A0A087XL68_POEFO Loading...

PRA1 family protein

AlphaFold DB , UniProt , Accession A0A087XL68, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 190 aa.

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Site Residue pLDDT pLDDT confidence pLDDT10 pLDDT10 confidence SASA SASA [Ų] SASA10 SASA10 [Ų] RSA RSA unformatted RSA10 RSA10 unformatted Surface Surface10 (not used) Disorder (not used) Disorder Sec. str. Secondary structure Isomer Phi (φ) Psi (ψ) Omega (ω) Chi 1 (χ1) Chi 2 (χ2) Chi 3 (χ3) Chi 4 (χ4) Chi 5 (χ5) Tau (τ) Contacts (colored by PAE) Contact details
1M34.5Very low59.1Low246 Ų246113.3 Ų113.3100%1.21262%0.622SS**  0119.20-73.1-178.3-173.200107.6A3M1-A3 PolarHBondContact O-N 2.85Å
2A38.6Very low61.5Low104 Ų104110 Ų11086%0.8661%0.61SS**  trans-70.1117.617500000108.4K4A2-K4 PolarHBondContact O-N 2.94Å; A2-K4 VanDerWaalsContact O-N 3.14Å
3A42.8Very low63.4Low79 Ų79110.6 Ų110.665%0.65360%0.597SS**  trans-60.4117.2173.300000108.2M1 M5M1-A3 PolarHBondContact O-N 2.85Å; A3-M5 VanDerWaalsContact C-N 3.31Å; A3-M5 PolarHBondContact O-N 3.38Å
4K39.8Very low65Low173 Ų173111.6 Ų111.675%0.75260%0.602SS**  trans-68.193.5173.9-160.9-176.1-175.9-160.70106.6A2 E6A2-K4 PolarHBondContact O-N 2.94Å; A2-K4 VanDerWaalsContact O-N 3.14Å; K4-E6 PolarHBondContact O-N 3.21Å; K4-E6 VanDerWaalsContact O-N 3.14Å
5M51Low66.3Low131 Ų131105.9 Ų105.965%0.64557%0.571SS**  trans-66109.1178.1-69.9170-164.900108.4A3 P163A3-M5 VanDerWaalsContact C-N 3.31Å; A3-M5 PolarHBondContact O-N 3.38Å; M5-P163 HydrophobicContact CB-CG 4.17Å; M5-P163 HydrophobicContact CE-CG 4.14Å; M5-P163 HydrophobicContact CG-CG 3.63Å; M5-P163 HydrophobicContact SD-CB 4.39Å; M5-P163 HydrophobicContact SD-CG 3.33Å; M5-P163 WeakPolarHBondContact SD-CG 3.34Å
6E59.8Low67.5Low123 Ų12399.4 Ų99.458%0.57554%0.536SS*.PPolyproline II helixtrans-85.8126.1170.4-66.7-177.7168.100108K4K4-E6 PolarHBondContact O-N 3.21Å; K4-E6 VanDerWaalsContact O-N 3.14Å
7L58.9Low68.6Low167 Ų167100.4 Ų100.487%0.87454%0.535SS*.PPolyproline II helixtrans-65135.8172.8-70172.3000108.4
8A73.5Confident69.3Low19 Ų1996.1 Ų96.116%0.15751%0.513CS..PPolyproline II helixtrans-58.5139.5174.600000109.8Q46 T47A8-Q46 HydrophobicContact CB-CB 4.34Å; A8-T47 PolarHBondContact O-OG1 3.35Å
9P79.8Confident69.8Low79 Ų7993.3 Ų93.351%0.51351%0.509SS..PPolyproline II helixtrans-63142.4178.426.3-33.8000110.4R11P9-R11 PolarHBondContact O-N 3.03Å
10L84.5Confident70Confident87 Ų8793.1 Ų93.146%0.45552%0.521SS..PPolyproline II helixtrans-63.5125.3171.3-176.871.2000108.8T47 N48 V51L10-T47 HydrophobicContact CB-CG2 4.01Å; L10-T47 HydrophobicContact CD1-CG2 3.87Å; L10-N48 HydrophobicContact CD1-CB 4.4Å; L10-V51 HydrophobicContact CD1-CG2 4.11Å
11R87.1Confident70.2Confident38 Ų3895 Ų9514%0.14353%0.53CS..PPolyproline II helixtrans-82.6148.7179.9-56.9-58.5-176.41703.1110.7P9 Y44 Y45 N48 E155P9-R11 PolarHBondContact O-N 3.03Å; R11-Y44 HydrophobicContact CG-CD1 4.46Å; R11-Y44 HydrophobicContact CG-CE1 4.09Å; R11-Y44 WeakPolarHBondContact CG-O 3.34Å; R11-Y44 PolarHBondContact NE-O 2.98Å; R11-Y45 HydrophobicContact CB-CD1 3.95Å; R11-Y45 HydrophobicContact CB-CE1 4.16Å; R11-Y45 HydrophobicContact CG-CD1 3.96Å; R11-Y45 HydrophobicContact CG-CE1 4.38Å; R11-N48 WeakPolarHBondContact CB-OD1 3.31Å; R11-N48 PolarHBondContact N-OD1 3.36Å; R11-N48 PolarHBondContact O-ND2 3.45Å; R11-E155 IonicContact CZ-OE1 3.93Å; R11-E155 IonicContact CZ-OE2 3.37Å; R11-E155 IonicContact NH1-OE1 2.73Å; R11-E155 PolarHBondContact NH1-OE1 3.33Å; R11-E155 IonicContact NH1-OE2 2.84Å; R11-E155 VanDerWaalsContact NH2-CD 3.26Å; R11-E155 IonicContact NH2-OE1 2.99Å; R11-E155 PolarHBondContact NH2-OE1 3.4Å; R11-E155 IonicContact NH2-OE2 2.94Å; R11-E155 PolarHBondContact NH2-OE2 3.23Å
12P87.8Confident72.1Confident74 Ų7489 Ų8948%0.48149%0.494SS..PPolyproline II helixtrans-53.2140.5175.2-25.635.3000112.5D14 D15 F16P12-D14 VanDerWaalsContact C-N 3.28Å; P12-D14 WeakPolarHBondContact CB-OD1 3.12Å; P12-D14 PolarHBondContact O-N 3.08Å; P12-D15 PolarHBondContact O-N 2.95Å; P12-D15 VanDerWaalsContact O-N 3.16Å; P12-F16 PolarHBondContact O-N 2.91Å; P12-F16 VanDerWaalsContact O-N 3.13Å
13W86.8Confident74Confident118 Ų11886.9 Ų86.945%0.44747%0.465SS..Hα-helixtrans-67.5-28.1-175.4-72.5111.2000113.4D15 F16 F17 V51 V52W13-D15 VanDerWaalsContact C-N 3.33Å; W13-F16 HydrophobicContact CE3-CB 4.4Å; W13-F16 AromaticContact CE3-CD1 3.77Å; W13-F16 HydrophobicContact CE3-CD1 3.77Å; W13-F16 HydrophobicContact CE3-CG 4.46Å; W13-F16 AromaticContact CZ3-CD1 3.63Å; W13-F16 HydrophobicContact CZ3-CD1 3.63Å; W13-F16 AromaticContact CZ3-CE1 3.99Å; W13-F16 HydrophobicContact CZ3-CE1 3.99Å; W13-F16 PolarHBondContact O-N 2.86Å; W13-F17 HydrophobicContact CE3-CD2 4.03Å; W13-F17 AromaticContact CE3-CE2 3.93Å; W13-F17 HydrophobicContact CE3-CE2 3.93Å; W13-F17 HydrophobicContact CZ3-CD2 4.47Å; W13-F17 AromaticContact CZ3-CE2 3.92Å; W13-F17 HydrophobicContact CZ3-CE2 3.92Å; W13-F17 PolarHBondContact O-N 3.15Å; W13-V51 HydrophobicContact CH2-CB 4.47Å; W13-V51 HydrophobicContact CH2-CG1 3.91Å; W13-V51 HydrophobicContact CZ2-CG1 3.98Å; W13-V52 HydrophobicContact CH2-CG2 4.45Å; W13-V52 HydrophobicContact CZ3-CG2 4.35Å
14D85.3Confident75.6Confident124 Ų12485 Ų8566%0.66345%0.447SS*.Hα-helixtrans-67.9-28.8173.357.9-48.3000113P12 P18P12-D14 VanDerWaalsContact C-N 3.28Å; P12-D14 WeakPolarHBondContact CB-OD1 3.12Å; P12-D14 PolarHBondContact O-N 3.08Å; D14-P18 WeakPolarHBondContact O-CA 3.29Å
15D83.8Confident77.3Confident26 Ų2685.4 Ų85.414%0.13945%0.449CS..Hα-helixtrans-79.8-35.3170.8-173.634.8000112P12 W13 P18 Y44 Y45 R142P12-D15 PolarHBondContact O-N 2.95Å; P12-D15 VanDerWaalsContact O-N 3.16Å; W13-D15 VanDerWaalsContact C-N 3.33Å; D15-P18 WeakPolarHBondContact O-CD 3.33Å; D15-Y44 WeakPolarHBondContact OD2-CE1 3.25Å; D15-Y44 PolarHBondContact OD2-OH 3.5Å; D15-Y45 PolarHBondContact O-OH 2.87Å; D15-Y45 PolarHBondContact OD1-OH 3.33Å; D15-Y45 PolarHBondContact OD2-OH 3.32Å; D15-R142 PolarHBondContact O-NE 2.86Å; D15-R142 VanDerWaalsContact O-NE 3.09Å; D15-R142 PolarHBondContact O-NH2 3.46Å; D15-R142 IonicContact OD1-NH2 3.59Å; D15-R142 PolarHBondContact OD1-NH2 3.14Å
16F86.5Confident78.4Confident3 Ų380.6 Ų80.61%0.01343%0.427CS..Hα-helixtrans-70-49.9178-169.8-116.9000111.9P12 W13 P18 Y45 N48 Y49 V52 H138P12-F16 PolarHBondContact O-N 2.91Å; P12-F16 VanDerWaalsContact O-N 3.13Å; W13-F16 HydrophobicContact CE3-CB 4.4Å; W13-F16 AromaticContact CE3-CD1 3.77Å; W13-F16 HydrophobicContact CE3-CD1 3.77Å; W13-F16 HydrophobicContact CE3-CG 4.46Å; W13-F16 AromaticContact CZ3-CD1 3.63Å; W13-F16 HydrophobicContact CZ3-CD1 3.63Å; W13-F16 AromaticContact CZ3-CE1 3.99Å; W13-F16 HydrophobicContact CZ3-CE1 3.99Å; W13-F16 PolarHBondContact O-N 2.86Å; F16-P18 WeakPolarHBondContact O-CD 3.15Å; F16-Y45 HydrophobicContact CB-CD1 4.33Å; F16-Y45 HydrophobicContact CB-CE1 4.16Å; F16-Y45 AromaticContact CD2-CD1 3.41Å; F16-Y45 HydrophobicContact CD2-CD1 3.41Å; F16-Y45 VanDerWaalsContact CD2-CD1 3.41Å; F16-Y45 HydrophobicContact CD2-CD2 4.15Å; F16-Y45 AromaticContact CD2-CE1 3.87Å; F16-Y45 HydrophobicContact CD2-CE1 3.87Å; F16-Y45 AromaticContact CD2-CG 3.55Å; F16-Y45 HydrophobicContact CD2-CG 3.55Å; F16-Y45 HydrophobicContact CE2-CD1 4.18Å; F16-Y45 HydrophobicContact CE2-CD2 4.39Å; F16-Y45 AromaticContact CE2-CG 3.87Å; F16-Y45 HydrophobicContact CE2-CG 3.87Å; F16-Y45 HydrophobicContact CG-CD1 4.32Å; F16-N48 HydrophobicContact CD1-CB 4.24Å; F16-N48 HydrophobicContact CD2-CB 3.71Å; F16-N48 HydrophobicContact CE1-CB 4.23Å; F16-N48 HydrophobicContact CE2-CB 3.66Å; F16-N48 HydrophobicContact CG-CB 4Å; F16-N48 HydrophobicContact CZ-CB 3.94Å; F16-Y49 AromaticContact CE2-CD1 3.84Å; F16-Y49 HydrophobicContact CE2-CD1 3.84Å; F16-Y49 AromaticContact CE2-CE1 3.53Å; F16-Y49 HydrophobicContact CE2-CE1 3.53Å; F16-Y49 AromaticContact CE2-CZ 3.97Å; F16-Y49 AromaticContact CZ-CD1 3.69Å; F16-Y49 HydrophobicContact CZ-CD1 3.69Å; F16-Y49 AromaticContact CZ-CE1 3.65Å; F16-Y49 HydrophobicContact CZ-CE1 3.65Å; F16-V52 HydrophobicContact CE1-CG2 3.81Å; F16-V52 HydrophobicContact CZ-CG2 4.2Å; F16-H138 AromaticContact CD2-CE1 3.46Å; F16-H138 VanDerWaalsContact CD2-CE1 3.46Å; F16-H138 WeakPolarHBondContact CD2-CE1 3.27Å; F16-H138 AromaticContact CD2-NE2 3.99Å; F16-H138 AromaticContact CE2-CE1 3.27Å; F16-H138 WeakPolarHBondContact CE2-CE1 3.19Å; F16-H138 AromaticContact CE2-ND1 3.56Å; F16-H138 AromaticContact CE2-NE2 3.93Å; F16-H138 AromaticContact CZ-CE1 3.8Å; F16-H138 AromaticContact CZ-ND1 3.9Å; F16-H138 PolarHBondContact O-CE1 3.14Å; F16-H138 PolarHBondContact O-NE2 3.13Å
17F85.7Confident79Confident116 Ų11679.1 Ų79.151%0.50942%0.42SS..SBendtrans-111.373.7175.1-64.3-65.2000111.3W13W13-F17 HydrophobicContact CE3-CD2 4.03Å; W13-F17 AromaticContact CE3-CE2 3.93Å; W13-F17 HydrophobicContact CE3-CE2 3.93Å; W13-F17 HydrophobicContact CZ3-CD2 4.47Å; W13-F17 AromaticContact CZ3-CE2 3.92Å; W13-F17 HydrophobicContact CZ3-CE2 3.92Å; W13-F17 PolarHBondContact O-N 3.15Å
18P81.1Confident79.7Confident22 Ų2277.5 Ų77.514%0.14341%0.407CS..  trans-73179176.735.5-41.5000111.9D14 D15 F16 R22 F23D14-P18 WeakPolarHBondContact O-CA 3.29Å; D15-P18 WeakPolarHBondContact O-CD 3.33Å; F16-P18 WeakPolarHBondContact O-CD 3.15Å; P18-R22 HydrophobicContact CB-CB 3.8Å; P18-R22 HydrophobicContact CB-CG 4.01Å; P18-R22 HydrophobicContact CG-CB 3.47Å; P18-R22 VanDerWaalsContact CG-CB 3.47Å; P18-R22 HydrophobicContact CG-CG 4.24Å; P18-F23 HydrophobicContact CG-CD2 4.45Å; P18-F23 HydrophobicContact CG-CE2 3.83Å; P18-F23 HydrophobicContact CG-CZ 4.15Å; P18-F23 WeakPolarHBondContact O-CE2 3.19Å
19G78.1Confident79.8Confident43 Ų4388.7 Ų88.744%0.44345%0.445SS..  trans-54158.516800000113.7D21 R22G19-D21 WeakPolarHBondContact CA-OD1 3.35Å; G19-D21 PolarHBondContact O-N 2.86Å; G19-D21 VanDerWaalsContact O-N 3.08Å; G19-R22 PolarHBondContact O-N 3.39Å
20A74.8Confident79.9Confident89 Ų8988.3 Ų88.374%0.73644%0.439SS*.G310 helixtrans-58.8-22.4-176.600000113.8R22 F23A20-R22 PolarHBondContact O-N 3.48Å; A20-F23 PolarHBondContact O-N 3.31Å
21D73.4Confident79.8Confident133 Ų13389.5 Ų89.571%0.71145%0.445SS*.G310 helixtrans-63.3-23175.263.6-58.4000113.3G19G19-D21 WeakPolarHBondContact CA-OD1 3.35Å; G19-D21 PolarHBondContact O-N 2.86Å; G19-D21 VanDerWaalsContact O-N 3.08Å
