A0A087WQB0_MOUSE Loading...

Mortality factor 4-like protein 1

AlphaFold DB , UniProt , Accession A0A087WQB0, Species MOUSE (Mus musculus, Mouse), Gene Morf4l1, Length 296 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
1M46.2Very low71.2Confident241 Ų241124.5 Ų124.5100%1.18764%0.643SS**  01180-75.1166.771.100107.7
2A47.8Very low73.1Confident90 Ų90126.4 Ų126.474%0.74465%0.647SS**  trans-65.5137.9175.800000109.8K4A2-K4 PolarHBondContact O-N 3.18Å
3P53.7Low74.8Confident121 Ų121125.8 Ų125.879%0.78664%0.64SS**  trans-63.8123.5176.224.6-30000109.1Q5P3-Q5 PolarHBondContact O-N 3.11Å; P3-Q5 VanDerWaalsContact O-N 3.1Å
4K59.8Low76Confident193 Ų193119.8 Ų119.884%0.83963%0.625SS**  trans-65109.4173.1-75.1-178.6176.5178.20107.6A2A2-K4 PolarHBondContact O-N 3.18Å
5Q65.5Low77.4Confident187 Ų187115.5 Ų115.587%0.87460%0.601SS**PPolyproline II helixtrans-60.1140.1178.1-76.8178.6-6.200111P3P3-Q5 PolarHBondContact O-N 3.11Å; P3-Q5 VanDerWaalsContact O-N 3.1Å
6D71Confident78.6Confident118 Ų118116 Ų11663%0.63159%0.592SS**PPolyproline II helixtrans-63.2146.6171.5-73.8-46.7000110.9K8D6-K8 PolarHBondContact O-N 2.95Å
7P78.5Confident79.7Confident46 Ų46109.2 Ų109.230%0.29956%0.557SS.*PPolyproline II helixtrans-63.8124-177.625.8-34000110.8I35 K38 V40P7-I35 HydrophobicContact CG-CG2 4.14Å; P7-I35 WeakPolarHBondContact O-CD1 3.46Å; P7-K38 HydrophobicContact CG-CB 4.48Å; P7-K38 WeakPolarHBondContact CG-O 3.26Å; P7-V40 HydrophobicContact CB-CG2 4.02Å; P7-V40 HydrophobicContact CG-CG2 4.18Å
8K85.4Confident80.5Confident185 Ų185103.1 Ų103.180%0.80453%0.526SS*.PPolyproline II helixtrans-78.7127.2178.8-170.8175.7-178177.30110.5D6 K10D6-K8 PolarHBondContact O-N 2.95Å; K8-K10 PolarHBondContact O-N 3.1Å
9P88.6Confident81.3Confident44 Ų4497.7 Ų97.729%0.28650%0.499SS..PPolyproline II helixtrans-60.6134.7175-22.933.5000112.4V33 I35 V40 Y42P9-V33 HydrophobicContact CB-CG1 3.73Å; P9-V33 HydrophobicContact CG-CG1 3.69Å; P9-I35 HydrophobicContact CG-CD1 3.94Å; P9-I35 HydrophobicContact CG-CG1 4.28Å; P9-V40 HydrophobicContact CB-CG1 3.87Å; P9-V40 HydrophobicContact CG-CG1 4.02Å; P9-Y42 WeakPolarHBondContact CA-OH 3.42Å; P9-Y42 HydrophobicContact CB-CE1 4.24Å
10K91.4Very high81.7Confident134 Ų13494.9 Ų94.958%0.58348%0.483SS*.SBendtrans-75.7-24.1174.2-73.4-178.4-175.2140.10114.5K8 Y42 E59K8-K10 PolarHBondContact O-N 3.1Å; K10-Y42 PolarHBondContact N-OH 2.86Å; K10-E59 WeakPolarHBondContact CB-OE1 3.45Å; K10-E59 VanDerWaalsContact CD-CD 3.46Å; K10-E59 HydrophobicContact CD-CG 4.09Å; K10-E59 WeakPolarHBondContact CD-OE2 3.37Å; K10-E59 WeakPolarHBondContact CE-OE2 3.3Å; K10-E59 VanDerWaalsContact CG-OE1 3.3Å; K10-E59 WeakPolarHBondContact CG-OE1 3.2Å; K10-E59 PolarHBondContact N-OE1 2.97Å; K10-E59 IonicContact NZ-OE2 3.42Å; K10-E59 PolarHBondContact NZ-OE2 3.24Å
11F94.9Very high81.8Confident10 Ų1091.7 Ų91.74%0.04447%0.466CS..SBendtrans-125.7154.9-176.7-51.4-81.5000111.2E15 V17 Y42 V62 K64F11-E15 VanDerWaalsContact CA-OE2 3.29Å; F11-E15 WeakPolarHBondContact CA-OE2 3.4Å; F11-V17 HydrophobicContact CB-CG1 4.45Å; F11-V17 HydrophobicContact CD1-CG1 3.62Å; F11-V17 HydrophobicContact CE1-CG1 4.11Å; F11-V17 HydrophobicContact CG-CG1 4.18Å; F11-Y42 HydrophobicContact CB-CD1 4.14Å; F11-Y42 HydrophobicContact CB-CE1 3.7Å; F11-Y42 HydrophobicContact CD2-CD2 4.44Å; F11-Y42 HydrophobicContact CD2-CE1 4.03Å; F11-Y42 AromaticContact CD2-CE2 3.9Å; F11-Y42 HydrophobicContact CD2-CE2 3.9Å; F11-Y42 AromaticContact CD2-CZ 3.66Å; F11-Y42 HydrophobicContact CG-CE1 4.38Å; F11-Y42 PolarHBondContact N-OH 3.36Å; F11-V62 HydrophobicContact CD1-CG1 4.26Å; F11-V62 HydrophobicContact CD2-CB 3.99Å; F11-V62 HydrophobicContact CD2-CG1 3.72Å; F11-V62 HydrophobicContact CE1-CG1 4.12Å; F11-V62 HydrophobicContact CE2-CB 3.62Å; F11-V62 HydrophobicContact CE2-CG1 3.61Å; F11-V62 WeakPolarHBondContact CE2-O 3.48Å; F11-V62 HydrophobicContact CG-CG1 4.06Å; F11-V62 HydrophobicContact CZ-CB 4.12Å; F11-V62 HydrophobicContact CZ-CG1 3.82Å; F11-V62 VanDerWaalsContact CZ-O 3.26Å; F11-V62 WeakPolarHBondContact CZ-O 3.33Å; F11-K64 HydrophobicContact CD1-CG 4.33Å; F11-K64 HydrophobicContact CE1-CB 4.32Å; F11-K64 HydrophobicContact CE1-CG 3.56Å; F11-K64 HydrophobicContact CZ-CG 4.38Å
12Q94.1Very high83.4Confident148 Ų14881.3 Ų81.369%0.69242%0.421SS*.  trans-110.7158.1-179-61.7-178.312.900112.6G14 E15 C30Q12-G14 PolarHBondContact O-N 2.99Å; Q12-E15 PolarHBondContact N-OE2 3.29Å; Q12-E15 WeakPolarHBondContact O-CB 3.47Å; Q12-E15 PolarHBondContact O-N 3.35Å; Q12-E15 VanDerWaalsContact O-N 3.12Å; Q12-C30 VanDerWaalsContact O-CB 3.3Å; Q12-C30 WeakPolarHBondContact O-CB 3.39Å; Q12-C30 PolarHBondContact O-SG 2.86Å
13E95.3Very high85.1Confident119 Ų11981 Ų8156%0.55641%0.412SS*.THydrogen-bonded Turntrans-61.1135.1170.5-58.4-167167.500110.1E15 K32 V33E13-E15 VanDerWaalsContact C-N 3.31Å; E13-K32 VanDerWaalsContact OE1-CA 3.24Å; E13-K32 WeakPolarHBondContact OE1-CA 3.43Å; E13-V33 HydrophobicContact CG-CB 4.41Å; E13-V33 HydrophobicContact CG-CG2 3.85Å; E13-V33 PolarHBondContact OE1-N 2.94Å
14G92.3Very high86.8Confident41 Ų4176.2 Ų76.242%0.42338%0.379SS..THydrogen-bonded Turntrans88.4-15.8-173.300000115Q12 K29 C30Q12-G14 PolarHBondContact O-N 2.99Å; G14-K29 WeakPolarHBondContact O-CE 3.33Å; G14-C30 WeakPolarHBondContact CA-O 3.42Å; G14-C30 PolarHBondContact N-O 3.32Å
15E96.3Very high88.3Confident56 Ų5667 Ų6726%0.26234%0.339SS..  trans-68135.9-174.2-169.2175.816300112F11 Q12 E13 V17 C30F11-E15 VanDerWaalsContact CA-OE2 3.29Å; F11-E15 WeakPolarHBondContact CA-OE2 3.4Å; Q12-E15 PolarHBondContact N-OE2 3.29Å; Q12-E15 WeakPolarHBondContact O-CB 3.47Å; Q12-E15 PolarHBondContact O-N 3.35Å; Q12-E15 VanDerWaalsContact O-N 3.12Å; E13-E15 VanDerWaalsContact C-N 3.31Å; E15-V17 HydrophobicContact CB-CG1 4.39Å; E15-V17 HydrophobicContact CG-CG1 4.11Å; E15-C30 PolarHBondContact O-N 3.07Å
16R96.8Very high89.6Confident123 Ų12361 Ų6146%0.46431%0.309SS..EExtended strand (participates in β ladder)trans-78.2125.1171.4-170.1-177.7-174.2-160.92109E27 Y65R16-E27 IonicContact CZ-OE1 3.01Å; R16-E27 IonicContact CZ-OE2 3.56Å; R16-E27 VanDerWaalsContact NE-CD 3.3Å; R16-E27 IonicContact NE-OE1 2.71Å; R16-E27 PolarHBondContact NE-OE1 3.45Å; R16-E27 IonicContact NE-OE2 2.76Å; R16-E27 IonicContact NH2-OE1 3.63Å; R16-E27 PolarHBondContact NH2-OE1 2.97Å; R16-E27 IonicContact NH2-OE2 3.27Å; R16-E27 PolarHBondContact NH2-OE2 2.8Å; R16-Y65 HydrophobicContact CG-CD2 4.03Å; R16-Y65 HydrophobicContact CG-CE2 4.5Å; R16-Y65 HydrophobicContact CG-CG 4.22Å; R16-Y65 PolarHBondContact NH2-OH 2.87Å; R16-Y65 WeakPolarHBondContact O-CB 3.39Å
17V97.4Very high90.7Very high0 Ų058.2 Ų58.20%029%0.292CS..EExtended strand (participates in β ladder)trans-134.9169-173.2-63.80000110.3F11 E15 A28 I44 V62F11-V17 HydrophobicContact CB-CG1 4.45Å; F11-V17 HydrophobicContact CD1-CG1 3.62Å; F11-V17 HydrophobicContact CE1-CG1 4.11Å; F11-V17 HydrophobicContact CG-CG1 4.18Å; E15-V17 HydrophobicContact CB-CG1 4.39Å; E15-V17 HydrophobicContact CG-CG1 4.11Å; V17-A28 HydrophobicContact CG2-CB 4.26Å; V17-A28 PolarHBondContact N-O 2.9Å; V17-A28 PolarHBondContact O-N 2.75Å; V17-I44 HydrophobicContact CG2-CD1 4.19Å; V17-V62 HydrophobicContact CB-CG1 3.68Å; V17-V62 HydrophobicContact CG1-CG1 3.91Å; V17-V62 HydrophobicContact CG2-CG1 3.76Å
18L94.6Very high91.6Very high0 Ų056.1 Ų56.10%028%0.278CS..EExtended strand (participates in β ladder)trans-107.5124.6165.1-65.3162.4000107.8L25 Y26 E27 L63 Y65 N69 L70L18-L25 HydrophobicContact CB-CD2 3.38Å; L18-L25 HydrophobicContact CB-CG 3.87Å; L18-L25 HydrophobicContact CD1-CD2 3.7Å; L18-L25 HydrophobicContact CD2-CD2 4.32Å; L18-L25 HydrophobicContact CG-CD2 3.97Å; L18-Y26 CarbonylContact C-O 3.5Å; L18-Y26 VanDerWaalsContact CA-O 3.29Å; L18-Y26 WeakPolarHBondContact CA-O 3.18Å; L18-E27 HydrophobicContact CD2-CB 4.49Å; L18-L63 HydrophobicContact CB-CB 4.33Å; L18-L63 PolarHBondContact N-O 3.24Å; L18-L63 PolarHBondContact O-N 3Å; L18-Y65 HydrophobicContact CD1-CD2 4.39Å; L18-Y65 HydrophobicContact CD2-CD2 3.87Å; L18-Y65 HydrophobicContact CD2-CE2 3.98Å; L18-Y65 HydrophobicContact CG-CD2 3.83Å; L18-Y65 HydrophobicContact CG-CE2 4.42Å; L18-N69 HydrophobicContact CD1-CB 3.6Å; L18-L70 HydrophobicContact CD1-CD2 4.08Å; L18-L70 HydrophobicContact CD1-CG 4.16Å; L18-L70 HydrophobicContact CD2-CD2 4.16Å
19C95.1Very high92.1Very high0 Ų052.4 Ų52.40%026%0.262CS..EExtended strand (participates in β ladder)trans-116.9133.5-179.1-1730000110H21 Y26 A28 I44 Y46 R61C19-H21 PolarHBondContact O-N 3.48Å; C19-Y26 PolarHBondContact N-O 2.88Å; C19-Y26 PolarHBondContact O-N 3.33Å; C19-A28 HydrophobicContact CB-CB 3.96Å; C19-I44 HydrophobicContact CB-CG2 3.84Å; C19-Y46 HydrophobicContact CB-CD1 4.45Å; C19-Y46 HydrophobicContact CB-CE1 3.72Å; C19-Y46 PolarHBondContact SG-OH 2.83Å; C19-R61 CarbonylContact C-O 3.59Å; C19-R61 WeakPolarHBondContact CA-O 3.47Å
20F89.8Confident92.5Very high41 Ų4150.3 Ų50.318%0.1825%0.249CC..EExtended strand (participates in β ladder)trans-65.5128.9170-82.1-78.3000109.9L24 L25 Y46 R61 L63 L76F20-L24 WeakPolarHBondContact CA-O 3.29Å; F20-L25 HydrophobicContact CD1-CD1 3.53Å; F20-L25 HydrophobicContact CD2-CD1 3.55Å; F20-L25 HydrophobicContact CE1-CD1 3.29Å; F20-L25 HydrophobicContact CE2-CD1 3.33Å; F20-L25 HydrophobicContact CG-CD1 3.66Å; F20-L25 HydrophobicContact CZ-CD1 3.19Å; F20-Y46 PolarHBondContact O-OH 3.41Å; F20-R61 HydrophobicContact CB-CB 4.4Å; F20-R61 HydrophobicContact CB-CG 4.38Å; F20-R61 PolarHBondContact N-O 3.33Å; F20-R61 VanDerWaalsContact O-CZ 3.28Å; F20-R61 PolarHBondContact O-NE 2.96Å; F20-R61 PolarHBondContact O-NH2 2.89Å; F20-L63 HydrophobicContact CE2-CD1 3.86Å; F20-L63 HydrophobicContact CE2-CG 4.24Å; F20-L63 HydrophobicContact CZ-CD1 4.41Å; F20-L76 HydrophobicContact CE1-CD1 3.83Å; F20-L76 HydrophobicContact CZ-CD1 4.38Å
21H83.6Confident92.8Very high28 Ų2846.5 Ų46.513%0.1324%0.236CC..EExtended strand (participates in β ladder)trans-130.6110.5163.4-17390.9000107.6C19 L24 Y26 Y46 W49 E55C19-H21 PolarHBondContact O-N 3.48Å; H21-L24 PolarHBondContact N-O 3.12Å; H21-L24 PolarHBondContact O-N 3.46Å; H21-Y26 HydrophobicContact CB-CD2 3.62Å; H21-Y26 HydrophobicContact CB-CE2 3.82Å; H21-Y26 WeakPolarHBondContact O-CE2 3.39Å; H21-Y46 HydrophobicContact CB-CE1 3.82Å; H21-Y46 AromaticContact ND1-CZ 3.89Å; H21-W49 HydrophobicContact CB-CH2 4.28Å; H21-W49 AromaticContact CD2-CH2 3.32Å; H21-W49 WeakPolarHBondContact CD2-CH2 3.3Å; H21-W49 AromaticContact CD2-CZ3 3.62Å; H21-W49 AromaticContact CE1-CZ3 3.75Å; H21-W49 AromaticContact CG-CH2 3.73Å; H21-W49 AromaticContact CG-CZ3 3.86Å; H21-W49 AromaticContact ND1-CZ3 3.95Å; H21-W49 AromaticContact NE2-CH2 3.72Å; H21-W49 AromaticContact NE2-CZ3 3.56Å; H21-E55 IonicContact ND1-OE1 3.75Å
22G80.5Confident92.8Very high24 Ų2451.4 Ų51.425%0.24726%0.258CS..THydrogen-bonded Turntrans59-141-163.200000111.8L24G22-L24 VanDerWaalsContact C-N 3.25Å; G22-L24 PolarHBondContact O-N 3.23Å
23P83.7Confident92.9Very high84 Ų8446 Ų4655%0.54524%0.235SC..THydrogen-bonded Turntrans-80.3-4.8-177.133.2-35.3000113.6
24L88.3Confident92.8Very high20 Ų2042 Ų4211%0.10522%0.222CC..EExtended strand (participates in β ladder)trans-107.5150.7-174-64-175.7000111.2F20 H21 G22 Y26 L76 Q77 N80F20-L24 WeakPolarHBondContact CA-O 3.29Å; H21-L24 PolarHBondContact N-O 3.12Å; H21-L24 PolarHBondContact O-N 3.46Å; G22-L24 VanDerWaalsContact C-N 3.25Å; G22-L24 PolarHBondContact O-N 3.23Å; L24-Y26 HydrophobicContact CB-CD2 4.34Å; L24-Y26 HydrophobicContact CB-CE2 3.6Å; L24-L76 HydrophobicContact CD2-CB 3.93Å; L24-L76 WeakPolarHBondContact CD2-O 3.37Å; L24-Q77 HydrophobicContact CD2-CG 4.28Å; L24-N80 HydrophobicContact CD2-CB 4.1Å
25L91.5Very high92.7Very high0 Ų044 Ų440%022%0.223CC..EExtended strand (participates in β ladder)trans-88.7133.8169.4-127.578.1000108.9L18 F20 L63 N69 Q73 L76L18-L25 HydrophobicContact CB-CD2 3.38Å; L18-L25 HydrophobicContact CB-CG 3.87Å; L18-L25 HydrophobicContact CD1-CD2 3.7Å; L18-L25 HydrophobicContact CD2-CD2 4.32Å; L18-L25 HydrophobicContact CG-CD2 3.97Å; F20-L25 HydrophobicContact CD1-CD1 3.53Å; F20-L25 HydrophobicContact CD2-CD1 3.55Å; F20-L25 HydrophobicContact CE1-CD1 3.29Å; F20-L25 HydrophobicContact CE2-CD1 3.33Å; F20-L25 HydrophobicContact CG-CD1 3.66Å; F20-L25 HydrophobicContact CZ-CD1 3.19Å; L25-L63 HydrophobicContact CD1-CD1 3.9Å; L25-L63 HydrophobicContact CD2-CD1 4.05Å; L25-N69 HydrophobicContact CD2-CB 4.49Å; L25-Q73 HydrophobicContact CB-CB 3.75Å; L25-Q73 HydrophobicContact CB-CG 3.84Å; L25-Q73 HydrophobicContact CD2-CB 4.12Å; L25-Q73 WeakPolarHBondContact O-CG 3.48Å; L25-Q73 PolarHBondContact O-NE2 3.49Å; L25-L76 HydrophobicContact CD1-CD1 4.48Å
26Y91.9Very high92Very high60 Ų6048.1 Ų48.124%0.23524%0.239CC..EExtended strand (participates in β ladder)trans-121.5150.3172.8-65.7-88.9000110.2L18 C19 H21 L24 W49L18-Y26 CarbonylContact C-O 3.5Å; L18-Y26 VanDerWaalsContact CA-O 3.29Å; L18-Y26 WeakPolarHBondContact CA-O 3.18Å; C19-Y26 PolarHBondContact N-O 2.88Å; C19-Y26 PolarHBondContact O-N 3.33Å; H21-Y26 HydrophobicContact CB-CD2 3.62Å; H21-Y26 HydrophobicContact CB-CE2 3.82Å; H21-Y26 WeakPolarHBondContact O-CE2 3.39Å; L24-Y26 HydrophobicContact CB-CD2 4.34Å; L24-Y26 HydrophobicContact CB-CE2 3.6Å; Y26-W49 AromaticContact CD1-CZ2 3.71Å; Y26-W49 HydrophobicContact CD1-CZ2 3.71Å; Y26-W49 HydrophobicContact CD2-CZ2 4.21Å; Y26-W49 AromaticContact CE1-CZ2 3.6Å; Y26-W49 HydrophobicContact CE1-CZ2 3.6Å; Y26-W49 HydrophobicContact CE2-CH2 4.32Å; Y26-W49 HydrophobicContact CE2-CZ2 4.09Å; Y26-W49 HydrophobicContact CG-CZ2 4Å; Y26-W49 AromaticContact CZ-CZ2 3.78Å
27E94.4Very high91.4Very high60 Ų6048.8 Ų48.828%0.2825%0.252SS..EExtended strand (participates in β ladder)trans-69.5135.5169-172.5178.314400109.9R16 L18 S47 Y65R16-E27 IonicContact CZ-OE1 3.01Å; R16-E27 IonicContact CZ-OE2 3.56Å; R16-E27 VanDerWaalsContact NE-CD 3.3Å; R16-E27 IonicContact NE-OE1 2.71Å; R16-E27 PolarHBondContact NE-OE1 3.45Å; R16-E27 IonicContact NE-OE2 2.76Å; R16-E27 IonicContact NH2-OE1 3.63Å; R16-E27 PolarHBondContact NH2-OE1 2.97Å; R16-E27 IonicContact NH2-OE2 3.27Å; R16-E27 PolarHBondContact NH2-OE2 2.8Å; L18-E27 HydrophobicContact CD2-CB 4.49Å; E27-S47 WeakPolarHBondContact O-CB 3.44Å; E27-S47 PolarHBondContact O-N 2.88Å; E27-Y65 HydrophobicContact CG-CD2 4.34Å; E27-Y65 HydrophobicContact CG-CE2 3.84Å; E27-Y65 PolarHBondContact OE2-OH 3.19Å
28A97.4Very high90.8Very high1 Ų156.1 Ų56.11%0.00828%0.284CS..EExtended strand (participates in β ladder)trans-150.8171.2-177.700000111.8V17 C19 I44 H45 Y46V17-A28 HydrophobicContact CG2-CB 4.26Å; V17-A28 PolarHBondContact N-O 2.9Å; V17-A28 PolarHBondContact O-N 2.75Å; C19-A28 HydrophobicContact CB-CB 3.96Å; A28-I44 HydrophobicContact CB-CG2 3.42Å; A28-I44 VanDerWaalsContact CB-CG2 3.42Å; A28-H45 CarbonylContact C-O 3.58Å; A28-H45 VanDerWaalsContact CA-O 3.25Å; A28-H45 WeakPolarHBondContact CA-O 3.46Å; A28-H45 WeakPolarHBondContact CB-O 3.47Å; A28-Y46 HydrophobicContact CB-CD1 4.01Å
29K96.9Very high90.3Very high107 Ų10761.8 Ų61.847%0.46531%0.311SS..EExtended strand (participates in β ladder)trans-117.9130.3173.4-172.1173.6-179176.40109.3G14 V31 H45G14-K29 WeakPolarHBondContact O-CE 3.33Å; K29-V31 PolarHBondContact O-N 3.26Å; K29-H45 PolarHBondContact N-O 2.74Å; K29-H45 PolarHBondContact O-N 2.71Å
30C96.9Very high90.2Very high0 Ų062.4 Ų62.40%031%0.314CS..EExtended strand (participates in β ladder)trans-71.2112.4166.5177.40000108.1Q12 G14 E15 I44Q12-C30 VanDerWaalsContact O-CB 3.3Å; Q12-C30 WeakPolarHBondContact O-CB 3.39Å; Q12-C30 PolarHBondContact O-SG 2.86Å; G14-C30 WeakPolarHBondContact CA-O 3.42Å; G14-C30 PolarHBondContact N-O 3.32Å; E15-C30 PolarHBondContact O-N 3.07Å; C30-I44 HydrophobicContact CB-CD1 4.28Å
31V96.3Very high90.4Very high54 Ų5464.5 Ų64.533%0.32732%0.323SS..EExtended strand (participates in β ladder)trans-93.5-41.7-176.8-177.50000111K29 F43 H45K29-V31 PolarHBondContact O-N 3.26Å; V31-F43 HydrophobicContact CB-CD1 3.95Å; V31-F43 WeakPolarHBondContact CB-O 3.41Å; V31-F43 HydrophobicContact CG1-CD1 4.13Å; V31-F43 PolarHBondContact N-O 3.39Å; V31-H45 HydrophobicContact CG2-CB 3.54Å
32K95.8Very high90.9Very high113 Ų11363.1 Ų63.149%0.49132%0.317SS..EExtended strand (participates in β ladder)trans-139.1152.9177.4-60.5-175.7176.3179.40112.5E13 Y42 F43 W56E13-K32 VanDerWaalsContact OE1-CA 3.24Å; E13-K32 WeakPolarHBondContact OE1-CA 3.43Å; K32-Y42 CarbonylContact O-C 3.48Å; K32-Y42 WeakPolarHBondContact O-CA 3.32Å; K32-F43 HydrophobicContact CB-CB 3.74Å; K32-F43 HydrophobicContact CG-CB 4.41Å; K32-F43 PolarHBondContact N-O 2.95Å; K32-F43 PolarHBondContact O-N 2.93Å; K32-W56 HydrophobicContact CB-CH2 3.63Å; K32-W56 HydrophobicContact CB-CZ2 4.2Å; K32-W56 HydrophobicContact CB-CZ3 4.35Å; K32-W56 HydrophobicContact CD-CZ2 4.46Å
33V96.1Very high91.7Very high36 Ų3664.2 Ų64.222%0.21832%0.315CS..EExtended strand (participates in β ladder)trans-118.7132.2172.2-173.80000109.6P9 E13 V40 Y42P9-V33 HydrophobicContact CB-CG1 3.73Å; P9-V33 HydrophobicContact CG-CG1 3.69Å; E13-V33 HydrophobicContact CG-CB 4.41Å; E13-V33 HydrophobicContact CG-CG2 3.85Å; E13-V33 PolarHBondContact OE1-N 2.94Å; V33-V40 HydrophobicContact CG1-CG1 4.08Å; V33-Y42 HydrophobicContact CB-CD1 4.49Å; V33-Y42 HydrophobicContact CG1-CD1 4.24Å; V33-Y42 HydrophobicContact CG1-CE1 3.93Å; V33-Y42 HydrophobicContact CG2-CD1 3.88Å; V33-Y42 HydrophobicContact CG2-CE1 3.98Å
34A92.7Very high92.4Very high35 Ų3560.2 Ų60.229%0.28929%0.289SS..EExtended strand (participates in β ladder)trans-133.2138.5174.900000110.9K41 W56A34-K41 PolarHBondContact N-O 3.17Å; A34-K41 PolarHBondContact O-N 3.19Å; A34-W56 HydrophobicContact CB-CE3 4.33Å; A34-W56 HydrophobicContact CB-CH2 3.52Å; A34-W56 HydrophobicContact CB-CZ2 4.43Å; A34-W56 HydrophobicContact CB-CZ3 3.47Å; A34-W56 VanDerWaalsContact CB-CZ3 3.47Å
35I90.9Very high92.8Very high83 Ų8361.7 Ų61.743%0.42630%0.295SS..EExtended strand (participates in β ladder)trans-112.2112.5171.5-52.3175.7000106.8P7 P9 Q39 V40P7-I35 HydrophobicContact CG-CG2 4.14Å; P7-I35 WeakPolarHBondContact O-CD1 3.46Å; P9-I35 HydrophobicContact CG-CD1 3.94Å; P9-I35 HydrophobicContact CG-CG1 4.28Å; I35-Q39 WeakPolarHBondContact CA-O 3.4Å; I35-V40 HydrophobicContact CG1-CG2 4.29Å
36K82.6Confident92.8Very high141 Ų14161.7 Ų61.761%0.61330%0.295SS*.EExtended strand (participates in β ladder)trans-131.7134.1177.8-165.8-177.5175.8179.20108.9K38 Q39K36-K38 PolarHBondContact O-N 3.45Å; K36-Q39 PolarHBondContact N-O 3.36Å; K36-Q39 WeakPolarHBondContact O-CB 3.47Å; K36-Q39 PolarHBondContact O-N 3.35Å
37D83.5Confident92.8Very high137 Ų13761.4 Ų61.473%0.73330%0.302SS*.THydrogen-bonded Turntrans53.936.9179.7-51.5-45.1000113.5Q39D37-Q39 PolarHBondContact O-N 3.13Å
38K83.9Confident92.3Very high154 Ų15462.6 Ų62.667%0.6733%0.331SS*.THydrogen-bonded Turntrans58.625.7-173.7-54.7177.6178.7176.60114P7 K36P7-K38 HydrophobicContact CG-CB 4.48Å; P7-K38 WeakPolarHBondContact CG-O 3.26Å; K36-K38 PolarHBondContact O-N 3.45Å
39Q85.3Confident91.6Very high120 Ų12065.8 Ų65.856%0.56134%0.343SS*.EExtended strand (participates in β ladder)trans-116.7130.4170.1-66.2-174.6-18.200110.1I35 K36 D37I35-Q39 WeakPolarHBondContact CA-O 3.4Å; K36-Q39 PolarHBondContact N-O 3.36Å; K36-Q39 WeakPolarHBondContact O-CB 3.47Å; K36-Q39 PolarHBondContact O-N 3.35Å; D37-Q39 PolarHBondContact O-N 3.13Å
40V91.4Very high90.9Very high13 Ų1365.6 Ų65.68%0.07935%0.347CS..EExtended strand (participates in β ladder)trans-84.4128.2173.3-169.10000109.1P7 P9 V33 I35 Y42 E59P7-V40 HydrophobicContact CB-CG2 4.02Å; P7-V40 HydrophobicContact CG-CG2 4.18Å; P9-V40 HydrophobicContact CB-CG1 3.87Å; P9-V40 HydrophobicContact CG-CG1 4.02Å; V33-V40 HydrophobicContact CG1-CG1 4.08Å; I35-V40 HydrophobicContact CG1-CG2 4.29Å; V40-Y42 HydrophobicContact CB-CE2 4.49Å; V40-Y42 HydrophobicContact CG1-CE1 4.02Å; V40-Y42 HydrophobicContact CG1-CE2 3.8Å; V40-Y42 VanDerWaalsContact CG1-CZ 3.47Å; V40-Y42 WeakPolarHBondContact CG1-OH 3.44Å; V40-E59 PolarHBondContact O-N 2.74Å
41K94.2Very high90.4Very high84 Ų8473.3 Ų73.337%0.36538%0.38SS..EExtended strand (participates in β ladder)trans-123.8148.8173.2-65-174.1179.7-179.20110A34 W56 V57A34-K41 PolarHBondContact N-O 3.17Å; A34-K41 PolarHBondContact O-N 3.19Å; K41-W56 HydrophobicContact CB-CE3 3.91Å; K41-W56 HydrophobicContact CB-CZ3 4.47Å; K41-V57 CarbonylContact C-O 3.5Å; K41-V57 VanDerWaalsContact CA-O 3.29Å; K41-V57 WeakPolarHBondContact CA-O 3.35Å
42Y95.9Very high89.8Confident0 Ų075.9 Ų75.90%039%0.392CS..EExtended strand (participates in β ladder)trans-120.6131.9-179.9-57.9-81.5000109P9 K10 F11 K32 V33 V40 W56 V57 E59 V62P9-Y42 WeakPolarHBondContact CA-OH 3.42Å; P9-Y42 HydrophobicContact CB-CE1 4.24Å; K10-Y42 PolarHBondContact N-OH 2.86Å; F11-Y42 HydrophobicContact CB-CD1 4.14Å; F11-Y42 HydrophobicContact CB-CE1 3.7Å; F11-Y42 HydrophobicContact CD2-CD2 4.44Å; F11-Y42 HydrophobicContact CD2-CE1 4.03Å; F11-Y42 AromaticContact CD2-CE2 3.9Å; F11-Y42 HydrophobicContact CD2-CE2 3.9Å; F11-Y42 AromaticContact CD2-CZ 3.66Å; F11-Y42 HydrophobicContact CG-CE1 4.38Å; F11-Y42 PolarHBondContact N-OH 3.36Å; K32-Y42 CarbonylContact O-C 3.48Å; K32-Y42 WeakPolarHBondContact O-CA 3.32Å; V33-Y42 HydrophobicContact CB-CD1 4.49Å; V33-Y42 HydrophobicContact CG1-CD1 4.24Å; V33-Y42 HydrophobicContact CG1-CE1 3.93Å; V33-Y42 HydrophobicContact CG2-CD1 3.88Å; V33-Y42 HydrophobicContact CG2-CE1 3.98Å; V40-Y42 HydrophobicContact CB-CE2 4.49Å; V40-Y42 HydrophobicContact CG1-CE1 4.02Å; V40-Y42 HydrophobicContact CG1-CE2 3.8Å; V40-Y42 VanDerWaalsContact CG1-CZ 3.47Å; V40-Y42 WeakPolarHBondContact CG1-OH 3.44Å; Y42-W56 VanDerWaalsContact C-CE3 3.48Å; Y42-W56 CarbonylContact O-C 3.6Å; Y42-W56 WeakPolarHBondContact O-CA 3.48Å; Y42-V57 PolarHBondContact N-O 3Å; Y42-V57 PolarHBondContact O-N 3.5Å; Y42-E59 HydrophobicContact CD2-CB 4.46Å; Y42-E59 HydrophobicContact CE2-CB 3.71Å; Y42-E59 HydrophobicContact CE2-CG 3.8Å; Y42-E59 PolarHBondContact OH-OE1 3.48Å; Y42-V62 HydrophobicContact CD2-CG2 4Å; Y42-V62 HydrophobicContact CG-CG2 4.36Å
