 3.52Å; M281-L311 HydrophobicContact CE-CB 4.26Å; M281-L311 HydrophobicContact CE-CD1 3.9Å; M281-L311 HydrophobicContact SD-CD1 4.3Å
282V94.3Very high96.4Very high4 Ų440 Ų402%0.02420%0.197CC..Hα-helixtrans-107.41.6179.8-62.20000113.2L279 Q280 E284 Q285 V286 A299 C300 L303L279-V282 WeakPolarHBondContact O-CG2 3.36Å; L279-V282 PolarHBondContact O-N 3.45Å; Q280-V282 VanDerWaalsContact C-N 3.28Å; Q280-V282 PolarHBondContact O-N 3.18Å; V282-E284 PolarHBondContact O-N 3.32Å; V282-Q285 WeakPolarHBondContact O-CB 3.33Å; V282-Q285 PolarHBondContact O-N 2.81Å; V282-Q285 VanDerWaalsContact O-N 3.17Å; V282-V286 HydrophobicContact CB-CG2 4.23Å; V282-V286 HydrophobicContact CG2-CG2 3.88Å; V282-V286 VanDerWaalsContact O-CG2 3.27Å; V282-V286 WeakPolarHBondContact O-CG2 3.35Å; V282-V286 PolarHBondContact O-N 2.88Å; V282-A299 HydrophobicContact CB-CB 4.49Å; V282-A299 HydrophobicContact CG1-CB 4.29Å; V282-C300 VanDerWaalsContact CG2-SG 3.6Å; V282-L303 HydrophobicContact CG1-CD1 4.3Å; V282-L303 HydrophobicContact CG1-CD2 4.15Å; V282-L303 HydrophobicContact CG1-CG 4.4Å
283R96.3Very high96.1Very high54 Ų5440.4 Ų40.420%0.20420%0.201CC..Hα-helixtrans-54.2-48.7-169.6178.2-173-178.2-88.76.5113.5D218 F221 L279 Q280 Q285 V286 L287D218-R283 IonicContact OD1-CZ 3.58Å; D218-R283 IonicContact OD1-NE 3.96Å; D218-R283 IonicContact OD1-NH2 3.39Å; D218-R283 PolarHBondContact OD1-NH2 3.16Å; D218-R283 WeakPolarHBondContact OD2-CD 3.5Å; D218-R283 IonicContact OD2-CZ 3.71Å; D218-R283 IonicContact OD2-NE 3.01Å; D218-R283 PolarHBondContact OD2-NE 3.33Å; D218-R283 IonicContact OD2-NH2 3.02Å; F221-R283 HydrophobicContact CD2-CG 3.92Å; F221-R283 HydrophobicContact CE2-CG 4.1Å; F221-R283 HydrophobicContact CG-CG 4.39Å; L279-R283 WeakPolarHBondContact O-CA 3.35Å; L279-R283 WeakPolarHBondContact O-CB 3.45Å; L279-R283 PolarHBondContact O-N 3.07Å; Q280-R283 WeakPolarHBondContact O-CB 3.39Å; Q280-R283 PolarHBondContact O-N 2.76Å; R283-Q285 VanDerWaalsContact C-N 3.33Å; R283-Q285 PolarHBondContact O-N 3.06Å; R283-V286 PolarHBondContact O-N 2.97Å; R283-L287 HydrophobicContact CG-CD1 4.01Å; R283-L287 WeakPolarHBondContact O-CG 3.44Å; R283-L287 PolarHBondContact O-N 3.37Å
284E96.3Very high95.8Very high140 Ų14046.2 Ų46.265%0.65423%0.232SC*.Hα-helixtrans-61.3-45.2-177.9-65.8-169.9165.100111.2V282 V286 L287 Q288V282-E284 PolarHBondContact O-N 3.32Å; E284-V286 PolarHBondContact O-N 3.46Å; E284-L287 PolarHBondContact O-N 2.7Å; E284-Q288 WeakPolarHBondContact O-CB 3.46Å; E284-Q288 VanDerWaalsContact O-CG 3.24Å; E284-Q288 WeakPolarHBondContact O-CG 3.47Å; E284-Q288 PolarHBondContact O-N 2.62Å
285Q96.1Very high95.6Very high79 Ų7950.3 Ų50.337%0.36925%0.254SS..Hα-helixtrans-61.2-45.6176.4-169.8-175.42.500111.3V282 R283 L287 Q288 E289 M291V282-Q285 WeakPolarHBondContact O-CB 3.33Å; V282-Q285 PolarHBondContact O-N 2.81Å; V282-Q285 VanDerWaalsContact O-N 3.17Å; R283-Q285 VanDerWaalsContact C-N 3.33Å; R283-Q285 PolarHBondContact O-N 3.06Å; Q285-L287 VanDerWaalsContact C-N 3.29Å; Q285-L287 PolarHBondContact O-N 3.19Å; Q285-Q288 PolarHBondContact O-N 3.25Å; Q285-E289 HydrophobicContact CG-CG 4.32Å; Q285-E289 WeakPolarHBondContact CG-OE1 3.44Å; Q285-E289 PolarHBondContact NE2-OE1 3.1Å; Q285-E289 WeakPolarHBondContact O-CB 3.45Å; Q285-E289 PolarHBondContact O-N 3.36Å; Q285-M291 HydrophobicContact CG-CE 3.75Å
286V96.3Very high95.4Very high0 Ų050.3 Ų50.30%025%0.254CS..Hα-helixtrans-59.6-40.6-179.6168.30000111.9F221 V282 R283 E284 S290 M291 I296F221-V286 HydrophobicContact CE2-CB 3.96Å; F221-V286 HydrophobicContact CE2-CG1 3.46Å; F221-V286 VanDerWaalsContact CE2-CG1 3.46Å; F221-V286 HydrophobicContact CZ-CB 4.43Å; F221-V286 HydrophobicContact CZ-CG1 3.92Å; V282-V286 HydrophobicContact CB-CG2 4.23Å; V282-V286 HydrophobicContact CG2-CG2 3.88Å; V282-V286 VanDerWaalsContact O-CG2 3.27Å; V282-V286 WeakPolarHBondContact O-CG2 3.35Å; V282-V286 PolarHBondContact O-N 2.88Å; R283-V286 PolarHBondContact O-N 2.97Å; E284-V286 PolarHBondContact O-N 3.46Å; V286-S290 CarbonylContact O-C 3.26Å; V286-S290 WeakPolarHBondContact O-CA 3.41Å; V286-S290 PolarHBondContact O-N 2.88Å; V286-S290 VanDerWaalsContact O-N 3.1Å; V286-M291 HydrophobicContact CB-CB 4.24Å; V286-M291 HydrophobicContact CB-SD 4.48Å; V286-M291 HydrophobicContact CG1-CB 4.01Å; V286-M291 HydrophobicContact CG2-CB 4.21Å; V286-M291 HydrophobicContact CG2-SD 3.85Å; V286-M291 PolarHBondContact O-N 3.06Å; V286-I296 HydrophobicContact CB-CG1 4.48Å; V286-I296 HydrophobicContact CG1-CD1 4Å; V286-I296 HydrophobicContact CG1-CG1 3.94Å; V286-I296 HydrophobicContact CG2-CG1 3.64Å