22R74.8Confident79.6Confident120 Ų12092.1 Ų92.145%0.45347%0.465SS..G310 helixtrans-98.19.7179.7-59.7-156.4-178.7-166-4113.8P18 G19 A20 Q143P18-R22 HydrophobicContact CB-CB 3.8Å; P18-R22 HydrophobicContact CB-CG 4.01Å; P18-R22 HydrophobicContact CG-CB 3.47Å; P18-R22 VanDerWaalsContact CG-CB 3.47Å; P18-R22 HydrophobicContact CG-CG 4.24Å; G19-R22 PolarHBondContact O-N 3.39Å; A20-R22 PolarHBondContact O-N 3.48Å; R22-Q143 PolarHBondContact O-N 2.98Å
23F78.2Confident79.2Confident61 Ų6193.8 Ų93.827%0.26847%0.465SS..BIsolated β-bridgetrans-113.1129.8167.3-67-78.5000108.8P18 A20 H138 L141 R142P18-F23 HydrophobicContact CG-CD2 4.45Å; P18-F23 HydrophobicContact CG-CE2 3.83Å; P18-F23 HydrophobicContact CG-CZ 4.15Å; P18-F23 WeakPolarHBondContact O-CE2 3.19Å; A20-F23 PolarHBondContact O-N 3.31Å; F23-H138 AromaticContact CE1-CD2 3.99Å; F23-H138 AromaticContact CE1-NE2 3.95Å; F23-L141 HydrophobicContact CD1-CB 3.78Å; F23-R142 HydrophobicContact CE1-CB 4.31Å
24S77.6Confident79Confident39 Ų3991.7 Ų91.727%0.27346%0.457SS..  trans-129.5156.6170.688.10000110.6L141 Q143S24-L141 PolarHBondContact N-O 3.25Å; S24-L141 WeakPolarHBondContact O-CA 3.41Å; S24-L141 WeakPolarHBondContact O-CD2 3.3Å; S24-Q143 WeakPolarHBondContact OG-CG 3.42Å; S24-Q143 PolarHBondContact OG-NE2 3.12Å
25K76Confident79Confident182 Ų18289.1 Ų89.179%0.79144%0.443SS*.  trans-58.3145.2171.7-65.3-176-178179.70110.1
26P73.9Confident79Confident29 Ų2992.1 Ų92.119%0.18846%0.459CS..  trans-61.6136.8175.8-20.433.9000111F28 L141P26-F28 HydrophobicContact CB-CD1 4.25Å; P26-F28 HydrophobicContact CB-CD2 4.27Å; P26-F28 HydrophobicContact CB-CE1 3.77Å; P26-F28 HydrophobicContact CB-CE2 3.81Å; P26-F28 HydrophobicContact CB-CG 4.48Å; P26-F28 HydrophobicContact CB-CZ 3.55Å; P26-F28 HydrophobicContact CG-CE1 4.29Å; P26-F28 HydrophobicContact CG-CE2 4.06Å; P26-F28 HydrophobicContact CG-CZ 3.69Å; P26-F28 PolarHBondContact O-N 3.25Å; P26-F28 VanDerWaalsContact O-N 3.16Å; P26-L141 HydrophobicContact CG-CD2 4.3Å
27E71.1Confident78.9Confident92 Ų9293.5 Ų93.543%0.4347%0.465SS..  trans-8481.4173.3-75.4174.7-164.600109.3R29 D30 K33E27-R29 PolarHBondContact O-N 2.81Å; E27-D30 PolarHBondContact O-N 3.48Å; E27-K33 IonicContact OE1-NZ 2.87Å; E27-K33 WeakPolarHBondContact OE2-CE 3.45Å; E27-K33 IonicContact OE2-NZ 3.78Å; E27-K33 PolarHBondContact OE2-NZ 3.3Å
28F74Confident78.9Confident134 Ų13488.6 Ų88.659%0.58845%0.445SS*.THydrogen-bonded Turntrans-66.5-7.5-179.9-61-68.1000114.4P26P26-F28 HydrophobicContact CB-CD1 4.25Å; P26-F28 HydrophobicContact CB-CD2 4.27Å; P26-F28 HydrophobicContact CB-CE1 3.77Å; P26-F28 HydrophobicContact CB-CE2 3.81Å; P26-F28 HydrophobicContact CB-CG 4.48Å; P26-F28 HydrophobicContact CB-CZ 3.55Å; P26-F28 HydrophobicContact CG-CE1 4.29Å; P26-F28 HydrophobicContact CG-CE2 4.06Å; P26-F28 HydrophobicContact CG-CZ 3.69Å; P26-F28 PolarHBondContact O-N 3.25Å; P26-F28 VanDerWaalsContact O-N 3.16Å
29R75.3Confident79.1Confident253 Ų25390.1 Ų90.196%0.95545%0.451SS*.THydrogen-bonded Turntrans-75.4-26.3175.7-68.5179.270.4155.71.4112.8E27E27-R29 PolarHBondContact O-N 2.81Å
30D81.5Confident79.3Confident72 Ų7289.9 Ų89.939%0.38544%0.443SS..  trans-125.787.6177-175-16.8000108.6E27 T32 K33 W34E27-D30 PolarHBondContact O-N 3.48Å; D30-T32 VanDerWaalsContact C-N 3.26Å; D30-T32 PolarHBondContact O-N 3Å; D30-T32 PolarHBondContact OD1-N 3.16Å; D30-K33 HydrophobicContact CB-CB 4.03Å; D30-K33 PolarHBondContact O-N 3.49Å; D30-K33 WeakPolarHBondContact OD1-CB 3.41Å; D30-K33 PolarHBondContact OD1-N 3.05Å; D30-K33 WeakPolarHBondContact OD2-CB 3.31Å; D30-W34 PolarHBondContact O-N 3.43Å
31L83.4Confident79.9Confident111 Ų11185.8 Ų85.858%0.58141%0.409SS*.Hα-helixtrans-62.6-34.4-177.3-66.2176.5000112W34 N35L31-W34 HydrophobicContact CD2-CE3 4.43Å; L31-W34 PolarHBondContact O-N 2.94Å; L31-N35 VanDerWaalsContact O-CB 3.27Å; L31-N35 WeakPolarHBondContact O-CB 3.44Å; L31-N35 PolarHBondContact O-N 2.84Å
32T82.2Confident80.6Confident94 Ų9481.2 Ų81.258%0.57738%0.384SS*.Hα-helixtrans-65.7-46.1178.8-52.90000110.5D30 N35 N36D30-T32 VanDerWaalsContact C-N 3.26Å; D30-T32 PolarHBondContact O-N 3Å; D30-T32 PolarHBondContact OD1-N 3.16Å; T32-N35 PolarHBondContact O-N 2.93Å; T32-N36 WeakPolarHBondContact O-CB 3.25Å; T32-N36 VanDerWaalsContact O-CG 3.22Å; T32-N36 PolarHBondContact O-N 3.32Å; T32-N36 PolarHBondContact O-ND2 3.14Å
33K80.6Confident81Confident109 Ų10976.6 Ų76.647%0.47437%0.368SS..Hα-helixtrans-65-40.2175.8-173.9-177.4176.1-162.60112.2E27 D30 K37E27-K33 IonicContact OE1-NZ 2.87Å; E27-K33 WeakPolarHBondContact OE2-CE 3.45Å; E27-K33 IonicContact OE2-NZ 3.78Å; E27-K33 PolarHBondContact OE2-NZ 3.3Å; D30-K33 HydrophobicContact CB-CB 4.03Å; D30-K33 PolarHBondContact O-N 3.49Å; D30-K33 WeakPolarHBondContact OD1-CB 3.41Å; D30-K33 PolarHBondContact OD1-N 3.05Å; D30-K33 WeakPolarHBondContact OD2-CB 3.31Å; K33-K37 WeakPolarHBondContact O-CB 3.5Å; K33-K37 PolarHBondContact O-N 3.13Å
34W82.6Confident81.2Confident73 Ų7375 Ų7528%0.27736%0.36SS..Hα-helixtrans-64.9-44.9175.817661.9000112.1D30 L31 N36 K37 V38 S140D30-W34 PolarHBondContact O-N 3.43Å; L31-W34 HydrophobicContact CD2-CE3 4.43Å; L31-W34 PolarHBondContact O-N 2.94Å; W34-N36 PolarHBondContact O-N 3.49Å; W34-K37 WeakPolarHBondContact O-CB 3.44Å; W34-K37 PolarHBondContact O-N 2.9Å; W34-V38 HydrophobicContact CD2-CG2 4.36Å; W34-V38 HydrophobicContact CZ2-CG2 4.12Å; W34-V38 WeakPolarHBondContact O-CG2 3.33Å; W34-V38 PolarHBondContact O-N 3.41Å; W34-S140 WeakPolarHBondContact CZ2-OG 3.36Å; W34-S140 PolarHBondContact NE1-OG 3.16Å
35N85Confident81.6Confident70 Ų7073.1 Ų73.137%0.37435%0.347SS..Hα-helixtrans-59.5-48.4176.6-174.744.6000111.4L31 T32 K37 V38 I39L31-N35 VanDerWaalsContact O-CB 3.27Å; L31-N35 WeakPolarHBondContact O-CB 3.44Å; L31-N35 PolarHBondContact O-N 2.84Å; T32-N35 PolarHBondContact O-N 2.93Å; N35-K37 VanDerWaalsContact C-N 3.25Å; N35-K37 PolarHBondContact O-N 3.48Å; N35-V38 PolarHBondContact O-N 2.82Å; N35-V38 VanDerWaalsContact O-N 3.11Å; N35-I39 WeakPolarHBondContact O-CB 3.5Å; N35-I39 WeakPolarHBondContact O-CG1 3.43Å; N35-I39 PolarHBondContact O-N 3.32Å
36N83.3Confident82.2Confident90 Ų9066.3 Ų66.348%0.48132%0.318SS..Hα-helixtrans-58.8-36.7176.7-74-25.7000112.6T32 W34 S40T32-N36 WeakPolarHBondContact O-CB 3.25Å; T32-N36 VanDerWaalsContact O-CG 3.22Å; T32-N36 PolarHBondContact O-N 3.32Å; T32-N36 PolarHBondContact O-ND2 3.14Å; W34-N36 PolarHBondContact O-N 3.49Å; N36-S40 WeakPolarHBondContact O-CB 3.46Å; N36-S40 PolarHBondContact O-N 2.8Å
37K84.6Confident83Confident31 Ų3166.6 Ų66.614%0.13532%0.319CS..Hα-helixtrans-65.2-49.3174.1179.6-171.1175.2-171.60111.4K33 W34 N35 S40 N41 S140 L141 R142K33-K37 WeakPolarHBondContact O-CB 3.5Å; K33-K37 PolarHBondContact O-N 3.13Å; W34-K37 WeakPolarHBondContact O-CB 3.44Å; W34-K37 PolarHBondContact O-N 2.9Å; N35-K37 VanDerWaalsContact C-N 3.25Å; N35-K37 PolarHBondContact O-N 3.48Å; K37-S40 PolarHBondContact O-N 3.39Å; K37-N41 WeakPolarHBondContact O-CB 3.5Å; K37-N41 PolarHBondContact O-N 2.84Å; K37-N41 PolarHBondContact O-ND2 2.69Å; K37-S140 VanDerWaalsContact CE-O 3.25Å; K37-S140 WeakPolarHBondContact CE-O 3.29Å; K37-S140 PolarHBondContact NZ-O 2.94Å; K37-L141 PolarHBondContact NZ-O 3.45Å; K37-R142 VanDerWaalsContact CE-C 3.49Å; K37-R142 WeakPolarHBondContact CE-O 3.2Å
38V85.8Confident84Confident13 Ų1362.2 Ų62.28%0.07930%0.299CS..Hα-helixtrans-59.2-51.5179.5171.70000110.1W34 N35 S40 N41 L42 L136 A139W34-V38 HydrophobicContact CD2-CG2 4.36Å; W34-V38 HydrophobicContact CZ2-CG2 4.12Å; W34-V38 WeakPolarHBondContact O-CG2 3.33Å; W34-V38 PolarHBondContact O-N 3.41Å; N35-V38 PolarHBondContact O-N 2.82Å; N35-V38 VanDerWaalsContact O-N 3.11Å; V38-S40 PolarHBondContact O-N 3.03Å; V38-N41 PolarHBondContact O-N 3.47Å; V38-L42 HydrophobicContact CG1-CD1 3.85Å; V38-L42 HydrophobicContact CG1-CG 4.24Å; V38-L42 WeakPolarHBondContact O-CB 3.22Å; V38-L42 VanDerWaalsContact O-CG 3.3Å; V38-L42 WeakPolarHBondContact O-CG 3.24Å; V38-L42 PolarHBondContact O-N 2.95Å; V38-L136 HydrophobicContact CG1-CD2 4.48Å; V38-A139 HydrophobicContact CG1-CB 4.13Å
39I84.1Confident85Confident54 Ų5456.3 Ų56.328%0.27727%0.273SS..Hα-helixtrans-55.6-51.8177.3-74.4173.6000111.1N35 N41 L42 M43 M168N35-I39 WeakPolarHBondContact O-CB 3.5Å; N35-I39 WeakPolarHBondContact O-CG1 3.43Å; N35-I39 PolarHBondContact O-N 3.32Å; I39-N41 VanDerWaalsContact C-N 3.26Å; I39-N41 PolarHBondContact O-N 3.29Å; I39-L42 PolarHBondContact O-N 3.32Å; I39-M43 WeakPolarHBondContact O-CG 3.25Å; I39-M43 PolarHBondContact O-N 2.7Å; I39-M168 HydrophobicContact CB-CE 3.76Å; I39-M168 HydrophobicContact CD1-CE 4.2Å; I39-M168 HydrophobicContact CG1-CE 3.6Å; I39-M168 HydrophobicContact CG2-CE 3.22Å; I39-M168 HydrophobicContact CG2-SD 3.53Å; I39-M168 VanDerWaalsContact CG2-SD 3.53Å
40S82.8Confident85.8Confident39 Ų3951 Ų5127%0.27326%0.257SS..Hα-helixtrans-59.5-37.6179.91790000112.4N36 K37 V38 Y44 R144N36-S40 WeakPolarHBondContact O-CB 3.46Å; N36-S40 PolarHBondContact O-N 2.8Å; K37-S40 PolarHBondContact O-N 3.39Å; V38-S40 PolarHBondContact O-N 3.03Å; S40-Y44 WeakPolarHBondContact O-CB 3.36Å; S40-Y44 PolarHBondContact O-N 2.92Å; S40-R144 PolarHBondContact OG-NH2 3Å
41N88.1Confident86.4Confident2 Ų249.5 Ų49.51%0.01125%0.25CS..Hα-helixtrans-74.1-40.1178.8-75.6-27.8000111.7K37 V38 I39 M43 Y44 Y45 Y49 A139 R142K37-N41 WeakPolarHBondContact O-CB 3.5Å; K37-N41 PolarHBondContact O-N 2.84Å; K37-N41 PolarHBondContact O-ND2 2.69Å; V38-N41 PolarHBondContact O-N 3.47Å; I39-N41 VanDerWaalsContact C-N 3.26Å; I39-N41 PolarHBondContact O-N 3.29Å; N41-M43 VanDerWaalsContact C-N 3.3Å; N41-M43 PolarHBondContact O-N 3.41Å; N41-Y44 PolarHBondContact O-N 3.37Å; N41-Y45 WeakPolarHBondContact O-CD2 3.48Å; N41-Y45 PolarHBondContact O-N 2.87Å; N41-Y45 VanDerWaalsContact O-N 3.13Å; N41-Y49 WeakPolarHBondContact O-CE2 3.48Å; N41-A139 HydrophobicContact CB-CB 4.08Å; N41-A139 PolarHBondContact ND2-O 3.37Å; N41-R142 PolarHBondContact ND2-O 3.35Å
42L88.3Confident86.9Confident38 Ų3845.5 Ų45.520%0.19923%0.23CC..Hα-helixtrans-56.3-45174.1-74.3175.3000111.3V38 I39 Q46 Y49 I135 A139V38-L42 HydrophobicContact CG1-CD1 3.85Å; V38-L42 HydrophobicContact CG1-CG 4.24Å; V38-L42 WeakPolarHBondContact O-CB 3.22Å; V38-L42 VanDerWaalsContact O-CG 3.3Å; V38-L42 WeakPolarHBondContact O-CG 3.24Å; V38-L42 PolarHBondContact O-N 2.95Å; I39-L42 PolarHBondContact O-N 3.32Å; L42-Q46 WeakPolarHBondContact O-CG 3.3Å; L42-Q46 PolarHBondContact O-N 3.01Å; L42-Y49 HydrophobicContact CD2-CD2 4.24Å; L42-Y49 HydrophobicContact CD2-CE2 4.02Å; L42-I135 HydrophobicContact CD2-CG2 3.5Å; L42-I135 VanDerWaalsContact CD2-CG2 3.5Å; L42-A139 HydrophobicContact CD2-CB 4.05Å; L42-A139 HydrophobicContact CG-CB 4.1Å