43F96.6Very high89.2Confident46 Ų4676.7 Ų76.720%0.20239%0.392CS..EExtended strand (participates in β ladder)trans-85.9114.5169.7-166.5-115.5000107.8V31 K32 D54 E55 W56V31-F43 HydrophobicContact CB-CD1 3.95Å; V31-F43 WeakPolarHBondContact CB-O 3.41Å; V31-F43 HydrophobicContact CG1-CD1 4.13Å; V31-F43 PolarHBondContact N-O 3.39Å; K32-F43 HydrophobicContact CB-CB 3.74Å; K32-F43 HydrophobicContact CG-CB 4.41Å; K32-F43 PolarHBondContact N-O 2.95Å; K32-F43 PolarHBondContact O-N 2.93Å; F43-D54 HydrophobicContact CE1-CB 3.77Å; F43-D54 HydrophobicContact CE2-CB 4.11Å; F43-D54 HydrophobicContact CZ-CB 3.41Å; F43-D54 VanDerWaalsContact CZ-CB 3.41Å; F43-E55 WeakPolarHBondContact CA-O 3.24Å; F43-W56 HydrophobicContact CB-CD2 3.87Å; F43-W56 HydrophobicContact CB-CE3 3.84Å; F43-W56 HydrophobicContact CB-CH2 3.88Å; F43-W56 HydrophobicContact CB-CZ2 3.9Å; F43-W56 HydrophobicContact CB-CZ3 3.84Å; F43-W56 AromaticContact CD2-CD1 3.6Å; F43-W56 AromaticContact CD2-CD2 3.87Å; F43-W56 HydrophobicContact CD2-CD2 3.87Å; F43-W56 AromaticContact CD2-CE2 3.74Å; F43-W56 AromaticContact CD2-CG 3.81Å; F43-W56 HydrophobicContact CD2-CG 3.81Å; F43-W56 HydrophobicContact CD2-CZ2 4.43Å; F43-W56 AromaticContact CD2-NE1 3.55Å; F43-W56 HydrophobicContact CG-CD2 4.31Å; F43-W56 HydrophobicContact CG-CZ2 4.35Å
44I97.8Very high89Confident0 Ų076.7 Ų76.70%039%0.391CS..EExtended strand (participates in β ladder)trans-109.3134.8-170.1-61-58.5000110.1V17 C19 A28 C30 Y46 D54 E55 V57 V62V17-I44 HydrophobicContact CG2-CD1 4.19Å; C19-I44 HydrophobicContact CB-CG2 3.84Å; A28-I44 HydrophobicContact CB-CG2 3.42Å; A28-I44 VanDerWaalsContact CB-CG2 3.42Å; C30-I44 HydrophobicContact CB-CD1 4.28Å; I44-Y46 HydrophobicContact CG2-CD1 4.46Å; I44-Y46 HydrophobicContact CG2-CE1 4.26Å; I44-Y46 HydrophobicContact CG2-CE2 4.37Å; I44-D54 VanDerWaalsContact O-CA 3.29Å; I44-D54 WeakPolarHBondContact O-CA 3.41Å; I44-E55 PolarHBondContact N-O 3.44Å; I44-E55 PolarHBondContact O-N 2.97Å; I44-V57 HydrophobicContact CD1-CG2 4.42Å; I44-V57 HydrophobicContact CG1-CG1 4.45Å; I44-V57 HydrophobicContact CG1-CG2 3.49Å; I44-V57 VanDerWaalsContact CG1-CG2 3.49Å; I44-V62 HydrophobicContact CD1-CG1 4.47Å; I44-V62 HydrophobicContact CD1-CG2 4.02Å; I44-V62 HydrophobicContact CG1-CG2 4.27Å
45H96.1Very high89.1Confident51 Ų5177 Ų7724%0.23639%0.387CS..EExtended strand (participates in β ladder)trans-111.1120.8166.9175.368.2000109.6A28 K29 V31 W49 D54A28-H45 CarbonylContact C-O 3.58Å; A28-H45 VanDerWaalsContact CA-O 3.25Å; A28-H45 WeakPolarHBondContact CA-O 3.46Å; A28-H45 WeakPolarHBondContact CB-O 3.47Å; K29-H45 PolarHBondContact N-O 2.74Å; K29-H45 PolarHBondContact O-N 2.71Å; V31-H45 HydrophobicContact CG2-CB 3.54Å; H45-W49 PolarHBondContact CE1-O 2.78Å; H45-D54 IonicContact CE1-OD1 2.68Å; H45-D54 IonicContact CG-OD1 2.7Å; H45-D54 IonicContact ND1-OD1 3.56Å; H45-D54 PolarHBondContact ND1-OD1 2.76Å; H45-D54 IonicContact ND1-OD2 3.66Å; H45-D54 PolarHBondContact ND1-OD2 3.26Å
46Y93.3Very high89.3Confident0 Ų078.7 Ų78.70%039%0.388CS..EExtended strand (participates in β ladder)trans-80.5131.6-179-62.1-85.7000111.5C19 F20 H21 A28 I44 G48 W49 E55 R61C19-Y46 HydrophobicContact CB-CD1 4.45Å; C19-Y46 HydrophobicContact CB-CE1 3.72Å; C19-Y46 PolarHBondContact SG-OH 2.83Å; F20-Y46 PolarHBondContact O-OH 3.41Å; H21-Y46 HydrophobicContact CB-CE1 3.82Å; H21-Y46 AromaticContact ND1-CZ 3.89Å; A28-Y46 HydrophobicContact CB-CD1 4.01Å; I44-Y46 HydrophobicContact CG2-CD1 4.46Å; I44-Y46 HydrophobicContact CG2-CE1 4.26Å; I44-Y46 HydrophobicContact CG2-CE2 4.37Å; Y46-G48 PolarHBondContact O-N 2.85Å; Y46-W49 VanDerWaalsContact CB-CG 3.46Å; Y46-W49 HydrophobicContact CD2-CE3 4.16Å; Y46-W49 HydrophobicContact CG-CD2 4.17Å; Y46-W49 HydrophobicContact CG-CE3 4.23Å; Y46-W49 HydrophobicContact CG-CG 4.44Å; Y46-W49 WeakPolarHBondContact O-CB 3.29Å; Y46-W49 PolarHBondContact O-N 2.75Å; Y46-W49 VanDerWaalsContact O-N 3.08Å; Y46-E55 HydrophobicContact CE2-CG 4.12Å; Y46-E55 WeakPolarHBondContact CE2-OE1 3.23Å; Y46-E55 PolarHBondContact OH-OE1 2.81Å; Y46-R61 PolarHBondContact OH-NH2 3.07Å
47S91.3Very high89.7Confident54 Ų5472 Ų7238%0.37836%0.358SS..THydrogen-bonded Turntrans-63.2120.7-178.2-67.30000110.9E27E27-S47 WeakPolarHBondContact O-CB 3.44Å; E27-S47 PolarHBondContact O-N 2.88Å
48G84.4Confident90.1Very high86 Ų8668.2 Ų68.289%0.88734%0.341SS*.THydrogen-bonded Turntrans84.25-179.200000114.8Y46Y46-G48 PolarHBondContact O-N 2.85Å
49W83.1Confident90.4Very high68 Ų6863 Ų6326%0.25832%0.319SS..SBendtrans-102.1157.7178.8-64.337.5000110.4H21 Y26 H45 Y46 W53H21-W49 HydrophobicContact CB-CH2 4.28Å; H21-W49 AromaticContact CD2-CH2 3.32Å; H21-W49 WeakPolarHBondContact CD2-CH2 3.3Å; H21-W49 AromaticContact CD2-CZ3 3.62Å; H21-W49 AromaticContact CE1-CZ3 3.75Å; H21-W49 AromaticContact CG-CH2 3.73Å; H21-W49 AromaticContact CG-CZ3 3.86Å; H21-W49 AromaticContact ND1-CZ3 3.95Å; H21-W49 AromaticContact NE2-CH2 3.72Å; H21-W49 AromaticContact NE2-CZ3 3.56Å; Y26-W49 AromaticContact CD1-CZ2 3.71Å; Y26-W49 HydrophobicContact CD1-CZ2 3.71Å; Y26-W49 HydrophobicContact CD2-CZ2 4.21Å; Y26-W49 AromaticContact CE1-CZ2 3.6Å; Y26-W49 HydrophobicContact CE1-CZ2 3.6Å; Y26-W49 HydrophobicContact CE2-CH2 4.32Å; Y26-W49 HydrophobicContact CE2-CZ2 4.09Å; Y26-W49 HydrophobicContact CG-CZ2 4Å; Y26-W49 AromaticContact CZ-CZ2 3.78Å; H45-W49 PolarHBondContact CE1-O 2.78Å; Y46-W49 VanDerWaalsContact CB-CG 3.46Å; Y46-W49 HydrophobicContact CD2-CE3 4.16Å; Y46-W49 HydrophobicContact CG-CD2 4.17Å; Y46-W49 HydrophobicContact CG-CE3 4.23Å; Y46-W49 HydrophobicContact CG-CG 4.44Å; Y46-W49 WeakPolarHBondContact O-CB 3.29Å; Y46-W49 PolarHBondContact O-N 2.75Å; Y46-W49 VanDerWaalsContact O-N 3.08Å; W49-W53 HydrophobicContact CE3-CB 4.02Å; W49-W53 HydrophobicContact CE3-CD2 4.27Å; W49-W53 AromaticContact CE3-CG 3.97Å; W49-W53 HydrophobicContact CE3-CG 3.97Å; W49-W53 HydrophobicContact CZ3-CD2 4.45Å; W49-W53 HydrophobicContact CZ3-CE3 4.46Å
50N81.4Confident90.7Very high102 Ų10262 Ų6255%0.54533%0.325SS..  trans-71143.7175.3-176.4-45.2000110.5N52 W53N50-N52 VanDerWaalsContact CB-OD1 3.23Å; N50-N52 WeakPolarHBondContact CB-OD1 3.37Å; N50-N52 VanDerWaalsContact CG-OD1 3.27Å; N50-N52 PolarHBondContact O-N 2.83Å; N50-N52 PolarHBondContact O-OD1 2.81Å; N50-N52 VanDerWaalsContact OD1-CG 3.3Å; N50-N52 PolarHBondContact OD1-N 2.89Å; N50-N52 PolarHBondContact OD1-OD1 2.93Å; N50-N52 VanDerWaalsContact OD1-OD1 3.14Å; N50-W53 WeakPolarHBondContact O-CB 3.33Å; N50-W53 PolarHBondContact O-N 3Å
51K86.1Confident90.8Very high163 Ų16363.7 Ų63.771%0.70933%0.33SS*.G310 helixtrans-55.7-20.9178.9-64.4-176.1-179.7-179.40114.4W53 D54K51-W53 PolarHBondContact O-N 3.37Å; K51-D54 WeakPolarHBondContact CA-OD1 3.46Å; K51-D54 VanDerWaalsContact O-CB 3.31Å; K51-D54 WeakPolarHBondContact O-CB 3.25Å; K51-D54 VanDerWaalsContact O-CG 3.22Å; K51-D54 PolarHBondContact O-N 3.28Å; K51-D54 VanDerWaalsContact O-N 3.08Å
52N84.2Confident90.8Very high107 Ų10759.9 Ų59.957%0.57232%0.315SS*.G310 helixtrans-65.8-13.4173.767.5-8.5000113.7N50N50-N52 VanDerWaalsContact CB-OD1 3.23Å; N50-N52 WeakPolarHBondContact CB-OD1 3.37Å; N50-N52 VanDerWaalsContact CG-OD1 3.27Å; N50-N52 PolarHBondContact O-N 2.83Å; N50-N52 PolarHBondContact O-OD1 2.81Å; N50-N52 VanDerWaalsContact OD1-CG 3.3Å; N50-N52 PolarHBondContact OD1-N 2.89Å; N50-N52 PolarHBondContact OD1-OD1 2.93Å; N50-N52 VanDerWaalsContact OD1-OD1 3.14Å
53W82.8Confident90.7Very high130 Ų13061.7 Ų61.749%0.49232%0.324SS..G310 helixtrans-93-0.5172.5-65.3100.4000113.4W49 N50 K51 E55W49-W53 HydrophobicContact CE3-CB 4.02Å; W49-W53 HydrophobicContact CE3-CD2 4.27Å; W49-W53 AromaticContact CE3-CG 3.97Å; W49-W53 HydrophobicContact CE3-CG 3.97Å; W49-W53 HydrophobicContact CZ3-CD2 4.45Å; W49-W53 HydrophobicContact CZ3-CE3 4.46Å; N50-W53 WeakPolarHBondContact O-CB 3.33Å; N50-W53 PolarHBondContact O-N 3Å; K51-W53 PolarHBondContact O-N 3.37Å; W53-E55 PolarHBondContact O-N 2.98Å
54D91.3Very high90.7Very high37 Ų3764.9 Ų64.920%0.19834%0.338CS..  trans-65.8129175.6-62.60.8000109.3F43 I44 H45 K51F43-D54 HydrophobicContact CE1-CB 3.77Å; F43-D54 HydrophobicContact CE2-CB 4.11Å; F43-D54 HydrophobicContact CZ-CB 3.41Å; F43-D54 VanDerWaalsContact CZ-CB 3.41Å; I44-D54 VanDerWaalsContact O-CA 3.29Å; I44-D54 WeakPolarHBondContact O-CA 3.41Å; H45-D54 IonicContact CE1-OD1 2.68Å; H45-D54 IonicContact CG-OD1 2.7Å; H45-D54 IonicContact ND1-OD1 3.56Å; H45-D54 PolarHBondContact ND1-OD1 2.76Å; H45-D54 IonicContact ND1-OD2 3.66Å; H45-D54 PolarHBondContact ND1-OD2 3.26Å; K51-D54 WeakPolarHBondContact CA-OD1 3.46Å; K51-D54 VanDerWaalsContact O-CB 3.31Å; K51-D54 WeakPolarHBondContact O-CB 3.25Å; K51-D54 VanDerWaalsContact O-CG 3.22Å; K51-D54 PolarHBondContact O-N 3.28Å; K51-D54 VanDerWaalsContact O-N 3.08Å
55E94.9Very high90.5Very high42 Ų4268.2 Ų68.220%0.19635%0.351CS..EExtended strand (participates in β ladder)trans-141.7152.8-171.656.8169.1149.500112.1H21 F43 I44 Y46 W53 V57 R61H21-E55 IonicContact ND1-OE1 3.75Å; F43-E55 WeakPolarHBondContact CA-O 3.24Å; I44-E55 PolarHBondContact N-O 3.44Å; I44-E55 PolarHBondContact O-N 2.97Å; Y46-E55 HydrophobicContact CE2-CG 4.12Å; Y46-E55 WeakPolarHBondContact CE2-OE1 3.23Å; Y46-E55 PolarHBondContact OH-OE1 2.81Å; W53-E55 PolarHBondContact O-N 2.98Å; E55-V57 HydrophobicContact CG-CG1 3.65Å; E55-R61 IonicContact OE1-CZ 3.79Å; E55-R61 IonicContact OE1-NH1 2.74Å; E55-R61 IonicContact OE1-NH2 2.75Å; E55-R61 PolarHBondContact OE1-NH2 3.06Å; E55-R61 IonicContact OE2-CZ 2.8Å; E55-R61 IonicContact OE2-NH1 2.74Å; E55-R61 PolarHBondContact OE2-NH1 3.11Å; E55-R61 IonicContact OE2-NH2 3.13Å
56W95.3Very high90.2Very high118 Ų11868.9 Ų68.945%0.44736%0.358SS..EExtended strand (participates in β ladder)trans-82.8117.6166.9-75.6101.6000109.5K32 A34 K41 Y42 F43K32-W56 HydrophobicContact CB-CH2 3.63Å; K32-W56 HydrophobicContact CB-CZ2 4.2Å; K32-W56 HydrophobicContact CB-CZ3 4.35Å; K32-W56 HydrophobicContact CD-CZ2 4.46Å; A34-W56 HydrophobicContact CB-CE3 4.33Å; A34-W56 HydrophobicContact CB-CH2 3.52Å; A34-W56 HydrophobicContact CB-CZ2 4.43Å; A34-W56 HydrophobicContact CB-CZ3 3.47Å; A34-W56 VanDerWaalsContact CB-CZ3 3.47Å; K41-W56 HydrophobicContact CB-CE3 3.91Å; K41-W56 HydrophobicContact CB-CZ3 4.47Å; Y42-W56 VanDerWaalsContact C-CE3 3.48Å; Y42-W56 CarbonylContact O-C 3.6Å; Y42-W56 WeakPolarHBondContact O-CA 3.48Å; F43-W56 HydrophobicContact CB-CD2 3.87Å; F43-W56 HydrophobicContact CB-CE3 3.84Å; F43-W56 HydrophobicContact CB-CH2 3.88Å; F43-W56 HydrophobicContact CB-CZ2 3.9Å; F43-W56 HydrophobicContact CB-CZ3 3.84Å; F43-W56 AromaticContact CD2-CD1 3.6Å; F43-W56 AromaticContact CD2-CD2 3.87Å; F43-W56 HydrophobicContact CD2-CD2 3.87Å; F43-W56 AromaticContact CD2-CE2 3.74Å; F43-W56 AromaticContact CD2-CG 3.81Å; F43-W56 HydrophobicContact CD2-CG 3.81Å; F43-W56 HydrophobicContact CD2-CZ2 4.43Å; F43-W56 AromaticContact CD2-NE1 3.55Å; F43-W56 HydrophobicContact CG-CD2 4.31Å; F43-W56 HydrophobicContact CG-CZ2 4.35Å
57V90.5Very high89.9Confident0 Ų075.2 Ų75.20%039%0.392CS..EExtended strand (participates in β ladder)trans-115.6149.6178.8-51.40000111.3K41 Y42 I44 E55 R61 V62K41-V57 CarbonylContact C-O 3.5Å; K41-V57 VanDerWaalsContact CA-O 3.29Å; K41-V57 WeakPolarHBondContact CA-O 3.35Å; Y42-V57 PolarHBondContact N-O 3Å; Y42-V57 PolarHBondContact O-N 3.5Å; I44-V57 HydrophobicContact CD1-CG2 4.42Å; I44-V57 HydrophobicContact CG1-CG1 4.45Å; I44-V57 HydrophobicContact CG1-CG2 3.49Å; I44-V57 VanDerWaalsContact CG1-CG2 3.49Å; E55-V57 HydrophobicContact CG-CG1 3.65Å; V57-R61 HydrophobicContact CB-CB 4.11Å; V57-R61 HydrophobicContact CG2-CB 4.19Å; V57-V62 HydrophobicContact CG2-CG2 3.51Å
58P93.2Very high89.9Confident58 Ų5878 Ų7838%0.37741%0.407SS..EExtended strand (participates in β ladder)trans-68.1159.2170.230.6-36.4000111.6S60 R61P58-S60 PolarHBondContact O-N 3.44Å; P58-S60 VanDerWaalsContact O-N 3.11Å; P58-R61 HydrophobicContact CG-CG 4.35Å; P58-R61 PolarHBondContact O-N 3.12Å; P58-R61 VanDerWaalsContact O-N 3.07Å
59E89.3Confident90.2Very high43 Ų4375.4 Ų75.420%0.20137%0.373CS..G310 helixtrans-53.8-31.9178.6-174.1167-95.900114.4K10 V40 Y42 R61 V62K10-E59 WeakPolarHBondContact CB-OE1 3.45Å; K10-E59 VanDerWaalsContact CD-CD 3.46Å; K10-E59 HydrophobicContact CD-CG 4.09Å; K10-E59 WeakPolarHBondContact CD-OE2 3.37Å; K10-E59 WeakPolarHBondContact CE-OE2 3.3Å; K10-E59 VanDerWaalsContact CG-OE1 3.3Å; K10-E59 WeakPolarHBondContact CG-OE1 3.2Å; K10-E59 PolarHBondContact N-OE1 2.97Å; K10-E59 IonicContact NZ-OE2 3.42Å; K10-E59 PolarHBondContact NZ-OE2 3.24Å; V40-E59 PolarHBondContact O-N 2.74Å; Y42-E59 HydrophobicContact CD2-CB 4.46Å; Y42-E59 HydrophobicContact CE2-CB 3.71Å; Y42-E59 HydrophobicContact CE2-CG 3.8Å; Y42-E59 PolarHBondContact OH-OE1 3.48Å; E59-R61 PolarHBondContact O-N 3.41Å; E59-V62 PolarHBondContact O-N 2.83Å; E59-V62 VanDerWaalsContact O-N 3.17Å
60S91.6Very high90.4Very high99 Ų9973.2 Ų73.269%0.69237%0.366SS*.G310 helixtrans-62.9-20.8179.454.40000114.3P58P58-S60 PolarHBondContact O-N 3.44Å; P58-S60 VanDerWaalsContact O-N 3.11Å
61R93.6Very high90.7Very high49 Ų4972 Ų7219%0.18536%0.357CS..G310 helixtrans-87.4-9.6178.4-78.1-17662.1-166.3-3.3113.8C19 F20 Y46 E55 V57 P58 E59C19-R61 CarbonylContact C-O 3.59Å; C19-R61 WeakPolarHBondContact CA-O 3.47Å; F20-R61 HydrophobicContact CB-CB 4.4Å; F20-R61 HydrophobicContact CB-CG 4.38Å; F20-R61 PolarHBondContact N-O 3.33Å; F20-R61 VanDerWaalsContact O-CZ 3.28Å; F20-R61 PolarHBondContact O-NE 2.96Å; F20-R61 PolarHBondContact O-NH2 2.89Å; Y46-R61 PolarHBondContact OH-NH2 3.07Å; E55-R61 IonicContact OE1-CZ 3.79Å; E55-R61 IonicContact OE1-NH1 2.74Å; E55-R61 IonicContact OE1-NH2 2.75Å; E55-R61 PolarHBondContact OE1-NH2 3.06Å; E55-R61 IonicContact OE2-CZ 2.8Å; E55-R61 IonicContact OE2-NH1 2.74Å; E55-R61 PolarHBondContact OE2-NH1 3.11Å; E55-R61 IonicContact OE2-NH2 3.13Å; V57-R61 HydrophobicContact CB-CB 4.11Å; V57-R61 HydrophobicContact CG2-CB 4.19Å; P58-R61 HydrophobicContact CG-CG 4.35Å; P58-R61 PolarHBondContact O-N 3.12Å; P58-R61 VanDerWaalsContact O-N 3.07Å; E59-R61 PolarHBondContact O-N 3.41Å
62V95.1Very high90.7Very high5 Ų568.6 Ų68.63%0.0334%0.342CS..EExtended strand (participates in β ladder)trans-111.4130-173.1-1680000110F11 V17 Y42 I44 V57 E59F11-V62 HydrophobicContact CD1-CG1 4.26Å; F11-V62 HydrophobicContact CD2-CB 3.99Å; F11-V62 HydrophobicContact CD2-CG1 3.72Å; F11-V62 HydrophobicContact CE1-CG1 4.12Å; F11-V62 HydrophobicContact CE2-CB 3.62Å; F11-V62 HydrophobicContact CE2-CG1 3.61Å; F11-V62 WeakPolarHBondContact CE2-O 3.48Å; F11-V62 HydrophobicContact CG-CG1 4.06Å; F11-V62 HydrophobicContact CZ-CB 4.12Å; F11-V62 HydrophobicContact CZ-CG1 3.82Å; F11-V62 VanDerWaalsContact CZ-O 3.26Å; F11-V62 WeakPolarHBondContact CZ-O 3.33Å; V17-V62 HydrophobicContact CB-CG1 3.68Å; V17-V62 HydrophobicContact CG1-CG1 3.91Å; V17-V62 HydrophobicContact CG2-CG1 3.76Å; Y42-V62 HydrophobicContact CD2-CG2 4Å; Y42-V62 HydrophobicContact CG-CG2 4.36Å; I44-V62 HydrophobicContact CD1-CG1 4.47Å; I44-V62 HydrophobicContact CD1-CG2 4.02Å; I44-V62 HydrophobicContact CG1-CG2 4.27Å; V57-V62 HydrophobicContact CG2-CG2 3.51Å; E59-V62 PolarHBondContact O-N 2.83Å; E59-V62 VanDerWaalsContact O-N 3.17Å
63L93.8Very high91Very high38 Ų3864.9 Ų64.920%0.19932%0.321CS..EExtended strand (participates in β ladder)trans-121.8150.2178.1-63.4-173.4000110.2L18 F20 L25 N69 K72L18-L63 HydrophobicContact CB-CB 4.33Å; L18-L63 PolarHBondContact N-O 3.24Å; L18-L63 PolarHBondContact O-N 3Å; F20-L63 HydrophobicContact CE2-CD1 3.86Å; F20-L63 HydrophobicContact CE2-CG 4.24Å; F20-L63 HydrophobicContact CZ-CD1 4.41Å; L25-L63 HydrophobicContact CD1-CD1 3.9Å; L25-L63 HydrophobicContact CD2-CD1 4.05Å; L63-N69 HydrophobicContact CB-CB 4.41Å; L63-N69 HydrophobicContact CD1-CB 4.4Å; L63-K72 HydrophobicContact CD1-CD 4.49Å
64K95.5Very high91.4Very high112 Ų11265 Ų6549%0.48732%0.322SS..EExtended strand (participates in β ladder)trans-63.5143.6173.7-77.7-167.6172.1-172.90110.8F11 V66 N69F11-K64 HydrophobicContact CD1-CG 4.33Å; F11-K64 HydrophobicContact CE1-CB 4.32Å; F11-K64 HydrophobicContact CE1-CG 3.56Å; F11-K64 HydrophobicContact CZ-CG 4.38Å; K64-V66 VanDerWaalsContact C-N 3.3Å; K64-V66 HydrophobicContact CB-CG1 4.09Å; K64-V66 HydrophobicContact CB-CG2 4.26Å; K64-V66 PolarHBondContact O-N 2.81Å; K64-N69 WeakPolarHBondContact O-CB 3.29Å; K64-N69 PolarHBondContact O-ND2 3.01Å
65Y93.2Very high91.2Very high71 Ų7168.3 Ų68.328%0.27834%0.336SS..SBendtrans-75.683.1171-163.2-83.6000109.8R16 L18 E27 L70R16-Y65 HydrophobicContact CG-CD2 4.03Å; R16-Y65 HydrophobicContact CG-CE2 4.5Å; R16-Y65 HydrophobicContact CG-CG 4.22Å; R16-Y65 PolarHBondContact NH2-OH 2.87Å; R16-Y65 WeakPolarHBondContact O-CB 3.39Å; L18-Y65 HydrophobicContact CD1-CD2 4.39Å; L18-Y65 HydrophobicContact CD2-CD2 3.87Å; L18-Y65 HydrophobicContact CD2-CE2 3.98Å; L18-Y65 HydrophobicContact CG-CD2 3.83Å; L18-Y65 HydrophobicContact CG-CE2 4.42Å; E27-Y65 HydrophobicContact CG-CD2 4.34Å; E27-Y65 HydrophobicContact CG-CE2 3.84Å; E27-Y65 PolarHBondContact OE2-OH 3.19Å; Y65-L70 HydrophobicContact CD1-CD1 4.47Å; Y65-L70 HydrophobicContact CE1-CD1 3.96Å; Y65-L70 HydrophobicContact CE1-CD2 4.41Å; Y65-L70 HydrophobicContact CE2-CD2 3.94Å
66V89.9Confident90.7Very high65 Ų6568.7 Ų68.739%0.39434%0.339SS..SBendtrans-136.8159.1-179.9-65.10000110.3K64 T68 N69 L70K64-V66 VanDerWaalsContact C-N 3.3Å; K64-V66 HydrophobicContact CB-CG1 4.09Å; K64-V66 HydrophobicContact CB-CG2 4.26Å; K64-V66 PolarHBondContact O-N 2.81Å; V66-T68 VanDerWaalsContact C-N 3.29Å; V66-T68 PolarHBondContact O-N 2.89Å; V66-N69 HydrophobicContact CG2-CB 4.27Å; V66-N69 WeakPolarHBondContact CG2-ND2 3.44Å; V66-N69 PolarHBondContact O-N 3.44Å; V66-L70 PolarHBondContact O-N 3.42Å
67D88.2Confident90Very high133 Ų13366.7 Ų66.771%0.71134%0.335SS*.Hα-helixtrans-54.1-40.4-173.2-66.9-46000113.9N69 L70 Q71D67-N69 VanDerWaalsContact C-N 3.31Å; D67-N69 PolarHBondContact O-N 3.38Å; D67-L70 PolarHBondContact O-N 3.43Å; D67-Q71 WeakPolarHBondContact O-CB 3.4Å; D67-Q71 PolarHBondContact O-N 2.91Å
68T91.4Very high89.8Confident112 Ų11273 Ų7369%0.68736%0.362SS*.Hα-helixtrans-59.8-40.7177.6-44.90000112.1V66 K72V66-T68 VanDerWaalsContact C-N 3.29Å; V66-T68 PolarHBondContact O-N 2.89Å; T68-K72 PolarHBondContact O-N 2.86Å; T68-K72 VanDerWaalsContact O-N 3.11Å
69N89.8Confident89.2Confident31 Ų3172.9 Ų72.917%0.16637%0.366CS..Hα-helixtrans-80.6-30-179.5-66.1-30.3000112L18 L25 L63 K64 V66 D67 Q71 K72 Q73L18-N69 HydrophobicContact CD1-CB 3.6Å; L25-N69 HydrophobicContact CD2-CB 4.49Å; L63-N69 HydrophobicContact CB-CB 4.41Å; L63-N69 HydrophobicContact CD1-CB 4.4Å; K64-N69 WeakPolarHBondContact O-CB 3.29Å; K64-N69 PolarHBondContact O-ND2 3.01Å; V66-N69 HydrophobicContact CG2-CB 4.27Å; V66-N69 WeakPolarHBondContact CG2-ND2 3.44Å; V66-N69 PolarHBondContact O-N 3.44Å; D67-N69 VanDerWaalsContact C-N 3.31Å; D67-N69 PolarHBondContact O-N 3.38Å; N69-Q71 VanDerWaalsContact C-N 3.33Å; N69-K72 WeakPolarHBondContact O-CB 3.38Å; N69-K72 PolarHBondContact O-N 2.88Å; N69-Q73 PolarHBondContact O-N 2.73Å
70L87.6Confident88.5Confident22 Ų2273.1 Ų73.112%0.11537%0.369CS..Hα-helixtrans-65.2-38.2169.8-73.1168.2000111.4L18 Y65 V66 D67 Q73 R74L18-L70 HydrophobicContact CD1-CD2 4.08Å; L18-L70 HydrophobicContact CD1-CG 4.16Å; L18-L70 HydrophobicContact CD2-CD2 4.16Å; Y65-L70 HydrophobicContact CD1-CD1 4.47Å; Y65-L70 HydrophobicContact CE1-CD1 3.96Å; Y65-L70 HydrophobicContact CE1-CD2 4.41Å; Y65-L70 HydrophobicContact CE2-CD2 3.94Å; V66-L70 PolarHBondContact O-N 3.42Å; D67-L70 PolarHBondContact O-N 3.43Å; L70-Q73 WeakPolarHBondContact O-CB 3.39Å; L70-Q73 PolarHBondContact O-N 2.89Å; L70-R74 WeakPolarHBondContact O-CG 3.41Å; L70-R74 PolarHBondContact O-N 2.96Å
71Q87.8Confident87.7Confident77 Ų7774.4 Ų74.436%0.3636%0.364SS..Hα-helixtrans-63.7-45.2173-176.659.721.200111D67 N69 Q73 R74 E75D67-Q71 WeakPolarHBondContact O-CB 3.4Å; D67-Q71 PolarHBondContact O-N 2.91Å; N69-Q71 VanDerWaalsContact C-N 3.33Å; Q71-Q73 VanDerWaalsContact C-N 3.31Å; Q71-Q73 PolarHBondContact O-N 2.81Å; Q71-R74 PolarHBondContact O-N 2.82Å; Q71-R74 VanDerWaalsContact O-N 3.13Å; Q71-E75 WeakPolarHBondContact CG-OE1 3.49Å; Q71-E75 PolarHBondContact NE2-OE1 3.47Å; Q71-E75 WeakPolarHBondContact O-CG 3.49Å; Q71-E75 PolarHBondContact O-N 3.5Å
72K86.5Confident86.8Confident92 Ų9279.7 Ų79.740%0.439%0.388SS..Hα-helixtrans-56.9-42.2173.1-172.2175.2-176.8177.10112.1L63 T68 N69 R74 E75 L76L63-K72 HydrophobicContact CD1-CD 4.49Å; T68-K72 PolarHBondContact O-N 2.86Å; T68-K72 VanDerWaalsContact O-N 3.11Å; N69-K72 WeakPolarHBondContact O-CB 3.38Å; N69-K72 PolarHBondContact O-N 2.88Å; K72-R74 PolarHBondContact O-N 3.28Å; K72-E75 PolarHBondContact O-N 2.72Å; K72-L76 HydrophobicContact CG-CD1 4.07Å; K72-L76 HydrophobicContact CG-CG 4.45Å; K72-L76 WeakPolarHBondContact O-CB 3.41Å; K72-L76 VanDerWaalsContact O-CG 3.23Å; K72-L76 WeakPolarHBondContact O-CG 3.48Å; K72-L76 PolarHBondContact O-N 3.29Å
73Q90.6Very high85.2Confident28 Ų2883.7 Ų83.713%0.13141%0.413CS..Hα-helixtrans-57.4-48.9174178.7-178.249.400111.9L25 N69 L70 Q71 E75 L76 Q77L25-Q73 HydrophobicContact CB-CB 3.75Å; L25-Q73 HydrophobicContact CB-CG 3.84Å; L25-Q73 HydrophobicContact CD2-CB 4.12Å; L25-Q73 WeakPolarHBondContact O-CG 3.48Å; L25-Q73 PolarHBondContact O-NE2 3.49Å; N69-Q73 PolarHBondContact O-N 2.73Å; L70-Q73 WeakPolarHBondContact O-CB 3.39Å; L70-Q73 PolarHBondContact O-N 2.89Å; Q71-Q73 VanDerWaalsContact C-N 3.31Å; Q71-Q73 PolarHBondContact O-N 2.81Å; Q73-E75 VanDerWaalsContact C-N 3.33Å; Q73-E75 PolarHBondContact O-N 3.09Å; Q73-L76 PolarHBondContact O-N 3.12Å; Q73-Q77 WeakPolarHBondContact O-CG 3.29Å; Q73-Q77 PolarHBondContact O-N 2.7Å
74R89.8Confident83.6Confident132 Ų13288.7 Ų88.750%0.49843%0.433SS..Hα-helixtrans-62.5-40.1178.8-67.7173.7-170.7151.10.6112.1L70 Q71 K72 Q77 K78L70-R74 WeakPolarHBondContact O-CG 3.41Å; L70-R74 PolarHBondContact O-N 2.96Å; Q71-R74 PolarHBondContact O-N 2.82Å; Q71-R74 VanDerWaalsContact O-N 3.13Å; K72-R74 PolarHBondContact O-N 3.28Å; R74-Q77 PolarHBondContact O-N 3.08Å; R74-K78 WeakPolarHBondContact O-CB 3.32Å; R74-K78 WeakPolarHBondContact O-CG 3.46Å; R74-K78 PolarHBondContact O-N 3.22Å
75E88Confident81.8Confident108 Ų10891 Ų9151%0.50544%0.443SS..Hα-helixtrans-65.5-45.5178-74.9170.8-168.700111.8Q71 K72 Q73 Q77 K78 A79Q71-E75 WeakPolarHBondContact CG-OE1 3.49Å; Q71-E75 PolarHBondContact NE2-OE1 3.47Å; Q71-E75 WeakPolarHBondContact O-CG 3.49Å; Q71-E75 PolarHBondContact O-N 3.5Å; K72-E75 PolarHBondContact O-N 2.72Å; Q73-E75 VanDerWaalsContact C-N 3.33Å; Q73-E75 PolarHBondContact O-N 3.09Å; E75-Q77 VanDerWaalsContact C-N 3.32Å; E75-Q77 PolarHBondContact O-N 3.01Å; E75-K78 PolarHBondContact O-N 3.5Å; E75-A79 WeakPolarHBondContact O-CB 3.39Å; E75-A79 PolarHBondContact O-N 3.12Å