287L97Very high95.1Very high44 Ų4450.8 Ų50.823%0.2326%0.257CS..Hα-helixtrans-72-44.1178.3-69170.4000112M220 F221 H224 R283 E284 Q285 S290M220-L287 HydrophobicContact CE-CD1 3.51Å; M220-L287 HydrophobicContact SD-CD1 3.45Å; M220-L287 WeakPolarHBondContact SD-CD1 3.13Å; M220-L287 HydrophobicContact SD-CD2 3.55Å; M220-L287 VanDerWaalsContact SD-CD2 3.55Å; M220-L287 HydrophobicContact SD-CG 4.15Å; F221-L287 HydrophobicContact CD2-CD1 4.48Å; F221-L287 HydrophobicContact CD2-CD2 3.98Å; F221-L287 HydrophobicContact CD2-CG 4.11Å; F221-L287 HydrophobicContact CE2-CG 4.5Å; H224-L287 HydrophobicContact CB-CD2 3.66Å; R283-L287 HydrophobicContact CG-CD1 4.01Å; R283-L287 WeakPolarHBondContact O-CG 3.44Å; R283-L287 PolarHBondContact O-N 3.37Å; E284-L287 PolarHBondContact O-N 2.7Å; Q285-L287 VanDerWaalsContact C-N 3.29Å; Q285-L287 PolarHBondContact O-N 3.19Å; L287-S290 PolarHBondContact O-N 3.38Å
288Q96.9Very high94.7Very high158 Ų15854.9 Ų54.974%0.73828%0.278SS*.Hα-helixtrans-66.4-45.3-178.9-72.7173.511.300112.3E284 Q285 S290E284-Q288 WeakPolarHBondContact O-CB 3.46Å; E284-Q288 VanDerWaalsContact O-CG 3.24Å; E284-Q288 WeakPolarHBondContact O-CG 3.47Å; E284-Q288 PolarHBondContact O-N 2.62Å; Q285-Q288 PolarHBondContact O-N 3.25Å; Q288-S290 VanDerWaalsContact C-N 3.27Å; Q288-S290 PolarHBondContact O-N 3.21Å
289E96.4Very high94.5Very high119 Ų11955.2 Ų55.256%0.55628%0.281SS*.THydrogen-bonded Turntrans-87-0.6-178.6-63.8-175.8-145.400112.6Q285 M291Q285-E289 HydrophobicContact CG-CG 4.32Å; Q285-E289 WeakPolarHBondContact CG-OE1 3.44Å; Q285-E289 PolarHBondContact NE2-OE1 3.1Å; Q285-E289 WeakPolarHBondContact O-CB 3.45Å; Q285-E289 PolarHBondContact O-N 3.36Å; E289-M291 HydrophobicContact CB-CE 3.93Å; E289-M291 HydrophobicContact CB-CG 3.98Å; E289-M291 VanDerWaalsContact CD-CE 3.45Å; E289-M291 HydrophobicContact CG-CE 4.23Å; E289-M291 PolarHBondContact O-N 3.49Å; E289-M291 WeakPolarHBondContact OE2-CE 3.39Å
290S95.1Very high94.1Very high58 Ų5855.2 Ų55.241%0.40628%0.281SS..THydrogen-bonded Turntrans53.350.3-177.8-150.90000112.4K228 V286 L287 Q288K228-S290 WeakPolarHBondContact CE-O 3.27Å; K228-S290 VanDerWaalsContact CE-OG 3.26Å; K228-S290 WeakPolarHBondContact CE-OG 3.11Å; K228-S290 PolarHBondContact NZ-O 2.95Å; K228-S290 PolarHBondContact NZ-OG 3.29Å; V286-S290 CarbonylContact O-C 3.26Å; V286-S290 WeakPolarHBondContact O-CA 3.41Å; V286-S290 PolarHBondContact O-N 2.88Å; V286-S290 VanDerWaalsContact O-N 3.1Å; L287-S290 PolarHBondContact O-N 3.38Å; Q288-S290 VanDerWaalsContact C-N 3.27Å; Q288-S290 PolarHBondContact O-N 3.21Å
291M95.9Very high93.5Very high14 Ų1455 Ų557%0.06928%0.282CS..  trans-73.9144.2-173.9-71.5-176.7177.300112.9H224 K228 Q285 V286 E289 D295 I296 A299H224-M291 PolarHBondContact NE2-O 3.21Å; K228-M291 WeakPolarHBondContact CG-O 3.17Å; Q285-M291 HydrophobicContact CG-CE 3.75Å; V286-M291 HydrophobicContact CB-CB 4.24Å; V286-M291 HydrophobicContact CB-SD 4.48Å; V286-M291 HydrophobicContact CG1-CB 4.01Å; V286-M291 HydrophobicContact CG2-CB 4.21Å; V286-M291 HydrophobicContact CG2-SD 3.85Å; V286-M291 PolarHBondContact O-N 3.06Å; E289-M291 HydrophobicContact CB-CE 3.93Å; E289-M291 HydrophobicContact CB-CG 3.98Å; E289-M291 VanDerWaalsContact CD-CE 3.45Å; E289-M291 HydrophobicContact CG-CE 4.23Å; E289-M291 PolarHBondContact O-N 3.49Å; E289-M291 WeakPolarHBondContact OE2-CE 3.39Å; M291-D295 HydrophobicContact CB-CB 3.66Å; M291-D295 HydrophobicContact CG-CB 3.77Å; M291-D295 HydrophobicContact SD-CB 4.18Å; M291-I296 HydrophobicContact CB-CG1 4.3Å; M291-A299 HydrophobicContact CE-CB 4.36Å; M291-A299 HydrophobicContact SD-CB 4Å
292G93.9Very high93Very high12 Ų1258 Ų5812%0.12429%0.293CS..  trans-94.2-172.5167.600000112.7D294 D295 I296G292-D294 PolarHBondContact O-N 3.03Å; G292-D295 PolarHBondContact N-OD2 3.42Å; G292-D295 PolarHBondContact O-N 3.46Å; G292-I296 WeakPolarHBondContact O-CD1 3.32Å; G292-I296 WeakPolarHBondContact O-CG1 3.21Å; G292-I296 PolarHBondContact O-N 3Å
293G91.5Very high92.4Very high8 Ų859.9 Ų59.98%0.08230%0.302CS..Hα-helixtrans-60.1-44.1-174.300000115.5A232 S235 I296 L297A232-G293 WeakPolarHBondContact O-CA 3.49Å; S235-G293 WeakPolarHBondContact OG-CA 3.39Å; S235-G293 PolarHBondContact OG-O 3.37Å; G293-I296 PolarHBondContact O-N 3.41Å; G293-L297 PolarHBondContact O-N 3.46Å; G293-L297 VanDerWaalsContact O-N 3.15Å
294D91.4Very high91Very high122 Ų12263.4 Ų63.465%0.65232%0.324SS*.Hα-helixtrans-70.2-35178.2-67.2-30000112G292 L297 L298G292-D294 PolarHBondContact O-N 3.03Å; D294-L297 PolarHBondContact O-N 2.92Å; D294-L298 PolarHBondContact O-N 3.06Å
295D93.8Very high90Very high85 Ų8563.4 Ų63.446%0.45533%0.328SS..Hα-helixtrans-66.4-39.9175.8-56.7-46.4000111M291 G292 L298 A299M291-D295 HydrophobicContact CB-CB 3.66Å; M291-D295 HydrophobicContact CG-CB 3.77Å; M291-D295 HydrophobicContact SD-CB 4.18Å; G292-D295 PolarHBondContact N-OD2 3.42Å; G292-D295 PolarHBondContact O-N 3.46Å; D295-L298 PolarHBondContact O-N 3Å; D295-A299 WeakPolarHBondContact O-CB 3.34Å; D295-A299 PolarHBondContact O-N 2.86Å