43M82.2Confident87.4Confident22 Ų2242.2 Ų42.211%0.10821%0.213CC..Hα-helixtrans-69.2-38.4179.8-67.3-55.6-74.800113.6I39 N41 Q46 L159 M164 M168I39-M43 WeakPolarHBondContact O-CG 3.25Å; I39-M43 PolarHBondContact O-N 2.7Å; N41-M43 VanDerWaalsContact C-N 3.3Å; N41-M43 PolarHBondContact O-N 3.41Å; M43-Q46 VanDerWaalsContact O-CG 3.31Å; M43-Q46 WeakPolarHBondContact O-CG 3.46Å; M43-Q46 PolarHBondContact SD-NE2 2.73Å; M43-L159 HydrophobicContact CE-CD2 3.82Å; M43-M164 HydrophobicContact CE-CB 4.13Å; M43-M164 HydrophobicContact CE-CG 4.03Å; M43-M164 HydrophobicContact SD-CB 3.96Å; M43-M164 HydrophobicContact SD-CE 4.44Å; M43-M164 HydrophobicContact SD-CG 3.23Å; M43-M164 WeakPolarHBondContact SD-CG 3.26Å; M43-M168 HydrophobicContact CE-SD 4.2Å; M43-M168 HydrophobicContact CG-CE 4.25Å; M43-M168 HydrophobicContact CG-SD 3.42Å; M43-M168 WeakPolarHBondContact CG-SD 3.3Å; M43-M168 HydrophobicContact SD-CE 4.3Å; M43-M168 HydrophobicContact SD-CG 4.3Å; M43-M168 HydrophobicContact SD-SD 3.41Å
44Y82.5Confident88Confident27 Ų2740.8 Ų40.811%0.10621%0.21CC..Hα-helixtrans-76.9-33.3-175.2-179.6-97.3000113.2R11 D15 S40 N41 R144R11-Y44 HydrophobicContact CG-CD1 4.46Å; R11-Y44 HydrophobicContact CG-CE1 4.09Å; R11-Y44 WeakPolarHBondContact CG-O 3.34Å; R11-Y44 PolarHBondContact NE-O 2.98Å; D15-Y44 WeakPolarHBondContact OD2-CE1 3.25Å; D15-Y44 PolarHBondContact OD2-OH 3.5Å; S40-Y44 WeakPolarHBondContact O-CB 3.36Å; S40-Y44 PolarHBondContact O-N 2.92Å; N41-Y44 PolarHBondContact O-N 3.37Å; Y44-R144 VanDerWaalsContact CG-NH1 3.27Å
45Y86.9Confident88.5Confident0 Ų040.7 Ų40.70%022%0.217CC..THydrogen-bonded Turntrans-108.922.8-177.1-61.9-68.3000114.3R11 D15 F16 N41 T47 N48 Y49 R142R11-Y45 HydrophobicContact CB-CD1 3.95Å; R11-Y45 HydrophobicContact CB-CE1 4.16Å; R11-Y45 HydrophobicContact CG-CD1 3.96Å; R11-Y45 HydrophobicContact CG-CE1 4.38Å; D15-Y45 PolarHBondContact O-OH 2.87Å; D15-Y45 PolarHBondContact OD1-OH 3.33Å; D15-Y45 PolarHBondContact OD2-OH 3.32Å; F16-Y45 HydrophobicContact CB-CD1 4.33Å; F16-Y45 HydrophobicContact CB-CE1 4.16Å; F16-Y45 AromaticContact CD2-CD1 3.41Å; F16-Y45 HydrophobicContact CD2-CD1 3.41Å; F16-Y45 VanDerWaalsContact CD2-CD1 3.41Å; F16-Y45 HydrophobicContact CD2-CD2 4.15Å; F16-Y45 AromaticContact CD2-CE1 3.87Å; F16-Y45 HydrophobicContact CD2-CE1 3.87Å; F16-Y45 AromaticContact CD2-CG 3.55Å; F16-Y45 HydrophobicContact CD2-CG 3.55Å; F16-Y45 HydrophobicContact CE2-CD1 4.18Å; F16-Y45 HydrophobicContact CE2-CD2 4.39Å; F16-Y45 AromaticContact CE2-CG 3.87Å; F16-Y45 HydrophobicContact CE2-CG 3.87Å; F16-Y45 HydrophobicContact CG-CD1 4.32Å; N41-Y45 WeakPolarHBondContact O-CD2 3.48Å; N41-Y45 PolarHBondContact O-N 2.87Å; N41-Y45 VanDerWaalsContact O-N 3.13Å; Y45-T47 VanDerWaalsContact C-N 3.29Å; Y45-T47 PolarHBondContact O-N 3.43Å; Y45-T47 VanDerWaalsContact O-N 3.17Å; Y45-N48 WeakPolarHBondContact O-CB 3.32Å; Y45-N48 PolarHBondContact O-N 3.24Å; Y45-Y49 WeakPolarHBondContact O-CD2 3.25Å; Y45-Y49 PolarHBondContact O-N 3.29Å; Y45-R142 HydrophobicContact CE2-CG 4.05Å; Y45-R142 PolarHBondContact OH-NE 3.41Å; Y45-R142 PolarHBondContact OH-NH2 2.91Å
46Q88.7Confident88.8Confident40 Ų4038.3 Ų38.319%0.18721%0.205CC..Hα-helixtrans-45-51.8-176.1-71.7172.3-2000113.4A8 L42 M43 Y49 F50A8-Q46 HydrophobicContact CB-CB 4.34Å; L42-Q46 WeakPolarHBondContact O-CG 3.3Å; L42-Q46 PolarHBondContact O-N 3.01Å; M43-Q46 VanDerWaalsContact O-CG 3.31Å; M43-Q46 WeakPolarHBondContact O-CG 3.46Å; M43-Q46 PolarHBondContact SD-NE2 2.73Å; Q46-Y49 PolarHBondContact O-N 3.37Å; Q46-F50 PolarHBondContact O-N 3.18Å
47T89.2Confident89.1Confident34 Ų3438 Ų3821%0.20920%0.2CC..Hα-helixtrans-70.7-35.8-176.7-52.90000111.7A8 L10 Y45 F50 V51A8-T47 PolarHBondContact O-OG1 3.35Å; L10-T47 HydrophobicContact CB-CG2 4.01Å; L10-T47 HydrophobicContact CD1-CG2 3.87Å; Y45-T47 VanDerWaalsContact C-N 3.29Å; Y45-T47 PolarHBondContact O-N 3.43Å; Y45-T47 VanDerWaalsContact O-N 3.17Å; T47-F50 PolarHBondContact O-N 3.44Å; T47-V51 VanDerWaalsContact O-CG2 3.29Å; T47-V51 WeakPolarHBondContact O-CG2 3.32Å; T47-V51 PolarHBondContact O-N 2.97Å
48N93.8Very high89.5Confident0 Ų041.4 Ų41.40%022%0.219CC..Hα-helixtrans-63.8-43.5173-62.868.5000111.2L10 R11 F16 Y45 F50 V51 V52L10-N48 HydrophobicContact CD1-CB 4.4Å; R11-N48 WeakPolarHBondContact CB-OD1 3.31Å; R11-N48 PolarHBondContact N-OD1 3.36Å; R11-N48 PolarHBondContact O-ND2 3.45Å; F16-N48 HydrophobicContact CD1-CB 4.24Å; F16-N48 HydrophobicContact CD2-CB 3.71Å; F16-N48 HydrophobicContact CE1-CB 4.23Å; F16-N48 HydrophobicContact CE2-CB 3.66Å; F16-N48 HydrophobicContact CG-CB 4Å; F16-N48 HydrophobicContact CZ-CB 3.94Å; Y45-N48 WeakPolarHBondContact O-CB 3.32Å; Y45-N48 PolarHBondContact O-N 3.24Å; N48-F50 VanDerWaalsContact C-N 3.35Å; N48-F50 PolarHBondContact O-N 3.33Å; N48-V51 PolarHBondContact O-N 3.29Å; N48-V52 WeakPolarHBondContact O-CG2 3.37Å; N48-V52 PolarHBondContact O-N 3.01Å
49Y93.5Very high89.7Confident11 Ų1145.2 Ų45.24%0.04324%0.238CC..Hα-helixtrans-63.3-40.8175.9-68.4-47.6000112.4F16 N41 L42 Y45 Q46 V52 A53 I135 H138 A139F16-Y49 AromaticContact CE2-CD1 3.84Å; F16-Y49 HydrophobicContact CE2-CD1 3.84Å; F16-Y49 AromaticContact CE2-CE1 3.53Å; F16-Y49 HydrophobicContact CE2-CE1 3.53Å; F16-Y49 AromaticContact CE2-CZ 3.97Å; F16-Y49 AromaticContact CZ-CD1 3.69Å; F16-Y49 HydrophobicContact CZ-CD1 3.69Å; F16-Y49 AromaticContact CZ-CE1 3.65Å; F16-Y49 HydrophobicContact CZ-CE1 3.65Å; N41-Y49 WeakPolarHBondContact O-CE2 3.48Å; L42-Y49 HydrophobicContact CD2-CD2 4.24Å; L42-Y49 HydrophobicContact CD2-CE2 4.02Å; Y45-Y49 WeakPolarHBondContact O-CD2 3.25Å; Y45-Y49 PolarHBondContact O-N 3.29Å; Q46-Y49 PolarHBondContact O-N 3.37Å; Y49-V52 PolarHBondContact O-N 3.44Å; Y49-A53 WeakPolarHBondContact O-CB 3.39Å; Y49-A53 PolarHBondContact O-N 2.91Å; Y49-I135 HydrophobicContact CD1-CB 3.99Å; Y49-I135 HydrophobicContact CD1-CG1 3.67Å; Y49-I135 HydrophobicContact CD1-CG2 3.66Å; Y49-I135 HydrophobicContact CD2-CG2 4.09Å; Y49-I135 HydrophobicContact CE1-CB 4.4Å; Y49-I135 HydrophobicContact CE1-CG2 3.97Å; Y49-I135 HydrophobicContact CE2-CG2 4.4Å; Y49-I135 HydrophobicContact CG-CB 4.4Å; Y49-I135 HydrophobicContact CG-CG1 4.02Å; Y49-I135 HydrophobicContact CG-CG2 3.71Å; Y49-H138 HydrophobicContact CE1-CB 3.99Å; Y49-H138 AromaticContact CE1-CG 3.88Å; Y49-H138 AromaticContact CE1-ND1 3.34Å; Y49-H138 VanDerWaalsContact CE1-ND1 3.34Å; Y49-H138 WeakPolarHBondContact CE1-ND1 3.4Å; Y49-H138 AromaticContact CZ-ND1 3.52Å; Y49-H138 PolarHBondContact OH-ND1 2.87Å; Y49-A139 WeakPolarHBondContact OH-CA 3.37Å
50F92.4Very high89.9Confident140 Ų14043.7 Ų43.761%0.61423%0.231SC*.Hα-helixtrans-61.2-44.8174.1-178.4-102.1000111.6Q46 T47 N48 A53 L54Q46-F50 PolarHBondContact O-N 3.18Å; T47-F50 PolarHBondContact O-N 3.44Å; N48-F50 VanDerWaalsContact C-N 3.35Å; N48-F50 PolarHBondContact O-N 3.33Å; F50-A53 PolarHBondContact O-N 2.89Å; F50-L54 WeakPolarHBondContact O-CB 3.47Å; F50-L54 PolarHBondContact O-N 3.5Å
51V93.7Very high90.2Very high41 Ų4142.4 Ų42.425%0.24822%0.224CC..Hα-helixtrans-62.1-45.8176170.70000111.3L10 W13 T47 N48 A53 L54 V55L10-V51 HydrophobicContact CD1-CG2 4.11Å; W13-V51 HydrophobicContact CH2-CB 4.47Å; W13-V51 HydrophobicContact CH2-CG1 3.91Å; W13-V51 HydrophobicContact CZ2-CG1 3.98Å; T47-V51 VanDerWaalsContact O-CG2 3.29Å; T47-V51 WeakPolarHBondContact O-CG2 3.32Å; T47-V51 PolarHBondContact O-N 2.97Å; N48-V51 PolarHBondContact O-N 3.29Å; V51-A53 VanDerWaalsContact C-N 3.34Å; V51-A53 PolarHBondContact O-N 2.86Å; V51-L54 PolarHBondContact O-N 3.37Å; V51-V55 HydrophobicContact CG1-CG2 4.32Å; V51-V55 WeakPolarHBondContact O-CB 3.1Å; V51-V55 VanDerWaalsContact O-CG2 3.31Å; V51-V55 WeakPolarHBondContact O-CG2 3.08Å; V51-V55 PolarHBondContact O-N 2.91Å
52V93.6Very high90.2Very high27 Ų2750.5 Ų50.516%0.16426%0.26CS..Hα-helixtrans-59.9-45.8176.3169.20000110.9W13 F16 N48 Y49 L54 V55 V56W13-V52 HydrophobicContact CH2-CG2 4.45Å; W13-V52 HydrophobicContact CZ3-CG2 4.35Å; F16-V52 HydrophobicContact CE1-CG2 3.81Å; F16-V52 HydrophobicContact CZ-CG2 4.2Å; N48-V52 WeakPolarHBondContact O-CG2 3.37Å; N48-V52 PolarHBondContact O-N 3.01Å; Y49-V52 PolarHBondContact O-N 3.44Å; V52-L54 VanDerWaalsContact C-N 3.33Å; V52-L54 PolarHBondContact O-N 3.03Å; V52-V55 PolarHBondContact O-N 3.24Å; V52-V56 HydrophobicContact CG1-CG2 4.37Å; V52-V56 WeakPolarHBondContact O-CB 3.24Å; V52-V56 VanDerWaalsContact O-CG2 3.29Å; V52-V56 WeakPolarHBondContact O-CG2 3.49Å; V52-V56 PolarHBondContact O-N 3.5Å
53A93Very high90.3Very high26 Ų2655.1 Ų55.122%0.21528%0.284CS..Hα-helixtrans-61.1-43.2177.500000112Y49 F50 V51 V56 F57 P131 I135Y49-A53 WeakPolarHBondContact O-CB 3.39Å; Y49-A53 PolarHBondContact O-N 2.91Å; F50-A53 PolarHBondContact O-N 2.89Å; V51-A53 VanDerWaalsContact C-N 3.34Å; V51-A53 PolarHBondContact O-N 2.86Å; A53-V56 PolarHBondContact O-N 3.07Å; A53-F57 WeakPolarHBondContact O-CB 3.24Å; A53-F57 PolarHBondContact O-N 3.08Å; A53-P131 HydrophobicContact CB-CB 3.93Å; A53-I135 HydrophobicContact CB-CD1 4.25Å
54L93.3Very high90.5Very high79 Ų7957.6 Ų57.641%0.41430%0.297SS..Hα-helixtrans-62.8-46.5176.8-176.265.6000111.6F50 V51 V52 F57 L58F50-L54 WeakPolarHBondContact O-CB 3.47Å; F50-L54 PolarHBondContact O-N 3.5Å; V51-L54 PolarHBondContact O-N 3.37Å; V52-L54 VanDerWaalsContact C-N 3.33Å; V52-L54 PolarHBondContact O-N 3.03Å; L54-F57 PolarHBondContact O-N 3.06Å; L54-L58 HydrophobicContact CD1-CD1 4.49Å; L54-L58 HydrophobicContact CD1-CG 4.46Å; L54-L58 HydrophobicContact CG-CD1 4.16Å; L54-L58 WeakPolarHBondContact O-CB 3.49Å; L54-L58 VanDerWaalsContact O-CG 3.24Å; L54-L58 WeakPolarHBondContact O-CG 3.43Å; L54-L58 PolarHBondContact O-N 3.27Å
55V93.9Very high90.8Very high71 Ų7159.5 Ų59.543%0.4331%0.313SS..Hα-helixtrans-61.5-47178.71690000110.8V51 V52 F57 L58 I59V51-V55 HydrophobicContact CG1-CG2 4.32Å; V51-V55 WeakPolarHBondContact O-CB 3.1Å; V51-V55 VanDerWaalsContact O-CG2 3.31Å; V51-V55 WeakPolarHBondContact O-CG2 3.08Å; V51-V55 PolarHBondContact O-N 2.91Å; V52-V55 PolarHBondContact O-N 3.24Å; V55-F57 PolarHBondContact O-N 3.4Å; V55-L58 PolarHBondContact O-N 3.23Å; V55-I59 HydrophobicContact CG1-CD1 3.78Å; V55-I59 HydrophobicContact CG1-CG1 4.45Å; V55-I59 VanDerWaalsContact O-CG1 3.28Å; V55-I59 WeakPolarHBondContact O-CG1 3.18Å; V55-I59 PolarHBondContact O-N 2.87Å