76L83.7Confident79.7Confident50 Ų5094.1 Ų94.126%0.26246%0.464SS..Hα-helixtrans-60-42.3174.8-70.2170000111.5F20 L24 L25 K72 Q73 A79 N80F20-L76 HydrophobicContact CE1-CD1 3.83Å; F20-L76 HydrophobicContact CZ-CD1 4.38Å; L24-L76 HydrophobicContact CD2-CB 3.93Å; L24-L76 WeakPolarHBondContact CD2-O 3.37Å; L25-L76 HydrophobicContact CD1-CD1 4.48Å; K72-L76 HydrophobicContact CG-CD1 4.07Å; K72-L76 HydrophobicContact CG-CG 4.45Å; K72-L76 WeakPolarHBondContact O-CB 3.41Å; K72-L76 VanDerWaalsContact O-CG 3.23Å; K72-L76 WeakPolarHBondContact O-CG 3.48Å; K72-L76 PolarHBondContact O-N 3.29Å; Q73-L76 PolarHBondContact O-N 3.12Å; L76-A79 PolarHBondContact O-N 3.38Å; L76-N80 WeakPolarHBondContact O-CB 3.38Å; L76-N80 PolarHBondContact O-N 3.49Å
77Q82.1Confident77.8Confident75 Ų7599.2 Ų99.235%0.3548%0.481SS..Hα-helixtrans-63.2-45.3175.1-73.7175.2-4.600112.2L24 Q73 R74 E75 N80 Q81L24-Q77 HydrophobicContact CD2-CG 4.28Å; Q73-Q77 WeakPolarHBondContact O-CG 3.29Å; Q73-Q77 PolarHBondContact O-N 2.7Å; R74-Q77 PolarHBondContact O-N 3.08Å; E75-Q77 VanDerWaalsContact C-N 3.32Å; E75-Q77 PolarHBondContact O-N 3.01Å; Q77-N80 PolarHBondContact O-N 2.76Å; Q77-Q81 WeakPolarHBondContact O-CG 3.38Å; Q77-Q81 PolarHBondContact O-N 3.14Å
78K85.7Confident75.7Confident132 Ų132101 Ų10157%0.57449%0.486SS*.Hα-helixtrans-64.4-42.5177.5-75.7176.7-178179.80112.1R74 E75 N80 Q81 K82R74-K78 WeakPolarHBondContact O-CB 3.32Å; R74-K78 WeakPolarHBondContact O-CG 3.46Å; R74-K78 PolarHBondContact O-N 3.22Å; E75-K78 PolarHBondContact O-N 3.5Å; K78-N80 VanDerWaalsContact C-N 3.35Å; K78-Q81 PolarHBondContact O-N 3.29Å; K78-K82 PolarHBondContact O-N 3.18Å; K78-K82 VanDerWaalsContact O-N 3.12Å
79A79.8Confident73.5Confident56 Ų56104.4 Ų104.446%0.46349%0.491SS..Hα-helixtrans-61.1-45.6177.100000110.8E75 L76 Q81 K82 T83E75-A79 WeakPolarHBondContact O-CB 3.39Å; E75-A79 PolarHBondContact O-N 3.12Å; L76-A79 PolarHBondContact O-N 3.38Å; A79-Q81 VanDerWaalsContact C-N 3.31Å; A79-Q81 PolarHBondContact O-N 3.37Å; A79-K82 PolarHBondContact O-N 2.82Å; A79-T83 PolarHBondContact O-N 3.08Å; A79-T83 VanDerWaalsContact O-N 3.12Å; A79-T83 PolarHBondContact O-OG1 3.32Å
80N75.5Confident71.1Confident49 Ų49109.3 Ų109.326%0.26252%0.522SS..Hα-helixtrans-66-30.2179-160.620.2000113.2L24 L76 Q77 K78 T83 K84L24-N80 HydrophobicContact CD2-CB 4.1Å; L76-N80 WeakPolarHBondContact O-CB 3.38Å; L76-N80 PolarHBondContact O-N 3.49Å; Q77-N80 PolarHBondContact O-N 2.76Å; K78-N80 VanDerWaalsContact C-N 3.35Å; N80-T83 WeakPolarHBondContact CA-OG1 3.23Å; N80-T83 PolarHBondContact O-OG1 3.03Å; N80-T83 VanDerWaalsContact O-OG1 3.09Å; N80-K84 WeakPolarHBondContact O-CG 3.31Å; N80-K84 PolarHBondContact O-N 2.99Å
81Q74.1Confident69Low125 Ų125114.3 Ų114.358%0.58456%0.556SS**Hα-helixtrans-71.9-36.4172.8-73.1177.118.900112.9Q77 K78 A79 K84 K85Q77-Q81 WeakPolarHBondContact O-CG 3.38Å; Q77-Q81 PolarHBondContact O-N 3.14Å; K78-Q81 PolarHBondContact O-N 3.29Å; A79-Q81 VanDerWaalsContact C-N 3.31Å; A79-Q81 PolarHBondContact O-N 3.37Å; Q81-K84 PolarHBondContact O-N 3.14Å; Q81-K85 PolarHBondContact O-N 2.9Å; Q81-K85 VanDerWaalsContact O-N 3.12Å
82K74.2Confident66.4Low161 Ų161114.3 Ų114.370%0.758%0.576SS**Hα-helixtrans-68.5-41.7178-73.8-178.6179.1-176.90112K78 A79 K84 K85 N86K78-K82 PolarHBondContact O-N 3.18Å; K78-K82 VanDerWaalsContact O-N 3.12Å; A79-K82 PolarHBondContact O-N 2.82Å; K82-K84 VanDerWaalsContact C-N 3.34Å; K82-K84 PolarHBondContact O-N 3.35Å; K82-K85 PolarHBondContact O-N 2.66Å; K82-N86 PolarHBondContact O-N 3.37Å; K82-N86 VanDerWaalsContact O-N 3.14Å
83T62.9Low64.1Low88 Ų88118.5 Ų118.554%0.5460%0.603SS.*Hα-helixtrans-63.3-38.2174.233.30000112.2A79 N80 N86 K87A79-T83 PolarHBondContact O-N 3.08Å; A79-T83 VanDerWaalsContact O-N 3.12Å; A79-T83 PolarHBondContact O-OG1 3.32Å; N80-T83 WeakPolarHBondContact CA-OG1 3.23Å; N80-T83 PolarHBondContact O-OG1 3.03Å; N80-T83 VanDerWaalsContact O-OG1 3.09Å; T83-N86 PolarHBondContact O-N 2.94Å; T83-K87 PolarHBondContact O-N 3.24Å
84K59.8Low61.3Low144 Ų144120.5 Ų120.563%0.62663%0.632SS**Hα-helixtrans-64.3-38.8173.6-74.9-176.3179.7-171.50113.3N80 Q81 K82 K87N80-K84 WeakPolarHBondContact O-CG 3.31Å; N80-K84 PolarHBondContact O-N 2.99Å; Q81-K84 PolarHBondContact O-N 3.14Å; K82-K84 VanDerWaalsContact C-N 3.34Å; K82-K84 PolarHBondContact O-N 3.35Å; K84-K87 PolarHBondContact O-N 3.11Å
85K57Low58.6Low159 Ų159122.5 Ų122.569%0.69165%0.652SS**Hα-helixtrans-68.8-34.7177.2-80.3-174.5175.8-1780113.7Q81 K82 K87 Q88Q81-K85 PolarHBondContact O-N 2.9Å; Q81-K85 VanDerWaalsContact O-N 3.12Å; K82-K85 PolarHBondContact O-N 2.66Å; K85-K87 VanDerWaalsContact C-N 3.34Å; K85-Q88 PolarHBondContact O-N 3Å
86N50.3Low55.9Low137 Ų137120.7 Ų120.773%0.73366%0.662SS**Hα-helixtrans-73.4-24.2178.2-98.79.5000113.5K82 T83 Q88K82-N86 PolarHBondContact O-N 3.37Å; K82-N86 VanDerWaalsContact O-N 3.14Å; T83-N86 PolarHBondContact O-N 2.94Å; N86-Q88 VanDerWaalsContact C-N 3.29Å; N86-Q88 PolarHBondContact O-N 2.99Å
87K49.6Very low53.2Low172 Ų172122.3 Ų122.375%0.74869%0.691SS**THydrogen-bonded Turntrans-75.9-12.6177-119.3178.3179.5178.80114T83 K84 K85T83-K87 PolarHBondContact O-N 3.24Å; K84-K87 PolarHBondContact O-N 3.11Å; K85-K87 VanDerWaalsContact C-N 3.34Å
88Q44.8Very low50.8Low172 Ų172124 Ų12480%0.80471%0.711SS**THydrogen-bonded Turntrans-94.5-2.3-179.8-97.4178.6-2.900114.9K85 N86K85-Q88 PolarHBondContact O-N 3Å; N86-Q88 VanDerWaalsContact C-N 3.29Å; N86-Q88 PolarHBondContact O-N 2.99Å
89K43.4Very low48.2Very low182 Ų182123.6 Ų123.679%0.79172%0.72SS**  trans-106.384.3173.2-75.4-170.8176-173.30110.5
90T39.3Very low45.8Very low135 Ų135126 Ų12683%0.82873%0.733SS**PPolyproline II helixtrans-77.4133.6155.832.80000109.2
91P43.8Very low43.7Very low127 Ų127132.5 Ų132.583%0.82576%0.762SS**PPolyproline II helixtrans-93.7124157.410.97.8000109.1
92G34.3Very low41.7Very low76 Ų76133.4 Ų133.478%0.78478%0.776SS**PPolyproline II helixtrans-77.6143.6168.700000112.3
93N37Very low39.9Very low180 Ų180131.9 Ų131.996%0.96378%0.783SS**  trans17.5137.3148.9-118.446.5000121.3
94G32.9Very low38.5Very low71 Ų71136.8 Ų136.873%0.73280%0.8SS**  trans143.592.9147.600000117.1
95D32.8Very low37.5Very low174 Ų174135.4 Ų135.493%0.9381%0.806SS**  trans10.7145.2143.3-155.921.4000123.5
96G31.2Very low36.5Very low70 Ų70134 Ų13472%0.72281%0.812SS**  trans99.5114.3141.900000120
97G27.4Very low36Very low84 Ų84139 Ų13987%0.86682%0.821SS**  trans148.2108.8151.900000117.8
98S31.4Very low35.7Very low109 Ų109140.9 Ų140.976%0.76283%0.829SS**  trans-71.9145.8179.4-177.50000115.2
99T30.4Very low35.3Very low125 Ų125142.7 Ų142.777%0.76783%0.834SS**  163.5141.4115.538.20000116.3
100S30.7Very low35.4Very low106 Ų106145.3 Ų145.374%0.74184%0.839SS**  trans61.2106.7151.758.20000124
101E30.6Very low35.5Very low186 Ų186143.3 Ų143.387%0.86984%0.836SS**  40.1120.4127-60.8-166.8139.600123.4
102T32.9Very low35.5Very low143 Ų143148.9 Ų148.988%0.87784%0.841SS**  -171.3144.7118.523.60000110.3
103P35.4Very low36.1Very low130 Ų130150.9 Ų150.984%0.84484%0.838SS**  trans-98.1132.1-172.618.2-0.6000113.5
104Q34.3Very low36.2Very low191 Ų191146.7 Ų146.789%0.89382%0.815SS**  trans-124.3147.7163.1-84.6-168.98.800111.6
105P37.1Very low36.9Very low115 Ų115149.5 Ų149.575%0.74782%0.82SS**  trans-77.4160.9-165.331.1-35000114.4R107P105-R107 PolarHBondContact O-N 3.03Å
106P37.8Very low37.8Very low128 Ų128146.5 Ų146.583%0.83181%0.809SS**  trans-85.2111.9-157.532.1-32.1000112.7
107R37.9Very low38.4Very low242 Ų242148.1 Ų148.191%0.91380%0.804SS**  trans-79.1120159.7-89.7-178.8168.7177.3-2.4109.4P105 K109P105-R107 PolarHBondContact O-N 3.03Å; R107-K109 PolarHBondContact O-N 3.42Å
108K43.9Very low39.4Very low212 Ų212148.6 Ų148.692%0.92278%0.784SS**  trans-43.6106.9173.1-73.1177.2175.5177.90110.7R110K108-R110 PolarHBondContact O-N 2.82Å; K108-R110 VanDerWaalsContact O-N 3.11Å
109K36.8Very low40.3Very low210 Ų210148.3 Ų148.391%0.91377%0.774SS**  trans-66.1105.9169.4-80.7-179.8176.6174.60108R107 A111R107-K109 PolarHBondContact O-N 3.42Å; K109-A111 PolarHBondContact O-N 3Å
110R46.2Very low41.1Very low238 Ų238149.8 Ų149.890%0.89877%0.772SS**  trans-56.8127.6154.2-87.2179.4166179.3-4.9106.9K108 R112K108-R110 PolarHBondContact O-N 2.82Å; K108-R110 VanDerWaalsContact O-N 3.11Å; R110-R112 PolarHBondContact O-N 3.48Å; R110-R112 VanDerWaalsContact O-N 3.16Å
111A40.9Very low41.9Very low92 Ų92151.3 Ų151.376%0.7677%0.767SS**  trans-49.9122.3176.400000109.1K109 V113K109-A111 PolarHBondContact O-N 3Å; A111-V113 PolarHBondContact O-N 3.45Å; A111-V113 VanDerWaalsContact O-N 3.11Å
112R42.9Very low42.9Very low245 Ų245146 Ų14693%0.92575%0.747SS**  trans-72.2102.5177.3-158.9-179.8-168.1-178.12.5105.6R110 D114R110-R112 PolarHBondContact O-N 3.48Å; R110-R112 VanDerWaalsContact O-N 3.16Å; R112-D114 PolarHBondContact O-N 3.15Å
113V47.1Very low43.7Very low118 Ų118143.9 Ų143.972%0.71573%0.726SS**  trans-61.4129.6173.3-173.30000107.3A111A111-V113 PolarHBondContact O-N 3.45Å; A111-V113 VanDerWaalsContact O-N 3.11Å
114D39.1Very low44.3Very low92 Ų92144.7 Ų144.749%0.49272%0.721SS.*  trans-57.2127-178-160.5-51.6000110.1R112 T116 V117R112-D114 PolarHBondContact O-N 3.15Å; D114-T116 PolarHBondContact O-N 2.74Å; D114-T116 WeakPolarHBondContact OD1-CB 3.39Å; D114-T116 WeakPolarHBondContact OD1-CG2 3.37Å; D114-T116 PolarHBondContact OD1-N 3.01Å; D114-T116 VanDerWaalsContact OD1-N 3.11Å; D114-T116 PolarHBondContact OD1-OG1 3.36Å; D114-V117 HydrophobicContact CB-CG2 4.45Å; D114-V117 PolarHBondContact O-N 3.47Å; D114-V117 VanDerWaalsContact O-N 3.16Å
115P48Very low45Very low129 Ų129141.1 Ų141.184%0.83871%0.708SS**THydrogen-bonded Turntrans-68.3-0.9-179.125.2-30.5000113.9
116T51Low46.3Very low112 Ų112139.6 Ų139.669%0.68769%0.687SS**THydrogen-bonded Turntrans-80-13.8170.853.80000114.1D114 E118D114-T116 PolarHBondContact O-N 2.74Å; D114-T116 WeakPolarHBondContact OD1-CB 3.39Å; D114-T116 WeakPolarHBondContact OD1-CG2 3.37Å; D114-T116 PolarHBondContact OD1-N 3.01Å; D114-T116 VanDerWaalsContact OD1-N 3.11Å; D114-T116 PolarHBondContact OD1-OG1 3.36Å; T116-E118 PolarHBondContact O-N 3.5Å
117V44.4Very low47.5Very low103 Ų103135.7 Ų135.762%0.62466%0.661SS**  trans-84.194.2177.1-172.10000108.9D114D114-V117 HydrophobicContact CB-CG2 4.45Å; D114-V117 PolarHBondContact O-N 3.47Å; D114-V117 VanDerWaalsContact O-N 3.16Å
118E47.9Very low49.1Very low95 Ų95129.7 Ų129.744%0.44464%0.643SS.*  trans-61.3142.5167.7-68-176.2179.300109.6T116 E120 R126T116-E118 PolarHBondContact O-N 3.5Å; E118-E120 PolarHBondContact O-N 3.11Å; E118-R126 IonicContact OE1-NH2 2.84Å; E118-R126 PolarHBondContact OE1-NH2 3.48Å; E118-R126 IonicContact OE2-CZ 2.72Å; E118-R126 IonicContact OE2-NE 3.13Å; E118-R126 IonicContact OE2-NH2 3.09Å; E118-R126 PolarHBondContact OE2-NH2 3.2Å
119N50.8Low51.1Low103 Ų103120.5 Ų120.555%0.55161%0.605SS**  trans-54.1136177.1-170.527.2000110.1E121 T122 F123N119-E121 PolarHBondContact O-N 3.38Å; N119-T122 WeakPolarHBondContact O-CA 3.46Å; N119-T122 WeakPolarHBondContact O-CB 3.46Å; N119-T122 PolarHBondContact O-N 3.35Å; N119-F123 PolarHBondContact O-N 3.36Å
120E48Very low53.3Low156 Ų156118.6 Ų118.673%0.72960%0.596SS**Hα-helixtrans-54.9-27.6-175.5-161.6175.6-167.700112.5E118 F123 M124E118-E120 PolarHBondContact O-N 3.11Å; E120-F123 WeakPolarHBondContact O-CB 3.39Å; E120-M124 WeakPolarHBondContact O-CG 3.48Å; E120-M124 PolarHBondContact O-N 3.16Å
121E46Very low55.5Low137 Ų137108 Ų10864%0.6456%0.558SS**Hα-helixtrans-74.5-36175.3-151.5174.4-162.300113N119 F123 N125N119-E121 PolarHBondContact O-N 3.38Å; E121-F123 VanDerWaalsContact C-N 3.33Å; E121-N125 WeakPolarHBondContact O-CB 3.43Å; E121-N125 VanDerWaalsContact O-CG 3.24Å; E121-N125 PolarHBondContact O-N 2.62Å; E121-N125 PolarHBondContact O-ND2 3.05Å
122T51.7Low58Low74 Ų74110.2 Ų110.245%0.45455%0.551SS.*Hα-helixtrans-73.6-31.2172.6-440000111N119N119-T122 WeakPolarHBondContact O-CA 3.46Å; N119-T122 WeakPolarHBondContact O-CB 3.46Å; N119-T122 PolarHBondContact O-N 3.35Å
123F49.7Very low60.6Low99 Ų9999.9 Ų99.943%0.43451%0.513SS..Hα-helixtrans-61.9-54.3173.6177.2-94.9000110.8N119 E120 E121 N125 Y249N119-F123 PolarHBondContact O-N 3.36Å; E120-F123 WeakPolarHBondContact O-CB 3.39Å; E121-F123 VanDerWaalsContact C-N 3.33Å; F123-N125 PolarHBondContact O-N 3.11Å; F123-N125 VanDerWaalsContact O-N 3.15Å; F123-Y249 HydrophobicContact CB-CE1 4.46Å; F123-Y249 HydrophobicContact CD1-CE1 4.12Å; F123-Y249 AromaticContact CD2-CD1 3.68Å; F123-Y249 HydrophobicContact CD2-CD1 3.68Å; F123-Y249 AromaticContact CD2-CE1 3.4Å; F123-Y249 HydrophobicContact CD2-CE1 3.4Å; F123-Y249 HydrophobicContact CE1-CE1 4.2Å; F123-Y249 AromaticContact CE2-CD1 3.62Å; F123-Y249 HydrophobicContact CE2-CD1 3.62Å; F123-Y249 AromaticContact CE2-CE1 3.49Å; F123-Y249 HydrophobicContact CE2-CE1 3.49Å; F123-Y249 VanDerWaalsContact CE2-CE1 3.49Å; F123-Y249 HydrophobicContact CE2-CG 4.41Å; F123-Y249 HydrophobicContact CG-CD1 4.43Å; F123-Y249 AromaticContact CG-CE1 3.72Å; F123-Y249 HydrophobicContact CG-CE1 3.72Å; F123-Y249 HydrophobicContact CZ-CD1 4.35Å; F123-Y249 AromaticContact CZ-CE1 3.9Å; F123-Y249 HydrophobicContact CZ-CE1 3.9Å; F123-Y249 WeakPolarHBondContact O-CE1 3.35Å; F123-Y249 PolarHBondContact O-OH 3.16Å; F123-Y249 VanDerWaalsContact O-OH 3.06Å
124M48.8Very low63Low147 Ų14795.2 Ų95.272%0.72449%0.486SS*.Hα-helixtrans-68.1-14.2-179.3-69.9-115-73.900115.4E120E120-M124 WeakPolarHBondContact O-CG 3.48Å; E120-M124 PolarHBondContact O-N 3.16Å
125N49.6Very low65.6Low116 Ų11696.8 Ų96.862%0.6249%0.49SS*.THydrogen-bonded Turntrans-97.86.1-172.7-79.9-40.2000114.8E121 F123E121-N125 WeakPolarHBondContact O-CB 3.43Å; E121-N125 VanDerWaalsContact O-CG 3.24Å; E121-N125 PolarHBondContact O-N 2.62Å; E121-N125 PolarHBondContact O-ND2 3.05Å; F123-N125 PolarHBondContact O-N 3.11Å; F123-N125 VanDerWaalsContact O-N 3.15Å
126R62.7Low67.9Low84 Ų8496.5 Ų96.532%0.31748%0.478SS..SBendtrans-73.1136.7175.9-64.1-164.4179.1-172.76.7110.8E118 E128 A248 Y249E118-R126 IonicContact OE1-NH2 2.84Å; E118-R126 PolarHBondContact OE1-NH2 3.48Å; E118-R126 IonicContact OE2-CZ 2.72Å; E118-R126 IonicContact OE2-NE 3.13Å; E118-R126 IonicContact OE2-NH2 3.09Å; E118-R126 PolarHBondContact OE2-NH2 3.2Å; R126-E128 PolarHBondContact O-N 3.17Å; R126-A248 HydrophobicContact CB-CB 3.95Å; R126-A248 WeakPolarHBondContact CD-O 3.03Å; R126-A248 PolarHBondContact NH1-O 3.26Å; R126-Y249 PolarHBondContact NH1-O 3.13Å
127V63Low70.1Confident46 Ų4691.1 Ų91.128%0.27945%0.445SS..PPolyproline II helixtrans-65.9119.2178.5178.10000108.4V129 A248V127-V129 PolarHBondContact O-N 3.06Å; V127-A248 WeakPolarHBondContact O-CB 3.32Å
128E73.4Confident72.5Confident115 Ų11590.3 Ų90.354%0.53743%0.433SS..PPolyproline II helixtrans-57.6127.6177.1177.2167.3-157.300110.6R126 K130 A245R126-E128 PolarHBondContact O-N 3.17Å; E128-K130 PolarHBondContact O-N 3.42Å; E128-A245 HydrophobicContact CG-CB 4.31Å; E128-A245 PolarHBondContact OE1-N 3.29Å
129V84.4Confident74.7Confident19 Ų1989.1 Ų89.112%0.11543%0.434CS..  trans-72.4114.8176.4178.30000108.1V127 V131 G244 L247 A248 L257 L261V127-V129 PolarHBondContact O-N 3.06Å; V129-V131 PolarHBondContact O-N 2.88Å; V129-G244 WeakPolarHBondContact CB-O 3.49Å; V129-G244 PolarHBondContact N-O 2.97Å; V129-G244 CarbonylContact O-C 3.46Å; V129-G244 WeakPolarHBondContact O-CA 3.18Å; V129-L247 HydrophobicContact CB-CB 4Å; V129-L247 HydrophobicContact CG1-CB 4.44Å; V129-L247 HydrophobicContact CG1-CD1 4.35Å; V129-L247 HydrophobicContact CG2-CB 3.96Å; V129-A248 HydrophobicContact CG2-CB 4.41Å; V129-L257 HydrophobicContact CG1-CD1 4.13Å; V129-L257 HydrophobicContact CG2-CD1 4.29Å; V129-L257 HydrophobicContact CG2-CD2 4.22Å; V129-L261 HydrophobicContact CG1-CD1 3.92Å; V129-L261 HydrophobicContact CG1-CD2 3.78Å; V129-L261 HydrophobicContact CG1-CG 4.25Å
130K83.3Confident76.8Confident170 Ų17087.6 Ų87.674%0.73942%0.42SS*.  trans-77.998.7-176.6-166.6172.4-174.7173.90112.2E128E128-K130 PolarHBondContact O-N 3.42Å
131V93Very high79.1Confident17 Ų1781.6 Ų81.610%0.10339%0.393CS..  trans-74.1126.3165-177.10000108.8V129 F240 I243 L247 L261 L264 L268V129-V131 PolarHBondContact O-N 2.88Å; V131-F240 HydrophobicContact CG1-CB 4.46Å; V131-F240 HydrophobicContact CG1-CD1 4.39Å; V131-I243 HydrophobicContact CG2-CG2 3.96Å; V131-L247 HydrophobicContact CG2-CD1 4.32Å; V131-L261 HydrophobicContact CG2-CD2 4.1Å; V131-L264 HydrophobicContact CG2-CD1 4.48Å; V131-L268 HydrophobicContact CG1-CD1 3.71Å
132K93.8Very high81.4Confident137 Ų13779.4 Ų79.460%0.59639%0.388SS*.  trans-92.2112.2-178.6-70.7-175.9179.1-179.70109.9H265K132-H265 PolarHBondContact N-NE2 3.32Å
133I96.6Very high83.4Confident28 Ų2879.7 Ų79.714%0.14439%0.387CS..  trans-73.1128.6171.2-53.4-58.6000109.4L137 K138 L141 F240 V241 L268I133-L137 HydrophobicContact CG2-CB 3.97Å; I133-K138 HydrophobicContact CG2-CG 4.21Å; I133-L141 HydrophobicContact CG2-CD1 4.07Å; I133-F240 HydrophobicContact CD1-CB 3.64Å; I133-V241 HydrophobicContact CD1-CG2 4.34Å; I133-V241 HydrophobicContact CG1-CG2 4.37Å; I133-L268 HydrophobicContact CD1-CD1 4.15Å; I133-L268 HydrophobicContact CD1-CD2 4.16Å
134P97.5Very high85.6Confident21 Ų2175.3 Ų75.314%0.13637%0.368CS..  trans-53.4144.2171.8-25.133000112.3E136 L137 K138 L268 A272P134-E136 WeakPolarHBondContact CB-OE2 3.11Å; P134-E136 PolarHBondContact O-N 2.8Å; P134-L137 HydrophobicContact CB-CD1 4.45Å; P134-L137 HydrophobicContact CB-CG 4.41Å; P134-L137 HydrophobicContact CG-CD1 4.12Å; P134-L137 PolarHBondContact O-N 3.35Å; P134-L137 VanDerWaalsContact O-N 3.1Å; P134-K138 PolarHBondContact O-N 3.36Å; P134-L268 HydrophobicContact CG-CB 3.86Å; P134-A272 HydrophobicContact CB-CB 4.19Å; P134-A272 HydrophobicContact CG-CB 4.39Å
135E94.5Very high87.9Confident124 Ų12473.7 Ų73.758%0.57935%0.354SS*.G310 helixtrans-61.9-32.8-176.1-161.264.4-145.400111.5L137 K138 P139E135-L137 PolarHBondContact O-N 3.04Å; E135-K138 PolarHBondContact O-N 3.05Å; E135-K138 IonicContact OE1-NZ 3.52Å; E135-K138 PolarHBondContact OE1-NZ 2.88Å; E135-K138 WeakPolarHBondContact OE2-CE 3.04Å; E135-K138 IonicContact OE2-NZ 2.7Å; E135-K138 PolarHBondContact OE2-NZ 2.96Å; E135-P139 WeakPolarHBondContact O-CD 3.35Å
136E95.1Very high90Very high123 Ų12369.5 Ų69.558%0.57533%0.332SS*.G310 helixtrans-66-24.1179.9-52.881-177.800112.7P134 A272P134-E136 WeakPolarHBondContact CB-OE2 3.11Å; P134-E136 PolarHBondContact O-N 2.8Å; E136-A272 HydrophobicContact CB-CB 4.48Å
137L96.8Very high91.6Very high0 Ų066.2 Ų66.20%032%0.32CS..G310 helixtrans-95.6-11.7-179.3-66.8-178000113.2I133 P134 E135 W140 L141 L237 L268 L271 A272 F279I133-L137 HydrophobicContact CG2-CB 3.97Å; P134-L137 HydrophobicContact CB-CD1 4.45Å; P134-L137 HydrophobicContact CB-CG 4.41Å; P134-L137 HydrophobicContact CG-CD1 4.12Å; P134-L137 PolarHBondContact O-N 3.35Å; P134-L137 VanDerWaalsContact O-N 3.1Å; E135-L137 PolarHBondContact O-N 3.04Å; L137-W140 PolarHBondContact O-N 3.22Å; L137-L141 PolarHBondContact O-N 2.54Å; L137-L237 HydrophobicContact CB-CD1 4.37Å; L137-L237 HydrophobicContact CB-CD2 4.13Å; L137-L237 HydrophobicContact CD1-CD1 3.81Å; L137-L237 HydrophobicContact CD2-CD2 4.47Å; L137-L268 HydrophobicContact CD1-CD2 4.39Å; L137-L271 HydrophobicContact CD1-CB 4.01Å; L137-A272 HydrophobicContact CD1-CB 4.06Å; L137-A272 HydrophobicContact CD2-CB 4.27Å; L137-A272 HydrophobicContact CG-CB 3.91Å; L137-F279 HydrophobicContact CD2-CD2 4.22Å; L137-F279 HydrophobicContact CD2-CE2 3.62Å; L137-F279 HydrophobicContact CD2-CZ 4.23Å
138K94.8Very high93.2Very high85 Ų8564 Ų6437%0.3731%0.307SS..Hα-helixtrans-68.4-42.8179.2-66.5178.6-173.6170.20113.3I133 P134 E135 W140 L141 V142I133-K138 HydrophobicContact CG2-CG 4.21Å; P134-K138 PolarHBondContact O-N 3.36Å; E135-K138 PolarHBondContact O-N 3.05Å; E135-K138 IonicContact OE1-NZ 3.52Å; E135-K138 PolarHBondContact OE1-NZ 2.88Å; E135-K138 WeakPolarHBondContact OE2-CE 3.04Å; E135-K138 IonicContact OE2-NZ 2.7Å; E135-K138 PolarHBondContact OE2-NZ 2.96Å; K138-W140 PolarHBondContact O-N 3.4Å; K138-L141 WeakPolarHBondContact O-CB 3.04Å; K138-L141 PolarHBondContact O-N 2.97Å; K138-L141 VanDerWaalsContact O-N 3.14Å; K138-V142 PolarHBondContact O-N 3.17Å
139P94.4Very high94.1Very high71 Ų7160.1 Ų60.146%0.46129%0.291SS..Hα-helixtrans-55.7-42.7173.6-26.635.4000111.7E135 L141 V142 D143E135-P139 WeakPolarHBondContact O-CD 3.35Å; P139-L141 VanDerWaalsContact C-N 3.33Å; P139-L141 PolarHBondContact O-N 3.18Å; P139-V142 WeakPolarHBondContact O-CA 3.05Å; P139-V142 WeakPolarHBondContact O-CB 3.44Å; P139-V142 PolarHBondContact O-N 3.21Å; P139-D143 PolarHBondContact O-N 2.98Å
140W95.9Very high94.4Very high71 Ų7167.3 Ų67.327%0.26932%0.316SS..Hα-helixtrans-60.1-37.5176.7-77.2112.5000113.9L137 K138 V142 D143 D144 F279L137-W140 PolarHBondContact O-N 3.22Å; K138-W140 PolarHBondContact O-N 3.4Å; W140-V142 VanDerWaalsContact C-N 3.32Å; W140-D143 PolarHBondContact O-N 3.49Å; W140-D144 WeakPolarHBondContact O-CB 3.31Å; W140-D144 PolarHBondContact O-N 3.29Å; W140-F279 HydrophobicContact CD2-CB 3.52Å; W140-F279 HydrophobicContact CD2-CG 4.21Å; W140-F279 HydrophobicContact CE3-CB 3.63Å; W140-F279 HydrophobicContact CG-CB 4.07Å; W140-F279 HydrophobicContact CG-CD2 4.48Å; W140-F279 HydrophobicContact CG-CG 4.25Å; W140-F279 HydrophobicContact CH2-CB 4.04Å; W140-F279 WeakPolarHBondContact CH2-O 3.39Å; W140-F279 HydrophobicContact CZ2-CB 3.95Å; W140-F279 WeakPolarHBondContact CZ2-O 3.03Å; W140-F279 HydrophobicContact CZ3-CB 3.89Å
141L95.1Very high94.9Very high30 Ų3063.6 Ų63.616%0.15730%0.301CS..Hα-helixtrans-66.3-34.4173.9-76.5169000112.5I133 L137 K138 P139 W145 L237 R238 V241I133-L141 HydrophobicContact CG2-CD1 4.07Å; L137-L141 PolarHBondContact O-N 2.54Å; K138-L141 WeakPolarHBondContact O-CB 3.04Å; K138-L141 PolarHBondContact O-N 2.97Å; K138-L141 VanDerWaalsContact O-N 3.14Å; P139-L141 VanDerWaalsContact C-N 3.33Å; P139-L141 PolarHBondContact O-N 3.18Å; L141-W145 WeakPolarHBondContact O-CB 3.45Å; L141-W145 PolarHBondContact O-N 3.33Å; L141-W145 VanDerWaalsContact O-N 3.14Å; L141-L237 HydrophobicContact CD2-CD2 4.03Å; L141-L237 HydrophobicContact CD2-CG 3.92Å; L141-L237 HydrophobicContact CG-CD2 3.91Å; L141-L237 HydrophobicContact CG-CG 4.17Å; L141-R238 HydrophobicContact CD2-CG 4.39Å; L141-V241 HydrophobicContact CD1-CG2 3.7Å; L141-V241 HydrophobicContact CD2-CG2 4.08Å