296I93.9Very high89.6Confident0 Ų060.4 Ų60.40%032%0.315CS..Hα-helixtrans-60.9-46.8174.7-70161.1000110.7L225 L236 W239 L279 V286 M291 G292 G293 L298 A299 C300L225-I296 HydrophobicContact CD2-CD1 3.5Å; L225-I296 VanDerWaalsContact CD2-CD1 3.5Å; L236-I296 HydrophobicContact CD2-CB 4.34Å; L236-I296 HydrophobicContact CD2-CG2 3.83Å; W239-I296 HydrophobicContact CH2-CG2 4.24Å; W239-I296 HydrophobicContact CZ2-CG2 4.49Å; L279-I296 HydrophobicContact CD2-CG2 3.51Å; V286-I296 HydrophobicContact CB-CG1 4.48Å; V286-I296 HydrophobicContact CG1-CD1 4Å; V286-I296 HydrophobicContact CG1-CG1 3.94Å; V286-I296 HydrophobicContact CG2-CG1 3.64Å; M291-I296 HydrophobicContact CB-CG1 4.3Å; G292-I296 WeakPolarHBondContact O-CD1 3.32Å; G292-I296 WeakPolarHBondContact O-CG1 3.21Å; G292-I296 PolarHBondContact O-N 3Å; G293-I296 PolarHBondContact O-N 3.41Å; I296-L298 VanDerWaalsContact C-N 3.27Å; I296-L298 PolarHBondContact O-N 3.02Å; I296-A299 PolarHBondContact O-N 3.43Å; I296-C300 PolarHBondContact O-N 3.5Å; I296-C300 PolarHBondContact O-SG 3.07Å
297L90.9Very high89.5Confident24 Ų2462.4 Ų62.413%0.12633%0.325CS..Hα-helixtrans-56.7-45.2175.1-78.7-177.9000111.2S235 L236 P238 W239 G293 D294 N301S235-L297 VanDerWaalsContact O-CD1 3.28Å; S235-L297 WeakPolarHBondContact O-CD1 3.39Å; L236-L297 HydrophobicContact CD2-CD2 3.84Å; L236-L297 HydrophobicContact CD2-CG 3.96Å; P238-L297 HydrophobicContact CG-CD1 4.05Å; W239-L297 HydrophobicContact CD2-CD2 4.32Å; W239-L297 HydrophobicContact CG-CD2 4.38Å; W239-L297 HydrophobicContact CZ2-CD2 4.09Å; W239-L297 VanDerWaalsContact NE1-CD2 3.31Å; G293-L297 PolarHBondContact O-N 3.46Å; G293-L297 VanDerWaalsContact O-N 3.15Å; D294-L297 PolarHBondContact O-N 2.92Å; L297-N301 WeakPolarHBondContact O-CB 3.22Å; L297-N301 PolarHBondContact O-N 3.33Å; L297-N301 PolarHBondContact O-ND2 3.29Å
298L90.6Very high89.4Confident91 Ų9160.3 Ų60.348%0.47632%0.315SS..Hα-helixtrans-65.9-41.4179.5-176.961.2000112D294 D295 I296 N301 K302D294-L298 PolarHBondContact O-N 3.06Å; D295-L298 PolarHBondContact O-N 3Å; I296-L298 VanDerWaalsContact C-N 3.27Å; I296-L298 PolarHBondContact O-N 3.02Å; L298-N301 PolarHBondContact O-N 3.37Å; L298-K302 HydrophobicContact CG-CD 4.39Å; L298-K302 VanDerWaalsContact O-CG 3.3Å; L298-K302 WeakPolarHBondContact O-CG 3.38Å; L298-K302 PolarHBondContact O-N 3.45Å
299A91.4Very high89.3Confident6 Ų654.1 Ų54.15%0.0529%0.287CS..Hα-helixtrans-61.6-47.3176.600000111.1V282 M291 D295 I296 N301 K302 L303V282-A299 HydrophobicContact CB-CB 4.49Å; V282-A299 HydrophobicContact CG1-CB 4.29Å; M291-A299 HydrophobicContact CE-CB 4.36Å; M291-A299 HydrophobicContact SD-CB 4Å; D295-A299 WeakPolarHBondContact O-CB 3.34Å; D295-A299 PolarHBondContact O-N 2.86Å; I296-A299 PolarHBondContact O-N 3.43Å; A299-N301 PolarHBondContact O-N 3.3Å; A299-K302 WeakPolarHBondContact O-CB 3.41Å; A299-K302 PolarHBondContact O-N 2.86Å; A299-K302 VanDerWaalsContact O-N 3.14Å; A299-L303 PolarHBondContact O-N 3.48Å
300C87.3Confident89.2Confident0 Ų053.7 Ų53.70%029%0.285CS..Hα-helixtrans-62.8-39.9176.4-710000112.6W239 M278 V282 I296 K302 L303W239-C300 HydrophobicContact CZ2-CB 3.75Å; W239-C300 VanDerWaalsContact CZ2-SG 3.51Å; M278-C300 HydrophobicContact CE-CB 4.07Å; V282-C300 VanDerWaalsContact CG2-SG 3.6Å; I296-C300 PolarHBondContact O-N 3.5Å; I296-C300 PolarHBondContact O-SG 3.07Å; C300-K302 PolarHBondContact O-N 2.94Å; C300-L303 WeakPolarHBondContact O-CB 3.37Å; C300-L303 VanDerWaalsContact O-CG 3.3Å; C300-L303 WeakPolarHBondContact O-CG 3.45Å; C300-L303 PolarHBondContact O-N 2.95Å; C300-L303 VanDerWaalsContact O-N 3.11Å
301N83.9Confident89.3Confident62 Ų6250.9 Ų50.933%0.33227%0.265SS..Hα-helixtrans-67.2-19.4177.8-70.3-20.1000113.5K249 L297 L298 A299K249-N301 PolarHBondContact NZ-O 2.89Å; L297-N301 WeakPolarHBondContact O-CB 3.22Å; L297-N301 PolarHBondContact O-N 3.33Å; L297-N301 PolarHBondContact O-ND2 3.29Å; L298-N301 PolarHBondContact O-N 3.37Å; A299-N301 PolarHBondContact O-N 3.3Å
302K84.4Confident89.3Confident137 Ų13750.2 Ų50.260%0.59626%0.262SS*.THydrogen-bonded Turntrans-87.8-2.5175.6-73.4172.8179.4175.40113.2L298 A299 C300 I304L298-K302 HydrophobicContact CG-CD 4.39Å; L298-K302 VanDerWaalsContact O-CG 3.3Å; L298-K302 WeakPolarHBondContact O-CG 3.38Å; L298-K302 PolarHBondContact O-N 3.45Å; A299-K302 WeakPolarHBondContact O-CB 3.41Å; A299-K302 PolarHBondContact O-N 2.86Å; A299-K302 VanDerWaalsContact O-N 3.14Å; C300-K302 PolarHBondContact O-N 2.94Å; K302-I304 VanDerWaalsContact O-CG1 3.28Å; K302-I304 WeakPolarHBondContact O-CG1 3.38Å; K302-I304 PolarHBondContact O-N 2.98Å