56V91.9Very high90.7Very high20 Ų2066.7 Ų66.712%0.12135%0.345CS..Hα-helixtrans-63-43.5177.6173.90000110.9V52 A53 L58 I59 V60 F130 P131 L134V52-V56 HydrophobicContact CG1-CG2 4.37Å; V52-V56 WeakPolarHBondContact O-CB 3.24Å; V52-V56 VanDerWaalsContact O-CG2 3.29Å; V52-V56 WeakPolarHBondContact O-CG2 3.49Å; V52-V56 PolarHBondContact O-N 3.5Å; A53-V56 PolarHBondContact O-N 3.07Å; V56-L58 VanDerWaalsContact C-N 3.33Å; V56-L58 PolarHBondContact O-N 3.09Å; V56-I59 PolarHBondContact O-N 3.37Å; V56-V60 HydrophobicContact CG1-CG2 4.39Å; V56-V60 WeakPolarHBondContact O-CG2 3.29Å; V56-V60 PolarHBondContact O-N 3.01Å; V56-F130 HydrophobicContact CG1-CD1 3.75Å; V56-F130 HydrophobicContact CG1-CE1 4.17Å; V56-P131 HydrophobicContact CB-CG 4.02Å; V56-P131 HydrophobicContact CG1-CG 3.66Å; V56-L134 HydrophobicContact CG2-CD1 4.09Å
57F89.8Confident90.6Very high82 Ų8265.1 Ų65.136%0.3634%0.339SS..Hα-helixtrans-59.2-43.3175.7-179.6-93.7000112A53 L54 V55 V60 G61 M68 G127A53-F57 WeakPolarHBondContact O-CB 3.24Å; A53-F57 PolarHBondContact O-N 3.08Å; L54-F57 PolarHBondContact O-N 3.06Å; V55-F57 PolarHBondContact O-N 3.4Å; F57-V60 PolarHBondContact O-N 3.46Å; F57-G61 PolarHBondContact O-N 2.85Å; F57-M68 HydrophobicContact CD1-CE 3.9Å; F57-M68 HydrophobicContact CD2-CE 3.81Å; F57-M68 HydrophobicContact CE1-CE 3.43Å; F57-M68 VanDerWaalsContact CE1-CE 3.43Å; F57-M68 HydrophobicContact CE1-SD 4.43Å; F57-M68 HydrophobicContact CE2-CE 3.34Å; F57-M68 HydrophobicContact CE2-SD 4.01Å; F57-M68 HydrophobicContact CG-CE 4.08Å; F57-M68 HydrophobicContact CZ-CE 3.12Å; F57-M68 HydrophobicContact CZ-SD 3.72Å; F57-G127 WeakPolarHBondContact CD2-O 3.38Å
58L91.2Very high90.5Very high104 Ų10465.1 Ų65.155%0.54534%0.337SS..Hα-helixtrans-66.2-40.5176.5-70.9174.6000112.2L54 V55 V56 G61 F62L54-L58 HydrophobicContact CD1-CD1 4.49Å; L54-L58 HydrophobicContact CD1-CG 4.46Å; L54-L58 HydrophobicContact CG-CD1 4.16Å; L54-L58 WeakPolarHBondContact O-CB 3.49Å; L54-L58 VanDerWaalsContact O-CG 3.24Å; L54-L58 WeakPolarHBondContact O-CG 3.43Å; L54-L58 PolarHBondContact O-N 3.27Å; V55-L58 PolarHBondContact O-N 3.23Å; V56-L58 VanDerWaalsContact C-N 3.33Å; V56-L58 PolarHBondContact O-N 3.09Å; L58-G61 PolarHBondContact O-N 3.45Å; L58-F62 WeakPolarHBondContact O-CB 3.18Å; L58-F62 PolarHBondContact O-N 2.86Å
59I90.9Very high90.3Very high92 Ų9272.9 Ų72.947%0.47237%0.371SS..Hα-helixtrans-62.3-49.4175.4-69.8166000110.2V55 V56 G61 F62 L63V55-I59 HydrophobicContact CG1-CD1 3.78Å; V55-I59 HydrophobicContact CG1-CG1 4.45Å; V55-I59 VanDerWaalsContact O-CG1 3.28Å; V55-I59 WeakPolarHBondContact O-CG1 3.18Å; V55-I59 PolarHBondContact O-N 2.87Å; V56-I59 PolarHBondContact O-N 3.37Å; I59-G61 VanDerWaalsContact C-N 3.3Å; I59-G61 PolarHBondContact O-N 2.93Å; I59-F62 PolarHBondContact O-N 3.41Å; I59-F62 VanDerWaalsContact O-N 3.16Å; I59-L63 HydrophobicContact CG2-CD1 3.95Å; I59-L63 HydrophobicContact CG2-CG 4.4Å; I59-L63 WeakPolarHBondContact O-CG 3.47Å; I59-L63 PolarHBondContact O-N 3.3Å
60V88.7Confident90Very high22 Ų2274.7 Ų74.713%0.13338%0.381CS..Hα-helixtrans-60.1-43.3177.4172.60000110.6V56 F57 F62 L63 N64 V123 F126V56-V60 HydrophobicContact CG1-CG2 4.39Å; V56-V60 WeakPolarHBondContact O-CG2 3.29Å; V56-V60 PolarHBondContact O-N 3.01Å; F57-V60 PolarHBondContact O-N 3.46Å; V60-F62 VanDerWaalsContact C-N 3.33Å; V60-F62 PolarHBondContact O-N 2.86Å; V60-L63 PolarHBondContact O-N 3.33Å; V60-N64 PolarHBondContact O-N 2.62Å; V60-V123 HydrophobicContact CG1-CG1 4.32Å; V60-F126 HydrophobicContact CG1-CB 4.18Å; V60-F126 HydrophobicContact CG2-CB 4.17Å
61G87.8Confident89.7Confident13 Ų1368 Ų6813%0.13435%0.353CS..Hα-helixtrans-63.1-36.3175.700000113.3F57 L58 I59 N64 P65F57-G61 PolarHBondContact O-N 2.85Å; L58-G61 PolarHBondContact O-N 3.45Å; I59-G61 VanDerWaalsContact C-N 3.3Å; I59-G61 PolarHBondContact O-N 2.93Å; G61-N64 CarbonylContact O-C 3.51Å; G61-N64 VanDerWaalsContact O-C 3.3Å; G61-P65 WeakPolarHBondContact O-CA 3.2Å
62F89.3Confident89.5Confident171 Ų17167.5 Ų67.575%0.7536%0.355SS*.Hα-helixtrans-72.7-36.7176.3-174.5-96.5000112.6L58 I59 V60 N64 P65L58-F62 WeakPolarHBondContact O-CB 3.18Å; L58-F62 PolarHBondContact O-N 2.86Å; I59-F62 PolarHBondContact O-N 3.41Å; I59-F62 VanDerWaalsContact O-N 3.16Å; V60-F62 VanDerWaalsContact C-N 3.33Å; V60-F62 PolarHBondContact O-N 2.86Å; F62-N64 VanDerWaalsContact C-N 3.35Å; F62-P65 WeakPolarHBondContact O-CD 3.39Å
63L89.4Confident89.3Confident135 Ų13568.4 Ų68.471%0.70737%0.366SS*.Hα-helixtrans-72.7-28.3177.4-68.2175.1000112.6I59 V60I59-L63 HydrophobicContact CG2-CD1 3.95Å; I59-L63 HydrophobicContact CG2-CG 4.4Å; I59-L63 WeakPolarHBondContact O-CG 3.47Å; I59-L63 PolarHBondContact O-N 3.3Å; V60-L63 PolarHBondContact O-N 3.33Å
64N86.8Confident89.1Confident74 Ų7467.8 Ų67.840%0.39636%0.359SS..SBendtrans-137.970.2176.8-164.7-20.9000111.9V60 G61 F62 F66 G67 M68 V123V60-N64 PolarHBondContact O-N 2.62Å; G61-N64 CarbonylContact O-C 3.51Å; G61-N64 VanDerWaalsContact O-C 3.3Å; F62-N64 VanDerWaalsContact C-N 3.35Å; N64-F66 PolarHBondContact O-N 3.34Å; N64-G67 PolarHBondContact O-N 2.94Å; N64-G67 WeakPolarHBondContact OD1-CA 3.43Å; N64-G67 PolarHBondContact OD1-N 3.47Å; N64-M68 WeakPolarHBondContact O-CB 3.29Å; N64-M68 PolarHBondContact O-N 3.28Å; N64-V123 HydrophobicContact CB-CG2 4.13Å
65P88Confident88.9Confident67 Ų6766.4 Ų66.444%0.43535%0.354SS..Hα-helixtrans-67.4-39.7-173.725.5-32.8000111.5G61 F62 M68 F69G61-P65 WeakPolarHBondContact O-CA 3.2Å; F62-P65 WeakPolarHBondContact O-CD 3.39Å; P65-M68 PolarHBondContact O-N 3.3Å; P65-F69 WeakPolarHBondContact O-CD2 3.31Å; P65-F69 PolarHBondContact O-N 3.15Å
66F86.7Confident88.8Confident152 Ų15266.6 Ų66.667%0.66736%0.358SS*.Hα-helixtrans-63.2-46.8178.2-176.1-101.2000111.8N64 M68 F69 L70N64-F66 PolarHBondContact O-N 3.34Å; F66-M68 VanDerWaalsContact C-N 3.3Å; F66-M68 PolarHBondContact O-N 2.62Å; F66-F69 PolarHBondContact O-N 3.17Å; F66-L70 HydrophobicContact CE1-CD2 3.81Å; F66-L70 HydrophobicContact CZ-CD2 4.25Å; F66-L70 WeakPolarHBondContact O-CB 3.37Å; F66-L70 PolarHBondContact O-N 3.41Å
67G85.9Confident88.9Confident7 Ų771.7 Ų71.77%0.07238%0.384CS..Hα-helixtrans-64-34.6176.900000112.7N64 G71N64-G67 PolarHBondContact O-N 2.94Å; N64-G67 WeakPolarHBondContact OD1-CA 3.43Å; N64-G67 PolarHBondContact OD1-N 3.47Å; G67-G71 WeakPolarHBondContact O-CA 3.35Å; G67-G71 PolarHBondContact O-N 3.13Å
68M87.2Confident89.1Confident34 Ų3469.1 Ų69.117%0.16738%0.375CS..Hα-helixtrans-66.1-49.3174.3-176.867.1103.800112F57 N64 P65 F66 G72 V123F57-M68 HydrophobicContact CD1-CE 3.9Å; F57-M68 HydrophobicContact CD2-CE 3.81Å; F57-M68 HydrophobicContact CE1-CE 3.43Å; F57-M68 VanDerWaalsContact CE1-CE 3.43Å; F57-M68 HydrophobicContact CE1-SD 4.43Å; F57-M68 HydrophobicContact CE2-CE 3.34Å; F57-M68 HydrophobicContact CE2-SD 4.01Å; F57-M68 HydrophobicContact CG-CE 4.08Å; F57-M68 HydrophobicContact CZ-CE 3.12Å; F57-M68 HydrophobicContact CZ-SD 3.72Å; N64-M68 WeakPolarHBondContact O-CB 3.29Å; N64-M68 PolarHBondContact O-N 3.28Å; P65-M68 PolarHBondContact O-N 3.3Å; F66-M68 VanDerWaalsContact C-N 3.3Å; F66-M68 PolarHBondContact O-N 2.62Å; M68-G72 PolarHBondContact O-N 3.46Å; M68-V123 HydrophobicContact CB-CG1 4.15Å; M68-V123 HydrophobicContact SD-CG1 4.11Å
69F88.8Confident89.2Confident162 Ų16270.3 Ų70.371%0.71138%0.376SS*.Hα-helixtrans-65.6-46.1178.6-77.6-63.2000112.1P65 F66 G71 G72 A73P65-F69 WeakPolarHBondContact O-CD2 3.31Å; P65-F69 PolarHBondContact O-N 3.15Å; F66-F69 PolarHBondContact O-N 3.17Å; F69-G71 VanDerWaalsContact C-N 3.35Å; F69-G72 PolarHBondContact O-N 2.9Å; F69-A73 VanDerWaalsContact O-CB 3.25Å; F69-A73 WeakPolarHBondContact O-CB 3.47Å; F69-A73 PolarHBondContact O-N 2.91Å
70L88Confident89.4Confident49 Ų4968.5 Ų68.526%0.25738%0.375SS..Hα-helixtrans-61.9-46.1178.2-17761.7000110.7F66 A73 V74 F118F66-L70 HydrophobicContact CE1-CD2 3.81Å; F66-L70 HydrophobicContact CZ-CD2 4.25Å; F66-L70 WeakPolarHBondContact O-CB 3.37Å; F66-L70 PolarHBondContact O-N 3.41Å; L70-A73 PolarHBondContact O-N 2.93Å; L70-V74 WeakPolarHBondContact O-CB 3.09Å; L70-V74 VanDerWaalsContact O-CG2 3.3Å; L70-V74 WeakPolarHBondContact O-CG2 3.44Å; L70-V74 PolarHBondContact O-N 2.83Å; L70-F118 HydrophobicContact CD2-CB 3.88Å; L70-F118 HydrophobicContact CD2-CD1 4.19Å; L70-F118 HydrophobicContact CD2-CG 4.23Å; L70-F118 HydrophobicContact CG-CB 4.46Å
71G86.6Confident89.7Confident1 Ų169.2 Ų69.21%0.0139%0.387CS..Hα-helixtrans-60.2-49176.500000112.7G67 F69 A73 V74 V75 F124G67-G71 WeakPolarHBondContact O-CA 3.35Å; G67-G71 PolarHBondContact O-N 3.13Å; F69-G71 VanDerWaalsContact C-N 3.35Å; G71-A73 VanDerWaalsContact C-N 3.35Å; G71-A73 PolarHBondContact O-N 3.48Å; G71-V74 PolarHBondContact O-N 2.89Å; G71-V75 WeakPolarHBondContact O-CG2 3.36Å; G71-V75 PolarHBondContact O-N 3.17Å; G71-F124 VanDerWaalsContact CA-CE2 3.49Å
72G87.8Confident90Very high29 Ų2969.3 Ų69.330%0.29939%0.386SS..Hα-helixtrans-60.7-41.6176.400000112.8M68 F69 S76M68-G72 PolarHBondContact O-N 3.46Å; F69-G72 PolarHBondContact O-N 2.9Å; G72-S76 VanDerWaalsContact O-CB 3.24Å; G72-S76 WeakPolarHBondContact O-CB 3.37Å; G72-S76 PolarHBondContact O-N 3.46Å; G72-S76 PolarHBondContact O-OG 3.3Å
73A90.3Very high90.2Very high47 Ų4763.2 Ų63.239%0.38836%0.362SS..Hα-helixtrans-63.9-47.6176.500000111.6F69 L70 G71 V75 S76 L77F69-A73 VanDerWaalsContact O-CB 3.25Å; F69-A73 WeakPolarHBondContact O-CB 3.47Å; F69-A73 PolarHBondContact O-N 2.91Å; L70-A73 PolarHBondContact O-N 2.93Å; G71-A73 VanDerWaalsContact C-N 3.35Å; G71-A73 PolarHBondContact O-N 3.48Å; A73-V75 PolarHBondContact O-N 3.31Å; A73-S76 PolarHBondContact O-N 2.89Å; A73-L77 WeakPolarHBondContact O-CB 3.23Å; A73-L77 VanDerWaalsContact O-CG 3.25Å; A73-L77 WeakPolarHBondContact O-CG 3.37Å; A73-L77 PolarHBondContact O-N 3.23Å