142V95.2Very high95.1Very high90 Ų9066.4 Ų66.455%0.54531%0.312SS..Hα-helixtrans-71.6-44.7176.3177.50000110.3K138 P139 W140 W145 D146K138-V142 PolarHBondContact O-N 3.17Å; P139-V142 WeakPolarHBondContact O-CA 3.05Å; P139-V142 WeakPolarHBondContact O-CB 3.44Å; P139-V142 PolarHBondContact O-N 3.21Å; W140-V142 VanDerWaalsContact C-N 3.32Å; V142-W145 PolarHBondContact O-N 3.21Å; V142-D146 PolarHBondContact O-N 2.9Å
143D93.3Very high95.3Very high80 Ų8061.3 Ų61.343%0.42829%0.291SS..Hα-helixtrans-64.6-45.2178.6-66.4-20.3000111.2P139 W140 W145 D146 L147P139-D143 PolarHBondContact O-N 2.98Å; W140-D143 PolarHBondContact O-N 3.49Å; D143-W145 VanDerWaalsContact C-N 3.34Å; D143-W145 PolarHBondContact O-N 3.16Å; D143-D146 PolarHBondContact O-N 3.3Å; D143-D146 VanDerWaalsContact O-N 3.14Å; D143-L147 WeakPolarHBondContact O-CB 3.45Å; D143-L147 VanDerWaalsContact O-CG 3.23Å; D143-L147 WeakPolarHBondContact O-CG 3.43Å; D143-L147 PolarHBondContact O-N 3.34Å
144D97Very high95.4Very high8 Ų860.7 Ų60.74%0.04329%0.287CS..Hα-helixtrans-55.8-47.1172.9167.967.7000111.8W140 D146 I148 R238 Y284W140-D144 WeakPolarHBondContact O-CB 3.31Å; W140-D144 PolarHBondContact O-N 3.29Å; D144-D146 VanDerWaalsContact C-N 3.35Å; D144-D146 PolarHBondContact O-N 3.38Å; D144-I148 WeakPolarHBondContact O-CG1 3.47Å; D144-I148 PolarHBondContact O-N 3.1Å; D144-I148 VanDerWaalsContact O-N 3.16Å; D144-R238 VanDerWaalsContact CG-NH2 3.31Å; D144-R238 IonicContact OD1-CZ 3.63Å; D144-R238 IonicContact OD1-NE 2.82Å; D144-R238 IonicContact OD1-NH2 3.01Å; D144-R238 PolarHBondContact OD1-NH2 3.22Å; D144-R238 IonicContact OD2-CZ 3.58Å; D144-R238 VanDerWaalsContact OD2-CZ 3.27Å; D144-R238 IonicContact OD2-NE 3.53Å; D144-R238 PolarHBondContact OD2-NE 2.84Å; D144-R238 IonicContact OD2-NH2 2.64Å; D144-R238 PolarHBondContact OD2-NH2 3.39Å; D144-R238 VanDerWaalsContact OD2-NH2 3.13Å; D144-Y284 PolarHBondContact OD1-OH 2.96Å
145W96.6Very high95.4Very high113 Ų11360.3 Ų60.343%0.42828%0.284SS..Hα-helixtrans-60.7-43.117517482.7000112.1L141 V142 D143 T149 R150 Y208L141-W145 WeakPolarHBondContact O-CB 3.45Å; L141-W145 PolarHBondContact O-N 3.33Å; L141-W145 VanDerWaalsContact O-N 3.14Å; V142-W145 PolarHBondContact O-N 3.21Å; D143-W145 VanDerWaalsContact C-N 3.34Å; D143-W145 PolarHBondContact O-N 3.16Å; W145-T149 VanDerWaalsContact CE2-OG1 3.31Å; W145-T149 HydrophobicContact CG-CG2 4.38Å; W145-T149 VanDerWaalsContact O-CB 3.27Å; W145-T149 WeakPolarHBondContact O-CB 3.46Å; W145-T149 WeakPolarHBondContact O-CG2 3.4Å; W145-T149 PolarHBondContact O-N 3.47Å; W145-T149 PolarHBondContact O-OG1 3.31Å; W145-R150 HydrophobicContact CH2-CG 4.33Å; W145-R150 HydrophobicContact CZ3-CG 4.45Å; W145-Y208 AromaticContact CD1-CE1 3.64Å; W145-Y208 AromaticContact CD1-CZ 3.77Å
146D94Very high95.6Very high28 Ų2858.6 Ų58.615%0.1527%0.273CS..Hα-helixtrans-66.5-46.4-179.7-169.875.2000111.9V142 D143 D144 I148 R150 Q151V142-D146 PolarHBondContact O-N 2.9Å; D143-D146 PolarHBondContact O-N 3.3Å; D143-D146 VanDerWaalsContact O-N 3.14Å; D144-D146 VanDerWaalsContact C-N 3.35Å; D144-D146 PolarHBondContact O-N 3.38Å; D146-I148 PolarHBondContact O-N 2.85Å; D146-R150 WeakPolarHBondContact O-CA 3.34Å; D146-R150 WeakPolarHBondContact O-CB 3.33Å; D146-R150 PolarHBondContact O-N 3.22Å; D146-R150 WeakPolarHBondContact OD1-CD 3.45Å; D146-R150 IonicContact OD1-CZ 3.53Å; D146-R150 IonicContact OD1-NE 2.74Å; D146-R150 IonicContact OD1-NH1 3.7Å; D146-R150 PolarHBondContact OD1-NH1 2.9Å; D146-Q151 PolarHBondContact O-N 3.47Å; D146-Q151 PolarHBondContact OD2-NE2 3.37Å
147L96.6Very high95.7Very high14 Ų1454.3 Ų54.37%0.07325%0.254CS..Hα-helixtrans-54.7-50.7177.7-74.3167.6000111.1D143 Q151 K152 Q153 A281 Y284D143-L147 WeakPolarHBondContact O-CB 3.45Å; D143-L147 VanDerWaalsContact O-CG 3.23Å; D143-L147 WeakPolarHBondContact O-CG 3.43Å; D143-L147 PolarHBondContact O-N 3.34Å; L147-Q151 CarbonylContact O-C 3.35Å; L147-Q151 WeakPolarHBondContact O-CB 3.4Å; L147-K152 PolarHBondContact O-N 3.03Å; L147-K152 VanDerWaalsContact O-N 3.13Å; L147-Q153 HydrophobicContact CD2-CG 4.49Å; L147-Q153 PolarHBondContact O-N 3.48Å; L147-A281 HydrophobicContact CD1-CB 4.37Å; L147-Y284 HydrophobicContact CB-CD1 4.31Å; L147-Y284 HydrophobicContact CD1-CD1 4.38Å; L147-Y284 HydrophobicContact CD1-CD2 3.89Å; L147-Y284 HydrophobicContact CD1-CE1 4.45Å; L147-Y284 HydrophobicContact CD1-CE2 3.97Å; L147-Y284 HydrophobicContact CD1-CG 4.11Å
148I95.6Very high95.7Very high0 Ų058.3 Ų58.30%028%0.279CS..Hα-helixtrans-73.9-50.7-178.2-59.3-58.9000111.8D144 D146 Q153 Y208 F210 E211 Y284D144-I148 WeakPolarHBondContact O-CG1 3.47Å; D144-I148 PolarHBondContact O-N 3.1Å; D144-I148 VanDerWaalsContact O-N 3.16Å; D146-I148 PolarHBondContact O-N 2.85Å; I148-Q153 WeakPolarHBondContact CA-O 3.26Å; I148-Q153 WeakPolarHBondContact CD1-O 3.39Å; I148-Y208 HydrophobicContact CB-CD2 3.87Å; I148-Y208 HydrophobicContact CB-CE2 4.39Å; I148-Y208 HydrophobicContact CG1-CD2 4.16Å; I148-Y208 HydrophobicContact CG1-CE2 4.47Å; I148-Y208 HydrophobicContact CG2-CD2 3.71Å; I148-Y208 HydrophobicContact CG2-CG 4.23Å; I148-F210 HydrophobicContact CG2-CB 4.15Å; I148-F210 HydrophobicContact CG2-CD1 4.33Å; I148-F210 WeakPolarHBondContact O-CD1 3.47Å; I148-E211 HydrophobicContact CD1-CG 4.33Å; I148-E211 HydrophobicContact CG2-CG 3.75Å; I148-Y284 HydrophobicContact CD1-CD1 3.85Å; I148-Y284 HydrophobicContact CD1-CE1 3.66Å; I148-Y284 HydrophobicContact CG1-CE1 4.21Å
149T92.5Very high95.8Very high33 Ų3354.8 Ų54.820%0.20227%0.266CS..Hα-helixtrans-86.3-34.9-165.768.90000113.3W145 K152 Y208W145-T149 VanDerWaalsContact CE2-OG1 3.31Å; W145-T149 HydrophobicContact CG-CG2 4.38Å; W145-T149 VanDerWaalsContact O-CB 3.27Å; W145-T149 WeakPolarHBondContact O-CB 3.46Å; W145-T149 WeakPolarHBondContact O-CG2 3.4Å; W145-T149 PolarHBondContact O-N 3.47Å; W145-T149 PolarHBondContact O-OG1 3.31Å; T149-K152 WeakPolarHBondContact O-CE 2.93Å; T149-K152 PolarHBondContact O-NZ 3.36Å; T149-Y208 HydrophobicContact CG2-CD1 4.07Å; T149-Y208 HydrophobicContact CG2-CD2 4.29Å; T149-Y208 HydrophobicContact CG2-CG 3.94Å
150R91.6Very high95.9Very high170 Ų17059.5 Ų59.564%0.64228%0.279SS*.THydrogen-bonded Turntrans-102.6-47.3-176.7-68.5-175.757.8-142.77112.1W145 D146 K152W145-R150 HydrophobicContact CH2-CG 4.33Å; W145-R150 HydrophobicContact CZ3-CG 4.45Å; D146-R150 WeakPolarHBondContact O-CA 3.34Å; D146-R150 WeakPolarHBondContact O-CB 3.33Å; D146-R150 PolarHBondContact O-N 3.22Å; D146-R150 WeakPolarHBondContact OD1-CD 3.45Å; D146-R150 IonicContact OD1-CZ 3.53Å; D146-R150 IonicContact OD1-NE 2.74Å; D146-R150 IonicContact OD1-NH1 3.7Å; D146-R150 PolarHBondContact OD1-NH1 2.9Å; R150-K152 VanDerWaalsContact C-N 3.31Å; R150-K152 PolarHBondContact O-N 2.87Å
151Q93.7Very high96Very high92 Ų9260.2 Ų60.243%0.4328%0.284SS..SBendtrans-83.7-7-177.9-52.7-173.728.300113.7D146 L147 Q153D146-Q151 PolarHBondContact O-N 3.47Å; D146-Q151 PolarHBondContact OD2-NE2 3.37Å; L147-Q151 CarbonylContact O-C 3.35Å; L147-Q151 WeakPolarHBondContact O-CB 3.4Å; Q151-Q153 HydrophobicContact CB-CG 4.08Å; Q151-Q153 PolarHBondContact O-N 3.48Å
152K96.4Very high96.1Very high77 Ų7760.2 Ų60.234%0.33529%0.285SS..  trans57.236.2177.8-51.8-56.8-174-167.20112.4L147 T149 R150 F210 A287L147-K152 PolarHBondContact O-N 3.03Å; L147-K152 VanDerWaalsContact O-N 3.13Å; T149-K152 WeakPolarHBondContact O-CE 2.93Å; T149-K152 PolarHBondContact O-NZ 3.36Å; R150-K152 VanDerWaalsContact C-N 3.31Å; R150-K152 PolarHBondContact O-N 2.87Å; K152-F210 HydrophobicContact CB-CE1 3.93Å; K152-F210 HydrophobicContact CB-CZ 3.79Å; K152-F210 HydrophobicContact CD-CD1 4.44Å; K152-F210 HydrophobicContact CD-CD2 4.17Å; K152-F210 HydrophobicContact CD-CE1 4.26Å; K152-F210 HydrophobicContact CD-CE2 3.97Å; K152-F210 HydrophobicContact CD-CG 4.4Å; K152-F210 HydrophobicContact CD-CZ 4.02Å; K152-F210 HydrophobicContact CG-CZ 4.42Å; K152-A287 VanDerWaalsContact O-CB 3.28Å; K152-A287 WeakPolarHBondContact O-CB 3.42Å; K152-A287 PolarHBondContact O-N 2.93Å
153Q97.8Very high96.3Very high30 Ų3056 Ų5614%0.1426%0.259CS..EExtended strand (participates in β ladder)trans-89.1161.4170.1-56-165.632.200110.4L147 I148 Q151 Y284 E285 V286L147-Q153 HydrophobicContact CD2-CG 4.49Å; L147-Q153 PolarHBondContact O-N 3.48Å; I148-Q153 WeakPolarHBondContact CA-O 3.26Å; I148-Q153 WeakPolarHBondContact CD1-O 3.39Å; Q151-Q153 HydrophobicContact CB-CG 4.08Å; Q151-Q153 PolarHBondContact O-N 3.48Å; Q153-Y284 VanDerWaalsContact OE1-CB 3.3Å; Q153-E285 CarbonylContact C-O 3.53Å; Q153-E285 WeakPolarHBondContact CA-O 3.49Å; Q153-E285 WeakPolarHBondContact CB-O 3.43Å; Q153-V286 HydrophobicContact CG-CG2 4.18Å
154L98.1Very high96.6Very high14 Ų1453.5 Ų53.57%0.07325%0.246CC..EExtended strand (participates in β ladder)trans-128.8146.8173.5-67.4167.3000108.8F210 E211 Y284 E285 A287 Y291L154-F210 HydrophobicContact CD2-CD1 3.94Å; L154-F210 HydrophobicContact CD2-CE1 4.07Å; L154-F210 HydrophobicContact CG-CE1 4.17Å; L154-E211 HydrophobicContact CD2-CG 4.11Å; L154-Y284 CarbonylContact O-C 3.53Å; L154-Y284 WeakPolarHBondContact O-CA 3.49Å; L154-E285 PolarHBondContact N-O 3.46Å; L154-E285 PolarHBondContact O-N 3.33Å; L154-A287 HydrophobicContact CD1-CB 3.77Å; L154-A287 HydrophobicContact CG-CB 4.08Å; L154-Y291 HydrophobicContact CD1-CD1 3.82Å; L154-Y291 HydrophobicContact CD1-CD2 3.83Å; L154-Y291 HydrophobicContact CD1-CE1 3.54Å; L154-Y291 HydrophobicContact CD1-CE2 3.52Å; L154-Y291 HydrophobicContact CD1-CG 3.96Å; L154-Y291 HydrophobicContact CD2-CE1 4.02Å; L154-Y291 HydrophobicContact CG-CE1 4.24Å
155F98.3Very high96.6Very high13 Ų1354.8 Ų54.86%0.05726%0.255CS..EExtended strand (participates in β ladder)trans-69.7140.9172-171.3-96.2000110L157 A159 Q214 P234 H235 D283 Y284F155-L157 HydrophobicContact CD1-CD2 3.74Å; F155-L157 HydrophobicContact CD1-CG 4.44Å; F155-L157 HydrophobicContact CE1-CD2 4.26Å; F155-L157 PolarHBondContact O-N 3.15Å; F155-A159 HydrophobicContact CE1-CB 3.75Å; F155-A159 HydrophobicContact CZ-CB 4.41Å; F155-Q214 PolarHBondContact O-NE2 3.02Å; F155-P234 HydrophobicContact CD2-CG 3.92Å; F155-P234 HydrophobicContact CE2-CG 3.65Å; F155-P234 HydrophobicContact CZ-CG 4.43Å; F155-H235 AromaticContact CG-CE1 3.95Å; F155-D283 WeakPolarHBondContact CA-O 3.35Å; F155-D283 HydrophobicContact CD2-CB 4.12Å; F155-D283 WeakPolarHBondContact CD2-O 3.44Å; F155-D283 HydrophobicContact CE2-CB 3.54Å; F155-D283 HydrophobicContact CZ-CB 4.15Å; F155-Y284 HydrophobicContact CB-CD1 4.16Å; F155-Y284 HydrophobicContact CB-CE1 3.92Å; F155-Y284 HydrophobicContact CD2-CD1 4.48Å; F155-Y284 HydrophobicContact CD2-CD2 4.29Å; F155-Y284 HydrophobicContact CD2-CE1 4.05Å; F155-Y284 AromaticContact CD2-CE2 3.85Å; F155-Y284 HydrophobicContact CD2-CE2 3.85Å; F155-Y284 AromaticContact CD2-CZ 3.7Å; F155-Y284 HydrophobicContact CE2-CE2 4.42Å
156Y97.8Very high96.7Very high89 Ų8949.4 Ų49.435%0.34924%0.235SC..  trans-65.2120.4175.6-73.8-70.2000110.8D283 E285Y156-D283 VanDerWaalsContact CD2-O 3.24Å; Y156-D283 WeakPolarHBondContact CD2-O 2.95Å; Y156-D283 PolarHBondContact N-O 2.65Å; Y156-E285 HydrophobicContact CE1-CB 3.73Å; Y156-E285 HydrophobicContact CE1-CG 4.2Å; Y156-E285 VanDerWaalsContact CE1-OE2 3.22Å; Y156-E285 WeakPolarHBondContact CE1-OE2 3.48Å; Y156-E285 HydrophobicContact CE2-CB 4.24Å; Y156-E285 WeakPolarHBondContact OH-CB 3.33Å; Y156-E285 WeakPolarHBondContact OH-CG 3.42Å
157L97.1Very high96.9Very high33 Ų3348.1 Ų48.117%0.17323%0.228CC..SBendtrans-119.6140.6173.2-60.9-179.9000110.1F155 Q214 I218 V230 Y231F155-L157 HydrophobicContact CD1-CD2 3.74Å; F155-L157 HydrophobicContact CD1-CG 4.44Å; F155-L157 HydrophobicContact CE1-CD2 4.26Å; F155-L157 PolarHBondContact O-N 3.15Å; L157-Q214 VanDerWaalsContact CD1-CD 3.47Å; L157-Q214 HydrophobicContact CD1-CG 3.87Å; L157-I218 HydrophobicContact CB-CD1 4.08Å; L157-I218 HydrophobicContact CD1-CD1 4.44Å; L157-I218 HydrophobicContact CD1-CG1 4.02Å; L157-V230 HydrophobicContact CB-CG1 4.35Å; L157-V230 HydrophobicContact CD2-CG1 4.35Å; L157-V230 WeakPolarHBondContact CD2-O 3.48Å; L157-Y231 HydrophobicContact CD1-CD1 4.09Å; L157-Y231 HydrophobicContact CD1-CE1 3.5Å; L157-Y231 VanDerWaalsContact CD1-CE1 3.5Å; L157-Y231 HydrophobicContact CD1-CE2 4.08Å; L157-Y231 VanDerWaalsContact CD1-CZ 3.48Å; L157-Y231 HydrophobicContact CD2-CD1 3.82Å; L157-Y231 HydrophobicContact CD2-CE1 4.11Å; L157-Y231 HydrophobicContact CD2-CG 4.1Å; L157-Y231 HydrophobicContact CG-CE1 4.44Å
158P97.1Very high97Very high83 Ų8353.1 Ų53.154%0.53925%0.251SS..SBendcis-65.6147-5.5-20.734000113.5K160P158-K160 PolarHBondContact O-N 3.27Å
159A97.7Very high97.1Very high11 Ų1156 Ų569%0.09127%0.266CS..  trans-65.3132.2-176.400000111.8F155 K161 N162 V230F155-A159 HydrophobicContact CE1-CB 3.75Å; F155-A159 HydrophobicContact CZ-CB 4.41Å; A159-K161 VanDerWaalsContact C-N 3.25Å; A159-K161 PolarHBondContact O-N 2.64Å; A159-N162 HydrophobicContact CB-CB 4.35Å; A159-V230 VanDerWaalsContact CB-O 3.25Å; A159-V230 WeakPolarHBondContact CB-O 3.42Å; A159-V230 PolarHBondContact N-O 3.38Å
160K96.1Very high97.3Very high170 Ų17054.4 Ų54.474%0.73926%0.256SS*.SBendtrans-56.8-39.8174.3-64.3174.5-171.6157.40112.4P158 D283P158-K160 PolarHBondContact O-N 3.27Å; K160-D283 IonicContact NZ-OD1 3.52Å
161K97.8Very high97.5Very high86 Ų8646.6 Ų46.637%0.37423%0.228SC..SBendtrans-123.596.7172.4-171.373.4176.1-179.20108.2A159 I166 D169A159-K161 VanDerWaalsContact C-N 3.25Å; A159-K161 PolarHBondContact O-N 2.64Å; K161-I166 HydrophobicContact CG-CD1 4.47Å; K161-I166 HydrophobicContact CG-CG1 3.9Å; K161-D169 WeakPolarHBondContact CE-OD2 3.49Å; K161-D169 VanDerWaalsContact NZ-CG 3.3Å; K161-D169 IonicContact NZ-OD1 2.61Å; K161-D169 PolarHBondContact NZ-OD1 2.94Å; K161-D169 IonicContact NZ-OD2 3.7Å; K161-D169 PolarHBondContact NZ-OD2 3.42Å
162N98.6Very high97.5Very high31 Ų3146 Ų4617%0.16623%0.228CC..BIsolated β-bridgetrans-78.4166.7-176.965.319.8000113A159 D164 S165 I166 Q229 Y231A159-N162 HydrophobicContact CB-CB 4.35Å; N162-D164 VanDerWaalsContact C-N 3.28Å; N162-D164 PolarHBondContact O-N 2.93Å; N162-S165 PolarHBondContact O-N 3.11Å; N162-S165 WeakPolarHBondContact OD1-CB 3.4Å; N162-S165 PolarHBondContact OD1-N 3.33Å; N162-S165 PolarHBondContact OD1-OG 3.39Å; N162-I166 WeakPolarHBondContact O-CG1 3.2Å; N162-I166 PolarHBondContact O-N 3.48Å; N162-I166 VanDerWaalsContact O-N 3.11Å; N162-Q229 VanDerWaalsContact CB-O 3.31Å; N162-Q229 WeakPolarHBondContact CB-O 3.24Å; N162-Q229 PolarHBondContact ND2-O 2.92Å; N162-Y231 CarbonylContact C-O 3.57Å; N162-Y231 WeakPolarHBondContact CA-O 3.48Å; N162-Y231 WeakPolarHBondContact CB-O 3.44Å
163V98.8Very high97.3Very high0 Ų044.9 Ų44.90%022%0.222CC..Hα-helixtrans-56.7-41.7179.9172.70000111.9S165 I166 L167 F198 S228 Y231 L236V163-S165 VanDerWaalsContact C-N 3.31Å; V163-S165 PolarHBondContact O-N 3.09Å; V163-I166 PolarHBondContact O-N 2.77Å; V163-I166 VanDerWaalsContact O-N 3.17Å; V163-L167 HydrophobicContact CG1-CD1 3.69Å; V163-L167 HydrophobicContact CG1-CG 4.04Å; V163-L167 WeakPolarHBondContact O-CB 3.23Å; V163-L167 VanDerWaalsContact O-CG 3.29Å; V163-L167 WeakPolarHBondContact O-CG 3.36Å; V163-L167 PolarHBondContact O-N 3.01Å; V163-F198 HydrophobicContact CB-CD1 4.46Å; V163-F198 HydrophobicContact CB-CE1 4.42Å; V163-F198 HydrophobicContact CG1-CD1 4.33Å; V163-F198 HydrophobicContact CG1-CG 4.42Å; V163-F198 HydrophobicContact CG2-CD1 4.13Å; V163-F198 HydrophobicContact CG2-CE1 3.72Å; V163-F198 HydrophobicContact CG2-CE2 4.21Å; V163-F198 HydrophobicContact CG2-CZ 3.77Å; V163-S228 WeakPolarHBondContact CB-O 3.42Å; V163-S228 PolarHBondContact N-O 3.15Å; V163-S228 VanDerWaalsContact N-O 3.12Å; V163-Y231 WeakPolarHBondContact CG2-O 3.31Å; V163-Y231 PolarHBondContact N-O 3.19Å; V163-L236 HydrophobicContact CG1-CD1 3.83Å; V163-L236 HydrophobicContact CG1-CD2 3.99Å; V163-L236 HydrophobicContact CG1-CG 4.37Å; V163-L236 HydrophobicContact CG2-CB 3.87Å; V163-L236 HydrophobicContact CG2-CD1 4.44Å; V163-L236 HydrophobicContact CG2-CD2 4.31Å; V163-L236 HydrophobicContact CG2-CG 4.43Å
164D98.6Very high97Very high29 Ų2946.1 Ų46.116%0.15523%0.227CC..Hα-helixtrans-55.3-47.6177.4-87.920.5000111.8N162 I166 L167 E168 K195 S228 Q229N162-D164 VanDerWaalsContact C-N 3.28Å; N162-D164 PolarHBondContact O-N 2.93Å; D164-I166 PolarHBondContact O-N 3.49Å; D164-L167 PolarHBondContact O-N 3.14Å; D164-E168 WeakPolarHBondContact O-CB 3.34Å; D164-E168 PolarHBondContact O-N 3.17Å; D164-K195 WeakPolarHBondContact OD1-CD 3.27Å; D164-K195 WeakPolarHBondContact OD1-CE 3.34Å; D164-K195 IonicContact OD1-NZ 3.42Å; D164-K195 PolarHBondContact OD1-NZ 2.89Å; D164-K195 IonicContact OD2-NZ 3.48Å; D164-K195 PolarHBondContact OD2-NZ 3.49Å; D164-S228 PolarHBondContact N-O 3.43Å; D164-S228 WeakPolarHBondContact OD1-CB 3.39Å; D164-S228 PolarHBondContact OD1-OG 3.05Å; D164-Q229 HydrophobicContact CB-CG 4.49Å
165S98.6Very high96.4Very high34 Ų3449.6 Ų49.624%0.23824%0.242CC..Hα-helixtrans-65.5-37.7178.4-55.40000112.5N162 V163 D169N162-S165 PolarHBondContact O-N 3.11Å; N162-S165 WeakPolarHBondContact OD1-CB 3.4Å; N162-S165 PolarHBondContact OD1-N 3.33Å; N162-S165 PolarHBondContact OD1-OG 3.39Å; V163-S165 VanDerWaalsContact C-N 3.31Å; V163-S165 PolarHBondContact O-N 3.09Å; S165-D169 WeakPolarHBondContact O-CB 3.43Å; S165-D169 PolarHBondContact O-N 3.44Å
166I98.7Very high95.9Very high1 Ų153.6 Ų53.61%0.00527%0.271CS..Hα-helixtrans-67.4-42.2179.1-64.2164.4000110.6K161 N162 V163 D164 D169 Y170 A233 L236 F267 L271 L278K161-I166 HydrophobicContact CG-CD1 4.47Å; K161-I166 HydrophobicContact CG-CG1 3.9Å; N162-I166 WeakPolarHBondContact O-CG1 3.2Å; N162-I166 PolarHBondContact O-N 3.48Å; N162-I166 VanDerWaalsContact O-N 3.11Å; V163-I166 PolarHBondContact O-N 2.77Å; V163-I166 VanDerWaalsContact O-N 3.17Å; D164-I166 PolarHBondContact O-N 3.49Å; I166-D169 PolarHBondContact O-N 3.18Å; I166-Y170 PolarHBondContact O-N 2.89Å; I166-A233 HydrophobicContact CD1-CB 3.67Å; I166-L236 HydrophobicContact CB-CD2 4.49Å; I166-L236 HydrophobicContact CG2-CD2 4.09Å; I166-F267 HydrophobicContact CG2-CZ 4.22Å; I166-L271 HydrophobicContact CG2-CD2 3.9Å; I166-L278 HydrophobicContact CD1-CD2 4.1Å; I166-L278 HydrophobicContact CG1-CD2 3.92Å
167L98.6Very high95.1Very high1 Ų157.7 Ų57.71%0.00529%0.286CS..Hα-helixtrans-66.9-39.3178.3-71.6177.1000111.7V163 D164 Y170 A171 V191 I194 K195 F267V163-L167 HydrophobicContact CG1-CD1 3.69Å; V163-L167 HydrophobicContact CG1-CG 4.04Å; V163-L167 WeakPolarHBondContact O-CB 3.23Å; V163-L167 VanDerWaalsContact O-CG 3.29Å; V163-L167 WeakPolarHBondContact O-CG 3.36Å; V163-L167 PolarHBondContact O-N 3.01Å; D164-L167 PolarHBondContact O-N 3.14Å; L167-Y170 PolarHBondContact O-N 2.92Å; L167-A171 PolarHBondContact O-N 3.5Å; L167-V191 HydrophobicContact CB-CG1 3.8Å; L167-V191 HydrophobicContact CD1-CG1 4.38Å; L167-V191 HydrophobicContact CD2-CG2 4.49Å; L167-V191 HydrophobicContact CG-CG1 4.47Å; L167-I194 HydrophobicContact CD1-CG2 4.43Å; L167-I194 HydrophobicContact CD2-CB 4.21Å; L167-I194 HydrophobicContact CD2-CD1 4.41Å; L167-I194 HydrophobicContact CD2-CG2 3.86Å; L167-K195 HydrophobicContact CD1-CB 3.82Å; L167-K195 HydrophobicContact CD1-CG 4.46Å; L167-F267 HydrophobicContact CD2-CE1 4.48Å; L167-F267 HydrophobicContact CD2-CE2 3.87Å; L167-F267 HydrophobicContact CD2-CZ 3.71Å
168E97.8Very high93.6Very high119 Ų11957.7 Ų57.756%0.55629%0.294SS*.Hα-helixtrans-63.9-46.9173.7-177.5172.7-154.200111.9D164 Y170 A171 N172D164-E168 WeakPolarHBondContact O-CB 3.34Å; D164-E168 PolarHBondContact O-N 3.17Å; E168-Y170 VanDerWaalsContact C-N 3.25Å; E168-Y170 PolarHBondContact O-N 3.36Å; E168-A171 PolarHBondContact O-N 3.29Å; E168-A171 VanDerWaalsContact O-N 3.15Å; E168-N172 WeakPolarHBondContact O-CB 3.25Å; E168-N172 PolarHBondContact O-N 3.35Å; E168-N172 PolarHBondContact O-ND2 3.23Å
169D97.8Very high91.6Very high59 Ų5961.9 Ų61.932%0.31631%0.312SS..Hα-helixtrans-57.1-41.5176.1-71.3-11000111.4K161 S165 I166 Y173 Y270K161-D169 WeakPolarHBondContact CE-OD2 3.49Å; K161-D169 VanDerWaalsContact NZ-CG 3.3Å; K161-D169 IonicContact NZ-OD1 2.61Å; K161-D169 PolarHBondContact NZ-OD1 2.94Å; K161-D169 IonicContact NZ-OD2 3.7Å; K161-D169 PolarHBondContact NZ-OD2 3.42Å; S165-D169 WeakPolarHBondContact O-CB 3.43Å; S165-D169 PolarHBondContact O-N 3.44Å; I166-D169 PolarHBondContact O-N 3.18Å; D169-Y173 VanDerWaalsContact O-CB 3.23Å; D169-Y173 WeakPolarHBondContact O-CB 3.49Å; D169-Y173 PolarHBondContact O-N 2.76Å; D169-Y270 VanDerWaalsContact CB-OH 3.28Å; D169-Y270 WeakPolarHBondContact CB-OH 3.48Å
170Y96.9Very high90.1Very high0 Ų064.8 Ų64.80%033%0.329CS..Hα-helixtrans-65.4-46.1175.8170.5-106.9000112.2I166 L167 E168 N172 Y173 K174 V187 V191 D266 F267 Y270I166-Y170 PolarHBondContact O-N 2.89Å; L167-Y170 PolarHBondContact O-N 2.92Å; E168-Y170 VanDerWaalsContact C-N 3.25Å; E168-Y170 PolarHBondContact O-N 3.36Å; Y170-N172 VanDerWaalsContact C-N 3.3Å; Y170-N172 PolarHBondContact O-N 3.25Å; Y170-Y173 HydrophobicContact CD2-CD1 4.39Å; Y170-Y173 WeakPolarHBondContact O-CB 3.31Å; Y170-Y173 PolarHBondContact O-N 3.06Å; Y170-K174 HydrophobicContact CD1-CG 4.49Å; Y170-K174 HydrophobicContact CD2-CD 4.48Å; Y170-K174 HydrophobicContact CD2-CG 4.18Å; Y170-K174 HydrophobicContact CE1-CG 4.09Å; Y170-K174 HydrophobicContact CE2-CD 3.74Å; Y170-K174 HydrophobicContact CE2-CG 3.73Å; Y170-K174 WeakPolarHBondContact O-CG 3.32Å; Y170-K174 PolarHBondContact O-N 2.92Å; Y170-V187 HydrophobicContact CD1-CG1 4.5Å; Y170-V187 HydrophobicContact CE1-CG1 4.16Å; Y170-V191 HydrophobicContact CD1-CG2 3.86Å; Y170-V191 HydrophobicContact CE1-CG2 4.28Å; Y170-D266 PolarHBondContact OH-OD2 3.27Å; Y170-F267 AromaticContact CD1-CD2 3.5Å; Y170-F267 HydrophobicContact CD1-CD2 3.5Å; Y170-F267 HydrophobicContact CD1-CE2 4Å; Y170-F267 AromaticContact CD2-CD2 3.67Å; Y170-F267 HydrophobicContact CD2-CD2 3.67Å; Y170-F267 HydrophobicContact CD2-CE2 4.31Å; Y170-F267 HydrophobicContact CE1-CB 4.33Å; Y170-F267 AromaticContact CE1-CD2 3.81Å; Y170-F267 HydrophobicContact CE1-CD2 3.81Å; Y170-F267 HydrophobicContact CE2-CB 4.23Å; Y170-F267 AromaticContact CE2-CD2 3.97Å; Y170-F267 HydrophobicContact CE2-CD2 3.97Å; Y170-F267 AromaticContact CG-CD2 3.41Å; Y170-F267 HydrophobicContact CG-CD2 3.41Å; Y170-F267 VanDerWaalsContact CG-CD2 3.41Å; Y170-F267 AromaticContact CG-CE2 3.76Å; Y170-F267 HydrophobicContact CG-CE2 3.76Å; Y170-Y270 AromaticContact CD2-CD1 3.95Å; Y170-Y270 HydrophobicContact CD2-CD1 3.95Å; Y170-Y270 HydrophobicContact CD2-CD2 4.08Å; Y170-Y270 AromaticContact CD2-CG 3.67Å; Y170-Y270 HydrophobicContact CD2-CG 3.67Å; Y170-Y270 HydrophobicContact CE2-CG 4.45Å; Y170-Y270 HydrophobicContact CG-CD1 4.43Å