303L82.1Confident89.4Confident44 Ų4449.8 Ų49.823%0.2326%0.257CS..  trans-61.9108.5168.8-63.3172.2000107.7M281 V282 A299 C300 D305 L306M281-L303 HydrophobicContact CB-CD1 4.44Å; M281-L303 HydrophobicContact SD-CD1 4.44Å; V282-L303 HydrophobicContact CG1-CD1 4.3Å; V282-L303 HydrophobicContact CG1-CD2 4.15Å; V282-L303 HydrophobicContact CG1-CG 4.4Å; A299-L303 PolarHBondContact O-N 3.48Å; C300-L303 WeakPolarHBondContact O-CB 3.37Å; C300-L303 VanDerWaalsContact O-CG 3.3Å; C300-L303 WeakPolarHBondContact O-CG 3.45Å; C300-L303 PolarHBondContact O-N 2.95Å; C300-L303 VanDerWaalsContact O-N 3.11Å; L303-D305 VanDerWaalsContact C-N 3.32Å; L303-L306 HydrophobicContact CB-CB 4.3Å
304I65.3Low89.6Confident129 Ų12951.1 Ų51.166%0.66227%0.267SS*.THydrogen-bonded Turntrans-74.4-28.4-169.2-60.2-177.1000110.9K302K302-I304 VanDerWaalsContact O-CG1 3.28Å; K302-I304 WeakPolarHBondContact O-CG1 3.38Å; K302-I304 PolarHBondContact O-N 2.98Å
305D75.5Confident89.9Confident139 Ų13945.3 Ų45.374%0.74324%0.236SC*.THydrogen-bonded Turntrans-133.340-168.6-56.1-55.8000112.5L303 D307L303-D305 VanDerWaalsContact C-N 3.32Å; D305-D307 PolarHBondContact O-N 3.36Å
306L89Confident90Very high16 Ų1641.2 Ų41.28%0.08421%0.214CC..  trans-67.8100.5177-175.965.2000110.2A247 F248 M278 M281 L303 L311A247-L306 HydrophobicContact CB-CD2 3.9Å; F248-L306 HydrophobicContact CD1-CD2 4.25Å; F248-L306 HydrophobicContact CD1-CG 4.23Å; F248-L306 WeakPolarHBondContact CD1-O 3.38Å; F248-L306 HydrophobicContact CE1-CD2 4.01Å; F248-L306 HydrophobicContact CE1-CG 3.97Å; M278-L306 HydrophobicContact CE-CD2 4.4Å; M281-L306 HydrophobicContact CE-CD1 3.76Å; M281-L306 HydrophobicContact SD-CD1 3.52Å; M281-L306 VanDerWaalsContact SD-CD1 3.52Å; L303-L306 HydrophobicContact CB-CB 4.3Å; L306-L311 HydrophobicContact CD1-CB 4.24Å; L306-L311 HydrophobicContact CD1-CD2 4.41Å; L306-L311 HydrophobicContact CD2-CD2 4.13Å
307D93Very high90.1Very high42 Ų4243.8 Ų43.823%0.22523%0.23CC..  trans-79.5134174174.6-74.3000110.3K22 D305 D309 E310 L311K22-D307 IonicContact NZ-OD2 2.62Å; D305-D307 PolarHBondContact O-N 3.36Å; D307-D309 PolarHBondContact O-N 2.9Å; D307-D309 WeakPolarHBondContact OD1-CA 3.37Å; D307-D309 VanDerWaalsContact OD1-CB 3.23Å; D307-D309 WeakPolarHBondContact OD1-CB 3.44Å; D307-D309 PolarHBondContact OD1-N 3.06Å; D307-E310 HydrophobicContact CB-CB 4.24Å; D307-E310 HydrophobicContact CB-CG 4Å; D307-E310 PolarHBondContact O-N 3.45Å; D307-E310 PolarHBondContact OD1-N 3.22Å; D307-L311 PolarHBondContact O-N 2.68Å; D307-L311 VanDerWaalsContact O-N 3.16Å
308A95.3Very high90.3Very high0 Ų043.4 Ų43.40%023%0.228CC..Hα-helixtrans-65.3-38.1-177.600000112.9F248 D253 R256 L311 I312F248-A308 HydrophobicContact CE1-CB 3.91Å; F248-A308 HydrophobicContact CZ-CB 4.26Å; D253-A308 HydrophobicContact CB-CB 3.86Å; D253-A308 WeakPolarHBondContact O-CB 3.31Å; D253-A308 WeakPolarHBondContact OD1-CB 3.26Å; D253-A308 PolarHBondContact OD1-N 3.23Å; R256-A308 HydrophobicContact CB-CB 3.97Å; R256-A308 HydrophobicContact CG-CB 3.74Å; A308-L311 PolarHBondContact O-N 3.44Å; A308-I312 HydrophobicContact CB-CD1 4.39Å; A308-I312 WeakPolarHBondContact O-CB 3.38Å; A308-I312 VanDerWaalsContact O-CD1 3.22Å; A308-I312 WeakPolarHBondContact O-CD1 3.28Å; A308-I312 WeakPolarHBondContact O-CG1 3.43Å; A308-I312 PolarHBondContact O-N 3.36Å
309D95.1Very high90.5Very high29 Ų2939.5 Ų39.516%0.15521%0.207CC..Hα-helixtrans-65.8-40.1179.1-79.8-28.4000111I19 R256 D307 I312 S313I19-D309 HydrophobicContact CG2-CB 3.49Å; I19-D309 VanDerWaalsContact CG2-CB 3.49Å; I19-D309 VanDerWaalsContact CG2-O 3.22Å; I19-D309 WeakPolarHBondContact CG2-O 2.95Å; R256-D309 IonicContact CZ-OD1 3.23Å; R256-D309 IonicContact NE-OD1 3.6Å; R256-D309 PolarHBondContact NE-OD1 3.06Å; R256-D309 IonicContact NH2-OD1 3.76Å; R256-D309 PolarHBondContact NH2-OD1 2.98Å; D307-D309 PolarHBondContact O-N 2.9Å; D307-D309 WeakPolarHBondContact OD1-CA 3.37Å; D307-D309 VanDerWaalsContact OD1-CB 3.23Å; D307-D309 WeakPolarHBondContact OD1-CB 3.44Å; D307-D309 PolarHBondContact OD1-N 3.06Å; D309-I312 PolarHBondContact O-N 3.39Å; D309-S313 WeakPolarHBondContact O-CB 3.32Å; D309-S313 PolarHBondContact O-N 3.48Å
310E94.1Very high90.5Very high109 Ų10939.2 Ų39.251%0.50921%0.205SC..Hα-helixtrans-60.5-47174.1-69.2-173.6176.100111.8L20 D307 S313 A314L20-E310 HydrophobicContact CD2-CG 4.21Å; D307-E310 HydrophobicContact CB-CB 4.24Å; D307-E310 HydrophobicContact CB-CG 4Å; D307-E310 PolarHBondContact O-N 3.45Å; D307-E310 PolarHBondContact OD1-N 3.22Å; E310-S313 PolarHBondContact O-N 2.94Å; E310-A314 WeakPolarHBondContact O-CB 3.33Å; E310-A314 PolarHBondContact O-N 2.87Å