74V89.4Confident90.5Very high13 Ų1363.8 Ų63.88%0.07936%0.355CS..Hα-helixtrans-57.7-51.9177.6165.10000110.9L70 G71 S76 L77 V78 V114 L115 F118L70-V74 WeakPolarHBondContact O-CB 3.09Å; L70-V74 VanDerWaalsContact O-CG2 3.3Å; L70-V74 WeakPolarHBondContact O-CG2 3.44Å; L70-V74 PolarHBondContact O-N 2.83Å; G71-V74 PolarHBondContact O-N 2.89Å; V74-S76 VanDerWaalsContact C-N 3.32Å; V74-S76 PolarHBondContact O-N 3.31Å; V74-L77 PolarHBondContact O-N 2.84Å; V74-V78 HydrophobicContact CG1-CG2 4.38Å; V74-V78 WeakPolarHBondContact O-CB 3.31Å; V74-V78 VanDerWaalsContact O-CG2 3.25Å; V74-V78 WeakPolarHBondContact O-CG2 3.21Å; V74-V78 PolarHBondContact O-N 2.96Å; V74-V114 HydrophobicContact CG1-CB 3.89Å; V74-V114 HydrophobicContact CG1-CG1 3.45Å; V74-V114 VanDerWaalsContact CG1-CG1 3.45Å; V74-V114 HydrophobicContact CG2-CG1 4.29Å; V74-L115 HydrophobicContact CB-CD2 4Å; V74-L115 HydrophobicContact CG1-CD2 3.84Å; V74-L115 HydrophobicContact CG1-CG 4.02Å; V74-F118 HydrophobicContact CG2-CD2 4.02Å; V74-F118 HydrophobicContact CG2-CE2 4.22Å
75V88.9Confident90.8Very high49 Ų4961.1 Ų61.130%0.29734%0.343SS..Hα-helixtrans-61.3-43.6-179.7173.20000110.9G71 A73 L77 V78 F79 L115 F124G71-V75 WeakPolarHBondContact O-CG2 3.36Å; G71-V75 PolarHBondContact O-N 3.17Å; A73-V75 PolarHBondContact O-N 3.31Å; V75-L77 PolarHBondContact O-N 2.76Å; V75-V78 PolarHBondContact O-N 3.28Å; V75-F79 VanDerWaalsContact O-CB 3.25Å; V75-F79 WeakPolarHBondContact O-CB 3.49Å; V75-F79 PolarHBondContact O-N 3.33Å; V75-L115 HydrophobicContact CG2-CD1 3.85Å; V75-L115 HydrophobicContact CG2-CD2 4.43Å; V75-L115 HydrophobicContact CG2-CG 4.42Å; V75-F124 HydrophobicContact CG2-CE1 4.27Å; V75-F124 HydrophobicContact CG2-CE2 4.17Å; V75-F124 HydrophobicContact CG2-CZ 3.68Å
76S91.8Very high90.9Very high75 Ų7558 Ų5852%0.52432%0.323SS..Hα-helixtrans-63.1-43.2179.2-59.60000112.1G72 A73 V74 A80G72-S76 VanDerWaalsContact O-CB 3.24Å; G72-S76 WeakPolarHBondContact O-CB 3.37Å; G72-S76 PolarHBondContact O-N 3.46Å; G72-S76 PolarHBondContact O-OG 3.3Å; A73-S76 PolarHBondContact O-N 2.89Å; V74-S76 VanDerWaalsContact C-N 3.32Å; V74-S76 PolarHBondContact O-N 3.31Å; S76-A80 WeakPolarHBondContact O-CB 3.29Å; S76-A80 PolarHBondContact O-N 3.21Å
77L94.6Very high91.1Very high128 Ų12856.4 Ų56.467%0.6732%0.318SS*.Hα-helixtrans-68.2-43.8179-73.2172.4000112.1A73 V74 V75 F79 G81A73-L77 WeakPolarHBondContact O-CB 3.23Å; A73-L77 VanDerWaalsContact O-CG 3.25Å; A73-L77 WeakPolarHBondContact O-CG 3.37Å; A73-L77 PolarHBondContact O-N 3.23Å; V74-L77 PolarHBondContact O-N 2.84Å; V75-L77 PolarHBondContact O-N 2.76Å; L77-F79 VanDerWaalsContact C-N 3.34Å; L77-G81 WeakPolarHBondContact O-CA 3.35Å; L77-G81 PolarHBondContact O-N 3.48Å
78V93.4Very high91.4Very high28 Ų2860.4 Ų60.417%0.1734%0.338CS..Hα-helixtrans-62.6-44.8176.7174.20000110V74 V75 S82 V107 T110 S111 V114V74-V78 HydrophobicContact CG1-CG2 4.38Å; V74-V78 WeakPolarHBondContact O-CB 3.31Å; V74-V78 VanDerWaalsContact O-CG2 3.25Å; V74-V78 WeakPolarHBondContact O-CG2 3.21Å; V74-V78 PolarHBondContact O-N 2.96Å; V75-V78 PolarHBondContact O-N 3.28Å; V78-S82 VanDerWaalsContact O-CB 3.29Å; V78-S82 WeakPolarHBondContact O-CB 3.3Å; V78-S82 PolarHBondContact O-N 3.23Å; V78-S82 PolarHBondContact O-OG 2.93Å; V78-V107 HydrophobicContact CG1-CG1 4.42Å; V78-T110 HydrophobicContact CG1-CG2 4.02Å; V78-S111 VanDerWaalsContact CG1-OG 3.3Å; V78-S111 WeakPolarHBondContact CG1-OG 3.37Å; V78-V114 HydrophobicContact CG2-CG2 4.47Å
79F92.8Very high91.7Very high128 Ų12863.8 Ų63.856%0.56135%0.352SS*.Hα-helixtrans-63.9-53.1177.8-176.7-103.7000111.7V75 L77 G81 S82 V83V75-F79 VanDerWaalsContact O-CB 3.25Å; V75-F79 WeakPolarHBondContact O-CB 3.49Å; V75-F79 PolarHBondContact O-N 3.33Å; L77-F79 VanDerWaalsContact C-N 3.34Å; F79-G81 VanDerWaalsContact C-N 3.33Å; F79-G81 PolarHBondContact O-N 3.26Å; F79-S82 PolarHBondContact O-N 3.3Å; F79-S82 VanDerWaalsContact O-N 3.13Å; F79-S82 PolarHBondContact O-OG 3.41Å; F79-V83 HydrophobicContact CD1-CG2 4.35Å; F79-V83 HydrophobicContact CE1-CG2 3.97Å; F79-V83 HydrophobicContact CE2-CG2 4.23Å; F79-V83 HydrophobicContact CZ-CG2 3.9Å; F79-V83 WeakPolarHBondContact O-CG2 3.33Å; F79-V83 PolarHBondContact O-N 2.86Å
80A95.1Very high91.8Very high55 Ų5560.4 Ų60.446%0.45535%0.346SS..Hα-helixtrans-59.5-44179.100000111.8S76 S82 V83 W84S76-A80 WeakPolarHBondContact O-CB 3.29Å; S76-A80 PolarHBondContact O-N 3.21Å; A80-S82 VanDerWaalsContact C-N 3.34Å; A80-S82 PolarHBondContact O-N 3.04Å; A80-V83 PolarHBondContact O-N 3.06Å; A80-W84 VanDerWaalsContact O-CB 3.29Å; A80-W84 WeakPolarHBondContact O-CB 3.34Å; A80-W84 PolarHBondContact O-N 3.11Å
81G95.1Very high92Very high36 Ų3663.6 Ų63.637%0.37137%0.367SS..Hα-helixtrans-60.8-41.2175.200000112.4L77 F79 A85L77-G81 WeakPolarHBondContact O-CA 3.35Å; L77-G81 PolarHBondContact O-N 3.48Å; F79-G81 VanDerWaalsContact C-N 3.33Å; F79-G81 PolarHBondContact O-N 3.26Å; G81-A85 WeakPolarHBondContact O-CB 3.49Å; G81-A85 PolarHBondContact O-N 3.37Å
82S93.6Very high92.2Very high16 Ų1666.4 Ų66.411%0.11238%0.382CS..Hα-helixtrans-66.8-41176.877.30000112.8V78 F79 A80 A85 G86 V107V78-S82 VanDerWaalsContact O-CB 3.29Å; V78-S82 WeakPolarHBondContact O-CB 3.3Å; V78-S82 PolarHBondContact O-N 3.23Å; V78-S82 PolarHBondContact O-OG 2.93Å; F79-S82 PolarHBondContact O-N 3.3Å; F79-S82 VanDerWaalsContact O-N 3.13Å; F79-S82 PolarHBondContact O-OG 3.41Å; A80-S82 VanDerWaalsContact C-N 3.34Å; A80-S82 PolarHBondContact O-N 3.04Å; S82-A85 PolarHBondContact O-N 3.32Å; S82-G86 PolarHBondContact O-N 3.49Å; S82-V107 VanDerWaalsContact CB-CG2 3.48Å; S82-V107 WeakPolarHBondContact OG-CG2 3.48Å
83V93.4Very high92.4Very high43 Ų4370.7 Ų70.726%0.26139%0.392SS..Hα-helixtrans-65.5-50176.9170.40000109.7F79 A80 A85 G86 E87F79-V83 HydrophobicContact CD1-CG2 4.35Å; F79-V83 HydrophobicContact CE1-CG2 3.97Å; F79-V83 HydrophobicContact CE2-CG2 4.23Å; F79-V83 HydrophobicContact CZ-CG2 3.9Å; F79-V83 WeakPolarHBondContact O-CG2 3.33Å; F79-V83 PolarHBondContact O-N 2.86Å; A80-V83 PolarHBondContact O-N 3.06Å; V83-A85 VanDerWaalsContact C-N 3.33Å; V83-A85 PolarHBondContact O-N 3.27Å; V83-G86 PolarHBondContact O-N 2.89Å; V83-G86 VanDerWaalsContact O-N 3.14Å; V83-E87 PolarHBondContact O-N 3.48Å
84W95.6Very high92.6Very high146 Ų14671.9 Ų71.955%0.55339%0.392SS*.Hα-helixtrans-56.7-47.1176.4177.186.2000111.5A80 G86 E87 N88A80-W84 VanDerWaalsContact O-CB 3.29Å; A80-W84 WeakPolarHBondContact O-CB 3.34Å; A80-W84 PolarHBondContact O-N 3.11Å; W84-G86 VanDerWaalsContact C-N 3.33Å; W84-G86 PolarHBondContact O-N 3.02Å; W84-E87 PolarHBondContact O-N 2.9Å; W84-N88 VanDerWaalsContact CD1-ND2 3.28Å; W84-N88 HydrophobicContact CZ2-CB 4.39Å; W84-N88 PolarHBondContact NE1-ND2 3.26Å; W84-N88 WeakPolarHBondContact O-CB 3.46Å; W84-N88 PolarHBondContact O-N 3.16Å; W84-N88 PolarHBondContact O-ND2 3.41Å
85A92.9Very high92.8Very high18 Ų1875.7 Ų75.715%0.14941%0.408CS..Hα-helixtrans-63.6-39.4177.900000112G81 S82 V83 E87 K89 I92G81-A85 WeakPolarHBondContact O-CB 3.49Å; G81-A85 PolarHBondContact O-N 3.37Å; S82-A85 PolarHBondContact O-N 3.32Å; V83-A85 VanDerWaalsContact C-N 3.33Å; V83-A85 PolarHBondContact O-N 3.27Å; A85-E87 VanDerWaalsContact C-N 3.25Å; A85-E87 PolarHBondContact O-N 2.92Å; A85-K89 VanDerWaalsContact O-CB 3.31Å; A85-K89 WeakPolarHBondContact O-CB 3.28Å; A85-K89 PolarHBondContact O-N 2.82Å; A85-I92 HydrophobicContact CB-CD1 3.79Å
86G91Very high92.9Very high2 Ų276.9 Ų76.92%0.02141%0.409CS..Hα-helixtrans-68-19.8176.600000114.5S82 V83 W84 K93S82-G86 PolarHBondContact O-N 3.49Å; V83-G86 PolarHBondContact O-N 2.89Å; V83-G86 VanDerWaalsContact O-N 3.14Å; W84-G86 VanDerWaalsContact C-N 3.33Å; W84-G86 PolarHBondContact O-N 3.02Å; G86-K93 WeakPolarHBondContact O-CA 3.35Å; G86-K93 WeakPolarHBondContact O-CB 3.31Å; G86-K93 WeakPolarHBondContact O-CG 3.21Å
87E91.4Very high93Very high118 Ų11882.5 Ų82.555%0.55142%0.419SS*.Hα-helixtrans-95.8-38.4176.4-71.4-179.3178.200112.6V83 W84 A85V83-E87 PolarHBondContact O-N 3.48Å; W84-E87 PolarHBondContact O-N 2.9Å; A85-E87 VanDerWaalsContact C-N 3.25Å; A85-E87 PolarHBondContact O-N 2.92Å
88N91.7Very high93Very high91 Ų9184 Ų8449%0.48742%0.419SS..Hα-helixtrans-98-19.6-169.3-67.9-83.8000114.1W84W84-N88 VanDerWaalsContact CD1-ND2 3.28Å; W84-N88 HydrophobicContact CZ2-CB 4.39Å; W84-N88 PolarHBondContact NE1-ND2 3.26Å; W84-N88 WeakPolarHBondContact O-CB 3.46Å; W84-N88 PolarHBondContact O-N 3.16Å; W84-N88 PolarHBondContact O-ND2 3.41Å
89K93.5Very high93Very high106 Ų10686 Ų8646%0.46143%0.429SS..  trans-105.6117.7178.4-59-61.6-174.7-178.60110.4A85 T91 I92 K93A85-K89 VanDerWaalsContact O-CB 3.31Å; A85-K89 WeakPolarHBondContact O-CB 3.28Å; A85-K89 PolarHBondContact O-N 2.82Å; K89-T91 VanDerWaalsContact C-N 3.28Å; K89-T91 PolarHBondContact O-N 3.46Å; K89-I92 HydrophobicContact CB-CB 4.21Å; K89-I92 HydrophobicContact CB-CD1 4Å; K89-I92 HydrophobicContact CB-CG1 4.1Å; K89-I92 HydrophobicContact CG-CD1 4.26Å; K89-I92 PolarHBondContact O-N 3.38Å; K89-I92 VanDerWaalsContact O-N 3.15Å; K89-K93 WeakPolarHBondContact O-CB 3.5Å; K89-K93 PolarHBondContact O-N 2.99Å
90P91.5Very high93Very high91 Ų9183.3 Ų83.359%0.59143%0.425SS*.Hα-helixtrans-60.7-35.6-173.820.6-30.5000112.9N94P90-N94 VanDerWaalsContact O-CB 3.27Å; P90-N94 WeakPolarHBondContact O-CB 3.32Å; P90-N94 PolarHBondContact O-N 3.34Å; P90-N94 PolarHBondContact O-ND2 2.86Å; P90-N94 VanDerWaalsContact O-ND2 3.08Å
91T91.8Very high92.9Very high115 Ų11585.5 Ų85.571%0.70643%0.433SS*.Hα-helixtrans-63.6-47.7176.1-47.50000112.2K89 N94 F95K89-T91 VanDerWaalsContact C-N 3.28Å; K89-T91 PolarHBondContact O-N 3.46Å; T91-N94 PolarHBondContact O-N 3.37Å; T91-F95 WeakPolarHBondContact O-CB 3.44Å; T91-F95 PolarHBondContact O-N 3.49Å
92I90.4Very high92.8Very high61 Ų6188.3 Ų88.331%0.31344%0.439SS..Hα-helixtrans-71.6-39.1-178.3-57.4176000110A85 K89 N94 F95 K96 F103A85-I92 HydrophobicContact CB-CD1 3.79Å; K89-I92 HydrophobicContact CB-CB 4.21Å; K89-I92 HydrophobicContact CB-CD1 4Å; K89-I92 HydrophobicContact CB-CG1 4.1Å; K89-I92 HydrophobicContact CG-CD1 4.26Å; K89-I92 PolarHBondContact O-N 3.38Å; K89-I92 VanDerWaalsContact O-N 3.15Å; I92-N94 PolarHBondContact O-N 2.86Å; I92-F95 PolarHBondContact O-N 2.91Å; I92-K96 WeakPolarHBondContact O-CB 3.32Å; I92-K96 PolarHBondContact O-N 3.42Å; I92-F103 HydrophobicContact CG2-CD2 4.46Å; I92-F103 HydrophobicContact CG2-CE2 3.84Å
93K93.1Very high92.8Very high118 Ų11888.9 Ų88.951%0.51344%0.439SS..Hα-helixtrans-57.7-47.5173.1-171.9171.5-176.7171.30112.1G86 K89 R97G86-K93 WeakPolarHBondContact O-CA 3.35Å; G86-K93 WeakPolarHBondContact O-CB 3.31Å; G86-K93 WeakPolarHBondContact O-CG 3.21Å; K89-K93 WeakPolarHBondContact O-CB 3.5Å; K89-K93 PolarHBondContact O-N 2.99Å; K93-R97 WeakPolarHBondContact O-CB 3.27Å; K93-R97 PolarHBondContact O-N 2.93Å