171A95Very high88.7Confident7 Ų763 Ų636%0.05833%0.327CS..Hα-helixtrans-57.2-46.7177.500000110.8L167 E168 Y173 K174 K175 V187 V191L167-A171 PolarHBondContact O-N 3.5Å; E168-A171 PolarHBondContact O-N 3.29Å; E168-A171 VanDerWaalsContact O-N 3.15Å; A171-Y173 PolarHBondContact O-N 3.1Å; A171-K174 PolarHBondContact O-N 3.25Å; A171-K174 VanDerWaalsContact O-N 3.17Å; A171-K175 WeakPolarHBondContact O-CG 3.39Å; A171-K175 PolarHBondContact O-N 2.98Å; A171-V187 HydrophobicContact CB-CG1 4.23Å; A171-V191 HydrophobicContact CB-CG2 4.44Å
172N94.1Very high87.5Confident79 Ų7965.8 Ų65.842%0.42235%0.346SS..Hα-helixtrans-64.6-39.2177.2-69.1-26.4000112.4E168 Y170 K174 K175 S176E168-N172 WeakPolarHBondContact O-CB 3.25Å; E168-N172 PolarHBondContact O-N 3.35Å; E168-N172 PolarHBondContact O-ND2 3.23Å; Y170-N172 VanDerWaalsContact C-N 3.3Å; Y170-N172 PolarHBondContact O-N 3.25Å; N172-K174 VanDerWaalsContact C-N 3.3Å; N172-K174 PolarHBondContact O-N 3.25Å; N172-K175 PolarHBondContact O-N 3.21Å; N172-S176 PolarHBondContact O-N 3.35Å; N172-S176 PolarHBondContact O-OG 3.42Å
173Y91.9Very high86.5Confident54 Ų5470.2 Ų70.221%0.21236%0.364CS..Hα-helixtrans-59.7-38.8172.8169.4-103.2000112.3D169 Y170 A171 S176 R177 Y270D169-Y173 VanDerWaalsContact O-CB 3.23Å; D169-Y173 WeakPolarHBondContact O-CB 3.49Å; D169-Y173 PolarHBondContact O-N 2.76Å; Y170-Y173 HydrophobicContact CD2-CD1 4.39Å; Y170-Y173 WeakPolarHBondContact O-CB 3.31Å; Y170-Y173 PolarHBondContact O-N 3.06Å; A171-Y173 PolarHBondContact O-N 3.1Å; Y173-S176 PolarHBondContact O-OG 3.5Å; Y173-R177 HydrophobicContact CE2-CG 4.46Å; Y173-R177 PolarHBondContact O-N 2.66Å; Y173-R177 PolarHBondContact OH-NE 3.45Å; Y173-R177 PolarHBondContact OH-NH1 3.39Å; Y173-Y270 AromaticContact CD1-CD2 3.63Å; Y173-Y270 HydrophobicContact CD1-CD2 3.63Å; Y173-Y270 HydrophobicContact CD1-CE2 4.07Å; Y173-Y270 HydrophobicContact CD2-CE2 4.48Å; Y173-Y270 AromaticContact CE1-CD2 3.99Å; Y173-Y270 HydrophobicContact CE1-CD2 3.99Å; Y173-Y270 AromaticContact CG-CD2 3.96Å; Y173-Y270 HydrophobicContact CG-CD2 3.96Å; Y173-Y270 AromaticContact CG-CE2 3.92Å; Y173-Y270 HydrophobicContact CG-CE2 3.92Å
174K91Very high85.9Confident56 Ų5673.7 Ų73.724%0.24338%0.38CS..Hα-helixtrans-71.5-40.6176.6-65-59.9-64.7-166.70112.5Y170 A171 N172 R177 G178 V187 D266Y170-K174 HydrophobicContact CD1-CG 4.49Å; Y170-K174 HydrophobicContact CD2-CD 4.48Å; Y170-K174 HydrophobicContact CD2-CG 4.18Å; Y170-K174 HydrophobicContact CE1-CG 4.09Å; Y170-K174 HydrophobicContact CE2-CD 3.74Å; Y170-K174 HydrophobicContact CE2-CG 3.73Å; Y170-K174 WeakPolarHBondContact O-CG 3.32Å; Y170-K174 PolarHBondContact O-N 2.92Å; A171-K174 PolarHBondContact O-N 3.25Å; A171-K174 VanDerWaalsContact O-N 3.17Å; N172-K174 VanDerWaalsContact C-N 3.3Å; N172-K174 PolarHBondContact O-N 3.25Å; K174-R177 PolarHBondContact O-N 3.18Å; K174-G178 PolarHBondContact O-N 3.12Å; K174-V187 HydrophobicContact CB-CG1 4.12Å; K174-V187 HydrophobicContact CB-CG2 3.96Å; K174-V187 HydrophobicContact CG-CG1 4.17Å; K174-V187 HydrophobicContact CG-CG2 4.06Å; K174-D266 WeakPolarHBondContact CD-OD2 3.26Å; K174-D266 WeakPolarHBondContact CE-OD2 3.37Å; K174-D266 VanDerWaalsContact NZ-CG 3.34Å; K174-D266 IonicContact NZ-OD1 3.84Å; K174-D266 PolarHBondContact NZ-OD1 2.94Å; K174-D266 IonicContact NZ-OD2 2.68Å; K174-D266 PolarHBondContact NZ-OD2 2.92Å
175K87.5Confident85.3Confident86 Ų8679.6 Ų79.637%0.37440%0.401SS..Hα-helixtrans-59.5-45.3176-67.3180-162.7-155.70111.7A171 N172 R177 G178 E184A171-K175 WeakPolarHBondContact O-CG 3.39Å; A171-K175 PolarHBondContact O-N 2.98Å; N172-K175 PolarHBondContact O-N 3.21Å; K175-R177 PolarHBondContact O-N 3.15Å; K175-G178 PolarHBondContact O-N 2.8Å; K175-E184 HydrophobicContact CD-CG 4.36Å; K175-E184 WeakPolarHBondContact CD-OE1 3.46Å; K175-E184 WeakPolarHBondContact CE-OE1 3.5Å; K175-E184 HydrophobicContact CG-CG 4.2Å; K175-E184 IonicContact NZ-OE1 3.28Å; K175-E184 PolarHBondContact NZ-OE1 3.02Å
176S86.3Confident84.9Confident97 Ų9779.1 Ų79.168%0.67840%0.399SS*.Hα-helixtrans-67-18.817963.40000114.5N172 Y173N172-S176 PolarHBondContact O-N 3.35Å; N172-S176 PolarHBondContact O-OG 3.42Å; Y173-S176 PolarHBondContact O-OG 3.5Å
177R80.4Confident84.6Confident176 Ų17679.2 Ų79.266%0.66440%0.4SS*.Hα-helixtrans-101.5-5.1-179.4-84.9-163.1168.3-158.9-6.4115.3Y173 K174 K175Y173-R177 HydrophobicContact CE2-CG 4.46Å; Y173-R177 PolarHBondContact O-N 2.66Å; Y173-R177 PolarHBondContact OH-NE 3.45Å; Y173-R177 PolarHBondContact OH-NH1 3.39Å; K174-R177 PolarHBondContact O-N 3.18Å; K175-R177 PolarHBondContact O-N 3.15Å
178G66.1Low84.3Confident33 Ų3382.1 Ų82.134%0.3442%0.416SS..  trans-152.7124.6-174.400000114K174 K175 T180K174-G178 PolarHBondContact O-N 3.12Å; K175-G178 PolarHBondContact O-N 2.8Å; G178-T180 PolarHBondContact O-N 2.82Å
179N55Low84.1Confident171 Ų17181.6 Ų81.691%0.91441%0.413SS*.  trans-96.644.3-171.3-154.327000113.4
180T66.4Low84Confident72 Ų7279.4 Ų79.444%0.44240%0.402SS..  trans-135.8116.1-179.117.30000111.9G178 N182 K183 E184G178-T180 PolarHBondContact O-N 2.82Å; T180-N182 PolarHBondContact O-N 3.44Å; T180-N182 VanDerWaalsContact O-N 3.14Å; T180-K183 WeakPolarHBondContact O-CB 3.16Å; T180-K183 PolarHBondContact O-N 2.92Å; T180-K183 WeakPolarHBondContact OG1-CD 3.31Å; T180-E184 PolarHBondContact O-N 2.87Å
181D66.6Low84Confident132 Ų13280.3 Ų80.371%0.70641%0.407SS*.Hα-helixtrans-52.2-38-176.3-55.2-19.6000113.3K183 E184 Y185D181-K183 PolarHBondContact O-N 3.38Å; D181-E184 WeakPolarHBondContact O-CB 3.14Å; D181-E184 PolarHBondContact O-N 3.39Å; D181-E184 VanDerWaalsContact O-N 3.09Å; D181-Y185 PolarHBondContact O-N 3.26Å; D181-Y185 VanDerWaalsContact O-N 3.16Å
182N72.4Confident84.1Confident144 Ų14482.6 Ų82.677%0.7743%0.426SS*.Hα-helixtrans-62.5-29.2177.6-71.2-4.3000113.3T180 A186T180-N182 PolarHBondContact O-N 3.44Å; T180-N182 VanDerWaalsContact O-N 3.14Å; N182-A186 PolarHBondContact O-N 2.94Å
183K79.2Confident84.1Confident124 Ų12480.1 Ų80.154%0.53942%0.419SS..Hα-helixtrans-77.9-31.8175.9-70.1-178.3-177.7165.70111.6T180 D181 V187T180-K183 WeakPolarHBondContact O-CB 3.16Å; T180-K183 PolarHBondContact O-N 2.92Å; T180-K183 WeakPolarHBondContact OG1-CD 3.31Å; D181-K183 PolarHBondContact O-N 3.38Å; K183-V187 VanDerWaalsContact O-CG2 3.24Å; K183-V187 WeakPolarHBondContact O-CG2 3.41Å; K183-V187 PolarHBondContact O-N 2.9Å
184E84.7Confident84.4Confident74 Ų7477.7 Ų77.735%0.34641%0.41SS..Hα-helixtrans-65.6-47.2177.3-178.2173.3178.900111K175 T180 D181 A186 V187 N188K175-E184 HydrophobicContact CD-CG 4.36Å; K175-E184 WeakPolarHBondContact CD-OE1 3.46Å; K175-E184 WeakPolarHBondContact CE-OE1 3.5Å; K175-E184 HydrophobicContact CG-CG 4.2Å; K175-E184 IonicContact NZ-OE1 3.28Å; K175-E184 PolarHBondContact NZ-OE1 3.02Å; T180-E184 PolarHBondContact O-N 2.87Å; D181-E184 WeakPolarHBondContact O-CB 3.14Å; D181-E184 PolarHBondContact O-N 3.39Å; D181-E184 VanDerWaalsContact O-N 3.09Å; E184-A186 VanDerWaalsContact C-N 3.33Å; E184-A186 PolarHBondContact O-N 2.78Å; E184-V187 PolarHBondContact O-N 2.63Å; E184-V187 VanDerWaalsContact O-N 3.16Å; E184-N188 VanDerWaalsContact O-CG 3.31Å; E184-N188 PolarHBondContact O-N 2.89Å; E184-N188 PolarHBondContact O-ND2 3.41Å
185Y86.9Confident84.8Confident152 Ų15278 Ų7860%0.59641%0.412SS*.Hα-helixtrans-55.8-48.8175.8-180-102.3000111.7D181 V187 N188 E189D181-Y185 PolarHBondContact O-N 3.26Å; D181-Y185 VanDerWaalsContact O-N 3.16Å; Y185-V187 VanDerWaalsContact C-N 3.33Å; Y185-V187 PolarHBondContact O-N 3.34Å; Y185-N188 PolarHBondContact O-N 2.95Å; Y185-E189 HydrophobicContact CD1-CG 4.16Å; Y185-E189 HydrophobicContact CE1-CG 3.69Å; Y185-E189 HydrophobicContact CE2-CG 4.1Å; Y185-E189 WeakPolarHBondContact O-CG 3.46Å; Y185-E189 PolarHBondContact O-N 2.76Å; Y185-E189 PolarHBondContact OH-OE1 3.01Å
186A89.6Confident85.2Confident24 Ų2479.6 Ų79.620%0.19842%0.42CS..Hα-helixtrans-62.5-37.1178.600000113.1N182 E184 V190 Y263N182-A186 PolarHBondContact O-N 2.94Å; E184-A186 VanDerWaalsContact C-N 3.33Å; E184-A186 PolarHBondContact O-N 2.78Å; A186-V190 VanDerWaalsContact O-CG2 3.25Å; A186-V190 WeakPolarHBondContact O-CG2 3.14Å; A186-V190 PolarHBondContact O-N 2.71Å; A186-Y263 HydrophobicContact CB-CE2 3.97Å; A186-Y263 WeakPolarHBondContact CB-OH 3.48Å
187V92.9Very high85.6Confident4 Ų478 Ų782%0.02440%0.4CS..Hα-helixtrans-65.1-44.2175.4168.50000110.8Y170 A171 K174 K183 E184 Y185 V190 V191 Y263Y170-V187 HydrophobicContact CD1-CG1 4.5Å; Y170-V187 HydrophobicContact CE1-CG1 4.16Å; A171-V187 HydrophobicContact CB-CG1 4.23Å; K174-V187 HydrophobicContact CB-CG1 4.12Å; K174-V187 HydrophobicContact CB-CG2 3.96Å; K174-V187 HydrophobicContact CG-CG1 4.17Å; K174-V187 HydrophobicContact CG-CG2 4.06Å; K183-V187 VanDerWaalsContact O-CG2 3.24Å; K183-V187 WeakPolarHBondContact O-CG2 3.41Å; K183-V187 PolarHBondContact O-N 2.9Å; E184-V187 PolarHBondContact O-N 2.63Å; E184-V187 VanDerWaalsContact O-N 3.16Å; Y185-V187 VanDerWaalsContact C-N 3.33Å; Y185-V187 PolarHBondContact O-N 3.34Å; V187-V190 PolarHBondContact O-N 3.24Å; V187-V191 HydrophobicContact CG1-CG2 4.4Å; V187-V191 WeakPolarHBondContact O-CB 3.24Å; V187-V191 WeakPolarHBondContact O-CG2 3.49Å; V187-V191 PolarHBondContact O-N 3.22Å; V187-Y263 HydrophobicContact CG2-CD1 4.3Å; V187-Y263 HydrophobicContact CG2-CE1 3.76Å
188N92.8Very high86.5Confident62 Ų6269.6 Ų69.633%0.33237%0.368SS..Hα-helixtrans-63.8-42.3179.4-66.2-24.1000111.5E184 Y185 V190 V191 A192E184-N188 VanDerWaalsContact O-CG 3.31Å; E184-N188 PolarHBondContact O-N 2.89Å; E184-N188 PolarHBondContact O-ND2 3.41Å; Y185-N188 PolarHBondContact O-N 2.95Å; N188-V190 PolarHBondContact O-N 3.27Å; N188-V191 PolarHBondContact O-N 3.22Å; N188-A192 WeakPolarHBondContact O-CB 3.22Å; N188-A192 PolarHBondContact O-N 3.45Å
189E93.5Very high87.9Confident107 Ų10769.9 Ų69.950%0.536%0.362SS..Hα-helixtrans-60.6-44174.8-72.7-70.4121.400111.9Y185 A192 G193Y185-E189 HydrophobicContact CD1-CG 4.16Å; Y185-E189 HydrophobicContact CE1-CG 3.69Å; Y185-E189 HydrophobicContact CE2-CG 4.1Å; Y185-E189 WeakPolarHBondContact O-CG 3.46Å; Y185-E189 PolarHBondContact O-N 2.76Å; Y185-E189 PolarHBondContact OH-OE1 3.01Å; E189-A192 PolarHBondContact O-N 2.88Å; E189-G193 PolarHBondContact O-N 3.24Å
190V94.6Very high89.8Confident14 Ų1466 Ų669%0.08534%0.344CS..Hα-helixtrans-65.4-43.6177.4171.90000111.1A186 V187 N188 G193 I194 L260 Y263 L264A186-V190 VanDerWaalsContact O-CG2 3.25Å; A186-V190 WeakPolarHBondContact O-CG2 3.14Å; A186-V190 PolarHBondContact O-N 2.71Å; V187-V190 PolarHBondContact O-N 3.24Å; N188-V190 PolarHBondContact O-N 3.27Å; V190-G193 PolarHBondContact O-N 3.25Å; V190-I194 HydrophobicContact CG1-CD1 3.77Å; V190-I194 HydrophobicContact CG1-CG1 4.34Å; V190-I194 VanDerWaalsContact O-CG1 3.31Å; V190-I194 WeakPolarHBondContact O-CG1 3.35Å; V190-I194 PolarHBondContact O-N 3.38Å; V190-L260 HydrophobicContact CG2-CD1 4.13Å; V190-Y263 HydrophobicContact CG2-CD2 4.1Å; V190-Y263 HydrophobicContact CG2-CG 3.94Å; V190-L264 HydrophobicContact CG1-CD2 4.3Å
191V97.2Very high91.1Very high18 Ų1862.6 Ų62.611%0.10932%0.323CS..Hα-helixtrans-61.2-46177.4158.70000111.1L167 Y170 A171 V187 N188 G193 I194 K195L167-V191 HydrophobicContact CB-CG1 3.8Å; L167-V191 HydrophobicContact CD1-CG1 4.38Å; L167-V191 HydrophobicContact CD2-CG2 4.49Å; L167-V191 HydrophobicContact CG-CG1 4.47Å; Y170-V191 HydrophobicContact CD1-CG2 3.86Å; Y170-V191 HydrophobicContact CE1-CG2 4.28Å; A171-V191 HydrophobicContact CB-CG2 4.44Å; V187-V191 HydrophobicContact CG1-CG2 4.4Å; V187-V191 WeakPolarHBondContact O-CB 3.24Å; V187-V191 WeakPolarHBondContact O-CG2 3.49Å; V187-V191 PolarHBondContact O-N 3.22Å; N188-V191 PolarHBondContact O-N 3.22Å; V191-G193 VanDerWaalsContact C-N 3.34Å; V191-G193 PolarHBondContact O-N 2.95Å; V191-I194 PolarHBondContact O-N 3.28Å; V191-K195 PolarHBondContact O-N 3Å
192A96.1Very high92.6Very high55 Ų5556.3 Ų56.346%0.45529%0.289SS..Hα-helixtrans-60.7-44.3175.400000111.2N188 E189 K195 E196N188-A192 WeakPolarHBondContact O-CB 3.22Å; N188-A192 PolarHBondContact O-N 3.45Å; E189-A192 PolarHBondContact O-N 2.88Å; A192-K195 WeakPolarHBondContact O-CB 3.46Å; A192-K195 PolarHBondContact O-N 3.37Å; A192-E196 PolarHBondContact O-N 3.28Å
193G95.8Very high93.5Very high27 Ų2750 Ų5028%0.27826%0.259SS..Hα-helixtrans-59.2-49.1175.500000112.7E189 V190 V191 K195 E196 Y197E189-G193 PolarHBondContact O-N 3.24Å; V190-G193 PolarHBondContact O-N 3.25Å; V191-G193 VanDerWaalsContact C-N 3.34Å; V191-G193 PolarHBondContact O-N 2.95Å; G193-K195 VanDerWaalsContact C-N 3.3Å; G193-K195 PolarHBondContact O-N 2.87Å; G193-E196 PolarHBondContact O-N 3.46Å; G193-Y197 VanDerWaalsContact O-CD2 3.23Å; G193-Y197 WeakPolarHBondContact O-CD2 3.47Å; G193-Y197 PolarHBondContact O-N 2.7Å
194I98Very high94Very high3 Ų348.3 Ų48.32%0.01526%0.259CS..Hα-helixtrans-58.3-44.2177.3-67.8162.9000110.6L167 V190 V191 F198 L236 L239 F240 L264 F267L167-I194 HydrophobicContact CD1-CG2 4.43Å; L167-I194 HydrophobicContact CD2-CB 4.21Å; L167-I194 HydrophobicContact CD2-CD1 4.41Å; L167-I194 HydrophobicContact CD2-CG2 3.86Å; V190-I194 HydrophobicContact CG1-CD1 3.77Å; V190-I194 HydrophobicContact CG1-CG1 4.34Å; V190-I194 VanDerWaalsContact O-CG1 3.31Å; V190-I194 WeakPolarHBondContact O-CG1 3.35Å; V190-I194 PolarHBondContact O-N 3.38Å; V191-I194 PolarHBondContact O-N 3.28Å; I194-F198 VanDerWaalsContact O-CB 3.29Å; I194-F198 WeakPolarHBondContact O-CB 3.22Å; I194-F198 PolarHBondContact O-N 3.41Å; I194-L236 HydrophobicContact CG2-CD1 3.8Å; I194-L239 HydrophobicContact CG2-CD2 4.06Å; I194-F240 HydrophobicContact CD1-CE1 4.45Å; I194-F240 HydrophobicContact CD1-CZ 4.06Å; I194-F240 HydrophobicContact CG1-CZ 4.29Å; I194-F240 HydrophobicContact CG2-CZ 4.15Å; I194-L264 HydrophobicContact CD1-CD2 4.03Å; I194-L264 HydrophobicContact CG1-CD2 3.99Å; I194-F267 HydrophobicContact CD1-CD1 4.25Å; I194-F267 HydrophobicContact CD1-CG 4.31Å
195K98.4Very high94.3Very high64 Ų6448.7 Ų48.728%0.27826%0.261SS..Hα-helixtrans-59.5-47.2177.6-173.7-178-63.3-155.20111.8D164 L167 V191 A192 G193 F198 N199D164-K195 WeakPolarHBondContact OD1-CD 3.27Å; D164-K195 WeakPolarHBondContact OD1-CE 3.34Å; D164-K195 IonicContact OD1-NZ 3.42Å; D164-K195 PolarHBondContact OD1-NZ 2.89Å; D164-K195 IonicContact OD2-NZ 3.48Å; D164-K195 PolarHBondContact OD2-NZ 3.49Å; L167-K195 HydrophobicContact CD1-CB 3.82Å; L167-K195 HydrophobicContact CD1-CG 4.46Å; V191-K195 PolarHBondContact O-N 3Å; A192-K195 WeakPolarHBondContact O-CB 3.46Å; A192-K195 PolarHBondContact O-N 3.37Å; G193-K195 VanDerWaalsContact C-N 3.3Å; G193-K195 PolarHBondContact O-N 2.87Å; K195-F198 WeakPolarHBondContact O-CB 3.42Å; K195-F198 PolarHBondContact O-N 2.9Å; K195-N199 PolarHBondContact O-N 3.14Å; K195-N199 PolarHBondContact O-ND2 2.92Å
196E96.1Very high94.8Very high119 Ų11941.7 Ų41.756%0.55623%0.233SC*.Hα-helixtrans-64.4-47.3-179.1-17060.3-158.100111.5A192 G193 F198 N199 V200A192-E196 PolarHBondContact O-N 3.28Å; G193-E196 PolarHBondContact O-N 3.46Å; E196-F198 VanDerWaalsContact C-N 3.27Å; E196-F198 PolarHBondContact O-N 2.87Å; E196-N199 PolarHBondContact O-N 3.3Å; E196-V200 WeakPolarHBondContact O-CG2 3.43Å; E196-V200 PolarHBondContact O-N 3.33Å
197Y95.7Very high95.2Very high62 Ų6241.1 Ų41.124%0.24323%0.227CC..Hα-helixtrans-58.4-41.4173.9-87.3-74.6000111.6G193 M201 I243 M246 T250G193-Y197 VanDerWaalsContact O-CD2 3.23Å; G193-Y197 WeakPolarHBondContact O-CD2 3.47Å; G193-Y197 PolarHBondContact O-N 2.7Å; Y197-M201 HydrophobicContact CD1-SD 3.83Å; Y197-M201 WeakPolarHBondContact O-CB 3.48Å; Y197-M201 WeakPolarHBondContact O-CG 3.18Å; Y197-M201 PolarHBondContact O-N 3.43Å; Y197-I243 HydrophobicContact CD1-CD1 4.38Å; Y197-I243 HydrophobicContact CD1-CG1 4.23Å; Y197-I243 HydrophobicContact CD2-CD1 4.04Å; Y197-I243 HydrophobicContact CG-CD1 3.9Å; Y197-I243 HydrophobicContact CG-CG1 4.25Å; Y197-M246 HydrophobicContact CD1-CB 4.32Å; Y197-M246 HydrophobicContact CE1-CB 3.7Å; Y197-M246 HydrophobicContact CE1-CG 4.33Å; Y197-T250 PolarHBondContact OH-OG1 2.78Å; Y197-T250 VanDerWaalsContact OH-OG1 3.1Å
198F98.4Very high95.4Very high0 Ų043.9 Ų43.90%024%0.237CC..Hα-helixtrans-61.4-49.9177.5-172.6-98.2000111.6V163 I194 K195 E196 V200 M201 L202 L206 M227 Y231 H235 L236 L239V163-F198 HydrophobicContact CB-CD1 4.46Å; V163-F198 HydrophobicContact CB-CE1 4.42Å; V163-F198 HydrophobicContact CG1-CD1 4.33Å; V163-F198 HydrophobicContact CG1-CG 4.42Å; V163-F198 HydrophobicContact CG2-CD1 4.13Å; V163-F198 HydrophobicContact CG2-CE1 3.72Å; V163-F198 HydrophobicContact CG2-CE2 4.21Å; V163-F198 HydrophobicContact CG2-CZ 3.77Å; I194-F198 VanDerWaalsContact O-CB 3.29Å; I194-F198 WeakPolarHBondContact O-CB 3.22Å; I194-F198 PolarHBondContact O-N 3.41Å; K195-F198 WeakPolarHBondContact O-CB 3.42Å; K195-F198 PolarHBondContact O-N 2.9Å; E196-F198 VanDerWaalsContact C-N 3.27Å; E196-F198 PolarHBondContact O-N 2.87Å; F198-V200 VanDerWaalsContact C-N 3.34Å; F198-V200 PolarHBondContact O-N 3.16Å; F198-M201 PolarHBondContact O-N 3.11Å; F198-L202 HydrophobicContact CE1-CG 4.44Å; F198-L202 HydrophobicContact CZ-CD2 4.16Å; F198-L202 HydrophobicContact CZ-CG 4.27Å; F198-L202 WeakPolarHBondContact O-CB 3.24Å; F198-L202 PolarHBondContact O-N 3.16Å; F198-L206 HydrophobicContact CD2-CD1 3.88Å; F198-L206 HydrophobicContact CE2-CD1 3.94Å; F198-M227 HydrophobicContact CE1-CB 4.18Å; F198-Y231 HydrophobicContact CZ-CG 4.45Å; F198-H235 HydrophobicContact CE2-CB 3.89Å; F198-H235 HydrophobicContact CZ-CB 3.85Å; F198-L236 HydrophobicContact CD2-CD1 4.03Å; F198-L236 HydrophobicContact CE2-CB 4.37Å; F198-L239 HydrophobicContact CB-CD2 4.02Å; F198-L239 HydrophobicContact CD2-CB 4.4Å; F198-L239 HydrophobicContact CD2-CD2 4.34Å
199N95.9Very high95.5Very high39 Ų3948.1 Ų48.121%0.20925%0.253CS..Hα-helixtrans-60.6-41.3-179.4-75.2-29.3000112.6K195 E196 M227 S228K195-N199 PolarHBondContact O-N 3.14Å; K195-N199 PolarHBondContact O-ND2 2.92Å; E196-N199 PolarHBondContact O-N 3.3Å; N199-M227 PolarHBondContact OD1-N 3.46Å; N199-M227 VanDerWaalsContact OD1-N 3.13Å; N199-S228 WeakPolarHBondContact OD1-CB 3.29Å; N199-S228 PolarHBondContact OD1-N 3.14Å; N199-S228 PolarHBondContact OD1-OG 3.43Å
200V93.9Very high95.6Very high89 Ų8943.9 Ų43.954%0.53923%0.233SC..Hα-helixtrans-74.5-40.2179.2173.90000112.2E196 F198 T204E196-V200 WeakPolarHBondContact O-CG2 3.43Å; E196-V200 PolarHBondContact O-N 3.33Å; F198-V200 VanDerWaalsContact C-N 3.34Å; F198-V200 PolarHBondContact O-N 3.16Å; V200-T204 PolarHBondContact O-OG1 3.49Å
201M95.1Very high95.7Very high1 Ų143.2 Ų43.21%0.00523%0.229CC..Hα-helixtrans-88-21-171.8-65.2-17974.100113.9Y197 F198 G203 T204 Q205 L206 L239 R242 M246Y197-M201 HydrophobicContact CD1-SD 3.83Å; Y197-M201 WeakPolarHBondContact O-CB 3.48Å; Y197-M201 WeakPolarHBondContact O-CG 3.18Å; Y197-M201 PolarHBondContact O-N 3.43Å; F198-M201 PolarHBondContact O-N 3.11Å; M201-G203 PolarHBondContact O-N 3.49Å; M201-T204 PolarHBondContact O-N 2.87Å; M201-T204 PolarHBondContact O-OG1 3.31Å; M201-Q205 HydrophobicContact CE-CB 4.28Å; M201-Q205 HydrophobicContact CE-CG 4.48Å; M201-Q205 PolarHBondContact O-N 3.07Å; M201-L206 HydrophobicContact CB-CD1 4.22Å; M201-L206 HydrophobicContact CB-CD2 4.46Å; M201-L206 HydrophobicContact CB-CG 4.15Å; M201-L206 PolarHBondContact O-N 2.97Å; M201-L239 HydrophobicContact CB-CD1 4.29Å; M201-L239 HydrophobicContact CE-CD1 4.32Å; M201-L239 HydrophobicContact CG-CD1 4.45Å; M201-L239 HydrophobicContact SD-CD1 3.48Å; M201-L239 WeakPolarHBondContact SD-CD1 3.39Å; M201-R242 HydrophobicContact CE-CB 3.84Å; M201-M246 HydrophobicContact CE-CG 3.51Å; M201-M246 HydrophobicContact CE-SD 4.33Å; M201-M246 HydrophobicContact SD-CG 3.66Å
202L97.3Very high95.7Very high0 Ų046.7 Ų46.70%024%0.24CC..Iπ-helixtrans-53.5-59.8-174.3-178.8-79.5000111.3F198 T204 L206 L207 Y215 M227 Y231 H235F198-L202 HydrophobicContact CE1-CG 4.44Å; F198-L202 HydrophobicContact CZ-CD2 4.16Å; F198-L202 HydrophobicContact CZ-CG 4.27Å; F198-L202 WeakPolarHBondContact O-CB 3.24Å; F198-L202 PolarHBondContact O-N 3.16Å; L202-T204 PolarHBondContact O-N 3.33Å; L202-T204 VanDerWaalsContact O-N 3.12Å; L202-L206 HydrophobicContact CB-CD1 4.48Å; L202-L206 HydrophobicContact CD2-CB 4Å; L202-L206 PolarHBondContact O-N 2.97Å; L202-L207 HydrophobicContact CD1-CD1 3.93Å; L202-L207 HydrophobicContact CD1-CD2 4.25Å; L202-L207 HydrophobicContact CD1-CG 4.15Å; L202-L207 HydrophobicContact CD2-CD2 3.66Å; L202-L207 HydrophobicContact CD2-CG 3.97Å; L202-L207 WeakPolarHBondContact O-CG 3.41Å; L202-Y215 HydrophobicContact CD1-CD2 3.72Å; L202-Y215 HydrophobicContact CD1-CE2 3.62Å; L202-M227 HydrophobicContact CB-CB 4.06Å; L202-M227 HydrophobicContact CB-CG 4.2Å; L202-M227 HydrophobicContact CD1-CB 4.2Å; L202-M227 HydrophobicContact CD1-CG 3.84Å; L202-M227 HydrophobicContact CD1-SD 3.85Å; L202-M227 HydrophobicContact CG-CB 3.96Å; L202-M227 HydrophobicContact CG-CG 4.12Å; L202-Y231 HydrophobicContact CD1-CD2 4.16Å; L202-Y231 HydrophobicContact CD1-CE1 4.45Å; L202-Y231 HydrophobicContact CD1-CE2 3.73Å; L202-Y231 HydrophobicContact CD2-CD1 4.26Å; L202-Y231 HydrophobicContact CD2-CE1 4.31Å; L202-Y231 HydrophobicContact CD2-CG 4.39Å; L202-Y231 HydrophobicContact CG-CD2 4.19Å; L202-Y231 HydrophobicContact CG-CE2 4.25Å; L202-Y231 HydrophobicContact CG-CG 4.44Å; L202-H235 HydrophobicContact CD2-CB 4.34Å
203G91.8Very high95.8Very high12 Ų1245 Ų4512%0.12422%0.224CC..Iπ-helixtrans-66.6-14.9-176.400000114.7M201 R212 Y215M201-G203 PolarHBondContact O-N 3.49Å; G203-R212 PolarHBondContact O-NH1 3.03Å; G203-Y215 VanDerWaalsContact CA-CZ 3.49Å; G203-Y215 WeakPolarHBondContact CA-OH 3.39Å
204T89.6Confident95.8Very high89 Ų8944.7 Ų44.755%0.54622%0.216SC..Iπ-helixtrans-108.2-42.2-174.252.90000112.6V200 M201 L202 R212V200-T204 PolarHBondContact O-OG1 3.49Å; M201-T204 PolarHBondContact O-N 2.87Å; M201-T204 PolarHBondContact O-OG1 3.31Å; L202-T204 PolarHBondContact O-N 3.33Å; L202-T204 VanDerWaalsContact O-N 3.12Å; T204-R212 PolarHBondContact O-NH2 2.9Å
205Q91.5Very high95.8Very high81 Ų8146.9 Ų46.938%0.37922%0.224SC..Iπ-helixtrans-127.7-15.2-164.8-60.5-174.642.100115.3M201M201-Q205 HydrophobicContact CE-CB 4.28Å; M201-Q205 HydrophobicContact CE-CG 4.48Å; M201-Q205 PolarHBondContact O-N 3.07Å