311L96.1Very high90.7Very high0 Ų043.2 Ų43.20%022%0.223CC..Hα-helixtrans-66.3-43.3178.8179.256.4000112.4F248 V274 M278 M281 L306 D307 A308 S313 A314 A315F248-L311 HydrophobicContact CE1-CD2 4.34Å; F248-L311 HydrophobicContact CZ-CD2 3.88Å; V274-L311 HydrophobicContact CG1-CD1 4.45Å; V274-L311 HydrophobicContact CG1-CD2 3.83Å; V274-L311 HydrophobicContact CG1-CG 4.14Å; M278-L311 HydrophobicContact CG-CD1 3.77Å; M278-L311 HydrophobicContact CG-CD2 3.8Å; M278-L311 HydrophobicContact CG-CG 4.48Å; M278-L311 HydrophobicContact SD-CD2 4.18Å; M281-L311 HydrophobicContact CE-CB 4.26Å; M281-L311 HydrophobicContact CE-CD1 3.9Å; M281-L311 HydrophobicContact SD-CD1 4.3Å; L306-L311 HydrophobicContact CD1-CB 4.24Å; L306-L311 HydrophobicContact CD1-CD2 4.41Å; L306-L311 HydrophobicContact CD2-CD2 4.13Å; D307-L311 PolarHBondContact O-N 2.68Å; D307-L311 VanDerWaalsContact O-N 3.16Å; A308-L311 PolarHBondContact O-N 3.44Å; L311-S313 VanDerWaalsContact C-N 3.32Å; L311-S313 PolarHBondContact O-N 2.84Å; L311-A314 PolarHBondContact O-N 3.05Å; L311-A315 WeakPolarHBondContact O-CB 3.45Å; L311-A315 PolarHBondContact O-N 3.39Å
312I97.4Very high91Very high0 Ų040.5 Ų40.50%021%0.209CC..Hα-helixtrans-62.3-42.9176.5-67.5158.2000109.8I19 L54 R256 L257 V260 F270 A308 D309 A315 C316I19-I312 HydrophobicContact CD1-CG2 3.82Å; L54-I312 HydrophobicContact CD1-CG2 3.78Å; R256-I312 HydrophobicContact CG-CD1 4.05Å; L257-I312 HydrophobicContact CD1-CD1 4.43Å; L257-I312 HydrophobicContact CD1-CG1 3.88Å; V260-I312 HydrophobicContact CG1-CG2 4.37Å; V260-I312 HydrophobicContact CG2-CD1 3.72Å; V260-I312 HydrophobicContact CG2-CG1 4.29Å; V260-I312 HydrophobicContact CG2-CG2 4.19Å; F270-I312 HydrophobicContact CE1-CG2 4.26Å; F270-I312 HydrophobicContact CZ-CG2 4.31Å; A308-I312 HydrophobicContact CB-CD1 4.39Å; A308-I312 WeakPolarHBondContact O-CB 3.38Å; A308-I312 VanDerWaalsContact O-CD1 3.22Å; A308-I312 WeakPolarHBondContact O-CD1 3.28Å; A308-I312 WeakPolarHBondContact O-CG1 3.43Å; A308-I312 PolarHBondContact O-N 3.36Å; D309-I312 PolarHBondContact O-N 3.39Å; I312-A315 PolarHBondContact O-N 3.39Å; I312-C316 PolarHBondContact O-N 2.78Å; I312-C316 PolarHBondContact O-SG 2.98Å
313S95.8Very high91.1Very high3 Ų335.2 Ų35.22%0.02119%0.187CC..Hα-helixtrans-62.8-48.1177.9-177.10000111.6A16 L20 D309 E310 L311 A315 C316 V317A16-S313 WeakPolarHBondContact CA-OG 3.29Å; A16-S313 PolarHBondContact O-OG 3.08Å; L20-S313 WeakPolarHBondContact CD1-OG 3.46Å; L20-S313 WeakPolarHBondContact CG-OG 3.29Å; D309-S313 WeakPolarHBondContact O-CB 3.32Å; D309-S313 PolarHBondContact O-N 3.48Å; E310-S313 PolarHBondContact O-N 2.94Å; L311-S313 VanDerWaalsContact C-N 3.32Å; L311-S313 PolarHBondContact O-N 2.84Å; S313-A315 VanDerWaalsContact C-N 3.31Å; S313-A315 PolarHBondContact O-N 3.43Å; S313-C316 WeakPolarHBondContact O-CB 3.37Å; S313-C316 PolarHBondContact O-N 3.05Å; S313-V317 WeakPolarHBondContact O-CG2 3.24Å; S313-V317 PolarHBondContact O-N 3.44Å
314A96.4Very high91.2Very high35 Ų3538.3 Ų38.329%0.28920%0.2SC..Hα-helixtrans-55.5-46.2175.700000111.6E310 L311 C316 V317 V318E310-A314 WeakPolarHBondContact O-CB 3.33Å; E310-A314 PolarHBondContact O-N 2.87Å; L311-A314 PolarHBondContact O-N 3.05Å; A314-C316 VanDerWaalsContact C-N 3.33Å; A314-C316 PolarHBondContact O-N 3.47Å; A314-V317 WeakPolarHBondContact O-CB 3.46Å; A314-V317 PolarHBondContact O-N 3.26Å; A314-V317 VanDerWaalsContact O-N 3.17Å; A314-V318 WeakPolarHBondContact O-CG2 3.4Å; A314-V318 PolarHBondContact O-N 3.46Å
315A97.5Very high92.2Very high0 Ų037.2 Ų37.20%019%0.191CC..Hα-helixtrans-65-33.8177.400000113.1F270 L273 V274 S277 L311 I312 S313 V318 Y319F270-A315 HydrophobicContact CE1-CB 4.2Å; F270-A315 HydrophobicContact CE2-CB 3.6Å; F270-A315 HydrophobicContact CZ-CB 3.38Å; L273-A315 HydrophobicContact CB-CB 4.1Å; V274-A315 HydrophobicContact CG2-CB 4.18Å; S277-A315 WeakPolarHBondContact OG-CA 3.4Å; S277-A315 PolarHBondContact OG-N 3.18Å; L311-A315 WeakPolarHBondContact O-CB 3.45Å; L311-A315 PolarHBondContact O-N 3.39Å; I312-A315 PolarHBondContact O-N 3.39Å; S313-A315 VanDerWaalsContact C-N 3.31Å; S313-A315 PolarHBondContact O-N 3.43Å; A315-V318 PolarHBondContact O-N 2.87Å; A315-Y319 PolarHBondContact O-N 3.18Å
316C96.2Very high92.8Very high0 Ų037.3 Ų37.30%019%0.191CC..Hα-helixtrans-67.6-37.8172.8-700000112.3A16 I312 S313 A314 Y319 A320A16-C316 HydrophobicContact CB-CB 3.74Å; I312-C316 PolarHBondContact O-N 2.78Å; I312-C316 PolarHBondContact O-SG 2.98Å; S313-C316 WeakPolarHBondContact O-CB 3.37Å; S313-C316 PolarHBondContact O-N 3.05Å; A314-C316 VanDerWaalsContact C-N 3.33Å; A314-C316 PolarHBondContact O-N 3.47Å; C316-Y319 PolarHBondContact O-N 3.09Å; C316-A320 WeakPolarHBondContact O-CB 3.35Å; C316-A320 PolarHBondContact O-N 2.85Å
317V95.2Very high92.8Very high54 Ų5437 Ų3733%0.32719%0.19SC..Hα-helixtrans-62.3-48173.6175.20000110.4A16 S313 A314 Y319 A320 E321A16-V317 HydrophobicContact CB-CG2 3.7Å; S313-V317 WeakPolarHBondContact O-CG2 3.24Å; S313-V317 PolarHBondContact O-N 3.44Å; A314-V317 WeakPolarHBondContact O-CB 3.46Å; A314-V317 PolarHBondContact O-N 3.26Å; A314-V317 VanDerWaalsContact O-N 3.17Å; V317-Y319 VanDerWaalsContact C-N 3.31Å; V317-Y319 PolarHBondContact O-N 3.2Å; V317-A320 PolarHBondContact O-N 2.94Å; V317-A320 VanDerWaalsContact O-N 3.1Å; V317-E321 HydrophobicContact CG1-CG 4.44Å; V317-E321 WeakPolarHBondContact O-CG 3.32Å; V317-E321 PolarHBondContact O-N 2.87Å