94N94.1Very high92.8Very high73 Ų7390.7 Ų90.739%0.3945%0.45SS..Hα-helixtrans-65.6-39.5177.1-75.1-30.7000111.8P90 T91 I92 R97 K98P90-N94 VanDerWaalsContact O-CB 3.27Å; P90-N94 WeakPolarHBondContact O-CB 3.32Å; P90-N94 PolarHBondContact O-N 3.34Å; P90-N94 PolarHBondContact O-ND2 2.86Å; P90-N94 VanDerWaalsContact O-ND2 3.08Å; T91-N94 PolarHBondContact O-N 3.37Å; I92-N94 PolarHBondContact O-N 2.86Å; N94-R97 PolarHBondContact O-N 3.33Å; N94-K98 WeakPolarHBondContact O-CB 3.29Å; N94-K98 VanDerWaalsContact O-CG 3.31Å; N94-K98 WeakPolarHBondContact O-CG 3.49Å; N94-K98 PolarHBondContact O-N 2.87Å
95F92.8Very high92.7Very high92 Ų9288.2 Ų88.240%0.40445%0.447SS..Hα-helixtrans-64-50175.2178.1-100.1000112.2T91 I92 R97 K98 N99 L102 F103T91-F95 WeakPolarHBondContact O-CB 3.44Å; T91-F95 PolarHBondContact O-N 3.49Å; I92-F95 PolarHBondContact O-N 2.91Å; F95-R97 VanDerWaalsContact C-N 3.26Å; F95-R97 PolarHBondContact O-N 2.86Å; F95-K98 PolarHBondContact O-N 3.32Å; F95-K98 VanDerWaalsContact O-N 3.16Å; F95-N99 HydrophobicContact CE2-CB 4.34Å; F95-N99 HydrophobicContact CZ-CB 4.46Å; F95-N99 PolarHBondContact O-N 3.45Å; F95-L102 HydrophobicContact CE1-CB 4.48Å; F95-L102 HydrophobicContact CZ-CB 3.9Å; F95-F103 HydrophobicContact CD1-CB 4.32Å; F95-F103 HydrophobicContact CD1-CD2 4.26Å; F95-F103 HydrophobicContact CE1-CB 4.07Å; F95-F103 HydrophobicContact CE1-CD2 4.5Å
96K92.1Very high92.7Very high75 Ų7589 Ų8933%0.32646%0.456SS..Hα-helixtrans-55.5-40.8176.2177.4-177.5173-1760111.7I92 P100 F103I92-K96 WeakPolarHBondContact O-CB 3.32Å; I92-K96 PolarHBondContact O-N 3.42Å; K96-P100 VanDerWaalsContact O-CA 3.22Å; K96-P100 WeakPolarHBondContact O-CA 3.45Å; K96-P100 WeakPolarHBondContact O-CB 3.39Å; K96-F103 HydrophobicContact CB-CB 4.42Å; K96-F103 HydrophobicContact CB-CD1 4.37Å; K96-F103 HydrophobicContact CB-CD2 4.07Å; K96-F103 HydrophobicContact CB-CE2 4.45Å; K96-F103 HydrophobicContact CB-CG 4.01Å; K96-F103 HydrophobicContact CD-CD1 4.15Å; K96-F103 HydrophobicContact CD-CE1 3.95Å; K96-F103 HydrophobicContact CD-CZ 4.24Å; K96-F103 HydrophobicContact CG-CD1 3.87Å; K96-F103 HydrophobicContact CG-CD2 4.45Å; K96-F103 HydrophobicContact CG-CE1 4.2Å; K96-F103 HydrophobicContact CG-CG 4.01Å
97R92.6Very high92.8Very high193 Ų19389.9 Ų89.973%0.72846%0.462SS*.Hα-helixtrans-71.4-38.9178.4-169.917667.5174.50.3112.8K93 N94 F95K93-R97 WeakPolarHBondContact O-CB 3.27Å; K93-R97 PolarHBondContact O-N 2.93Å; N94-R97 PolarHBondContact O-N 3.33Å; F95-R97 VanDerWaalsContact C-N 3.26Å; F95-R97 PolarHBondContact O-N 2.86Å
98K95.6Very high92.8Very high158 Ų15890.4 Ų90.469%0.68747%0.466SS*.Hα-helixtrans-74.5-39.5179.4-74.7-178.2177.9-171.20112.3N94 F95N94-K98 WeakPolarHBondContact O-CB 3.29Å; N94-K98 VanDerWaalsContact O-CG 3.31Å; N94-K98 WeakPolarHBondContact O-CG 3.49Å; N94-K98 PolarHBondContact O-N 2.87Å; F95-K98 PolarHBondContact O-N 3.32Å; F95-K98 VanDerWaalsContact O-N 3.16Å
99N93.8Very high92.9Very high70 Ų7088.8 Ų88.837%0.37447%0.465SS..  trans-136.869.3-173.6-57.9-69.8000111.2F95 T101 L102 F103F95-N99 HydrophobicContact CE2-CB 4.34Å; F95-N99 HydrophobicContact CZ-CB 4.46Å; F95-N99 PolarHBondContact O-N 3.45Å; N99-T101 VanDerWaalsContact C-N 3.29Å; N99-T101 PolarHBondContact O-N 3.26Å; N99-L102 HydrophobicContact CB-CB 4.02Å; N99-L102 HydrophobicContact CB-CD1 3.97Å; N99-L102 HydrophobicContact CB-CG 4.25Å; N99-L102 PolarHBondContact O-N 2.89Å; N99-F103 PolarHBondContact O-N 3.33Å; N99-F103 VanDerWaalsContact O-N 3.07Å
100P92.6Very high92.8Very high73 Ų7387.2 Ų87.247%0.47446%0.464SS..Hα-helixtrans-60.7-37.7-176.623.4-33.5000112.5K96 F103 V104K96-P100 VanDerWaalsContact O-CA 3.22Å; K96-P100 WeakPolarHBondContact O-CA 3.45Å; K96-P100 WeakPolarHBondContact O-CB 3.39Å; P100-F103 WeakPolarHBondContact O-CB 3.48Å; P100-F103 PolarHBondContact O-N 2.88Å; P100-V104 WeakPolarHBondContact O-CG2 3.37Å; P100-V104 PolarHBondContact O-N 3.46Å
101T92.6Very high92.7Very high101 Ų10183.6 Ų83.662%0.6244%0.441SS*.Hα-helixtrans-63.8-46.7178.2-46.30000111.9N99 F103 V104 I105N99-T101 VanDerWaalsContact C-N 3.29Å; N99-T101 PolarHBondContact O-N 3.26Å; T101-F103 VanDerWaalsContact C-N 3.28Å; T101-F103 PolarHBondContact O-N 3.43Å; T101-V104 PolarHBondContact O-N 2.77Å; T101-I105 HydrophobicContact CG2-CD1 4.05Å; T101-I105 WeakPolarHBondContact O-CG1 3.34Å; T101-I105 PolarHBondContact O-N 3.23Å
102L92.8Very high92.5Very high94 Ų9485.3 Ų85.349%0.49244%0.436SS..Hα-helixtrans-64.4-34.9177.3-69.1178.8000112F95 N99 I105 G106F95-L102 HydrophobicContact CE1-CB 4.48Å; F95-L102 HydrophobicContact CZ-CB 3.9Å; N99-L102 HydrophobicContact CB-CB 4.02Å; N99-L102 HydrophobicContact CB-CD1 3.97Å; N99-L102 HydrophobicContact CB-CG 4.25Å; N99-L102 PolarHBondContact O-N 2.89Å; L102-I105 PolarHBondContact O-N 3.28Å; L102-G106 PolarHBondContact O-N 3.39Å
103F93.1Very high92.6Very high28 Ų2888.2 Ų88.212%0.12345%0.446CS..Hα-helixtrans-62-48173.7178.7-97.2000111.5I92 F95 K96 N99 P100 T101 G106 V107I92-F103 HydrophobicContact CG2-CD2 4.46Å; I92-F103 HydrophobicContact CG2-CE2 3.84Å; F95-F103 HydrophobicContact CD1-CB 4.32Å; F95-F103 HydrophobicContact CD1-CD2 4.26Å; F95-F103 HydrophobicContact CE1-CB 4.07Å; F95-F103 HydrophobicContact CE1-CD2 4.5Å; K96-F103 HydrophobicContact CB-CB 4.42Å; K96-F103 HydrophobicContact CB-CD1 4.37Å; K96-F103 HydrophobicContact CB-CD2 4.07Å; K96-F103 HydrophobicContact CB-CE2 4.45Å; K96-F103 HydrophobicContact CB-CG 4.01Å; K96-F103 HydrophobicContact CD-CD1 4.15Å; K96-F103 HydrophobicContact CD-CE1 3.95Å; K96-F103 HydrophobicContact CD-CZ 4.24Å; K96-F103 HydrophobicContact CG-CD1 3.87Å; K96-F103 HydrophobicContact CG-CD2 4.45Å; K96-F103 HydrophobicContact CG-CE1 4.2Å; K96-F103 HydrophobicContact CG-CG 4.01Å; N99-F103 PolarHBondContact O-N 3.33Å; N99-F103 VanDerWaalsContact O-N 3.07Å; P100-F103 WeakPolarHBondContact O-CB 3.48Å; P100-F103 PolarHBondContact O-N 2.88Å; T101-F103 VanDerWaalsContact C-N 3.28Å; T101-F103 PolarHBondContact O-N 3.43Å; F103-G106 PolarHBondContact O-N 3.2Å; F103-V107 HydrophobicContact CD1-CG2 4.43Å; F103-V107 HydrophobicContact CE1-CG2 4.03Å; F103-V107 HydrophobicContact CZ-CG2 4.08Å; F103-V107 WeakPolarHBondContact O-CG2 3.42Å; F103-V107 PolarHBondContact O-N 2.89Å
104V93Very high92.4Very high81 Ų8184.3 Ų84.349%0.49143%0.432SS..Hα-helixtrans-62.4-44.9176.8174.40000111.4P100 T101 G106 V107 M108P100-V104 WeakPolarHBondContact O-CG2 3.37Å; P100-V104 PolarHBondContact O-N 3.46Å; T101-V104 PolarHBondContact O-N 2.77Å; V104-G106 VanDerWaalsContact C-N 3.28Å; V104-G106 PolarHBondContact O-N 3.34Å; V104-V107 PolarHBondContact O-N 3.08Å; V104-M108 HydrophobicContact CG1-CG 4.4Å; V104-M108 HydrophobicContact CG1-SD 4.15Å; V104-M108 WeakPolarHBondContact O-CG 3.41Å; V104-M108 PolarHBondContact O-N 3.13Å
105I94.1Very high92Very high94 Ų9481.4 Ų81.448%0.48242%0.417SS..Hα-helixtrans-57.9-43.4175.3-69.6168.2000110.5T101 L102 M108 A109T101-I105 HydrophobicContact CG2-CD1 4.05Å; T101-I105 WeakPolarHBondContact O-CG1 3.34Å; T101-I105 PolarHBondContact O-N 3.23Å; L102-I105 PolarHBondContact O-N 3.28Å; I105-M108 PolarHBondContact O-N 2.89Å; I105-A109 VanDerWaalsContact O-CB 3.31Å; I105-A109 WeakPolarHBondContact O-CB 3.41Å; I105-A109 PolarHBondContact O-N 3.27Å
106G93.8Very high91.7Very high34 Ų3479.6 Ų79.635%0.35142%0.415SS..Hα-helixtrans-59.3-47.6175.600000112.4L102 F103 V104 M108 A109 T110L102-G106 PolarHBondContact O-N 3.39Å; F103-G106 PolarHBondContact O-N 3.2Å; V104-G106 VanDerWaalsContact C-N 3.28Å; V104-G106 PolarHBondContact O-N 3.34Å; G106-M108 VanDerWaalsContact C-N 3.35Å; G106-M108 PolarHBondContact O-N 3.02Å; G106-A109 PolarHBondContact O-N 3.43Å; G106-T110 WeakPolarHBondContact O-CB 3.49Å; G106-T110 PolarHBondContact O-N 3.47Å; G106-T110 PolarHBondContact O-OG1 3.28Å
107V92.9Very high91.5Very high22 Ų2281.5 Ų81.513%0.13343%0.428CS..Hα-helixtrans-61-42.8176.9174.40000111.6V78 S82 F103 V104 S111V78-V107 HydrophobicContact CG1-CG1 4.42Å; S82-V107 VanDerWaalsContact CB-CG2 3.48Å; S82-V107 WeakPolarHBondContact OG-CG2 3.48Å; F103-V107 HydrophobicContact CD1-CG2 4.43Å; F103-V107 HydrophobicContact CE1-CG2 4.03Å; F103-V107 HydrophobicContact CZ-CG2 4.08Å; F103-V107 WeakPolarHBondContact O-CG2 3.42Å; F103-V107 PolarHBondContact O-N 2.89Å; V104-V107 PolarHBondContact O-N 3.08Å; V107-S111 WeakPolarHBondContact O-CB 3.2Å; V107-S111 PolarHBondContact O-N 2.94Å; V107-S111 PolarHBondContact O-OG 2.95Å
108M90.8Very high90.9Very high129 Ų12977.9 Ų77.964%0.63542%0.418SS*.Hα-helixtrans-64.2-45176.3-69.6-178.372.600111.7V104 I105 G106 S111 Y112V104-M108 HydrophobicContact CG1-CG 4.4Å; V104-M108 HydrophobicContact CG1-SD 4.15Å; V104-M108 WeakPolarHBondContact O-CG 3.41Å; V104-M108 PolarHBondContact O-N 3.13Å; I105-M108 PolarHBondContact O-N 2.89Å; G106-M108 VanDerWaalsContact C-N 3.35Å; G106-M108 PolarHBondContact O-N 3.02Å; M108-S111 PolarHBondContact O-N 3.49Å; M108-Y112 WeakPolarHBondContact O-CB 3.47Å; M108-Y112 PolarHBondContact O-N 2.87Å
109A92.9Very high90.1Very high57 Ų5773 Ų7347%0.47141%0.413SS..Hα-helixtrans-63.8-43.6178.400000111.9I105 G106 Y112 F113I105-A109 VanDerWaalsContact O-CB 3.31Å; I105-A109 WeakPolarHBondContact O-CB 3.41Å; I105-A109 PolarHBondContact O-N 3.27Å; G106-A109 PolarHBondContact O-N 3.43Å; A109-Y112 PolarHBondContact O-N 3.34Å; A109-F113 WeakPolarHBondContact O-CB 3.48Å; A109-F113 PolarHBondContact O-N 3.34Å
110T91.9Very high89.3Confident73 Ų7369.9 Ų69.945%0.44840%0.397SS..Hα-helixtrans-62.4-44.5174.1-58.50000111.2V78 G106 Y112 F113 V114V78-T110 HydrophobicContact CG1-CG2 4.02Å; G106-T110 WeakPolarHBondContact O-CB 3.49Å; G106-T110 PolarHBondContact O-N 3.47Å; G106-T110 PolarHBondContact O-OG1 3.28Å; T110-Y112 PolarHBondContact O-N 2.89Å; T110-F113 PolarHBondContact O-N 2.95Å; T110-V114 HydrophobicContact CG2-CG2 4.3Å; T110-V114 VanDerWaalsContact O-CG2 3.29Å; T110-V114 WeakPolarHBondContact O-CG2 3.37Å; T110-V114 PolarHBondContact O-N 3.49Å
111S89.5Confident88.5Confident14 Ų1467.8 Ų67.810%0.09838%0.383CS..Hα-helixtrans-59.9-46.8177.5-580000111.3V78 V107 M108 V114 L115V78-S111 VanDerWaalsContact CG1-OG 3.3Å; V78-S111 WeakPolarHBondContact CG1-OG 3.37Å; V107-S111 WeakPolarHBondContact O-CB 3.2Å; V107-S111 PolarHBondContact O-N 2.94Å; V107-S111 PolarHBondContact O-OG 2.95Å; M108-S111 PolarHBondContact O-N 3.49Å; S111-V114 PolarHBondContact O-N 3.38Å; S111-L115 WeakPolarHBondContact O-CB 3.34Å; S111-L115 WeakPolarHBondContact O-CG 3.42Å; S111-L115 PolarHBondContact O-N 2.87Å