206L97.3Very high95.7Very high5 Ų546.5 Ų46.53%0.02623%0.233CC..Iπ-helixtrans-104.9-7.4-171.5-48.7-175.8000114.5F198 M201 L202 R238 L239 R242F198-L206 HydrophobicContact CD2-CD1 3.88Å; F198-L206 HydrophobicContact CE2-CD1 3.94Å; M201-L206 HydrophobicContact CB-CD1 4.22Å; M201-L206 HydrophobicContact CB-CD2 4.46Å; M201-L206 HydrophobicContact CB-CG 4.15Å; M201-L206 PolarHBondContact O-N 2.97Å; L202-L206 HydrophobicContact CB-CD1 4.48Å; L202-L206 HydrophobicContact CD2-CB 4Å; L202-L206 PolarHBondContact O-N 2.97Å; L206-R238 WeakPolarHBondContact O-CD 3.36Å; L206-R238 PolarHBondContact O-NH1 2.83Å; L206-L239 HydrophobicContact CD1-CB 3.89Å; L206-L239 HydrophobicContact CD1-CD1 4.16Å; L206-L239 HydrophobicContact CD2-CB 4.42Å; L206-L239 HydrophobicContact CD2-CD1 4.45Å; L206-R242 HydrophobicContact CD2-CB 4.17Å; L206-R242 HydrophobicContact CD2-CG 4.08Å
207L97.5Very high95.7Very high12 Ų1244 Ų446%0.06322%0.221CC..  trans-100.8134.3179.1-61.5177.8000112.1L202 E211 R212 Y215 Y231L202-L207 HydrophobicContact CD1-CD1 3.93Å; L202-L207 HydrophobicContact CD1-CD2 4.25Å; L202-L207 HydrophobicContact CD1-CG 4.15Å; L202-L207 HydrophobicContact CD2-CD2 3.66Å; L202-L207 HydrophobicContact CD2-CG 3.97Å; L202-L207 WeakPolarHBondContact O-CG 3.41Å; L207-E211 HydrophobicContact CB-CB 4.37Å; L207-E211 HydrophobicContact CD2-CB 4.2Å; L207-R212 PolarHBondContact O-NH2 3.36Å; L207-Y215 VanDerWaalsContact CD1-CB 3.47Å; L207-Y215 HydrophobicContact CD1-CD1 3.95Å; L207-Y215 HydrophobicContact CD1-CD2 3.82Å; L207-Y215 HydrophobicContact CD1-CG 3.46Å; L207-Y215 VanDerWaalsContact CD1-CG 3.46Å; L207-Y231 HydrophobicContact CD2-CE1 3.94Å
208Y96.6Very high95.7Very high62 Ų6241.7 Ų41.724%0.24321%0.213CC..  trans-69.5162.3166.6-61.8-61.4000110.8W145 I148 T149 F210 E211W145-Y208 AromaticContact CD1-CE1 3.64Å; W145-Y208 AromaticContact CD1-CZ 3.77Å; I148-Y208 HydrophobicContact CB-CD2 3.87Å; I148-Y208 HydrophobicContact CB-CE2 4.39Å; I148-Y208 HydrophobicContact CG1-CD2 4.16Å; I148-Y208 HydrophobicContact CG1-CE2 4.47Å; I148-Y208 HydrophobicContact CG2-CD2 3.71Å; I148-Y208 HydrophobicContact CG2-CG 4.23Å; T149-Y208 HydrophobicContact CG2-CD1 4.07Å; T149-Y208 HydrophobicContact CG2-CD2 4.29Å; T149-Y208 HydrophobicContact CG2-CG 3.94Å; Y208-F210 PolarHBondContact O-N 2.74Å; Y208-E211 WeakPolarHBondContact CB-OE2 3.15Å; Y208-E211 WeakPolarHBondContact CD2-OE2 3.44Å; Y208-E211 PolarHBondContact N-OE2 3.2Å; Y208-E211 PolarHBondContact O-N 3.39Å; Y208-E211 VanDerWaalsContact O-N 3.15Å
209K94.6Very high95.4Very high151 Ų15145 Ų4566%0.65723%0.23SC*.G310 helixtrans-56.2-37.7179.1-170.6-173.5171.9-160.10111.9E211 R212 V296K209-E211 VanDerWaalsContact C-N 3.3Å; K209-E211 PolarHBondContact O-N 3.49Å; K209-R212 WeakPolarHBondContact O-CB 3.22Å; K209-R212 VanDerWaalsContact O-CG 3.24Å; K209-R212 WeakPolarHBondContact O-CG 3.31Å; K209-R212 PolarHBondContact O-N 3.37Å; K209-V296 PolarHBondContact NZ-OXT 2.69Å
210F96.4Very high95.4Very high19 Ų1946.7 Ų46.78%0.08325%0.25CC..G310 helixtrans-69.1-24.4-177.2-167.6-114.8000113.5I148 K152 L154 Y208 R212 P213 A287 Y291 H292 A295I148-F210 HydrophobicContact CG2-CB 4.15Å; I148-F210 HydrophobicContact CG2-CD1 4.33Å; I148-F210 WeakPolarHBondContact O-CD1 3.47Å; K152-F210 HydrophobicContact CB-CE1 3.93Å; K152-F210 HydrophobicContact CB-CZ 3.79Å; K152-F210 HydrophobicContact CD-CD1 4.44Å; K152-F210 HydrophobicContact CD-CD2 4.17Å; K152-F210 HydrophobicContact CD-CE1 4.26Å; K152-F210 HydrophobicContact CD-CE2 3.97Å; K152-F210 HydrophobicContact CD-CG 4.4Å; K152-F210 HydrophobicContact CD-CZ 4.02Å; K152-F210 HydrophobicContact CG-CZ 4.42Å; L154-F210 HydrophobicContact CD2-CD1 3.94Å; L154-F210 HydrophobicContact CD2-CE1 4.07Å; L154-F210 HydrophobicContact CG-CE1 4.17Å; Y208-F210 PolarHBondContact O-N 2.74Å; F210-R212 VanDerWaalsContact C-N 3.33Å; F210-P213 WeakPolarHBondContact O-CD 3.38Å; F210-A287 HydrophobicContact CE1-CB 3.83Å; F210-A287 HydrophobicContact CZ-CB 3.71Å; F210-Y291 HydrophobicContact CD1-CE1 4.48Å; F210-Y291 HydrophobicContact CE1-CD1 4.39Å; F210-Y291 HydrophobicContact CE1-CE1 4.13Å; F210-Y291 HydrophobicContact CE2-CD1 4.26Å; F210-Y291 HydrophobicContact CE2-CE1 4.21Å; F210-Y291 AromaticContact CZ-CD1 3.92Å; F210-Y291 HydrophobicContact CZ-CD1 3.92Å; F210-Y291 AromaticContact CZ-CE1 3.99Å; F210-Y291 HydrophobicContact CZ-CE1 3.99Å; F210-Y291 VanDerWaalsContact O-CE1 3.31Å; F210-Y291 WeakPolarHBondContact O-CE1 3.47Å; F210-Y291 PolarHBondContact O-OH 2.88Å; F210-H292 AromaticContact CZ-NE2 3.93Å; F210-A295 HydrophobicContact CD2-CB 3.58Å; F210-A295 HydrophobicContact CE2-CB 3.6Å
211E97.6Very high95.5Very high0 Ų047.9 Ų47.90%025%0.253CS..G310 helixtrans-84.1-8-179.9-67.2165.4119.800112.9I148 L154 L207 Y208 K209 Q214 Y215 H235 R238I148-E211 HydrophobicContact CD1-CG 4.33Å; I148-E211 HydrophobicContact CG2-CG 3.75Å; L154-E211 HydrophobicContact CD2-CG 4.11Å; L207-E211 HydrophobicContact CB-CB 4.37Å; L207-E211 HydrophobicContact CD2-CB 4.2Å; Y208-E211 WeakPolarHBondContact CB-OE2 3.15Å; Y208-E211 WeakPolarHBondContact CD2-OE2 3.44Å; Y208-E211 PolarHBondContact N-OE2 3.2Å; Y208-E211 PolarHBondContact O-N 3.39Å; Y208-E211 VanDerWaalsContact O-N 3.15Å; K209-E211 VanDerWaalsContact C-N 3.3Å; K209-E211 PolarHBondContact O-N 3.49Å; E211-Q214 PolarHBondContact O-N 3.49Å; E211-Y215 PolarHBondContact O-N 2.84Å; E211-H235 IonicContact OE1-CD2 2.65Å; E211-H235 IonicContact OE1-CE1 3.02Å; E211-H235 IonicContact OE1-NE2 2.98Å; E211-H235 PolarHBondContact OE1-NE2 3.32Å; E211-R238 VanDerWaalsContact CD-NH1 3.3Å; E211-R238 IonicContact OE1-CZ 3.49Å; E211-R238 IonicContact OE1-NH1 2.76Å; E211-R238 PolarHBondContact OE1-NH1 2.91Å; E211-R238 IonicContact OE1-NH2 3.73Å; E211-R238 PolarHBondContact OE1-NH2 2.93Å; E211-R238 VanDerWaalsContact OE1-NH2 3.09Å; E211-R238 IonicContact OE2-CZ 3.76Å; E211-R238 IonicContact OE2-NH1 3.55Å; E211-R238 PolarHBondContact OE2-NH1 3.47Å; E211-R238 IonicContact OE2-NH2 3.63Å
212R96.3Very high95.3Very high91 Ų9151.5 Ų51.534%0.34327%0.27SS..Hα-helixtrans-60.1-41-173.5-62-61.9-177.1160.4-2.9113.9G203 T204 L207 K209 F210 Y215 A216G203-R212 PolarHBondContact O-NH1 3.03Å; T204-R212 PolarHBondContact O-NH2 2.9Å; L207-R212 PolarHBondContact O-NH2 3.36Å; K209-R212 WeakPolarHBondContact O-CB 3.22Å; K209-R212 VanDerWaalsContact O-CG 3.24Å; K209-R212 WeakPolarHBondContact O-CG 3.31Å; K209-R212 PolarHBondContact O-N 3.37Å; F210-R212 VanDerWaalsContact C-N 3.33Å; R212-Y215 PolarHBondContact O-N 3.47Å; R212-A216 PolarHBondContact O-N 2.91Å
213P97.4Very high94.9Very high18 Ų1855.9 Ų55.912%0.11730%0.298CS..Hα-helixtrans-64.2-41.1175.1-22.334.4000113F210 Y215 A216 E217 Y291 K294 A295F210-P213 WeakPolarHBondContact O-CD 3.38Å; P213-Y215 VanDerWaalsContact C-N 3.32Å; P213-Y215 PolarHBondContact O-N 3.03Å; P213-A216 PolarHBondContact O-N 3.16Å; P213-E217 WeakPolarHBondContact O-CG 3.42Å; P213-E217 PolarHBondContact O-N 3.09Å; P213-Y291 HydrophobicContact CB-CE1 4.43Å; P213-Y291 HydrophobicContact CB-CE2 3.87Å; P213-Y291 HydrophobicContact CG-CE1 4.33Å; P213-K294 HydrophobicContact CB-CB 3.85Å; P213-K294 HydrophobicContact CG-CB 4.02Å; P213-K294 WeakPolarHBondContact CG-O 3.47Å; P213-A295 HydrophobicContact CG-CB 3.87Å
214Q97.5Very high95Very high22 Ų2262.8 Ų62.810%0.10333%0.332CS..Hα-helixtrans-62.6-42.1177.9-177.7-17551.500110.4F155 L157 E211 A216 E217 I218 Y291F155-Q214 PolarHBondContact O-NE2 3.02Å; L157-Q214 VanDerWaalsContact CD1-CD 3.47Å; L157-Q214 HydrophobicContact CD1-CG 3.87Å; E211-Q214 PolarHBondContact O-N 3.49Å; Q214-A216 PolarHBondContact O-N 3.47Å; Q214-E217 PolarHBondContact O-N 3.24Å; Q214-I218 WeakPolarHBondContact O-CG1 3.23Å; Q214-I218 PolarHBondContact O-N 3.14Å; Q214-Y291 HydrophobicContact CB-CE2 3.75Å; Q214-Y291 WeakPolarHBondContact CB-OH 3.41Å; Q214-Y291 PolarHBondContact N-OH 3.12Å
215Y96.9Very high95.2Very high48 Ų4859.9 Ų59.919%0.18832%0.317CS..Hα-helixtrans-62.1-41.8174.8174.5-113.7000112.8L202 G203 L207 E211 R212 P213 E217 I218 L219 M227L202-Y215 HydrophobicContact CD1-CD2 3.72Å; L202-Y215 HydrophobicContact CD1-CE2 3.62Å; G203-Y215 VanDerWaalsContact CA-CZ 3.49Å; G203-Y215 WeakPolarHBondContact CA-OH 3.39Å; L207-Y215 VanDerWaalsContact CD1-CB 3.47Å; L207-Y215 HydrophobicContact CD1-CD1 3.95Å; L207-Y215 HydrophobicContact CD1-CD2 3.82Å; L207-Y215 HydrophobicContact CD1-CG 3.46Å; L207-Y215 VanDerWaalsContact CD1-CG 3.46Å; E211-Y215 PolarHBondContact O-N 2.84Å; R212-Y215 PolarHBondContact O-N 3.47Å; P213-Y215 VanDerWaalsContact C-N 3.32Å; P213-Y215 PolarHBondContact O-N 3.03Å; Y215-E217 VanDerWaalsContact C-N 3.33Å; Y215-E217 PolarHBondContact O-N 2.89Å; Y215-I218 PolarHBondContact O-N 3.16Å; Y215-L219 HydrophobicContact CD1-CD1 4.21Å; Y215-L219 HydrophobicContact CD2-CG 4.43Å; Y215-L219 HydrophobicContact CE1-CD1 3.57Å; Y215-L219 HydrophobicContact CE1-CG 4.27Å; Y215-L219 HydrophobicContact CE2-CD1 4.13Å; Y215-L219 HydrophobicContact CE2-CD2 4.07Å; Y215-L219 HydrophobicContact CE2-CG 3.97Å; Y215-L219 WeakPolarHBondContact O-CG 3.4Å; Y215-L219 PolarHBondContact O-N 3.46Å; Y215-M227 HydrophobicContact CD2-SD 4.1Å; Y215-M227 HydrophobicContact CE2-CG 4.43Å; Y215-M227 HydrophobicContact CE2-SD 3.59Å; Y215-M227 VanDerWaalsContact CE2-SD 3.59Å
216A95.8Very high95.4Very high56 Ų5658.2 Ų58.246%0.46331%0.313SS..Hα-helixtrans-63.6-38.7176.600000112.2R212 P213 Q214 L219 A220R212-A216 PolarHBondContact O-N 2.91Å; P213-A216 PolarHBondContact O-N 3.16Å; Q214-A216 PolarHBondContact O-N 3.47Å; A216-L219 PolarHBondContact O-N 3.4Å; A216-A220 PolarHBondContact O-N 3.33Å; A216-A220 VanDerWaalsContact O-N 3.12Å
217E95.8Very high95.5Very high68 Ų6858.5 Ų58.532%0.31831%0.314SS..Hα-helixtrans-63.3-46.7173.9-72171.5-175.200111.2P213 Q214 Y215 L219 A220 D221 K294P213-E217 WeakPolarHBondContact O-CG 3.42Å; P213-E217 PolarHBondContact O-N 3.09Å; Q214-E217 PolarHBondContact O-N 3.24Å; Y215-E217 VanDerWaalsContact C-N 3.33Å; Y215-E217 PolarHBondContact O-N 2.89Å; E217-L219 VanDerWaalsContact C-N 3.32Å; E217-L219 PolarHBondContact O-N 2.93Å; E217-A220 WeakPolarHBondContact O-CB 3.3Å; E217-A220 PolarHBondContact O-N 2.94Å; E217-D221 WeakPolarHBondContact O-CB 3.43Å; E217-D221 PolarHBondContact O-N 2.68Å; E217-K294 IonicContact OE1-NZ 3.52Å; E217-K294 PolarHBondContact OE1-NZ 3.5Å
218I96.3Very high95.5Very high13 Ų1357.9 Ų57.97%0.06731%0.312CS..Hα-helixtrans-57.8-42.4175.7-70.9-61000112.2L157 Q214 Y215 A220 H222 M227 V230L157-I218 HydrophobicContact CB-CD1 4.08Å; L157-I218 HydrophobicContact CD1-CD1 4.44Å; L157-I218 HydrophobicContact CD1-CG1 4.02Å; Q214-I218 WeakPolarHBondContact O-CG1 3.23Å; Q214-I218 PolarHBondContact O-N 3.14Å; Y215-I218 PolarHBondContact O-N 3.16Å; I218-A220 VanDerWaalsContact C-N 3.28Å; I218-A220 PolarHBondContact O-N 2.9Å; I218-H222 CarbonylContact O-C 3.59Å; I218-H222 WeakPolarHBondContact O-CA 3.24Å; I218-H222 WeakPolarHBondContact O-CB 3.45Å; I218-H222 PolarHBondContact O-N 3.35Å; I218-M227 HydrophobicContact CG2-CE 4.07Å; I218-M227 HydrophobicContact CG2-SD 4.42Å; I218-V230 HydrophobicContact CD1-CG1 3.88Å; I218-V230 HydrophobicContact CG1-CG1 4.23Å; I218-V230 HydrophobicContact CG2-CB 4.46Å; I218-V230 HydrophobicContact CG2-CG1 3.84Å; I218-V230 HydrophobicContact CG2-CG2 4.26Å
219L93.1Very high95.6Very high70 Ų7059.5 Ų59.537%0.36632%0.321SS..Hα-helixtrans-66.4-30.8177.1-71.3-178.8000112.8Y215 A216 E217 P223 M227Y215-L219 HydrophobicContact CD1-CD1 4.21Å; Y215-L219 HydrophobicContact CD2-CG 4.43Å; Y215-L219 HydrophobicContact CE1-CD1 3.57Å; Y215-L219 HydrophobicContact CE1-CG 4.27Å; Y215-L219 HydrophobicContact CE2-CD1 4.13Å; Y215-L219 HydrophobicContact CE2-CD2 4.07Å; Y215-L219 HydrophobicContact CE2-CG 3.97Å; Y215-L219 WeakPolarHBondContact O-CG 3.4Å; Y215-L219 PolarHBondContact O-N 3.46Å; A216-L219 PolarHBondContact O-N 3.4Å; E217-L219 VanDerWaalsContact C-N 3.32Å; E217-L219 PolarHBondContact O-N 2.93Å; L219-P223 WeakPolarHBondContact O-CA 3.48Å; L219-M227 HydrophobicContact CD2-CE 3.97Å
220A95.9Very high95.8Very high74 Ų7452.6 Ų52.661%0.61229%0.292SS*.Hα-helixtrans-76.8-43.2177.900000111.7A216 E217 I218A216-A220 PolarHBondContact O-N 3.33Å; A216-A220 VanDerWaalsContact O-N 3.12Å; E217-A220 WeakPolarHBondContact O-CB 3.3Å; E217-A220 PolarHBondContact O-N 2.94Å; I218-A220 VanDerWaalsContact C-N 3.28Å; I218-A220 PolarHBondContact O-N 2.9Å
221D94.8Very high95.9Very high114 Ų11451.7 Ų51.761%0.6129%0.288SS*.Hα-helixtrans-78.9-28.7-176.8-66.6-15.1000112.3E217E217-D221 WeakPolarHBondContact O-CB 3.43Å; E217-D221 PolarHBondContact O-N 2.68Å
222H92Very high95.9Very high77 Ų7751.7 Ų51.736%0.35629%0.288SS..  trans-137.565.7-175.2-53.2-55.8000112.1I218 D224 A225I218-H222 CarbonylContact O-C 3.59Å; I218-H222 WeakPolarHBondContact O-CA 3.24Å; I218-H222 WeakPolarHBondContact O-CB 3.45Å; I218-H222 PolarHBondContact O-N 3.35Å; H222-D224 VanDerWaalsContact C-N 3.28Å; H222-D224 PolarHBondContact O-N 3.35Å; H222-A225 HydrophobicContact CB-CB 3.74Å; H222-A225 PolarHBondContact O-N 3.19Å
223P89.4Confident96Very high92 Ų9247.5 Ų47.560%0.59727%0.273SS*.THydrogen-bonded Turntrans-62.5-31.2-170.824.7-35.2000114.3L219L219-P223 WeakPolarHBondContact O-CA 3.48Å
224D93.2Very high96.1Very high156 Ų15647 Ų4783%0.83427%0.269SS*.THydrogen-bonded Turntrans-96.9-3.8-177.5-58.9-47.7000113.3H222 P226H222-D224 VanDerWaalsContact C-N 3.28Å; H222-D224 PolarHBondContact O-N 3.35Å; D224-P226 WeakPolarHBondContact O-CD 3.39Å
225A93.4Very high96.1Very high28 Ų2846 Ų4623%0.23126%0.264CS..  trans-77.7123.9-176.600000110.6H222 M227 V230H222-A225 HydrophobicContact CB-CB 3.74Å; H222-A225 PolarHBondContact O-N 3.19Å; A225-M227 VanDerWaalsContact O-CE 3.23Å; A225-M227 WeakPolarHBondContact O-CE 3.39Å; A225-V230 HydrophobicContact CB-CG2 4.02Å
226P96.8Very high96.2Very high46 Ų4643.7 Ų43.730%0.29926%0.255SS..  trans-66.4142.7172.628.5-33.8000109.8D224 S228 Q229D224-P226 WeakPolarHBondContact O-CD 3.39Å; P226-S228 PolarHBondContact O-N 2.97Å; P226-S228 VanDerWaalsContact O-N 3.1Å; P226-Q229 HydrophobicContact CG-CB 4.17Å; P226-Q229 HydrophobicContact CG-CG 3.77Å; P226-Q229 WeakPolarHBondContact O-CB 3.38Å; P226-Q229 PolarHBondContact O-N 3.27Å
227M97.6Very high96.3Very high11 Ų1141.1 Ų41.15%0.05423%0.234CC..Hα-helixtrans-60.7-27.2-176.5-64.1-62.1106.900112.7F198 N199 L202 Y215 I218 L219 A225 Q229 V230 Y231F198-M227 HydrophobicContact CE1-CB 4.18Å; N199-M227 PolarHBondContact OD1-N 3.46Å; N199-M227 VanDerWaalsContact OD1-N 3.13Å; L202-M227 HydrophobicContact CB-CB 4.06Å; L202-M227 HydrophobicContact CB-CG 4.2Å; L202-M227 HydrophobicContact CD1-CB 4.2Å; L202-M227 HydrophobicContact CD1-CG 3.84Å; L202-M227 HydrophobicContact CD1-SD 3.85Å; L202-M227 HydrophobicContact CG-CB 3.96Å; L202-M227 HydrophobicContact CG-CG 4.12Å; Y215-M227 HydrophobicContact CD2-SD 4.1Å; Y215-M227 HydrophobicContact CE2-CG 4.43Å; Y215-M227 HydrophobicContact CE2-SD 3.59Å; Y215-M227 VanDerWaalsContact CE2-SD 3.59Å; I218-M227 HydrophobicContact CG2-CE 4.07Å; I218-M227 HydrophobicContact CG2-SD 4.42Å; L219-M227 HydrophobicContact CD2-CE 3.97Å; A225-M227 VanDerWaalsContact O-CE 3.23Å; A225-M227 WeakPolarHBondContact O-CE 3.39Å; M227-Q229 PolarHBondContact O-N 3.18Å; M227-V230 PolarHBondContact O-N 3.34Å; M227-V230 VanDerWaalsContact O-N 3.12Å; M227-Y231 HydrophobicContact CB-CD2 4.18Å; M227-Y231 PolarHBondContact O-N 3.01Å; M227-Y231 HydrophobicContact SD-CD2 4.04Å; M227-Y231 HydrophobicContact SD-CE2 3.61Å
228S98.4Very high96.5Very high0 Ų038.5 Ų38.50%022%0.221CC..Hα-helixtrans-65-19.417568.90000114.1V163 D164 N199 P226V163-S228 WeakPolarHBondContact CB-O 3.42Å; V163-S228 PolarHBondContact N-O 3.15Å; V163-S228 VanDerWaalsContact N-O 3.12Å; D164-S228 PolarHBondContact N-O 3.43Å; D164-S228 WeakPolarHBondContact OD1-CB 3.39Å; D164-S228 PolarHBondContact OD1-OG 3.05Å; N199-S228 WeakPolarHBondContact OD1-CB 3.29Å; N199-S228 PolarHBondContact OD1-N 3.14Å; N199-S228 PolarHBondContact OD1-OG 3.43Å; P226-S228 PolarHBondContact O-N 2.97Å; P226-S228 VanDerWaalsContact O-N 3.1Å
229Q98.3Very high96.6Very high96 Ų9637.9 Ų37.945%0.44922%0.218SC..Hα-helixtrans-89.8-21173.2-72179.4-2.700113.1N162 D164 P226 M227N162-Q229 VanDerWaalsContact CB-O 3.31Å; N162-Q229 WeakPolarHBondContact CB-O 3.24Å; N162-Q229 PolarHBondContact ND2-O 2.92Å; D164-Q229 HydrophobicContact CB-CG 4.49Å; P226-Q229 HydrophobicContact CG-CB 4.17Å; P226-Q229 HydrophobicContact CG-CG 3.77Å; P226-Q229 WeakPolarHBondContact O-CB 3.38Å; P226-Q229 PolarHBondContact O-N 3.27Å; M227-Q229 PolarHBondContact O-N 3.18Å
230V98.3Very high96.8Very high6 Ų634.7 Ų34.74%0.03620%0.201CC..Hα-helixtrans-95.8-42.4-176.6-173.10000112L157 A159 I218 A225 M227L157-V230 HydrophobicContact CB-CG1 4.35Å; L157-V230 HydrophobicContact CD2-CG1 4.35Å; L157-V230 WeakPolarHBondContact CD2-O 3.48Å; A159-V230 VanDerWaalsContact CB-O 3.25Å; A159-V230 WeakPolarHBondContact CB-O 3.42Å; A159-V230 PolarHBondContact N-O 3.38Å; I218-V230 HydrophobicContact CD1-CG1 3.88Å; I218-V230 HydrophobicContact CG1-CG1 4.23Å; I218-V230 HydrophobicContact CG2-CB 4.46Å; I218-V230 HydrophobicContact CG2-CG1 3.84Å; I218-V230 HydrophobicContact CG2-CG2 4.26Å; A225-V230 HydrophobicContact CB-CG2 4.02Å; M227-V230 PolarHBondContact O-N 3.34Å; M227-V230 VanDerWaalsContact O-N 3.12Å
231Y98.7Very high96.7Very high0 Ų034.3 Ų34.30%019%0.191CC..  trans-94.9163.1-173.9-72.9-97.9000112.6L157 N162 V163 F198 L202 L207 M227 H235L157-Y231 HydrophobicContact CD1-CD1 4.09Å; L157-Y231 HydrophobicContact CD1-CE1 3.5Å; L157-Y231 VanDerWaalsContact CD1-CE1 3.5Å; L157-Y231 HydrophobicContact CD1-CE2 4.08Å; L157-Y231 VanDerWaalsContact CD1-CZ 3.48Å; L157-Y231 HydrophobicContact CD2-CD1 3.82Å; L157-Y231 HydrophobicContact CD2-CE1 4.11Å; L157-Y231 HydrophobicContact CD2-CG 4.1Å; L157-Y231 HydrophobicContact CG-CE1 4.44Å; N162-Y231 CarbonylContact C-O 3.57Å; N162-Y231 WeakPolarHBondContact CA-O 3.48Å; N162-Y231 WeakPolarHBondContact CB-O 3.44Å; V163-Y231 WeakPolarHBondContact CG2-O 3.31Å; V163-Y231 PolarHBondContact N-O 3.19Å; F198-Y231 HydrophobicContact CZ-CG 4.45Å; L202-Y231 HydrophobicContact CD1-CD2 4.16Å; L202-Y231 HydrophobicContact CD1-CE1 4.45Å; L202-Y231 HydrophobicContact CD1-CE2 3.73Å; L202-Y231 HydrophobicContact CD2-CD1 4.26Å; L202-Y231 HydrophobicContact CD2-CE1 4.31Å; L202-Y231 HydrophobicContact CD2-CG 4.39Å; L202-Y231 HydrophobicContact CG-CD2 4.19Å; L202-Y231 HydrophobicContact CG-CE2 4.25Å; L202-Y231 HydrophobicContact CG-CG 4.44Å; L207-Y231 HydrophobicContact CD2-CE1 3.94Å; M227-Y231 HydrophobicContact CB-CD2 4.18Å; M227-Y231 PolarHBondContact O-N 3.01Å; M227-Y231 HydrophobicContact SD-CD2 4.04Å; M227-Y231 HydrophobicContact SD-CE2 3.61Å; Y231-H235 HydrophobicContact CD1-CB 4.22Å; Y231-H235 AromaticContact CD1-CD2 3.66Å; Y231-H235 AromaticContact CD1-CE1 3.69Å; Y231-H235 AromaticContact CD1-CG 3.52Å; Y231-H235 AromaticContact CD1-ND1 3.56Å; Y231-H235 AromaticContact CD1-NE2 3.76Å; Y231-H235 AromaticContact CE1-CD2 3.95Å; Y231-H235 AromaticContact CE1-NE2 3.86Å
232G98.4Very high96.5Very high0 Ų035.5 Ų35.50%019%0.187CC..BIsolated β-bridgetrans-116.5-161.8-17400000115.1P234 L236G232-P234 VanDerWaalsContact C-CD 3.49Å; G232-L236 PolarHBondContact O-N 3.13Å
233A98.5Very high96.5Very high3 Ų332 Ų323%0.02517%0.171CC..Hα-helixtrans-59-39.2-174.700000115.5I166 H235 L236 L237 L278 F279I166-A233 HydrophobicContact CD1-CB 3.67Å; A233-H235 PolarHBondContact O-N 3.38Å; A233-L236 WeakPolarHBondContact O-CB 3.48Å; A233-L236 PolarHBondContact O-N 2.89Å; A233-L237 PolarHBondContact O-N 3.27Å; A233-L278 HydrophobicContact CB-CB 3.93Å; A233-L278 HydrophobicContact CB-CD2 4.45Å; A233-L278 VanDerWaalsContact CB-O 3.32Å; A233-L278 WeakPolarHBondContact CB-O 3.38Å; A233-F279 HydrophobicContact CB-CD1 4.21Å; A233-F279 HydrophobicContact CB-CE1 3.79Å; A233-F279 HydrophobicContact CB-CZ 4.19Å
234P98.4Very high96.5Very high7 Ų727.7 Ų27.75%0.04514%0.144CC..Hα-helixtrans-59.3-49.5-178.8-26.436.4000112.4F155 G232 L236 L237 R238 F279 Y284F155-P234 HydrophobicContact CD2-CG 3.92Å; F155-P234 HydrophobicContact CE2-CG 3.65Å; F155-P234 HydrophobicContact CZ-CG 4.43Å; G232-P234 VanDerWaalsContact C-CD 3.49Å; P234-L236 VanDerWaalsContact C-N 3.32Å; P234-L236 PolarHBondContact O-N 3.13Å; P234-L237 WeakPolarHBondContact O-CB 3.47Å; P234-L237 PolarHBondContact O-N 3.41Å; P234-L237 VanDerWaalsContact O-N 3.16Å; P234-R238 WeakPolarHBondContact O-CG 3.48Å; P234-R238 PolarHBondContact O-N 2.82Å; P234-R238 VanDerWaalsContact O-N 3.11Å; P234-F279 HydrophobicContact CG-CD1 4.34Å; P234-Y284 WeakPolarHBondContact CB-OH 3.49Å; P234-Y284 VanDerWaalsContact CG-OH 3.26Å; P234-Y284 WeakPolarHBondContact CG-OH 3.49Å
235H98.8Very high96.1Very high0 Ų021.9 Ų21.90%012%0.117CC..Hα-helixtrans-64.7-38.1177.2-55.582.8000111.9F155 F198 L202 E211 Y231 A233 L237 R238 L239F155-H235 AromaticContact CG-CE1 3.95Å; F198-H235 HydrophobicContact CE2-CB 3.89Å; F198-H235 HydrophobicContact CZ-CB 3.85Å; L202-H235 HydrophobicContact CD2-CB 4.34Å; E211-H235 IonicContact OE1-CD2 2.65Å; E211-H235 IonicContact OE1-CE1 3.02Å; E211-H235 IonicContact OE1-NE2 2.98Å; E211-H235 PolarHBondContact OE1-NE2 3.32Å; Y231-H235 HydrophobicContact CD1-CB 4.22Å; Y231-H235 AromaticContact CD1-CD2 3.66Å; Y231-H235 AromaticContact CD1-CE1 3.69Å; Y231-H235 AromaticContact CD1-CG 3.52Å; Y231-H235 AromaticContact CD1-ND1 3.56Å; Y231-H235 AromaticContact CD1-NE2 3.76Å; Y231-H235 AromaticContact CE1-CD2 3.95Å; Y231-H235 AromaticContact CE1-NE2 3.86Å; A233-H235 PolarHBondContact O-N 3.38Å; H235-L237 VanDerWaalsContact C-N 3.3Å; H235-L237 PolarHBondContact O-N 2.93Å; H235-R238 PolarHBondContact CD2-NH1 3.25Å; H235-R238 WeakPolarHBondContact O-CB 3.1Å; H235-R238 PolarHBondContact O-N 3.5Å; H235-L239 PolarHBondContact O-N 3.36Å
236L98.8Very high95.6Very high0 Ų023.2 Ų23.20%012%0.12CC..Hα-helixtrans-61.4-39.8174.4-17859.5000111.7V163 I166 I194 F198 G232 A233 P234 R238 L239 F240 F267V163-L236 HydrophobicContact CG1-CD1 3.83Å; V163-L236 HydrophobicContact CG1-CD2 3.99Å; V163-L236 HydrophobicContact CG1-CG 4.37Å; V163-L236 HydrophobicContact CG2-CB 3.87Å; V163-L236 HydrophobicContact CG2-CD1 4.44Å; V163-L236 HydrophobicContact CG2-CD2 4.31Å; V163-L236 HydrophobicContact CG2-CG 4.43Å; I166-L236 HydrophobicContact CB-CD2 4.49Å; I166-L236 HydrophobicContact CG2-CD2 4.09Å; I194-L236 HydrophobicContact CG2-CD1 3.8Å; F198-L236 HydrophobicContact CD2-CD1 4.03Å; F198-L236 HydrophobicContact CE2-CB 4.37Å; G232-L236 PolarHBondContact O-N 3.13Å; A233-L236 WeakPolarHBondContact O-CB 3.48Å; A233-L236 PolarHBondContact O-N 2.89Å; P234-L236 VanDerWaalsContact C-N 3.32Å; P234-L236 PolarHBondContact O-N 3.13Å; L236-R238 VanDerWaalsContact C-N 3.34Å; L236-R238 PolarHBondContact O-N 3.09Å; L236-L239 HydrophobicContact CD1-CD2 4.34Å; L236-L239 VanDerWaalsContact O-CB 3.24Å; L236-L239 WeakPolarHBondContact O-CB 3.48Å; L236-L239 PolarHBondContact O-N 2.96Å; L236-F240 HydrophobicContact CD1-CE2 4.19Å; L236-F240 HydrophobicContact CG-CE2 4.23Å; L236-F240 WeakPolarHBondContact O-CD2 3.13Å; L236-F240 WeakPolarHBondContact O-CE2 3.39Å; L236-F267 HydrophobicContact CD2-CE1 4.08Å; L236-F267 HydrophobicContact CD2-CZ 3.88Å; L236-F267 HydrophobicContact CG-CE1 4.47Å