318V95.3Very high92.6Very high16 Ų1637.4 Ų37.410%0.09720%0.195CC..Hα-helixtrans-57.8-45.3176.9176.40000110.8L217 L273 Y276 A314 A315 A320 E321 L322L217-V318 HydrophobicContact CD1-CG1 3.76Å; L273-V318 HydrophobicContact CD2-CB 4.41Å; L273-V318 HydrophobicContact CD2-CG1 3.7Å; Y276-V318 HydrophobicContact CD1-CB 4.47Å; Y276-V318 HydrophobicContact CD1-CG1 3.71Å; Y276-V318 HydrophobicContact CD1-CG2 3.95Å; Y276-V318 HydrophobicContact CE1-CG1 3.93Å; Y276-V318 HydrophobicContact CE1-CG2 4.03Å; A314-V318 WeakPolarHBondContact O-CG2 3.4Å; A314-V318 PolarHBondContact O-N 3.46Å; A315-V318 PolarHBondContact O-N 2.87Å; V318-A320 VanDerWaalsContact C-N 3.33Å; V318-A320 PolarHBondContact O-N 3.22Å; V318-E321 PolarHBondContact O-N 3.44Å; V318-L322 HydrophobicContact CG1-CD1 4.07Å; V318-L322 WeakPolarHBondContact O-CG 3.27Å; V318-L322 PolarHBondContact O-N 2.98Å
319Y94.6Very high92.3Very high9 Ų943 Ų434%0.03522%0.221CC..Hα-helixtrans-57.4-47.6175.4-179.5-113.6000111.8A12 P266 C267 L273 A315 C316 V317 E321 L322 I323 F335 L336A12-Y319 HydrophobicContact CB-CD1 3.64Å; A12-Y319 HydrophobicContact CB-CE1 4.2Å; P266-Y319 HydrophobicContact CB-CD1 3.76Å; P266-Y319 HydrophobicContact CB-CE1 3.87Å; P266-Y319 HydrophobicContact CG-CD1 3.68Å; P266-Y319 HydrophobicContact CG-CE1 4.24Å; P266-Y319 HydrophobicContact CG-CG 4.05Å; C267-Y319 HydrophobicContact CB-CD2 4.04Å; C267-Y319 HydrophobicContact CB-CE2 3.54Å; L273-Y319 HydrophobicContact CD1-CD2 3.91Å; L273-Y319 HydrophobicContact CD1-CG 4.2Å; A315-Y319 PolarHBondContact O-N 3.18Å; C316-Y319 PolarHBondContact O-N 3.09Å; V317-Y319 VanDerWaalsContact C-N 3.31Å; V317-Y319 PolarHBondContact O-N 3.2Å; Y319-E321 VanDerWaalsContact C-N 3.31Å; Y319-E321 PolarHBondContact O-N 3.3Å; Y319-L322 WeakPolarHBondContact O-CB 3.37Å; Y319-L322 PolarHBondContact O-N 3.1Å; Y319-I323 HydrophobicContact CD1-CD1 4.25Å; Y319-I323 HydrophobicContact CD2-CG2 4.41Å; Y319-I323 HydrophobicContact CE1-CD1 3.82Å; Y319-I323 HydrophobicContact CE2-CG2 3.9Å; Y319-I323 WeakPolarHBondContact O-CG1 3.27Å; Y319-I323 PolarHBondContact O-N 3.35Å; Y319-F335 HydrophobicContact CE2-CB 4.39Å; Y319-L336 HydrophobicContact CE2-CD2 4.13Å; Y319-L336 VanDerWaalsContact OH-CD2 3.27Å; Y319-L336 WeakPolarHBondContact OH-CD2 3.41Å
320A91.8Very high92.2Very high0 Ų045.4 Ų45.40%024%0.237CC..Hα-helixtrans-65.2-35.1-177.900000113.2S9 A12 R13 C316 V317 V318 I323 Q324S9-A320 PolarHBondContact OG-O 3.38Å; A12-A320 HydrophobicContact CB-CB 3.91Å; R13-A320 HydrophobicContact CB-CB 4.47Å; R13-A320 HydrophobicContact CG-CB 3.38Å; C316-A320 WeakPolarHBondContact O-CB 3.35Å; C316-A320 PolarHBondContact O-N 2.85Å; V317-A320 PolarHBondContact O-N 2.94Å; V317-A320 VanDerWaalsContact O-N 3.1Å; V318-A320 VanDerWaalsContact C-N 3.33Å; V318-A320 PolarHBondContact O-N 3.22Å; A320-I323 VanDerWaalsContact O-CG1 3.29Å; A320-I323 WeakPolarHBondContact O-CG1 3.38Å; A320-Q324 WeakPolarHBondContact O-CG 3.45Å
321E90.6Very high92.1Very high83 Ų8340.2 Ų40.239%0.38821%0.213SC..Hα-helixtrans-68.9-42.1173.8-72.2-179.1-178.400112.3V317 V318 Y319 I323 Q324 K325V317-E321 HydrophobicContact CG1-CG 4.44Å; V317-E321 WeakPolarHBondContact O-CG 3.32Å; V317-E321 PolarHBondContact O-N 2.87Å; V318-E321 PolarHBondContact O-N 3.44Å; Y319-E321 VanDerWaalsContact C-N 3.31Å; Y319-E321 PolarHBondContact O-N 3.3Å; E321-I323 VanDerWaalsContact C-N 3.34Å; E321-I323 PolarHBondContact O-N 3.48Å; E321-Q324 PolarHBondContact O-N 2.92Å; E321-K325 PolarHBondContact O-N 3.22Å
322L90.1Very high91.8Very high5 Ų542 Ų423%0.02622%0.221CC..Hα-helixtrans-55.5-51.2176.9-80.5164.1000110.8L213 F216 L217 L273 V318 Y319 Q324 K325 V327L213-L322 HydrophobicContact CD1-CD1 3.7Å; L213-L322 HydrophobicContact CD1-CD2 3.61Å; L213-L322 HydrophobicContact CD1-CG 4.21Å; F216-L322 HydrophobicContact CD1-CD2 3.98Å; F216-L322 HydrophobicContact CE1-CD2 4.03Å; L217-L322 HydrophobicContact CD1-CD1 4.48Å; L217-L322 HydrophobicContact CD1-CD2 3.98Å; L217-L322 HydrophobicContact CD1-CG 4.18Å; L217-L322 HydrophobicContact CD2-CD2 3.72Å; L217-L322 HydrophobicContact CD2-CG 4.33Å; L217-L322 HydrophobicContact CG-CD2 3.99Å; L273-L322 HydrophobicContact CD2-CD1 3.4Å; L273-L322 VanDerWaalsContact CD2-CD1 3.4Å; V318-L322 HydrophobicContact CG1-CD1 4.07Å; V318-L322 WeakPolarHBondContact O-CG 3.27Å; V318-L322 PolarHBondContact O-N 2.98Å; Y319-L322 WeakPolarHBondContact O-CB 3.37Å; Y319-L322 PolarHBondContact O-N 3.1Å; L322-Q324 PolarHBondContact O-N 2.98Å; L322-Q324 VanDerWaalsContact O-N 3.08Å; L322-K325 PolarHBondContact O-N 3.39Å; L322-V327 HydrophobicContact CB-CG2 4.42Å; L322-V327 HydrophobicContact CD2-CG2 4.36Å; L322-V327 WeakPolarHBondContact O-CG2 3.48Å