112Y89Confident87.9Confident152 Ų15268.2 Ų68.260%0.59638%0.381SS*.Hα-helixtrans-60.6-46.9176.2177.9-97.2000112.2M108 A109 T110 V114 L115 S116 V121M108-Y112 WeakPolarHBondContact O-CB 3.47Å; M108-Y112 PolarHBondContact O-N 2.87Å; A109-Y112 PolarHBondContact O-N 3.34Å; T110-Y112 PolarHBondContact O-N 2.89Å; Y112-V114 PolarHBondContact O-N 2.92Å; Y112-L115 PolarHBondContact O-N 3.35Å; Y112-S116 WeakPolarHBondContact O-CB 3.48Å; Y112-S116 PolarHBondContact O-N 3.3Å; Y112-V121 HydrophobicContact CE2-CG1 4.07Å
113F90.8Very high87.1Confident122 Ų12264.1 Ų64.154%0.53536%0.36SS..Hα-helixtrans-58.8-49.5178.5177.4-103.2000111.4A109 T110 L115 S116 L117A109-F113 WeakPolarHBondContact O-CB 3.48Å; A109-F113 PolarHBondContact O-N 3.34Å; T110-F113 PolarHBondContact O-N 2.95Å; F113-L115 PolarHBondContact O-N 3.32Å; F113-S116 WeakPolarHBondContact O-CB 3.26Å; F113-S116 PolarHBondContact O-N 3.46Å; F113-S116 VanDerWaalsContact O-N 3.15Å; F113-S116 PolarHBondContact O-OG 2.98Å; F113-L117 HydrophobicContact CD1-CD1 4.43Å; F113-L117 HydrophobicContact CE1-CD1 3.91Å; F113-L117 HydrophobicContact CZ-CD1 4.29Å; F113-L117 HydrophobicContact CZ-CD2 4.41Å; F113-L117 PolarHBondContact O-N 3.19Å
114V88.7Confident86.3Confident35 Ų3565.1 Ų65.121%0.21236%0.364CS..Hα-helixtrans-63.8-43.7179.5-1790000110.8V74 V78 T110 S111 Y112 S116 L117 F118V74-V114 HydrophobicContact CG1-CB 3.89Å; V74-V114 HydrophobicContact CG1-CG1 3.45Å; V74-V114 VanDerWaalsContact CG1-CG1 3.45Å; V74-V114 HydrophobicContact CG2-CG1 4.29Å; V78-V114 HydrophobicContact CG2-CG2 4.47Å; T110-V114 HydrophobicContact CG2-CG2 4.3Å; T110-V114 VanDerWaalsContact O-CG2 3.29Å; T110-V114 WeakPolarHBondContact O-CG2 3.37Å; T110-V114 PolarHBondContact O-N 3.49Å; S111-V114 PolarHBondContact O-N 3.38Å; Y112-V114 PolarHBondContact O-N 2.92Å; V114-S116 PolarHBondContact O-N 2.94Å; V114-L117 WeakPolarHBondContact O-CB 3.46Å; V114-L117 PolarHBondContact O-N 2.84Å; V114-L117 VanDerWaalsContact O-N 3.13Å; V114-F118 HydrophobicContact CG1-CD2 3.98Å; V114-F118 HydrophobicContact CG1-CE2 3.67Å; V114-F118 WeakPolarHBondContact O-CD2 3.31Å; V114-F118 PolarHBondContact O-N 2.85Å
115L87Confident85.7Confident13 Ų1365.1 Ų65.17%0.06836%0.36CS..Hα-helixtrans-59.7-34.4175.5-73.6172.6000112.9V74 V75 S111 Y112 F113 L117 F118 G119 G120 V121 F124V74-L115 HydrophobicContact CB-CD2 4Å; V74-L115 HydrophobicContact CG1-CD2 3.84Å; V74-L115 HydrophobicContact CG1-CG 4.02Å; V75-L115 HydrophobicContact CG2-CD1 3.85Å; V75-L115 HydrophobicContact CG2-CD2 4.43Å; V75-L115 HydrophobicContact CG2-CG 4.42Å; S111-L115 WeakPolarHBondContact O-CB 3.34Å; S111-L115 WeakPolarHBondContact O-CG 3.42Å; S111-L115 PolarHBondContact O-N 2.87Å; Y112-L115 PolarHBondContact O-N 3.35Å; F113-L115 PolarHBondContact O-N 3.32Å; L115-L117 VanDerWaalsContact C-N 3.32Å; L115-L117 PolarHBondContact O-N 3.13Å; L115-F118 PolarHBondContact O-N 3.44Å; L115-G119 PolarHBondContact O-N 3.45Å; L115-G120 PolarHBondContact O-N 3.36Å; L115-G120 VanDerWaalsContact O-N 3.08Å; L115-V121 HydrophobicContact CB-CG2 4.25Å; L115-F124 HydrophobicContact CD1-CD2 3.7Å; L115-F124 HydrophobicContact CD1-CE2 3.68Å; L115-F124 HydrophobicContact CD1-CG 4.46Å; L115-F124 HydrophobicContact CD1-CZ 4.45Å; L115-F124 HydrophobicContact CD2-CD2 4.13Å; L115-F124 HydrophobicContact CD2-CE2 3.6Å; L115-F124 HydrophobicContact CG-CE2 4.31Å
116S86.3Confident85.2Confident53 Ų5365.5 Ų65.537%0.37136%0.359SS..Hα-helixtrans-66.3-33.1177.778.80000112.8Y112 F113 V114 F118 G119Y112-S116 WeakPolarHBondContact O-CB 3.48Å; Y112-S116 PolarHBondContact O-N 3.3Å; F113-S116 WeakPolarHBondContact O-CB 3.26Å; F113-S116 PolarHBondContact O-N 3.46Å; F113-S116 VanDerWaalsContact O-N 3.15Å; F113-S116 PolarHBondContact O-OG 2.98Å; V114-S116 PolarHBondContact O-N 2.94Å; S116-F118 VanDerWaalsContact C-N 3.29Å; S116-F118 PolarHBondContact O-N 3.22Å; S116-G119 PolarHBondContact O-N 2.95Å
117L86.9Confident84.8Confident115 Ų11564.1 Ų64.160%0.60234%0.344SS*.Hα-helixtrans-66.9-31.4175.5-61.5176.7000112.6F113 V114 L115F113-L117 HydrophobicContact CD1-CD1 4.43Å; F113-L117 HydrophobicContact CE1-CD1 3.91Å; F113-L117 HydrophobicContact CZ-CD1 4.29Å; F113-L117 HydrophobicContact CZ-CD2 4.41Å; F113-L117 PolarHBondContact O-N 3.19Å; V114-L117 WeakPolarHBondContact O-CB 3.46Å; V114-L117 PolarHBondContact O-N 2.84Å; V114-L117 VanDerWaalsContact O-N 3.13Å; L115-L117 VanDerWaalsContact C-N 3.32Å; L115-L117 PolarHBondContact O-N 3.13Å
118F81.6Confident84.4Confident117 Ų11767.2 Ų67.251%0.51336%0.359SS..THydrogen-bonded Turntrans-96.13.9-178.7-66.6-71.1000113.7L70 V74 V114 L115 S116 G120L70-F118 HydrophobicContact CD2-CB 3.88Å; L70-F118 HydrophobicContact CD2-CD1 4.19Å; L70-F118 HydrophobicContact CD2-CG 4.23Å; L70-F118 HydrophobicContact CG-CB 4.46Å; V74-F118 HydrophobicContact CG2-CD2 4.02Å; V74-F118 HydrophobicContact CG2-CE2 4.22Å; V114-F118 HydrophobicContact CG1-CD2 3.98Å; V114-F118 HydrophobicContact CG1-CE2 3.67Å; V114-F118 WeakPolarHBondContact O-CD2 3.31Å; V114-F118 PolarHBondContact O-N 2.85Å; L115-F118 PolarHBondContact O-N 3.44Å; S116-F118 VanDerWaalsContact C-N 3.29Å; S116-F118 PolarHBondContact O-N 3.22Å; F118-G120 PolarHBondContact O-N 3.18Å; F118-G120 VanDerWaalsContact O-N 3.13Å
119G77.1Confident84.2Confident56 Ų5664.3 Ų64.358%0.57735%0.349SS*.THydrogen-bonded Turntrans64.812-176.800000114.5L115 S116 V121L115-G119 PolarHBondContact O-N 3.45Å; S116-G119 PolarHBondContact O-N 2.95Å; G119-V121 PolarHBondContact O-N 2.79Å
120G77.8Confident84.1Confident5 Ų565.6 Ų65.65%0.05234%0.344CS..THydrogen-bonded Turntrans-77.1-3.9-175.600000114.5L115 F118 L122 V123L115-G120 PolarHBondContact O-N 3.36Å; L115-G120 VanDerWaalsContact O-N 3.08Å; F118-G120 PolarHBondContact O-N 3.18Å; F118-G120 VanDerWaalsContact O-N 3.13Å; G120-L122 VanDerWaalsContact C-N 3.33Å; G120-L122 PolarHBondContact O-N 3Å; G120-V123 PolarHBondContact O-N 3.3Å
121V76.3Confident84Confident29 Ų2962.3 Ų62.318%0.17632%0.324CS..Hα-helixtrans-60-41.4-173.9-179.90000111.9Y112 L115 G119 V123 F124 I125Y112-V121 HydrophobicContact CE2-CG1 4.07Å; L115-V121 HydrophobicContact CB-CG2 4.25Å; G119-V121 PolarHBondContact O-N 2.79Å; V121-V123 VanDerWaalsContact C-N 3.29Å; V121-V123 PolarHBondContact O-N 3.42Å; V121-F124 PolarHBondContact O-N 3.17Å; V121-I125 HydrophobicContact CG1-CD1 3.66Å; V121-I125 HydrophobicContact CG1-CG1 4.14Å; V121-I125 WeakPolarHBondContact O-CG1 3.32Å; V121-I125 PolarHBondContact O-N 2.98Å
122L78.8Confident84Confident110 Ų11066.2 Ų66.258%0.57634%0.343SS*.Hα-helixtrans-62.8-36-178.5-68.6178000112.3G120 F124 I125 F126G120-L122 VanDerWaalsContact C-N 3.33Å; G120-L122 PolarHBondContact O-N 3Å; L122-F124 VanDerWaalsContact C-N 3.29Å; L122-F124 PolarHBondContact O-N 3.45Å; L122-I125 PolarHBondContact O-N 3.2Å; L122-F126 HydrophobicContact CB-CD2 4.41Å; L122-F126 HydrophobicContact CD2-CE2 4.3Å; L122-F126 WeakPolarHBondContact O-CB 3.46Å; L122-F126 VanDerWaalsContact O-CD2 3.28Å; L122-F126 WeakPolarHBondContact O-CD2 2.93Å; L122-F126 PolarHBondContact O-N 3.27Å
123V77.3Confident84.2Confident7 Ų763.3 Ų63.34%0.04234%0.337CS..Hα-helixtrans-64.5-36.3179.2-179.10000111.1V60 N64 M68 G120 V121 G127V60-V123 HydrophobicContact CG1-CG1 4.32Å; N64-V123 HydrophobicContact CB-CG2 4.13Å; M68-V123 HydrophobicContact CB-CG1 4.15Å; M68-V123 HydrophobicContact SD-CG1 4.11Å; G120-V123 PolarHBondContact O-N 3.3Å; V121-V123 VanDerWaalsContact C-N 3.29Å; V121-V123 PolarHBondContact O-N 3.42Å; V123-G127 VanDerWaalsContact O-CA 3.27Å; V123-G127 WeakPolarHBondContact O-CA 3.5Å; V123-G127 PolarHBondContact O-N 3.21Å
124F75.3Confident84.3Confident50 Ų5060.4 Ų60.422%0.21933%0.327CS..Hα-helixtrans-77.2-38175.3-76.4-79.3000113.1G71 V75 L115 V121 L122 G127 I128G71-F124 VanDerWaalsContact CA-CE2 3.49Å; V75-F124 HydrophobicContact CG2-CE1 4.27Å; V75-F124 HydrophobicContact CG2-CE2 4.17Å; V75-F124 HydrophobicContact CG2-CZ 3.68Å; L115-F124 HydrophobicContact CD1-CD2 3.7Å; L115-F124 HydrophobicContact CD1-CE2 3.68Å; L115-F124 HydrophobicContact CD1-CG 4.46Å; L115-F124 HydrophobicContact CD1-CZ 4.45Å; L115-F124 HydrophobicContact CD2-CD2 4.13Å; L115-F124 HydrophobicContact CD2-CE2 3.6Å; L115-F124 HydrophobicContact CG-CE2 4.31Å; V121-F124 PolarHBondContact O-N 3.17Å; L122-F124 VanDerWaalsContact C-N 3.29Å; L122-F124 PolarHBondContact O-N 3.45Å; F124-G127 PolarHBondContact O-N 3.32Å; F124-I128 HydrophobicContact CD1-CD1 3.9Å; F124-I128 WeakPolarHBondContact O-CB 3.46Å; F124-I128 PolarHBondContact O-N 3.29Å
125I81.9Confident84.5Confident80 Ų8059.7 Ų59.741%0.4132%0.322SS..Iπ-helixtrans-60.1-49.5174.4-68.9175.8000110V121 L122 T129 F130V121-I125 HydrophobicContact CG1-CD1 3.66Å; V121-I125 HydrophobicContact CG1-CG1 4.14Å; V121-I125 WeakPolarHBondContact O-CG1 3.32Å; V121-I125 PolarHBondContact O-N 2.98Å; L122-I125 PolarHBondContact O-N 3.2Å; I125-T129 WeakPolarHBondContact O-CA 3.26Å; I125-T129 WeakPolarHBondContact O-CB 3.27Å; I125-T129 PolarHBondContact O-N 2.95Å; I125-F130 PolarHBondContact O-N 3.41Å; I125-F130 VanDerWaalsContact O-N 3.12Å
126F83.5Confident84.7Confident103 Ų10363 Ų6345%0.45234%0.34SS..Iπ-helixtrans-77.1-29.9178.9-76.3-74.8000113.2V60 L122 F130 P131V60-F126 HydrophobicContact CG1-CB 4.18Å; V60-F126 HydrophobicContact CG2-CB 4.17Å; L122-F126 HydrophobicContact CB-CD2 4.41Å; L122-F126 HydrophobicContact CD2-CE2 4.3Å; L122-F126 WeakPolarHBondContact O-CB 3.46Å; L122-F126 VanDerWaalsContact O-CD2 3.28Å; L122-F126 WeakPolarHBondContact O-CD2 2.93Å; L122-F126 PolarHBondContact O-N 3.27Å; F126-F130 HydrophobicContact CD1-CB 4.19Å; F126-F130 HydrophobicContact CD1-CG 4.31Å; F126-F130 WeakPolarHBondContact O-CB 3.27Å; F126-P131 WeakPolarHBondContact O-CD 3.21Å
127G84.7Confident84.9Confident4 Ų464.9 Ų64.94%0.04134%0.344CS..Iπ-helixtrans-76.3-26.2179.800000113.9F57 V123 F124 P131F57-G127 WeakPolarHBondContact CD2-O 3.38Å; V123-G127 VanDerWaalsContact O-CA 3.27Å; V123-G127 WeakPolarHBondContact O-CA 3.5Å; V123-G127 PolarHBondContact O-N 3.21Å; F124-G127 PolarHBondContact O-N 3.32Å; G127-P131 WeakPolarHBondContact O-CG 3.38Å