237L98.6Very high95.1Very high3 Ų321.4 Ų21.42%0.01611%0.107CC..Hα-helixtrans-65-38.9176.2-177.259000111.6L137 L141 A233 P234 H235 L239 F240 L268 L271 F279L137-L237 HydrophobicContact CB-CD1 4.37Å; L137-L237 HydrophobicContact CB-CD2 4.13Å; L137-L237 HydrophobicContact CD1-CD1 3.81Å; L137-L237 HydrophobicContact CD2-CD2 4.47Å; L141-L237 HydrophobicContact CD2-CD2 4.03Å; L141-L237 HydrophobicContact CD2-CG 3.92Å; L141-L237 HydrophobicContact CG-CD2 3.91Å; L141-L237 HydrophobicContact CG-CG 4.17Å; A233-L237 PolarHBondContact O-N 3.27Å; P234-L237 WeakPolarHBondContact O-CB 3.47Å; P234-L237 PolarHBondContact O-N 3.41Å; P234-L237 VanDerWaalsContact O-N 3.16Å; H235-L237 VanDerWaalsContact C-N 3.3Å; H235-L237 PolarHBondContact O-N 2.93Å; L237-L239 PolarHBondContact O-N 3.15Å; L237-F240 PolarHBondContact O-N 3.05Å; L237-F240 VanDerWaalsContact O-N 3.09Å; L237-L268 HydrophobicContact CD1-CD2 3.91Å; L237-L271 HydrophobicContact CD1-CD1 4.4Å; L237-F279 HydrophobicContact CB-CE1 4.01Å; L237-F279 HydrophobicContact CB-CZ 4.2Å; L237-F279 HydrophobicContact CD2-CE1 3.84Å; L237-F279 HydrophobicContact CD2-CZ 3.86Å
238R98.3Very high94.2Very high13 Ų1321.6 Ų21.65%0.04911%0.11CC..Hα-helixtrans-58.9-32.2174.8-62.5177-165.61705.9112.3L141 D144 L206 E211 P234 H235 L236 F240 V241 R242L141-R238 HydrophobicContact CD2-CG 4.39Å; D144-R238 VanDerWaalsContact CG-NH2 3.31Å; D144-R238 IonicContact OD1-CZ 3.63Å; D144-R238 IonicContact OD1-NE 2.82Å; D144-R238 IonicContact OD1-NH2 3.01Å; D144-R238 PolarHBondContact OD1-NH2 3.22Å; D144-R238 IonicContact OD2-CZ 3.58Å; D144-R238 VanDerWaalsContact OD2-CZ 3.27Å; D144-R238 IonicContact OD2-NE 3.53Å; D144-R238 PolarHBondContact OD2-NE 2.84Å; D144-R238 IonicContact OD2-NH2 2.64Å; D144-R238 PolarHBondContact OD2-NH2 3.39Å; D144-R238 VanDerWaalsContact OD2-NH2 3.13Å; L206-R238 WeakPolarHBondContact O-CD 3.36Å; L206-R238 PolarHBondContact O-NH1 2.83Å; E211-R238 VanDerWaalsContact CD-NH1 3.3Å; E211-R238 IonicContact OE1-CZ 3.49Å; E211-R238 IonicContact OE1-NH1 2.76Å; E211-R238 PolarHBondContact OE1-NH1 2.91Å; E211-R238 IonicContact OE1-NH2 3.73Å; E211-R238 PolarHBondContact OE1-NH2 2.93Å; E211-R238 VanDerWaalsContact OE1-NH2 3.09Å; E211-R238 IonicContact OE2-CZ 3.76Å; E211-R238 IonicContact OE2-NH1 3.55Å; E211-R238 PolarHBondContact OE2-NH1 3.47Å; E211-R238 IonicContact OE2-NH2 3.63Å; P234-R238 WeakPolarHBondContact O-CG 3.48Å; P234-R238 PolarHBondContact O-N 2.82Å; P234-R238 VanDerWaalsContact O-N 3.11Å; H235-R238 PolarHBondContact CD2-NH1 3.25Å; H235-R238 WeakPolarHBondContact O-CB 3.1Å; H235-R238 PolarHBondContact O-N 3.5Å; L236-R238 VanDerWaalsContact C-N 3.34Å; L236-R238 PolarHBondContact O-N 3.09Å; R238-F240 VanDerWaalsContact C-N 3.27Å; R238-F240 PolarHBondContact O-N 2.72Å; R238-V241 WeakPolarHBondContact O-CB 3.04Å; R238-V241 PolarHBondContact O-N 3.13Å; R238-V241 VanDerWaalsContact O-N 3.11Å; R238-R242 PolarHBondContact O-N 3.3Å
239L98.2Very high93.2Very high0 Ų024.9 Ų24.90%012%0.123CC..Hα-helixtrans-54.6-45174.4176.162.8000111.2I194 F198 M201 L206 H235 L236 L237 V241 R242 I243I194-L239 HydrophobicContact CG2-CD2 4.06Å; F198-L239 HydrophobicContact CB-CD2 4.02Å; F198-L239 HydrophobicContact CD2-CB 4.4Å; F198-L239 HydrophobicContact CD2-CD2 4.34Å; M201-L239 HydrophobicContact CB-CD1 4.29Å; M201-L239 HydrophobicContact CE-CD1 4.32Å; M201-L239 HydrophobicContact CG-CD1 4.45Å; M201-L239 HydrophobicContact SD-CD1 3.48Å; M201-L239 WeakPolarHBondContact SD-CD1 3.39Å; L206-L239 HydrophobicContact CD1-CB 3.89Å; L206-L239 HydrophobicContact CD1-CD1 4.16Å; L206-L239 HydrophobicContact CD2-CB 4.42Å; L206-L239 HydrophobicContact CD2-CD1 4.45Å; H235-L239 PolarHBondContact O-N 3.36Å; L236-L239 HydrophobicContact CD1-CD2 4.34Å; L236-L239 VanDerWaalsContact O-CB 3.24Å; L236-L239 WeakPolarHBondContact O-CB 3.48Å; L236-L239 PolarHBondContact O-N 2.96Å; L237-L239 PolarHBondContact O-N 3.15Å; L239-V241 PolarHBondContact O-N 3.42Å; L239-R242 CarbonylContact O-C 3.6Å; L239-R242 PolarHBondContact O-N 3.47Å; L239-I243 HydrophobicContact CD1-CB 4.14Å; L239-I243 HydrophobicContact CD1-CD1 4.32Å; L239-I243 HydrophobicContact CD1-CG1 4.38Å; L239-I243 HydrophobicContact CD2-CD1 4.36Å; L239-I243 HydrophobicContact CG-CB 4.29Å; L239-I243 HydrophobicContact CG-CD1 4.25Å; L239-I243 WeakPolarHBondContact O-CB 3.4Å; L239-I243 PolarHBondContact O-N 3.48Å
240F97.4Very high92.4Very high3 Ų322.3 Ų22.31%0.01311%0.114CC..Hα-helixtrans-68.5-16.7-177.1-65.7-87.2000113.8V131 I133 I194 L236 L237 R238 L264 F267 L268V131-F240 HydrophobicContact CG1-CB 4.46Å; V131-F240 HydrophobicContact CG1-CD1 4.39Å; I133-F240 HydrophobicContact CD1-CB 3.64Å; I194-F240 HydrophobicContact CD1-CE1 4.45Å; I194-F240 HydrophobicContact CD1-CZ 4.06Å; I194-F240 HydrophobicContact CG1-CZ 4.29Å; I194-F240 HydrophobicContact CG2-CZ 4.15Å; L236-F240 HydrophobicContact CD1-CE2 4.19Å; L236-F240 HydrophobicContact CG-CE2 4.23Å; L236-F240 WeakPolarHBondContact O-CD2 3.13Å; L236-F240 WeakPolarHBondContact O-CE2 3.39Å; L237-F240 PolarHBondContact O-N 3.05Å; L237-F240 VanDerWaalsContact O-N 3.09Å; R238-F240 VanDerWaalsContact C-N 3.27Å; R238-F240 PolarHBondContact O-N 2.72Å; F240-L264 HydrophobicContact CE1-CB 4.41Å; F240-L264 HydrophobicContact CE1-CD2 3.93Å; F240-F267 HydrophobicContact CE1-CD1 4Å; F240-F267 AromaticContact CE2-CD1 3.8Å; F240-F267 HydrophobicContact CE2-CD1 3.8Å; F240-F267 AromaticContact CE2-CE1 3.63Å; F240-F267 HydrophobicContact CE2-CE1 3.63Å; F240-F267 AromaticContact CZ-CD1 3.27Å; F240-F267 HydrophobicContact CZ-CD1 3.27Å; F240-F267 AromaticContact CZ-CE1 3.5Å; F240-F267 HydrophobicContact CZ-CE1 3.5Å; F240-F267 HydrophobicContact CZ-CG 4.43Å; F240-L268 HydrophobicContact CB-CD1 4.29Å; F240-L268 HydrophobicContact CB-CD2 3.87Å; F240-L268 HydrophobicContact CB-CG 4.49Å; F240-L268 HydrophobicContact CD1-CD1 4.04Å; F240-L268 HydrophobicContact CD1-CD2 4.07Å; F240-L268 HydrophobicContact CD1-CG 3.98Å; F240-L268 HydrophobicContact CD2-CD2 3.94Å; F240-L268 HydrophobicContact CE1-CG 4.41Å; F240-L268 HydrophobicContact CG-CD1 4.29Å; F240-L268 HydrophobicContact CG-CD2 3.67Å; F240-L268 HydrophobicContact CG-CG 4.11Å
241V94.5Very high91.4Very high66 Ų6627.3 Ų27.340%0.415%0.147SC..Hα-helixtrans-77.1-26.1171.4-176.40000111.4I133 L141 R238 L239I133-V241 HydrophobicContact CD1-CG2 4.34Å; I133-V241 HydrophobicContact CG1-CG2 4.37Å; L141-V241 HydrophobicContact CD1-CG2 3.7Å; L141-V241 HydrophobicContact CD2-CG2 4.08Å; R238-V241 WeakPolarHBondContact O-CB 3.04Å; R238-V241 PolarHBondContact O-N 3.13Å; R238-V241 VanDerWaalsContact O-N 3.11Å; L239-V241 PolarHBondContact O-N 3.42Å
242R91.6Very high90.6Very high138 Ų13830.5 Ų30.552%0.52116%0.164SC..Hα-helixtrans-108.7-26.7-174.8-63.5-60.1-172.5-173.6-0.6114.5M201 L206 R238 L239 G244 A245M201-R242 HydrophobicContact CE-CB 3.84Å; L206-R242 HydrophobicContact CD2-CB 4.17Å; L206-R242 HydrophobicContact CD2-CG 4.08Å; R238-R242 PolarHBondContact O-N 3.3Å; L239-R242 CarbonylContact O-C 3.6Å; L239-R242 PolarHBondContact O-N 3.47Å; R242-G244 PolarHBondContact O-N 3.01Å; R242-G244 VanDerWaalsContact O-N 3.16Å; R242-A245 PolarHBondContact O-N 3.17Å
243I91.4Very high90Very high3 Ų334.7 Ų34.72%0.01519%0.186CC..Hα-helixtrans-63.9-25-173-159.5172.2000112.5V131 Y197 L239 A245 M246 L247V131-I243 HydrophobicContact CG2-CG2 3.96Å; Y197-I243 HydrophobicContact CD1-CD1 4.38Å; Y197-I243 HydrophobicContact CD1-CG1 4.23Å; Y197-I243 HydrophobicContact CD2-CD1 4.04Å; Y197-I243 HydrophobicContact CG-CD1 3.9Å; Y197-I243 HydrophobicContact CG-CG1 4.25Å; L239-I243 HydrophobicContact CD1-CB 4.14Å; L239-I243 HydrophobicContact CD1-CD1 4.32Å; L239-I243 HydrophobicContact CD1-CG1 4.38Å; L239-I243 HydrophobicContact CD2-CD1 4.36Å; L239-I243 HydrophobicContact CG-CB 4.29Å; L239-I243 HydrophobicContact CG-CD1 4.25Å; L239-I243 WeakPolarHBondContact O-CB 3.4Å; L239-I243 PolarHBondContact O-N 3.48Å; I243-A245 VanDerWaalsContact C-N 3.26Å; I243-A245 PolarHBondContact O-N 2.68Å; I243-M246 WeakPolarHBondContact O-CA 3.29Å; I243-M246 WeakPolarHBondContact O-CB 3.45Å; I243-M246 PolarHBondContact O-N 3.37Å; I243-L247 HydrophobicContact CG1-CG 4.36Å; I243-L247 WeakPolarHBondContact O-CG 3.26Å; I243-L247 PolarHBondContact O-N 3Å
244G88.2Confident89.3Confident3 Ų342.7 Ų42.73%0.03122%0.223CC..Hα-helixtrans-55.2-40.8176.100000113.6V129 R242 M246V129-G244 WeakPolarHBondContact CB-O 3.49Å; V129-G244 PolarHBondContact N-O 2.97Å; V129-G244 CarbonylContact O-C 3.46Å; V129-G244 WeakPolarHBondContact O-CA 3.18Å; R242-G244 PolarHBondContact O-N 3.01Å; R242-G244 VanDerWaalsContact O-N 3.16Å; G244-M246 VanDerWaalsContact C-N 3.35Å
245A85.7Confident88.8Confident34 Ų3450.6 Ų50.628%0.28126%0.256SS..Hα-helixtrans-63.8-43.1174.400000110.6E128 R242 I243 L247 A248 Y249E128-A245 HydrophobicContact CG-CB 4.31Å; E128-A245 PolarHBondContact OE1-N 3.29Å; R242-A245 PolarHBondContact O-N 3.17Å; I243-A245 VanDerWaalsContact C-N 3.26Å; I243-A245 PolarHBondContact O-N 2.68Å; A245-L247 PolarHBondContact O-N 2.9Å; A245-A248 WeakPolarHBondContact O-CB 3.38Å; A245-A248 PolarHBondContact O-N 3.23Å; A245-Y249 WeakPolarHBondContact O-CD2 3.45Å; A245-Y249 WeakPolarHBondContact O-CE2 3.13Å
246M83.4Confident88.3Confident56 Ų5653 Ų5328%0.27627%0.274SS..Hα-helixtrans-66.4-38.2-179.3-61.3-56-68.100113Y197 M201 I243 G244 A248 Y249Y197-M246 HydrophobicContact CD1-CB 4.32Å; Y197-M246 HydrophobicContact CE1-CB 3.7Å; Y197-M246 HydrophobicContact CE1-CG 4.33Å; M201-M246 HydrophobicContact CE-CG 3.51Å; M201-M246 HydrophobicContact CE-SD 4.33Å; M201-M246 HydrophobicContact SD-CG 3.66Å; I243-M246 WeakPolarHBondContact O-CA 3.29Å; I243-M246 WeakPolarHBondContact O-CB 3.45Å; I243-M246 PolarHBondContact O-N 3.37Å; G244-M246 VanDerWaalsContact C-N 3.35Å; M246-A248 PolarHBondContact O-N 3.27Å; M246-Y249 WeakPolarHBondContact O-CB 3.46Å; M246-Y249 PolarHBondContact O-N 3.05Å
247L85.3Confident87.9Confident7 Ų755 Ų554%0.03728%0.284CS..Hα-helixtrans-63.8-23.7178.5-68.1179.7000113.2V129 V131 I243 A245 Y249 T250 L260 L264V129-L247 HydrophobicContact CB-CB 4Å; V129-L247 HydrophobicContact CG1-CB 4.44Å; V129-L247 HydrophobicContact CG1-CD1 4.35Å; V129-L247 HydrophobicContact CG2-CB 3.96Å; V131-L247 HydrophobicContact CG2-CD1 4.32Å; I243-L247 HydrophobicContact CG1-CG 4.36Å; I243-L247 WeakPolarHBondContact O-CG 3.26Å; I243-L247 PolarHBondContact O-N 3Å; A245-L247 PolarHBondContact O-N 2.9Å; L247-Y249 PolarHBondContact O-N 3.02Å; L247-T250 PolarHBondContact O-N 3.21Å; L247-L260 HydrophobicContact CD1-CD2 4.39Å; L247-L260 HydrophobicContact CD2-CD2 3.69Å; L247-L264 HydrophobicContact CD1-CD1 3.75Å
248A80Confident87.5Confident15 Ų1557.1 Ų57.112%0.12430%0.302CS..THydrogen-bonded Turntrans-65.3-22.3173.700000112.3R126 V127 V129 A245 M246R126-A248 HydrophobicContact CB-CB 3.95Å; R126-A248 WeakPolarHBondContact CD-O 3.03Å; R126-A248 PolarHBondContact NH1-O 3.26Å; V127-A248 WeakPolarHBondContact O-CB 3.32Å; V129-A248 HydrophobicContact CG2-CB 4.41Å; A245-A248 WeakPolarHBondContact O-CB 3.38Å; A245-A248 PolarHBondContact O-N 3.23Å; M246-A248 PolarHBondContact O-N 3.27Å
249Y77Confident87.2Confident69 Ų6960.9 Ų60.927%0.27132%0.323SS..THydrogen-bonded Turntrans-91.2-20.9179.5-57.7-81.4000113.1F123 R126 A245 M246 L247F123-Y249 HydrophobicContact CB-CE1 4.46Å; F123-Y249 HydrophobicContact CD1-CE1 4.12Å; F123-Y249 AromaticContact CD2-CD1 3.68Å; F123-Y249 HydrophobicContact CD2-CD1 3.68Å; F123-Y249 AromaticContact CD2-CE1 3.4Å; F123-Y249 HydrophobicContact CD2-CE1 3.4Å; F123-Y249 HydrophobicContact CE1-CE1 4.2Å; F123-Y249 AromaticContact CE2-CD1 3.62Å; F123-Y249 HydrophobicContact CE2-CD1 3.62Å; F123-Y249 AromaticContact CE2-CE1 3.49Å; F123-Y249 HydrophobicContact CE2-CE1 3.49Å; F123-Y249 VanDerWaalsContact CE2-CE1 3.49Å; F123-Y249 HydrophobicContact CE2-CG 4.41Å; F123-Y249 HydrophobicContact CG-CD1 4.43Å; F123-Y249 AromaticContact CG-CE1 3.72Å; F123-Y249 HydrophobicContact CG-CE1 3.72Å; F123-Y249 HydrophobicContact CZ-CD1 4.35Å; F123-Y249 AromaticContact CZ-CE1 3.9Å; F123-Y249 HydrophobicContact CZ-CE1 3.9Å; F123-Y249 WeakPolarHBondContact O-CE1 3.35Å; F123-Y249 PolarHBondContact O-OH 3.16Å; F123-Y249 VanDerWaalsContact O-OH 3.06Å; R126-Y249 PolarHBondContact NH1-O 3.13Å; A245-Y249 WeakPolarHBondContact O-CD2 3.45Å; A245-Y249 WeakPolarHBondContact O-CE2 3.13Å; M246-Y249 WeakPolarHBondContact O-CB 3.46Å; M246-Y249 PolarHBondContact O-N 3.05Å; L247-Y249 PolarHBondContact O-N 3.02Å
250T80.2Confident86.9Confident42 Ų4262.8 Ų62.826%0.25833%0.333SS..SBendtrans-72.1128.3179.3-46.80000110.5Y197 L247 L252Y197-T250 PolarHBondContact OH-OG1 2.78Å; Y197-T250 VanDerWaalsContact OH-OG1 3.1Å; L247-T250 PolarHBondContact O-N 3.21Å; T250-L252 HydrophobicContact CG2-CD1 4.02Å; T250-L252 HydrophobicContact CG2-CD2 4.24Å; T250-L252 HydrophobicContact CG2-CG 3.78Å; T250-L252 PolarHBondContact O-N 3.45Å
251P78.8Confident86.8Confident112 Ų11264.2 Ų64.273%0.72734%0.34SS*.  trans-75.871.5-178.132.6-36.6000111.5
252L81.1Confident86.8Confident66 Ų6666.1 Ų66.135%0.34635%0.348SS..  trans-101.8139.4176.4-61.7172000110.3T250 L257 L260T250-L252 HydrophobicContact CG2-CD1 4.02Å; T250-L252 HydrophobicContact CG2-CD2 4.24Å; T250-L252 HydrophobicContact CG2-CG 3.78Å; T250-L252 PolarHBondContact O-N 3.45Å; L252-L257 HydrophobicContact CB-CB 4.23Å; L252-L257 HydrophobicContact CD1-CD1 4.12Å; L252-L260 HydrophobicContact CD1-CD2 3.6Å
253D85.3Confident86.9Confident88 Ų8861.1 Ų61.147%0.47133%0.33SS..  trans-76.3163.9165.874.2-51.3000110.5K255 S256 L257D253-K255 PolarHBondContact O-N 3.13Å; D253-K255 VanDerWaalsContact O-N 3.17Å; D253-S256 PolarHBondContact O-N 3.31Å; D253-S256 WeakPolarHBondContact OD1-CB 3.46Å; D253-S256 PolarHBondContact OD1-N 2.93Å; D253-S256 PolarHBondContact OD1-OG 3.18Å; D253-L257 WeakPolarHBondContact O-CB 3.41Å; D253-L257 PolarHBondContact O-N 3.21Å
254E84.3Confident87.2Confident171 Ų17161.2 Ų61.280%0.79933%0.33SS*.Hα-helixtrans-56.5-36.5-174.2-68.3171.2-162.700113A258E254-A258 VanDerWaalsContact O-CB 3.31Å; E254-A258 WeakPolarHBondContact O-CB 3.34Å; E254-A258 PolarHBondContact O-N 3.46Å
255K87.4Confident87.6Confident173 Ų17363.2 Ų63.275%0.75234%0.338SS*.Hα-helixtrans-70.3-46.6179.7-65.2-178179.6179.90111.5D253 L257 A258 L259D253-K255 PolarHBondContact O-N 3.13Å; D253-K255 VanDerWaalsContact O-N 3.17Å; K255-L257 VanDerWaalsContact C-N 3.34Å; K255-A258 PolarHBondContact O-N 2.97Å; K255-L259 WeakPolarHBondContact O-CB 3.37Å; K255-L259 PolarHBondContact O-N 3.02Å
256S89.4Confident88.1Confident52 Ų5264 Ų6436%0.36434%0.338SS..Hα-helixtrans-66.2-37.7177.5-56.70000111.7D253 L259 L260D253-S256 PolarHBondContact O-N 3.31Å; D253-S256 WeakPolarHBondContact OD1-CB 3.46Å; D253-S256 PolarHBondContact OD1-N 2.93Å; D253-S256 PolarHBondContact OD1-OG 3.18Å; S256-L259 PolarHBondContact O-N 3.32Å; S256-L260 WeakPolarHBondContact O-CB 3.4Å; S256-L260 PolarHBondContact O-N 3.22Å
257L89.6Confident88.8Confident41 Ų4161.3 Ų61.322%0.21532%0.324CS..Hα-helixtrans-64.2-45.3175.4-177.962.1000111.8V129 L252 D253 K255 L259 L260 L261V129-L257 HydrophobicContact CG1-CD1 4.13Å; V129-L257 HydrophobicContact CG2-CD1 4.29Å; V129-L257 HydrophobicContact CG2-CD2 4.22Å; L252-L257 HydrophobicContact CB-CB 4.23Å; L252-L257 HydrophobicContact CD1-CD1 4.12Å; D253-L257 WeakPolarHBondContact O-CB 3.41Å; D253-L257 PolarHBondContact O-N 3.21Å; K255-L257 VanDerWaalsContact C-N 3.34Å; L257-L259 VanDerWaalsContact C-N 3.32Å; L257-L259 PolarHBondContact O-N 3.27Å; L257-L260 PolarHBondContact O-N 3.39Å; L257-L261 HydrophobicContact CD1-CG 4.47Å; L257-L261 HydrophobicContact CG-CD1 4.26Å; L257-L261 WeakPolarHBondContact O-CB 3.26Å; L257-L261 WeakPolarHBondContact O-CG 3.43Å; L257-L261 PolarHBondContact O-N 3.4Å
258A90.2Very high89.4Confident48 Ų4861 Ų6140%0.39732%0.323SS..Hα-helixtrans-62-41.317600000111.7E254 K255 L261 N262E254-A258 VanDerWaalsContact O-CB 3.31Å; E254-A258 WeakPolarHBondContact O-CB 3.34Å; E254-A258 PolarHBondContact O-N 3.46Å; K255-A258 PolarHBondContact O-N 2.97Å; A258-L261 PolarHBondContact O-N 2.96Å; A258-N262 VanDerWaalsContact O-CG 3.24Å; A258-N262 PolarHBondContact O-N 3.48Å; A258-N262 PolarHBondContact O-ND2 2.86Å
259L91.2Very high90.3Very high92 Ų9266.9 Ų66.948%0.48235%0.346SS..Hα-helixtrans-64.2-46.2176.4-17661.5000111.6K255 S256 L257 L261 N262 Y263K255-L259 WeakPolarHBondContact O-CB 3.37Å; K255-L259 PolarHBondContact O-N 3.02Å; S256-L259 PolarHBondContact O-N 3.32Å; L257-L259 VanDerWaalsContact C-N 3.32Å; L257-L259 PolarHBondContact O-N 3.27Å; L259-L261 PolarHBondContact O-N 3.17Å; L259-N262 WeakPolarHBondContact O-CB 3.43Å; L259-N262 PolarHBondContact O-N 3.44Å; L259-Y263 HydrophobicContact CD1-CD2 4.17Å; L259-Y263 HydrophobicContact CD1-CE2 3.68Å; L259-Y263 HydrophobicContact CD2-CE2 4.45Å; L259-Y263 HydrophobicContact CG-CD2 4.12Å; L259-Y263 HydrophobicContact CG-CE2 3.84Å; L259-Y263 VanDerWaalsContact O-CD2 3.26Å; L259-Y263 WeakPolarHBondContact O-CD2 3.39Å; L259-Y263 PolarHBondContact O-N 3.42Å; L259-Y263 VanDerWaalsContact O-N 3.15Å
260L93.3Very high91.3Very high40 Ų4064.8 Ų64.821%0.20934%0.337CS..Hα-helixtrans-58.2-48.4175.517760.8000111V190 L247 L252 S256 L257 N262 Y263 L264V190-L260 HydrophobicContact CG2-CD1 4.13Å; L247-L260 HydrophobicContact CD1-CD2 4.39Å; L247-L260 HydrophobicContact CD2-CD2 3.69Å; L252-L260 HydrophobicContact CD1-CD2 3.6Å; S256-L260 WeakPolarHBondContact O-CB 3.4Å; S256-L260 PolarHBondContact O-N 3.22Å; L257-L260 PolarHBondContact O-N 3.39Å; L260-N262 VanDerWaalsContact C-N 3.27Å; L260-N262 PolarHBondContact O-N 3.18Å; L260-Y263 PolarHBondContact O-N 3.02Å; L260-L264 HydrophobicContact CD1-CD1 4.35Å; L260-L264 HydrophobicContact CD1-CD2 4.35Å; L260-L264 HydrophobicContact CD1-CG 4.15Å; L260-L264 HydrophobicContact CG-CD1 4.08Å; L260-L264 HydrophobicContact CG-CG 4.29Å; L260-L264 WeakPolarHBondContact O-CG 3.15Å; L260-L264 PolarHBondContact O-N 3.33Å
261L93.9Very high92.1Very high32 Ų3262.8 Ų62.817%0.16833%0.325CS..Hα-helixtrans-59.1-38.1177.8-75.3172.9000112.5V129 V131 L257 A258 L259 Y263 L264 H265V129-L261 HydrophobicContact CG1-CD1 3.92Å; V129-L261 HydrophobicContact CG1-CD2 3.78Å; V129-L261 HydrophobicContact CG1-CG 4.25Å; V131-L261 HydrophobicContact CG2-CD2 4.1Å; L257-L261 HydrophobicContact CD1-CG 4.47Å; L257-L261 HydrophobicContact CG-CD1 4.26Å; L257-L261 WeakPolarHBondContact O-CB 3.26Å; L257-L261 WeakPolarHBondContact O-CG 3.43Å; L257-L261 PolarHBondContact O-N 3.4Å; A258-L261 PolarHBondContact O-N 2.96Å; L259-L261 PolarHBondContact O-N 3.17Å; L261-Y263 VanDerWaalsContact C-N 3.34Å; L261-Y263 PolarHBondContact O-N 3.4Å; L261-L264 HydrophobicContact CD2-CD1 4.49Å; L261-L264 PolarHBondContact O-N 2.97Å; L261-H265 WeakPolarHBondContact O-CB 3.23Å; L261-H265 PolarHBondContact O-CD2 3.42Å; L261-H265 PolarHBondContact O-N 3.32Å
262N94.4Very high93.1Very high106 Ų10658.1 Ų58.157%0.56730%0.296SS*.Hα-helixtrans-61.1-43.4174.5-71.2-27.6000111.7A258 L259 L260 D266A258-N262 VanDerWaalsContact O-CG 3.24Å; A258-N262 PolarHBondContact O-N 3.48Å; A258-N262 PolarHBondContact O-ND2 2.86Å; L259-N262 WeakPolarHBondContact O-CB 3.43Å; L259-N262 PolarHBondContact O-N 3.44Å; L260-N262 VanDerWaalsContact C-N 3.27Å; L260-N262 PolarHBondContact O-N 3.18Å; N262-D266 VanDerWaalsContact O-CB 3.31Å; N262-D266 WeakPolarHBondContact O-CB 3.46Å; N262-D266 PolarHBondContact O-N 3.43Å
263Y95.6Very high93.8Very high34 Ų3461.5 Ų61.513%0.13331%0.308CS..Hα-helixtrans-68-39.7176.3-78.3-72.4000112.9A186 V187 V190 L259 L260 L261 D266 F267A186-Y263 HydrophobicContact CB-CE2 3.97Å; A186-Y263 WeakPolarHBondContact CB-OH 3.48Å; V187-Y263 HydrophobicContact CG2-CD1 4.3Å; V187-Y263 HydrophobicContact CG2-CE1 3.76Å; V190-Y263 HydrophobicContact CG2-CD2 4.1Å; V190-Y263 HydrophobicContact CG2-CG 3.94Å; L259-Y263 HydrophobicContact CD1-CD2 4.17Å; L259-Y263 HydrophobicContact CD1-CE2 3.68Å; L259-Y263 HydrophobicContact CD2-CE2 4.45Å; L259-Y263 HydrophobicContact CG-CD2 4.12Å; L259-Y263 HydrophobicContact CG-CE2 3.84Å; L259-Y263 VanDerWaalsContact O-CD2 3.26Å; L259-Y263 WeakPolarHBondContact O-CD2 3.39Å; L259-Y263 PolarHBondContact O-N 3.42Å; L259-Y263 VanDerWaalsContact O-N 3.15Å; L260-Y263 PolarHBondContact O-N 3.02Å; L261-Y263 VanDerWaalsContact C-N 3.34Å; L261-Y263 PolarHBondContact O-N 3.4Å; Y263-D266 PolarHBondContact O-N 3.33Å; Y263-F267 WeakPolarHBondContact O-CB 3.23Å; Y263-F267 PolarHBondContact O-N 3.49Å
264L96.5Very high94.4Very high4 Ų459.6 Ų59.62%0.02130%0.298CS..Hα-helixtrans-64.3-41.6175.7-62.8177.6000111.4V131 V190 I194 F240 L247 L260 L261 F267 L268V131-L264 HydrophobicContact CG2-CD1 4.48Å; V190-L264 HydrophobicContact CG1-CD2 4.3Å; I194-L264 HydrophobicContact CD1-CD2 4.03Å; I194-L264 HydrophobicContact CG1-CD2 3.99Å; F240-L264 HydrophobicContact CE1-CB 4.41Å; F240-L264 HydrophobicContact CE1-CD2 3.93Å; L247-L264 HydrophobicContact CD1-CD1 3.75Å; L260-L264 HydrophobicContact CD1-CD1 4.35Å; L260-L264 HydrophobicContact CD1-CD2 4.35Å; L260-L264 HydrophobicContact CD1-CG 4.15Å; L260-L264 HydrophobicContact CG-CD1 4.08Å; L260-L264 HydrophobicContact CG-CG 4.29Å; L260-L264 WeakPolarHBondContact O-CG 3.15Å; L260-L264 PolarHBondContact O-N 3.33Å; L261-L264 HydrophobicContact CD2-CD1 4.49Å; L261-L264 PolarHBondContact O-N 2.97Å; L264-F267 PolarHBondContact O-N 3.41Å; L264-L268 WeakPolarHBondContact O-CG 3.34Å; L264-L268 PolarHBondContact O-N 3.49Å
265H96.9Very high95Very high46 Ų4652.8 Ų52.821%0.21327%0.269CS..Hα-helixtrans-70.6-33.4176.9-65.6169.6000112.2K132 L261 L268 K269K132-H265 PolarHBondContact N-NE2 3.32Å; L261-H265 WeakPolarHBondContact O-CB 3.23Å; L261-H265 PolarHBondContact O-CD2 3.42Å; L261-H265 PolarHBondContact O-N 3.32Å; H265-L268 PolarHBondContact O-N 3.27Å; H265-K269 VanDerWaalsContact O-CG 3.31Å; H265-K269 WeakPolarHBondContact O-CG 3.49Å; H265-K269 PolarHBondContact O-N 2.8Å