323I86.4Confident91.4Very high26 Ų2647.1 Ų47.113%0.13325%0.248CC..THydrogen-bonded Turntrans-70.7-6.5-175.460.6-178.2000114.6L4 N8 S9 Y319 A320 E321 L336L4-I323 HydrophobicContact CD2-CB 3.76Å; L4-I323 HydrophobicContact CD2-CG2 3.7Å; N8-I323 HydrophobicContact CB-CD1 4.15Å; S9-I323 VanDerWaalsContact CB-CD1 3.42Å; Y319-I323 HydrophobicContact CD1-CD1 4.25Å; Y319-I323 HydrophobicContact CD2-CG2 4.41Å; Y319-I323 HydrophobicContact CE1-CD1 3.82Å; Y319-I323 HydrophobicContact CE2-CG2 3.9Å; Y319-I323 WeakPolarHBondContact O-CG1 3.27Å; Y319-I323 PolarHBondContact O-N 3.35Å; A320-I323 VanDerWaalsContact O-CG1 3.29Å; A320-I323 WeakPolarHBondContact O-CG1 3.38Å; E321-I323 VanDerWaalsContact C-N 3.34Å; E321-I323 PolarHBondContact O-N 3.48Å; I323-L336 HydrophobicContact CG2-CD2 4.19Å
324Q85.4Confident91.2Very high110 Ų11047.5 Ų47.551%0.51425%0.249SC..THydrogen-bonded Turntrans-91.9-16.1169.6-68.2-179.77.600113.4S9 R13 A320 E321 L322S9-Q324 WeakPolarHBondContact OG-CG 3.38Å; S9-Q324 PolarHBondContact OG-NE2 2.93Å; R13-Q324 VanDerWaalsContact NH2-CD 3.27Å; A320-Q324 WeakPolarHBondContact O-CG 3.45Å; E321-Q324 PolarHBondContact O-N 2.92Å; L322-Q324 PolarHBondContact O-N 2.98Å; L322-Q324 VanDerWaalsContact O-N 3.08Å
325K86.8Confident90.8Very high106 Ų10646.4 Ų46.446%0.46124%0.238SC..SBendtrans-90.3160.9179.4-67.8169.4-178.3-84.80110.5F216 L217 E321 L322 V327F216-K325 HydrophobicContact CE1-CB 4.19Å; F216-K325 HydrophobicContact CE1-CD 3.97Å; F216-K325 HydrophobicContact CZ-CB 4.04Å; F216-K325 HydrophobicContact CZ-CD 4.34Å; L217-K325 HydrophobicContact CD2-CD 4.11Å; E321-K325 PolarHBondContact O-N 3.22Å; L322-K325 PolarHBondContact O-N 3.39Å; K325-V327 VanDerWaalsContact C-N 3.29Å; K325-V327 HydrophobicContact CB-CG2 4.25Å; K325-V327 PolarHBondContact O-N 2.95Å
326D87.7Confident89.5Confident140 Ų14049.6 Ų49.675%0.74925%0.254SS*.  trans-77.386.4166.5-171.323.2000110K332D326-K332 IonicContact OD1-NZ 3.48Å; D326-K332 PolarHBondContact OD1-NZ 3.01Å
327V87.8Confident89.2Confident10 Ų1052.1 Ų52.16%0.06127%0.267CS..  trans-77.1140.8-174.4-177.50000110.8F216 L322 K325 L331 K332F216-V327 HydrophobicContact CE1-CG2 4.11Å; F216-V327 HydrophobicContact CZ-CG2 4.36Å; L322-V327 HydrophobicContact CB-CG2 4.42Å; L322-V327 HydrophobicContact CD2-CG2 4.36Å; L322-V327 WeakPolarHBondContact O-CG2 3.48Å; K325-V327 VanDerWaalsContact C-N 3.29Å; K325-V327 HydrophobicContact CB-CG2 4.25Å; K325-V327 PolarHBondContact O-N 2.95Å; V327-L331 HydrophobicContact CG1-CB 3.39Å; V327-L331 HydrophobicContact CG1-CD1 4.05Å; V327-L331 HydrophobicContact CG1-CG 4.36Å; V327-K332 HydrophobicContact CB-CG 3.98Å; V327-K332 HydrophobicContact CG1-CG 4.17Å; V327-K332 WeakPolarHBondContact O-CD 3.38Å; V327-K332 WeakPolarHBondContact O-CE 3.32Å; V327-K332 PolarHBondContact O-NZ 3.49Å
328P90.1Very high88.9Confident50 Ų5051.9 Ų51.933%0.32526%0.264SS..  trans-50.8143.2169.5-2934.8000112.9F216 T330 L331 K332F216-P328 HydrophobicContact CD2-CG 3.94Å; F216-P328 HydrophobicContact CE2-CG 4.23Å; P328-T330 PolarHBondContact O-N 3.21Å; P328-T330 VanDerWaalsContact O-N 3.16Å; P328-L331 HydrophobicContact CG-CD1 4.43Å; P328-L331 PolarHBondContact O-N 3.32Å; P328-K332 PolarHBondContact O-N 2.94Å
329Q89.3Confident88.5Confident117 Ų11753.9 Ų53.955%0.54727%0.273SS..Hα-helixtrans-56.8-36.3-177.1-169.660.539.300112.7L331 K332 D333Q329-L331 VanDerWaalsContact C-N 3.34Å; Q329-L331 PolarHBondContact O-N 2.84Å; Q329-K332 WeakPolarHBondContact O-CB 3.46Å; Q329-K332 PolarHBondContact O-N 2.62Å; Q329-D333 PolarHBondContact NE2-OD1 3.07Å; Q329-D333 VanDerWaalsContact O-CG 3.27Å; Q329-D333 PolarHBondContact O-N 2.8Å
330T92.6Very high88.2Confident81 Ų8156.6 Ų56.650%0.49729%0.287SS..Hα-helixtrans-58.8-42.5177.150.10000112.9P328 F334P328-T330 PolarHBondContact O-N 3.21Å; P328-T330 VanDerWaalsContact O-N 3.16Å; T330-F334 VanDerWaalsContact O-CB 3.31Å; T330-F334 WeakPolarHBondContact O-CB 3.36Å; T330-F334 PolarHBondContact O-N 3.29Å
331L92Very high88Confident0 Ų060.1 Ų60.10%031%0.305CS..Hα-helixtrans-75.3-34.3176.6-69.2179.2000111.3M209 T212 L213 F216 V327 P328 Q329 F334 F335M209-L331 HydrophobicContact SD-CD2 4.4Å; T212-L331 HydrophobicContact CG2-CD1 4.11Å; T212-L331 HydrophobicContact CG2-CD2 3.83Å; T212-L331 HydrophobicContact CG2-CG 3.83Å; L213-L331 HydrophobicContact CB-CD2 4.33Å; L213-L331 HydrophobicContact CD1-CD1 4.36Å; F216-L331 HydrophobicContact CB-CD1 4.14Å; F216-L331 HydrophobicContact CD1-CD1 4.36Å; F216-L331 HydrophobicContact CG-CD1 4.34Å; V327-L331 HydrophobicContact CG1-CB 3.39Å; V327-L331 HydrophobicContact CG1-CD1 4.05Å; V327-L331 HydrophobicContact CG1-CG 4.36Å; P328-L331 HydrophobicContact CG-CD1 4.43Å; P328-L331 PolarHBondContact O-N 3.32Å; Q329-L331 VanDerWaalsContact C-N 3.34Å; Q329-L331 PolarHBondContact O-N 2.84Å; L331-F334 PolarHBondContact O-N 3.15Å; L331-F335 HydrophobicContact CD2-CE2 4.09Å; L331-F335 VanDerWaalsContact O-CD2 3.27Å; L331-F335 WeakPolarHBondContact O-CD2 3.37Å; L331-F335 PolarHBondContact O-N 3.26Å