266D96.4Very high95.4Very high49 Ų4948.7 Ų48.726%0.26227%0.268SS..Hα-helixtrans-65.3-42.7172.4-171.681.5000111.6Y170 K174 N262 Y263 K269 Y270Y170-D266 PolarHBondContact OH-OD2 3.27Å; K174-D266 WeakPolarHBondContact CD-OD2 3.26Å; K174-D266 WeakPolarHBondContact CE-OD2 3.37Å; K174-D266 VanDerWaalsContact NZ-CG 3.34Å; K174-D266 IonicContact NZ-OD1 3.84Å; K174-D266 PolarHBondContact NZ-OD1 2.94Å; K174-D266 IonicContact NZ-OD2 2.68Å; K174-D266 PolarHBondContact NZ-OD2 2.92Å; N262-D266 VanDerWaalsContact O-CB 3.31Å; N262-D266 WeakPolarHBondContact O-CB 3.46Å; N262-D266 PolarHBondContact O-N 3.43Å; Y263-D266 PolarHBondContact O-N 3.33Å; D266-K269 WeakPolarHBondContact O-CB 3.21Å; D266-K269 PolarHBondContact O-N 2.92Å; D266-Y270 PolarHBondContact O-N 2.96Å
267F98.1Very high95.7Very high0 Ų051.7 Ų51.70%028%0.284CS..Hα-helixtrans-61.4-45.3172.7-177.1-104.2000112.2I166 L167 Y170 I194 L236 F240 Y263 L264 K269 Y270 L271I166-F267 HydrophobicContact CG2-CZ 4.22Å; L167-F267 HydrophobicContact CD2-CE1 4.48Å; L167-F267 HydrophobicContact CD2-CE2 3.87Å; L167-F267 HydrophobicContact CD2-CZ 3.71Å; Y170-F267 AromaticContact CD1-CD2 3.5Å; Y170-F267 HydrophobicContact CD1-CD2 3.5Å; Y170-F267 HydrophobicContact CD1-CE2 4Å; Y170-F267 AromaticContact CD2-CD2 3.67Å; Y170-F267 HydrophobicContact CD2-CD2 3.67Å; Y170-F267 HydrophobicContact CD2-CE2 4.31Å; Y170-F267 HydrophobicContact CE1-CB 4.33Å; Y170-F267 AromaticContact CE1-CD2 3.81Å; Y170-F267 HydrophobicContact CE1-CD2 3.81Å; Y170-F267 HydrophobicContact CE2-CB 4.23Å; Y170-F267 AromaticContact CE2-CD2 3.97Å; Y170-F267 HydrophobicContact CE2-CD2 3.97Å; Y170-F267 AromaticContact CG-CD2 3.41Å; Y170-F267 HydrophobicContact CG-CD2 3.41Å; Y170-F267 VanDerWaalsContact CG-CD2 3.41Å; Y170-F267 AromaticContact CG-CE2 3.76Å; Y170-F267 HydrophobicContact CG-CE2 3.76Å; I194-F267 HydrophobicContact CD1-CD1 4.25Å; I194-F267 HydrophobicContact CD1-CG 4.31Å; L236-F267 HydrophobicContact CD2-CE1 4.08Å; L236-F267 HydrophobicContact CD2-CZ 3.88Å; L236-F267 HydrophobicContact CG-CE1 4.47Å; F240-F267 HydrophobicContact CE1-CD1 4Å; F240-F267 AromaticContact CE2-CD1 3.8Å; F240-F267 HydrophobicContact CE2-CD1 3.8Å; F240-F267 AromaticContact CE2-CE1 3.63Å; F240-F267 HydrophobicContact CE2-CE1 3.63Å; F240-F267 AromaticContact CZ-CD1 3.27Å; F240-F267 HydrophobicContact CZ-CD1 3.27Å; F240-F267 AromaticContact CZ-CE1 3.5Å; F240-F267 HydrophobicContact CZ-CE1 3.5Å; F240-F267 HydrophobicContact CZ-CG 4.43Å; Y263-F267 WeakPolarHBondContact O-CB 3.23Å; Y263-F267 PolarHBondContact O-N 3.49Å; L264-F267 PolarHBondContact O-N 3.41Å; F267-K269 VanDerWaalsContact C-N 3.29Å; F267-K269 PolarHBondContact O-N 3.1Å; F267-Y270 HydrophobicContact CE2-CD1 4.4Å; F267-Y270 CarbonylContact O-C 3.57Å; F267-Y270 WeakPolarHBondContact O-CA 3.48Å; F267-Y270 VanDerWaalsContact O-CB 3.3Å; F267-Y270 WeakPolarHBondContact O-CB 3.28Å; F267-Y270 PolarHBondContact O-N 3.41Å; F267-L271 HydrophobicContact CD1-CD1 4.15Å; F267-L271 HydrophobicContact CD1-CG 4.24Å; F267-L271 HydrophobicContact CE1-CD1 3.68Å; F267-L271 HydrophobicContact CE1-CD2 4.02Å; F267-L271 HydrophobicContact CE1-CG 3.87Å; F267-L271 HydrophobicContact CE2-CD2 4.45Å; F267-L271 HydrophobicContact CZ-CD1 4.34Å; F267-L271 HydrophobicContact CZ-CD2 3.83Å; F267-L271 HydrophobicContact CZ-CG 4.16Å; F267-L271 PolarHBondContact O-N 2.97Å
268L98.4Very high96Very high0 Ų050.6 Ų50.60%028%0.278CS..Hα-helixtrans-60.7-37.4175.5-77.8168.8000112.5V131 I133 P134 L137 L237 F240 L264 H265 Y270 L271 A272V131-L268 HydrophobicContact CG1-CD1 3.71Å; I133-L268 HydrophobicContact CD1-CD1 4.15Å; I133-L268 HydrophobicContact CD1-CD2 4.16Å; P134-L268 HydrophobicContact CG-CB 3.86Å; L137-L268 HydrophobicContact CD1-CD2 4.39Å; L237-L268 HydrophobicContact CD1-CD2 3.91Å; F240-L268 HydrophobicContact CB-CD1 4.29Å; F240-L268 HydrophobicContact CB-CD2 3.87Å; F240-L268 HydrophobicContact CB-CG 4.49Å; F240-L268 HydrophobicContact CD1-CD1 4.04Å; F240-L268 HydrophobicContact CD1-CD2 4.07Å; F240-L268 HydrophobicContact CD1-CG 3.98Å; F240-L268 HydrophobicContact CD2-CD2 3.94Å; F240-L268 HydrophobicContact CE1-CG 4.41Å; F240-L268 HydrophobicContact CG-CD1 4.29Å; F240-L268 HydrophobicContact CG-CD2 3.67Å; F240-L268 HydrophobicContact CG-CG 4.11Å; L264-L268 WeakPolarHBondContact O-CG 3.34Å; L264-L268 PolarHBondContact O-N 3.49Å; H265-L268 PolarHBondContact O-N 3.27Å; L268-Y270 VanDerWaalsContact C-N 3.34Å; L268-L271 HydrophobicContact CD2-CD1 4.38Å; L268-L271 PolarHBondContact O-N 3.12Å; L268-A272 WeakPolarHBondContact O-CB 3.25Å; L268-A272 PolarHBondContact O-N 3.04Å
269K97.7Very high96.3Very high140 Ų14048.7 Ų48.761%0.60926%0.261SS*.Hα-helixtrans-66-36.6172.4-74.3171.7-176.7176.40112.1H265 D266 F267 A272 K273H265-K269 VanDerWaalsContact O-CG 3.31Å; H265-K269 WeakPolarHBondContact O-CG 3.49Å; H265-K269 PolarHBondContact O-N 2.8Å; D266-K269 WeakPolarHBondContact O-CB 3.21Å; D266-K269 PolarHBondContact O-N 2.92Å; F267-K269 VanDerWaalsContact C-N 3.29Å; F267-K269 PolarHBondContact O-N 3.1Å; K269-A272 PolarHBondContact O-N 3.12Å; K269-K273 WeakPolarHBondContact O-CB 3.46Å; K269-K273 PolarHBondContact O-N 3.25Å
270Y97.9Very high96.5Very high24 Ų2446.2 Ų46.29%0.09425%0.251CS..Hα-helixtrans-62.2-45.1172.2169.7-90.5000111.2D169 Y170 Y173 D266 F267 L268 A272 K273 N274D169-Y270 VanDerWaalsContact CB-OH 3.28Å; D169-Y270 WeakPolarHBondContact CB-OH 3.48Å; Y170-Y270 AromaticContact CD2-CD1 3.95Å; Y170-Y270 HydrophobicContact CD2-CD1 3.95Å; Y170-Y270 HydrophobicContact CD2-CD2 4.08Å; Y170-Y270 AromaticContact CD2-CG 3.67Å; Y170-Y270 HydrophobicContact CD2-CG 3.67Å; Y170-Y270 HydrophobicContact CE2-CG 4.45Å; Y170-Y270 HydrophobicContact CG-CD1 4.43Å; Y173-Y270 AromaticContact CD1-CD2 3.63Å; Y173-Y270 HydrophobicContact CD1-CD2 3.63Å; Y173-Y270 HydrophobicContact CD1-CE2 4.07Å; Y173-Y270 HydrophobicContact CD2-CE2 4.48Å; Y173-Y270 AromaticContact CE1-CD2 3.99Å; Y173-Y270 HydrophobicContact CE1-CD2 3.99Å; Y173-Y270 AromaticContact CG-CD2 3.96Å; Y173-Y270 HydrophobicContact CG-CD2 3.96Å; Y173-Y270 AromaticContact CG-CE2 3.92Å; Y173-Y270 HydrophobicContact CG-CE2 3.92Å; D266-Y270 PolarHBondContact O-N 2.96Å; F267-Y270 HydrophobicContact CE2-CD1 4.4Å; F267-Y270 CarbonylContact O-C 3.57Å; F267-Y270 WeakPolarHBondContact O-CA 3.48Å; F267-Y270 VanDerWaalsContact O-CB 3.3Å; F267-Y270 WeakPolarHBondContact O-CB 3.28Å; F267-Y270 PolarHBondContact O-N 3.41Å; L268-Y270 VanDerWaalsContact C-N 3.34Å; Y270-A272 VanDerWaalsContact C-N 3.35Å; Y270-A272 PolarHBondContact O-N 2.98Å; Y270-K273 PolarHBondContact O-N 2.9Å; Y270-N274 WeakPolarHBondContact CD2-ND2 3.39Å; Y270-N274 VanDerWaalsContact CE2-ND2 3.26Å; Y270-N274 WeakPolarHBondContact CE2-ND2 3.33Å; Y270-N274 PolarHBondContact O-N 2.8Å; Y270-N274 VanDerWaalsContact O-N 3.13Å; Y270-N274 PolarHBondContact O-ND2 2.91Å
271L98.4Very high96.5Very high0 Ų046.8 Ų46.80%026%0.262CS..Hα-helixtrans-59.9-45.1174.3-63.1-175.5000111.6L137 I166 L237 F267 L268 K273 N274 S275 L278L137-L271 HydrophobicContact CD1-CB 4.01Å; I166-L271 HydrophobicContact CG2-CD2 3.9Å; L237-L271 HydrophobicContact CD1-CD1 4.4Å; F267-L271 HydrophobicContact CD1-CD1 4.15Å; F267-L271 HydrophobicContact CD1-CG 4.24Å; F267-L271 HydrophobicContact CE1-CD1 3.68Å; F267-L271 HydrophobicContact CE1-CD2 4.02Å; F267-L271 HydrophobicContact CE1-CG 3.87Å; F267-L271 HydrophobicContact CE2-CD2 4.45Å; F267-L271 HydrophobicContact CZ-CD1 4.34Å; F267-L271 HydrophobicContact CZ-CD2 3.83Å; F267-L271 HydrophobicContact CZ-CG 4.16Å; F267-L271 PolarHBondContact O-N 2.97Å; L268-L271 HydrophobicContact CD2-CD1 4.38Å; L268-L271 PolarHBondContact O-N 3.12Å; L271-K273 PolarHBondContact O-N 3.28Å; L271-N274 CarbonylContact O-C 3.4Å; L271-N274 PolarHBondContact O-N 2.63Å; L271-S275 WeakPolarHBondContact O-CA 3.08Å; L271-S275 PolarHBondContact O-N 3.18Å; L271-L278 HydrophobicContact CD2-CD1 3.67Å
272A97.9Very high96.6Very high15 Ų1549.1 Ų49.112%0.12428%0.281CS..Hα-helixtrans-60.7-42.7177.700000112.2P134 E136 L137 L268 K269 Y270 N274 S275P134-A272 HydrophobicContact CB-CB 4.19Å; P134-A272 HydrophobicContact CG-CB 4.39Å; E136-A272 HydrophobicContact CB-CB 4.48Å; L137-A272 HydrophobicContact CD1-CB 4.06Å; L137-A272 HydrophobicContact CD2-CB 4.27Å; L137-A272 HydrophobicContact CG-CB 3.91Å; L268-A272 WeakPolarHBondContact O-CB 3.25Å; L268-A272 PolarHBondContact O-N 3.04Å; K269-A272 PolarHBondContact O-N 3.12Å; Y270-A272 VanDerWaalsContact C-N 3.35Å; Y270-A272 PolarHBondContact O-N 2.98Å; A272-N274 VanDerWaalsContact C-N 3.25Å; A272-N274 PolarHBondContact O-N 3.02Å; A272-S275 WeakPolarHBondContact O-CB 3.49Å; A272-S275 PolarHBondContact O-N 3.35Å; A272-S275 PolarHBondContact O-OG 2.89Å
273K97.5Very high96.7Very high137 Ų13745.4 Ų45.460%0.59626%0.261SS*.Hα-helixtrans-63.9-32.5178.1-174-179176.6-1680112.7K269 Y270 L271K269-K273 WeakPolarHBondContact O-CB 3.46Å; K269-K273 PolarHBondContact O-N 3.25Å; Y270-K273 PolarHBondContact O-N 2.9Å; L271-K273 PolarHBondContact O-N 3.28Å
274N97.4Very high96.8Very high48 Ų4844.7 Ų44.726%0.25726%0.258SS..THydrogen-bonded Turntrans-103.821.5-179.2-58.9-75.8000111.7Y270 L271 A272 A276 T277 L278Y270-N274 WeakPolarHBondContact CD2-ND2 3.39Å; Y270-N274 VanDerWaalsContact CE2-ND2 3.26Å; Y270-N274 WeakPolarHBondContact CE2-ND2 3.33Å; Y270-N274 PolarHBondContact O-N 2.8Å; Y270-N274 VanDerWaalsContact O-N 3.13Å; Y270-N274 PolarHBondContact O-ND2 2.91Å; L271-N274 CarbonylContact O-C 3.4Å; L271-N274 PolarHBondContact O-N 2.63Å; A272-N274 VanDerWaalsContact C-N 3.25Å; A272-N274 PolarHBondContact O-N 3.02Å; N274-A276 VanDerWaalsContact C-N 3.26Å; N274-A276 PolarHBondContact O-N 3.11Å; N274-T277 PolarHBondContact O-N 3.14Å; N274-T277 VanDerWaalsContact O-N 3.13Å; N274-T277 PolarHBondContact O-OG1 2.91Å; N274-L278 HydrophobicContact CB-CD1 3.79Å; N274-L278 HydrophobicContact CB-CG 4.14Å; N274-L278 WeakPolarHBondContact O-CB 3.2Å; N274-L278 WeakPolarHBondContact O-CG 3.45Å; N274-L278 PolarHBondContact O-N 3.38Å
275S96.4Very high96.8Very high27 Ų2749.7 Ų49.719%0.18928%0.281CS..Hα-helixtrans-62.2-35.8-170.563.10000112.7L271 A272 T277 L278 F279L271-S275 WeakPolarHBondContact O-CA 3.08Å; L271-S275 PolarHBondContact O-N 3.18Å; A272-S275 WeakPolarHBondContact O-CB 3.49Å; A272-S275 PolarHBondContact O-N 3.35Å; A272-S275 PolarHBondContact O-OG 2.89Å; S275-T277 PolarHBondContact O-N 3.17Å; S275-L278 PolarHBondContact O-N 2.7Å; S275-F279 WeakPolarHBondContact O-CD2 3.24Å; S275-F279 PolarHBondContact O-N 2.99Å
276A95.2Very high96.8Very high88 Ų8852 Ų5273%0.72730%0.299SS*.Hα-helixtrans-64.6-24.1-179.700000113.9N274N274-A276 VanDerWaalsContact C-N 3.26Å; N274-A276 PolarHBondContact O-N 3.11Å
277T95.8Very high96.8Very high114 Ų11450 Ų5070%0.69929%0.289SS*.Hα-helixtrans-100.8-25.717858.10000112.6N274 S275N274-T277 PolarHBondContact O-N 3.14Å; N274-T277 VanDerWaalsContact O-N 3.13Å; N274-T277 PolarHBondContact O-OG1 2.91Å; S275-T277 PolarHBondContact O-N 3.17Å
278L96.7Very high96.7Very high19 Ų1953.2 Ų53.210%0.09931%0.31CS..Hα-helixtrans-90.3-28.7-177.4-68176.3000113.3I166 A233 L271 N274 S275I166-L278 HydrophobicContact CD1-CD2 4.1Å; I166-L278 HydrophobicContact CG1-CD2 3.92Å; A233-L278 HydrophobicContact CB-CB 3.93Å; A233-L278 HydrophobicContact CB-CD2 4.45Å; A233-L278 VanDerWaalsContact CB-O 3.32Å; A233-L278 WeakPolarHBondContact CB-O 3.38Å; L271-L278 HydrophobicContact CD2-CD1 3.67Å; N274-L278 HydrophobicContact CB-CD1 3.79Å; N274-L278 HydrophobicContact CB-CG 4.14Å; N274-L278 WeakPolarHBondContact O-CB 3.2Å; N274-L278 WeakPolarHBondContact O-CG 3.45Å; N274-L278 PolarHBondContact O-N 3.38Å; S275-L278 PolarHBondContact O-N 2.7Å
279F96.9Very high96.5Very high8 Ų857.3 Ų57.34%0.03534%0.336CS..  trans-122.6118.4-177.6-50.9-78.5000109.6L137 W140 A233 P234 L237 S275L137-F279 HydrophobicContact CD2-CD2 4.22Å; L137-F279 HydrophobicContact CD2-CE2 3.62Å; L137-F279 HydrophobicContact CD2-CZ 4.23Å; W140-F279 HydrophobicContact CD2-CB 3.52Å; W140-F279 HydrophobicContact CD2-CG 4.21Å; W140-F279 HydrophobicContact CE3-CB 3.63Å; W140-F279 HydrophobicContact CG-CB 4.07Å; W140-F279 HydrophobicContact CG-CD2 4.48Å; W140-F279 HydrophobicContact CG-CG 4.25Å; W140-F279 HydrophobicContact CH2-CB 4.04Å; W140-F279 WeakPolarHBondContact CH2-O 3.39Å; W140-F279 HydrophobicContact CZ2-CB 3.95Å; W140-F279 WeakPolarHBondContact CZ2-O 3.03Å; W140-F279 HydrophobicContact CZ3-CB 3.89Å; A233-F279 HydrophobicContact CB-CD1 4.21Å; A233-F279 HydrophobicContact CB-CE1 3.79Å; A233-F279 HydrophobicContact CB-CZ 4.19Å; P234-F279 HydrophobicContact CG-CD1 4.34Å; L237-F279 HydrophobicContact CB-CE1 4.01Å; L237-F279 HydrophobicContact CB-CZ 4.2Å; L237-F279 HydrophobicContact CD2-CE1 3.84Å; L237-F279 HydrophobicContact CD2-CZ 3.86Å; S275-F279 WeakPolarHBondContact O-CD2 3.24Å; S275-F279 PolarHBondContact O-N 2.99Å
280S95.3Very high96.3Very high39 Ų3955.7 Ų55.727%0.27333%0.331SS..  trans-144.5136.6174.7-176.10000110.5S282 D283 Y284S280-S282 WeakPolarHBondContact CB-OG 3.34Å; S280-S282 PolarHBondContact O-N 3.47Å; S280-S282 WeakPolarHBondContact OG-CB 3.39Å; S280-S282 PolarHBondContact OG-N 3.21Å; S280-S282 VanDerWaalsContact OG-N 3.13Å; S280-S282 PolarHBondContact OG-OG 3.15Å; S280-D283 PolarHBondContact O-N 3.27Å; S280-D283 VanDerWaalsContact O-N 3.15Å; S280-Y284 WeakPolarHBondContact O-CD2 3.28Å
281A93.4Very high96.2Very high53 Ų5355.1 Ų55.144%0.43833%0.329SS..G310 helixtrans-63.8-21.1169.800000112L147 D283 Y284L147-A281 HydrophobicContact CD1-CB 4.37Å; A281-D283 PolarHBondContact O-N 3.13Å; A281-Y284 PolarHBondContact O-N 3.28Å; A281-Y284 VanDerWaalsContact O-N 3.14Å
282S95.6Very high95.9Very high80 Ų8058.4 Ų58.456%0.55934%0.344SS*.G310 helixtrans-67.4-13.3174.869.20000113.7S280S280-S282 WeakPolarHBondContact CB-OG 3.34Å; S280-S282 PolarHBondContact O-N 3.47Å; S280-S282 WeakPolarHBondContact OG-CB 3.39Å; S280-S282 PolarHBondContact OG-N 3.21Å; S280-S282 VanDerWaalsContact OG-N 3.13Å; S280-S282 PolarHBondContact OG-OG 3.15Å
283D96.6Very high95.6Very high29 Ų2966.4 Ų66.416%0.15537%0.371CS..G310 helixtrans-88.712.1175.2-62.1-44.7000112.4F155 Y156 K160 S280 A281F155-D283 WeakPolarHBondContact CA-O 3.35Å; F155-D283 HydrophobicContact CD2-CB 4.12Å; F155-D283 WeakPolarHBondContact CD2-O 3.44Å; F155-D283 HydrophobicContact CE2-CB 3.54Å; F155-D283 HydrophobicContact CZ-CB 4.15Å; Y156-D283 VanDerWaalsContact CD2-O 3.24Å; Y156-D283 WeakPolarHBondContact CD2-O 2.95Å; Y156-D283 PolarHBondContact N-O 2.65Å; K160-D283 IonicContact NZ-OD1 3.52Å; S280-D283 PolarHBondContact O-N 3.27Å; S280-D283 VanDerWaalsContact O-N 3.15Å; A281-D283 PolarHBondContact O-N 3.13Å
284Y97.9Very high95.2Very high18 Ų1866.1 Ų66.17%0.07137%0.37CS..EExtended strand (participates in β ladder)trans-117.9151.4173.9-63.2-102.5000111.1D144 L147 I148 Q153 L154 F155 P234 S280 A281D144-Y284 PolarHBondContact OD1-OH 2.96Å; L147-Y284 HydrophobicContact CB-CD1 4.31Å; L147-Y284 HydrophobicContact CD1-CD1 4.38Å; L147-Y284 HydrophobicContact CD1-CD2 3.89Å; L147-Y284 HydrophobicContact CD1-CE1 4.45Å; L147-Y284 HydrophobicContact CD1-CE2 3.97Å; L147-Y284 HydrophobicContact CD1-CG 4.11Å; I148-Y284 HydrophobicContact CD1-CD1 3.85Å; I148-Y284 HydrophobicContact CD1-CE1 3.66Å; I148-Y284 HydrophobicContact CG1-CE1 4.21Å; Q153-Y284 VanDerWaalsContact OE1-CB 3.3Å; L154-Y284 CarbonylContact O-C 3.53Å; L154-Y284 WeakPolarHBondContact O-CA 3.49Å; F155-Y284 HydrophobicContact CB-CD1 4.16Å; F155-Y284 HydrophobicContact CB-CE1 3.92Å; F155-Y284 HydrophobicContact CD2-CD1 4.48Å; F155-Y284 HydrophobicContact CD2-CD2 4.29Å; F155-Y284 HydrophobicContact CD2-CE1 4.05Å; F155-Y284 AromaticContact CD2-CE2 3.85Å; F155-Y284 HydrophobicContact CD2-CE2 3.85Å; F155-Y284 AromaticContact CD2-CZ 3.7Å; F155-Y284 HydrophobicContact CE2-CE2 4.42Å; P234-Y284 WeakPolarHBondContact CB-OH 3.49Å; P234-Y284 VanDerWaalsContact CG-OH 3.26Å; P234-Y284 WeakPolarHBondContact CG-OH 3.49Å; S280-Y284 WeakPolarHBondContact O-CD2 3.28Å; A281-Y284 PolarHBondContact O-N 3.28Å; A281-Y284 VanDerWaalsContact O-N 3.14Å
285E96.6Very high94.4Very high109 Ų10964.5 Ų64.551%0.50936%0.363SS..EExtended strand (participates in β ladder)trans-130.8145.9173.6-158.5176.4-169.300110.5Q153 L154 Y156 A287Q153-E285 CarbonylContact C-O 3.53Å; Q153-E285 WeakPolarHBondContact CA-O 3.49Å; Q153-E285 WeakPolarHBondContact CB-O 3.43Å; L154-E285 PolarHBondContact N-O 3.46Å; L154-E285 PolarHBondContact O-N 3.33Å; Y156-E285 HydrophobicContact CE1-CB 3.73Å; Y156-E285 HydrophobicContact CE1-CG 4.2Å; Y156-E285 VanDerWaalsContact CE1-OE2 3.22Å; Y156-E285 WeakPolarHBondContact CE1-OE2 3.48Å; Y156-E285 HydrophobicContact CE2-CB 4.24Å; Y156-E285 WeakPolarHBondContact OH-CB 3.33Å; Y156-E285 WeakPolarHBondContact OH-CG 3.42Å; E285-A287 PolarHBondContact O-N 3.39Å
286V97.1Very high93Very high95 Ų9570.5 Ų70.558%0.57640%0.398SS*.EExtended strand (participates in β ladder)trans-61.1124.8170179.80000109Q153Q153-V286 HydrophobicContact CG-CG2 4.18Å
287A96.7Very high92.9Very high7 Ų769.7 Ų69.76%0.05838%0.382CS..PPolyproline II helixtrans-63.9135.6-179.500000110.7K152 L154 F210 E285 Y291 H292K152-A287 VanDerWaalsContact O-CB 3.28Å; K152-A287 WeakPolarHBondContact O-CB 3.42Å; K152-A287 PolarHBondContact O-N 2.93Å; L154-A287 HydrophobicContact CD1-CB 3.77Å; L154-A287 HydrophobicContact CG-CB 4.08Å; F210-A287 HydrophobicContact CE1-CB 3.83Å; F210-A287 HydrophobicContact CZ-CB 3.71Å; E285-A287 PolarHBondContact O-N 3.39Å; A287-Y291 HydrophobicContact CB-CD1 3.83Å; A287-Y291 HydrophobicContact CB-CG 4.19Å; A287-H292 PolarHBondContact O-CD2 2.87Å; A287-H292 PolarHBondContact O-NE2 3.18Å
288P95.8Very high92.8Very high67 Ų6767.3 Ų67.344%0.43537%0.365SS..PPolyproline II helixtrans-68.6155.8-178.727.9-34.6000111.4E290 Y291 H292P288-E290 PolarHBondContact O-N 3.29Å; P288-Y291 WeakPolarHBondContact O-CA 3.22Å; P288-Y291 VanDerWaalsContact O-CB 3.26Å; P288-Y291 WeakPolarHBondContact O-CB 3.31Å; P288-Y291 PolarHBondContact O-N 3.03Å; P288-H292 PolarHBondContact O-CD2 2.97Å; P288-H292 PolarHBondContact O-N 3.44Å
289P94.1Very high92.6Very high86 Ų8670 Ų7056%0.55838%0.38SS*.Hα-helixtrans-54.6-30.6-178.2-27.435.9000114.6Y291 H292P289-Y291 VanDerWaalsContact C-N 3.33Å; P289-H292 PolarHBondContact O-N 2.61Å
290E94Very high92.3Very high106 Ų10673.6 Ų73.650%0.49540%0.4SS..Hα-helixtrans-65.6-38.1176.3-64.765-137.300111.4P288 R293P288-E290 PolarHBondContact O-N 3.29Å; E290-R293 PolarHBondContact O-N 3.22Å; E290-R293 IonicContact OE1-NH2 3.7Å
291Y95.9Very high92.1Very high13 Ų1375.8 Ų75.85%0.05141%0.408CS..Hα-helixtrans-65.5-42176.8-172.2-84.7000111.2L154 F210 P213 Q214 A287 P288 P289 R293 K294 A295L154-Y291 HydrophobicContact CD1-CD1 3.82Å; L154-Y291 HydrophobicContact CD1-CD2 3.83Å; L154-Y291 HydrophobicContact CD1-CE1 3.54Å; L154-Y291 HydrophobicContact CD1-CE2 3.52Å; L154-Y291 HydrophobicContact CD1-CG 3.96Å; L154-Y291 HydrophobicContact CD2-CE1 4.02Å; L154-Y291 HydrophobicContact CG-CE1 4.24Å; F210-Y291 HydrophobicContact CD1-CE1 4.48Å; F210-Y291 HydrophobicContact CE1-CD1 4.39Å; F210-Y291 HydrophobicContact CE1-CE1 4.13Å; F210-Y291 HydrophobicContact CE2-CD1 4.26Å; F210-Y291 HydrophobicContact CE2-CE1 4.21Å; F210-Y291 AromaticContact CZ-CD1 3.92Å; F210-Y291 HydrophobicContact CZ-CD1 3.92Å; F210-Y291 AromaticContact CZ-CE1 3.99Å; F210-Y291 HydrophobicContact CZ-CE1 3.99Å; F210-Y291 VanDerWaalsContact O-CE1 3.31Å; F210-Y291 WeakPolarHBondContact O-CE1 3.47Å; F210-Y291 PolarHBondContact O-OH 2.88Å; P213-Y291 HydrophobicContact CB-CE1 4.43Å; P213-Y291 HydrophobicContact CB-CE2 3.87Å; P213-Y291 HydrophobicContact CG-CE1 4.33Å; Q214-Y291 HydrophobicContact CB-CE2 3.75Å; Q214-Y291 WeakPolarHBondContact CB-OH 3.41Å; Q214-Y291 PolarHBondContact N-OH 3.12Å; A287-Y291 HydrophobicContact CB-CD1 3.83Å; A287-Y291 HydrophobicContact CB-CG 4.19Å; P288-Y291 WeakPolarHBondContact O-CA 3.22Å; P288-Y291 VanDerWaalsContact O-CB 3.26Å; P288-Y291 WeakPolarHBondContact O-CB 3.31Å; P288-Y291 PolarHBondContact O-N 3.03Å; P289-Y291 VanDerWaalsContact C-N 3.33Å; Y291-R293 PolarHBondContact O-N 2.87Å; Y291-K294 WeakPolarHBondContact O-CB 3.38Å; Y291-K294 PolarHBondContact O-N 2.89Å; Y291-A295 HydrophobicContact CD1-CB 4.23Å; Y291-A295 HydrophobicContact CE1-CB 4.01Å; Y291-A295 PolarHBondContact O-N 3.03Å; Y291-A295 VanDerWaalsContact O-N 3.15Å
292H91.5Very high92Very high69 Ų6977.3 Ų77.332%0.31941%0.406SS..Hα-helixtrans-55.6-36.7178.4-81.2-112.5000112.7F210 A287 P288 P289 K294 A295 V296F210-H292 AromaticContact CZ-NE2 3.93Å; A287-H292 PolarHBondContact O-CD2 2.87Å; A287-H292 PolarHBondContact O-NE2 3.18Å; P288-H292 PolarHBondContact O-CD2 2.97Å; P288-H292 PolarHBondContact O-N 3.44Å; P289-H292 PolarHBondContact O-N 2.61Å; H292-K294 VanDerWaalsContact C-N 3.27Å; H292-K294 PolarHBondContact O-N 3.06Å; H292-A295 PolarHBondContact O-N 3.3Å; H292-V296 VanDerWaalsContact O-CG2 3.24Å; H292-V296 WeakPolarHBondContact O-CG2 3.43Å
293R91.2Very high91.8Very high183 Ų18377.1 Ų77.169%0.69140%0.395SS*.Hα-helixtrans-65.8-30178.4-59.5177.8-149.4172.49.6112.5E290 Y291E290-R293 PolarHBondContact O-N 3.22Å; E290-R293 IonicContact OE1-NH2 3.7Å; Y291-R293 PolarHBondContact O-N 2.87Å
294K89.3Confident91.4Very high130 Ų13080.8 Ų80.857%0.56541%0.414SS*.Hα-helixtrans-80.2-23.4176-60.1174.8175.91740112.5P213 E217 Y291 H292P213-K294 HydrophobicContact CB-CB 3.85Å; P213-K294 HydrophobicContact CG-CB 4.02Å; P213-K294 WeakPolarHBondContact CG-O 3.47Å; E217-K294 IonicContact OE1-NZ 3.52Å; E217-K294 PolarHBondContact OE1-NZ 3.5Å; Y291-K294 WeakPolarHBondContact O-CB 3.38Å; Y291-K294 PolarHBondContact O-N 2.89Å; H292-K294 VanDerWaalsContact C-N 3.27Å; H292-K294 PolarHBondContact O-N 3.06Å
295A81.4Confident90.9Very high14 Ų1486.1 Ų86.112%0.11644%0.442CS..  trans-94-2.5-170.700000115.4F210 P213 Y291 H292F210-A295 HydrophobicContact CD2-CB 3.58Å; F210-A295 HydrophobicContact CE2-CB 3.6Å; P213-A295 HydrophobicContact CG-CB 3.87Å; Y291-A295 HydrophobicContact CD1-CB 4.23Å; Y291-A295 HydrophobicContact CE1-CB 4.01Å; Y291-A295 PolarHBondContact O-N 3.03Å; Y291-A295 VanDerWaalsContact O-N 3.15Å; H292-A295 PolarHBondContact O-N 3.3Å
296V66.9Low90.3Very high154 Ų15484 Ų8493%0.93344%0.436SS*.  trans-69.70-179.9-172.70000111.5K209 H292K209-V296 PolarHBondContact NZ-OXT 2.69Å; H292-V296 VanDerWaalsContact O-CG2 3.24Å; H292-V296 WeakPolarHBondContact O-CG2 3.43Å

Retrieved 296 of 296 residues in 918 ms (Link to these results)

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