332K88.6Confident87.8Confident38 Ų3858.6 Ų58.617%0.16530%0.3CS..Hα-helixtrans-58.8-54.4172.2-71.2174.3173.5147.70110.3L4 D326 V327 P328 Q329 F334 F335 L336L4-K332 HydrophobicContact CD1-CD 3.92Å; L4-K332 HydrophobicContact CD1-CG 4.22Å; D326-K332 IonicContact OD1-NZ 3.48Å; D326-K332 PolarHBondContact OD1-NZ 3.01Å; V327-K332 HydrophobicContact CB-CG 3.98Å; V327-K332 HydrophobicContact CG1-CG 4.17Å; V327-K332 WeakPolarHBondContact O-CD 3.38Å; V327-K332 WeakPolarHBondContact O-CE 3.32Å; V327-K332 PolarHBondContact O-NZ 3.49Å; P328-K332 PolarHBondContact O-N 2.94Å; Q329-K332 WeakPolarHBondContact O-CB 3.46Å; Q329-K332 PolarHBondContact O-N 2.62Å; K332-F334 PolarHBondContact O-N 2.92Å; K332-F335 PolarHBondContact O-N 3.29Å; K332-L336 HydrophobicContact CB-CD1 4.13Å; K332-L336 HydrophobicContact CG-CD1 4.3Å; K332-L336 WeakPolarHBondContact O-CB 3.5Å; K332-L336 WeakPolarHBondContact O-CG 3.19Å; K332-L336 PolarHBondContact O-N 3.03Å
333D89.3Confident87.6Confident106 Ų10662.4 Ų62.457%0.56732%0.319SS*.Hα-helixtrans-63.4-26-179.7-63.8-19.4000113.1Q329Q329-D333 PolarHBondContact NE2-OD1 3.07Å; Q329-D333 VanDerWaalsContact O-CG 3.27Å; Q329-D333 PolarHBondContact O-N 2.8Å
334F91.3Very high87.7Confident12 Ų1265.2 Ų65.25%0.05333%0.334CS..Hα-helixtrans-79.5-40.2179.2-171.4-103.8000112.2K205 N206 M209 N269 V272 T330 L331 K332K205-F334 HydrophobicContact CD-CE2 4.25Å; K205-F334 HydrophobicContact CG-CE2 4.18Å; N206-F334 WeakPolarHBondContact OD1-CZ 3.08Å; M209-F334 HydrophobicContact CB-CD1 3.99Å; M209-F334 HydrophobicContact CB-CD2 4.48Å; M209-F334 HydrophobicContact CB-CE1 3.81Å; M209-F334 HydrophobicContact CB-CE2 4.33Å; M209-F334 HydrophobicContact CB-CG 4.31Å; M209-F334 HydrophobicContact CB-CZ 3.98Å; M209-F334 HydrophobicContact CG-CB 4.46Å; M209-F334 HydrophobicContact CG-CD1 3.93Å; M209-F334 HydrophobicContact CG-CD2 3.61Å; M209-F334 HydrophobicContact CG-CE1 3.99Å; M209-F334 HydrophobicContact CG-CE2 3.68Å; M209-F334 HydrophobicContact CG-CG 3.72Å; M209-F334 HydrophobicContact CG-CZ 3.86Å; M209-F334 HydrophobicContact SD-CB 4.06Å; M209-F334 HydrophobicContact SD-CD1 4.49Å; M209-F334 HydrophobicContact SD-CD2 4.13Å; M209-F334 HydrophobicContact SD-CG 3.97Å; N269-F334 HydrophobicContact CB-CD1 3.87Å; N269-F334 HydrophobicContact CB-CE1 3.32Å; N269-F334 HydrophobicContact CB-CE2 4.27Å; N269-F334 HydrophobicContact CB-CZ 3.56Å; N269-F334 PolarHBondContact ND2-O 3.4Å; V272-F334 HydrophobicContact CB-CE1 4.08Å; V272-F334 HydrophobicContact CG2-CE1 3.57Å; V272-F334 HydrophobicContact CG2-CZ 3.84Å; T330-F334 VanDerWaalsContact O-CB 3.31Å; T330-F334 WeakPolarHBondContact O-CB 3.36Å; T330-F334 PolarHBondContact O-N 3.29Å; L331-F334 PolarHBondContact O-N 3.15Å; K332-F334 PolarHBondContact O-N 2.92Å
335F88.1Confident87.9Confident11 Ų1161.5 Ų61.55%0.04832%0.319CS..Hα-helixtrans-95.6-17.4-176.9-67.7-67000114.5L213 C267 N269 V272 L273 Y319 L331 K332L213-F335 HydrophobicContact CD2-CZ 4.27Å; C267-F335 WeakPolarHBondContact CB-O 3.44Å; N269-F335 HydrophobicContact CB-CD1 4.28Å; N269-F335 HydrophobicContact CB-CE1 4.4Å; N269-F335 VanDerWaalsContact O-CE1 3.32Å; N269-F335 WeakPolarHBondContact O-CE1 3.29Å; V272-F335 HydrophobicContact CB-CE1 4.09Å; V272-F335 HydrophobicContact CB-CZ 3.99Å; V272-F335 HydrophobicContact CG1-CZ 3.93Å; L273-F335 HydrophobicContact CD1-CD1 4.13Å; L273-F335 HydrophobicContact CD1-CE1 3.97Å; L273-F335 HydrophobicContact CD2-CE1 4.14Å; L273-F335 HydrophobicContact CD2-CZ 4.02Å; L273-F335 HydrophobicContact CG-CD1 4.32Å; L273-F335 HydrophobicContact CG-CE1 3.67Å; L273-F335 HydrophobicContact CG-CZ 4.02Å; Y319-F335 HydrophobicContact CE2-CB 4.39Å; L331-F335 HydrophobicContact CD2-CE2 4.09Å; L331-F335 VanDerWaalsContact O-CD2 3.27Å; L331-F335 WeakPolarHBondContact O-CD2 3.37Å; L331-F335 PolarHBondContact O-N 3.26Å; K332-F335 PolarHBondContact O-N 3.29Å
336L71.4Confident88Confident67 Ų6757.5 Ų57.535%0.35131%0.306SS..  trans-124.10-167.7-49.5170.8000112.3L4 Y319 I323 K332L4-L336 HydrophobicContact CD1-CD1 4.14Å; L4-L336 HydrophobicContact CD2-CD1 3.28Å; L4-L336 HydrophobicContact CD2-CD2 4.39Å; L4-L336 HydrophobicContact CD2-CG 4.46Å; L4-L336 HydrophobicContact CG-CD1 3.43Å; L4-L336 VanDerWaalsContact CG-CD1 3.43Å; Y319-L336 HydrophobicContact CE2-CD2 4.13Å; Y319-L336 VanDerWaalsContact OH-CD2 3.27Å; Y319-L336 WeakPolarHBondContact OH-CD2 3.41Å; I323-L336 HydrophobicContact CG2-CD2 4.19Å; K332-L336 HydrophobicContact CB-CD1 4.13Å; K332-L336 HydrophobicContact CG-CD1 4.3Å; K332-L336 WeakPolarHBondContact O-CB 3.5Å; K332-L336 WeakPolarHBondContact O-CG 3.19Å; K332-L336 PolarHBondContact O-N 3.03Å

Retrieved 336 of 336 residues in 1251.5 ms (Link to these results)

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