128I84Confident85.2Confident87 Ų8760.3 Ų60.345%0.44632%0.32SS..Iπ-helixtrans-120.3-57.2-175.5-56.3178000111.1F124 F130 P131 L132F124-I128 HydrophobicContact CD1-CD1 3.9Å; F124-I128 WeakPolarHBondContact O-CB 3.46Å; F124-I128 PolarHBondContact O-N 3.29Å; I128-F130 PolarHBondContact O-N 2.98Å; I128-P131 WeakPolarHBondContact O-CD 3.47Å; I128-L132 HydrophobicContact CG2-CD1 4.15Å; I128-L132 WeakPolarHBondContact O-CG 3.14Å; I128-L132 PolarHBondContact O-N 3.03Å
129T87.1Confident85.5Confident68 Ų6854.7 Ų54.742%0.41730%0.295SS..Iπ-helixtrans-65.9-41.7-174.1-49.50000111.8I125 L132 L133I125-T129 WeakPolarHBondContact O-CA 3.26Å; I125-T129 WeakPolarHBondContact O-CB 3.27Å; I125-T129 PolarHBondContact O-N 2.95Å; T129-L132 PolarHBondContact O-N 3.18Å; T129-L133 HydrophobicContact CG2-CD1 4.2Å; T129-L133 HydrophobicContact CG2-CG 4.39Å; T129-L133 WeakPolarHBondContact O-CG 3.28Å; T129-L133 PolarHBondContact O-N 3.37Å
130F89.6Confident86.1Confident84 Ų8452.7 Ų52.737%0.36827%0.272SS..Hα-helixtrans-63.8-47.5-179-179.3-110000113.4V56 I125 F126 I128 L132 L133 L134V56-F130 HydrophobicContact CG1-CD1 3.75Å; V56-F130 HydrophobicContact CG1-CE1 4.17Å; I125-F130 PolarHBondContact O-N 3.41Å; I125-F130 VanDerWaalsContact O-N 3.12Å; F126-F130 HydrophobicContact CD1-CB 4.19Å; F126-F130 HydrophobicContact CD1-CG 4.31Å; F126-F130 WeakPolarHBondContact O-CB 3.27Å; I128-F130 PolarHBondContact O-N 2.98Å; F130-L132 VanDerWaalsContact C-N 3.32Å; F130-L132 PolarHBondContact O-N 3.19Å; F130-L133 PolarHBondContact O-N 3.03Å; F130-L134 HydrophobicContact CD1-CD1 4.14Å; F130-L134 HydrophobicContact CE1-CD1 3.64Å; F130-L134 HydrophobicContact CE1-CG 4.24Å; F130-L134 HydrophobicContact CE2-CD2 4.26Å; F130-L134 HydrophobicContact CE2-CG 4.33Å; F130-L134 HydrophobicContact CZ-CD1 3.89Å; F130-L134 HydrophobicContact CZ-CD2 4.08Å; F130-L134 HydrophobicContact CZ-CG 4.11Å; F130-L134 WeakPolarHBondContact O-CG 3.46Å; F130-L134 PolarHBondContact O-N 3.03Å
131P90.4Very high86.4Confident4 Ų455 Ų553%0.02628%0.283CS..Hα-helixtrans-51.3-45.7168.4-31.433.7000114.5A53 V56 F126 G127 I128 L133 L134 I135A53-P131 HydrophobicContact CB-CB 3.93Å; V56-P131 HydrophobicContact CB-CG 4.02Å; V56-P131 HydrophobicContact CG1-CG 3.66Å; F126-P131 WeakPolarHBondContact O-CD 3.21Å; G127-P131 WeakPolarHBondContact O-CG 3.38Å; I128-P131 WeakPolarHBondContact O-CD 3.47Å; P131-L133 VanDerWaalsContact C-N 3.33Å; P131-L133 PolarHBondContact O-N 3.46Å; P131-L134 PolarHBondContact O-N 3.49Å; P131-I135 WeakPolarHBondContact O-CD1 3.47Å; P131-I135 VanDerWaalsContact O-CG1 3.22Å; P131-I135 WeakPolarHBondContact O-CG1 3.22Å; P131-I135 PolarHBondContact O-N 2.9Å
132L90.9Very high86.9Confident97 Ų9753.7 Ų53.751%0.50828%0.275SS..Hα-helixtrans-62.8-41.1179.3-68.8173.2000111.6I128 T129 F130 I135 L136I128-L132 HydrophobicContact CG2-CD1 4.15Å; I128-L132 WeakPolarHBondContact O-CG 3.14Å; I128-L132 PolarHBondContact O-N 3.03Å; T129-L132 PolarHBondContact O-N 3.18Å; F130-L132 VanDerWaalsContact C-N 3.32Å; F130-L132 PolarHBondContact O-N 3.19Å; L132-I135 PolarHBondContact O-N 2.95Å; L132-L136 WeakPolarHBondContact O-CG 3.42Å; L132-L136 PolarHBondContact O-N 3.16Å
133L92.2Very high86.5Confident90 Ų9051.4 Ų51.447%0.47126%0.261SS..Hα-helixtrans-62.5-44.8174.7-70.7172.6000111.7T129 F130 P131 I135 L136 I137T129-L133 HydrophobicContact CG2-CD1 4.2Å; T129-L133 HydrophobicContact CG2-CG 4.39Å; T129-L133 WeakPolarHBondContact O-CG 3.28Å; T129-L133 PolarHBondContact O-N 3.37Å; F130-L133 PolarHBondContact O-N 3.03Å; P131-L133 VanDerWaalsContact C-N 3.33Å; P131-L133 PolarHBondContact O-N 3.46Å; L133-I135 VanDerWaalsContact C-N 3.32Å; L133-I135 PolarHBondContact O-N 3.18Å; L133-L136 PolarHBondContact O-N 3.33Å; L133-I137 WeakPolarHBondContact O-CB 3.19Å; L133-I137 WeakPolarHBondContact O-CG1 3.28Å; L133-I137 PolarHBondContact O-N 3.35Å
134L92.3Very high85.8Confident61 Ų6152.9 Ų52.932%0.31927%0.266SS..Hα-helixtrans-60.2-43.1176.7-69179.9000111.8V56 F130 P131 I137 H138V56-L134 HydrophobicContact CG2-CD1 4.09Å; F130-L134 HydrophobicContact CD1-CD1 4.14Å; F130-L134 HydrophobicContact CE1-CD1 3.64Å; F130-L134 HydrophobicContact CE1-CG 4.24Å; F130-L134 HydrophobicContact CE2-CD2 4.26Å; F130-L134 HydrophobicContact CE2-CG 4.33Å; F130-L134 HydrophobicContact CZ-CD1 3.89Å; F130-L134 HydrophobicContact CZ-CD2 4.08Å; F130-L134 HydrophobicContact CZ-CG 4.11Å; F130-L134 WeakPolarHBondContact O-CG 3.46Å; F130-L134 PolarHBondContact O-N 3.03Å; P131-L134 PolarHBondContact O-N 3.49Å; L134-I137 PolarHBondContact O-N 3.34Å; L134-H138 VanDerWaalsContact O-CB 3.3Å; L134-H138 WeakPolarHBondContact O-CB 3.47Å; L134-H138 PolarHBondContact O-N 2.81Å
135I93.7Very high84.8Confident21 Ų2156.9 Ų56.911%0.10829%0.29CS..Hα-helixtrans-60.4-47.9176.1-69.1164.6000110.6L42 Y49 A53 P131 L132 L133 H138 A139L42-I135 HydrophobicContact CD2-CG2 3.5Å; L42-I135 VanDerWaalsContact CD2-CG2 3.5Å; Y49-I135 HydrophobicContact CD1-CB 3.99Å; Y49-I135 HydrophobicContact CD1-CG1 3.67Å; Y49-I135 HydrophobicContact CD1-CG2 3.66Å; Y49-I135 HydrophobicContact CD2-CG2 4.09Å; Y49-I135 HydrophobicContact CE1-CB 4.4Å; Y49-I135 HydrophobicContact CE1-CG2 3.97Å; Y49-I135 HydrophobicContact CE2-CG2 4.4Å; Y49-I135 HydrophobicContact CG-CB 4.4Å; Y49-I135 HydrophobicContact CG-CG1 4.02Å; Y49-I135 HydrophobicContact CG-CG2 3.71Å; A53-I135 HydrophobicContact CB-CD1 4.25Å; P131-I135 WeakPolarHBondContact O-CD1 3.47Å; P131-I135 VanDerWaalsContact O-CG1 3.22Å; P131-I135 WeakPolarHBondContact O-CG1 3.22Å; P131-I135 PolarHBondContact O-N 2.9Å; L132-I135 PolarHBondContact O-N 2.95Å; L133-I135 VanDerWaalsContact C-N 3.32Å; L133-I135 PolarHBondContact O-N 3.18Å; I135-H138 PolarHBondContact O-N 3.07Å; I135-A139 VanDerWaalsContact O-CB 3.28Å; I135-A139 WeakPolarHBondContact O-CB 3.4Å; I135-A139 PolarHBondContact O-N 2.98Å
136L91.3Very high83.2Confident83 Ų8359.7 Ų59.744%0.43530%0.303SS..Hα-helixtrans-66.1-40.3-179.9-72.6176000112.4V38 L132 L133 S140V38-L136 HydrophobicContact CG1-CD2 4.48Å; L132-L136 WeakPolarHBondContact O-CG 3.42Å; L132-L136 PolarHBondContact O-N 3.16Å; L133-L136 PolarHBondContact O-N 3.33Å; L136-S140 WeakPolarHBondContact O-CB 3.34Å; L136-S140 PolarHBondContact O-N 3.32Å; L136-S140 PolarHBondContact O-OG 2.95Å
137I91Very high81.4Confident92 Ų9263.5 Ų63.547%0.47232%0.319SS..Hα-helixtrans-60.7-50.2174.5-71.3166.2000109.4L133 L134 A139 S140 L141L133-I137 WeakPolarHBondContact O-CB 3.19Å; L133-I137 WeakPolarHBondContact O-CG1 3.28Å; L133-I137 PolarHBondContact O-N 3.35Å; L134-I137 PolarHBondContact O-N 3.34Å; I137-A139 PolarHBondContact O-N 2.99Å; I137-S140 PolarHBondContact O-N 3.38Å; I137-L141 HydrophobicContact CG2-CD1 3.63Å; I137-L141 HydrophobicContact CG2-CG 4.33Å; I137-L141 WeakPolarHBondContact O-CB 3.44Å; I137-L141 VanDerWaalsContact O-CG 3.26Å; I137-L141 WeakPolarHBondContact O-CG 3.34Å; I137-L141 PolarHBondContact O-N 3.35Å
138H91.6Very high79.8Confident18 Ų1864.7 Ų64.78%0.08333%0.325CS..Hα-helixtrans-59.5-49.8178.9-176.5-87.6000111.8F16 F23 Y49 L134 I135 S140 L141 R142F16-H138 AromaticContact CD2-CE1 3.46Å; F16-H138 VanDerWaalsContact CD2-CE1 3.46Å; F16-H138 WeakPolarHBondContact CD2-CE1 3.27Å; F16-H138 AromaticContact CD2-NE2 3.99Å; F16-H138 AromaticContact CE2-CE1 3.27Å; F16-H138 WeakPolarHBondContact CE2-CE1 3.19Å; F16-H138 AromaticContact CE2-ND1 3.56Å; F16-H138 AromaticContact CE2-NE2 3.93Å; F16-H138 AromaticContact CZ-CE1 3.8Å; F16-H138 AromaticContact CZ-ND1 3.9Å; F16-H138 PolarHBondContact O-CE1 3.14Å; F16-H138 PolarHBondContact O-NE2 3.13Å; F23-H138 AromaticContact CE1-CD2 3.99Å; F23-H138 AromaticContact CE1-NE2 3.95Å; Y49-H138 HydrophobicContact CE1-CB 3.99Å; Y49-H138 AromaticContact CE1-CG 3.88Å; Y49-H138 AromaticContact CE1-ND1 3.34Å; Y49-H138 VanDerWaalsContact CE1-ND1 3.34Å; Y49-H138 WeakPolarHBondContact CE1-ND1 3.4Å; Y49-H138 AromaticContact CZ-ND1 3.52Å; Y49-H138 PolarHBondContact OH-ND1 2.87Å; L134-H138 VanDerWaalsContact O-CB 3.3Å; L134-H138 WeakPolarHBondContact O-CB 3.47Å; L134-H138 PolarHBondContact O-N 2.81Å; I135-H138 PolarHBondContact O-N 3.07Å; H138-S140 VanDerWaalsContact C-N 3.26Å; H138-S140 PolarHBondContact O-N 3.32Å; H138-L141 PolarHBondContact O-N 3.39Å; H138-R142 VanDerWaalsContact O-CB 3.26Å; H138-R142 WeakPolarHBondContact O-CB 3.36Å; H138-R142 PolarHBondContact O-N 3.19Å
139A89.3Confident78.1Confident0 Ų068.9 Ų68.90%034%0.335CS..Hα-helixtrans-61.4-34.2178.100000112.6V38 N41 L42 Y49 I135 I137V38-A139 HydrophobicContact CG1-CB 4.13Å; N41-A139 HydrophobicContact CB-CB 4.08Å; N41-A139 PolarHBondContact ND2-O 3.37Å; L42-A139 HydrophobicContact CD2-CB 4.05Å; L42-A139 HydrophobicContact CG-CB 4.1Å; Y49-A139 WeakPolarHBondContact OH-CA 3.37Å; I135-A139 VanDerWaalsContact O-CB 3.28Å; I135-A139 WeakPolarHBondContact O-CB 3.4Å; I135-A139 PolarHBondContact O-N 2.98Å; I137-A139 PolarHBondContact O-N 2.99Å
140S88.3Confident76.4Confident13 Ų1371.8 Ų71.89%0.09135%0.347CS..Hα-helixtrans-73.1-38.3177.9-65.40000112.9W34 K37 L136 I137 H138W34-S140 WeakPolarHBondContact CZ2-OG 3.36Å; W34-S140 PolarHBondContact NE1-OG 3.16Å; K37-S140 VanDerWaalsContact CE-O 3.25Å; K37-S140 WeakPolarHBondContact CE-O 3.29Å; K37-S140 PolarHBondContact NZ-O 2.94Å; L136-S140 WeakPolarHBondContact O-CB 3.34Å; L136-S140 PolarHBondContact O-N 3.32Å; L136-S140 PolarHBondContact O-OG 2.95Å; I137-S140 PolarHBondContact O-N 3.38Å; H138-S140 VanDerWaalsContact C-N 3.26Å; H138-S140 PolarHBondContact O-N 3.32Å
141L86Confident74.4Confident54 Ų5473.7 Ų73.728%0.28336%0.357SS..Hα-helixtrans-84.8-37.8-174.5-65.2176.1000112.4F23 S24 P26 K37 I137 H138 Q143F23-L141 HydrophobicContact CD1-CB 3.78Å; S24-L141 PolarHBondContact N-O 3.25Å; S24-L141 WeakPolarHBondContact O-CA 3.41Å; S24-L141 WeakPolarHBondContact O-CD2 3.3Å; P26-L141 HydrophobicContact CG-CD2 4.3Å; K37-L141 PolarHBondContact NZ-O 3.45Å; I137-L141 HydrophobicContact CG2-CD1 3.63Å; I137-L141 HydrophobicContact CG2-CG 4.33Å; I137-L141 WeakPolarHBondContact O-CB 3.44Å; I137-L141 VanDerWaalsContact O-CG 3.26Å; I137-L141 WeakPolarHBondContact O-CG 3.34Å; I137-L141 PolarHBondContact O-N 3.35Å; H138-L141 PolarHBondContact O-N 3.39Å; L141-Q143 PolarHBondContact O-N 3.46Å; L141-Q143 VanDerWaalsContact O-N 3.1Å
142R84.8Confident72.6Confident1 Ų174.5 Ų74.50%0.00436%0.361CS..BIsolated β-bridgetrans-59.7112.3-173.3-175.873.2-179.281.86.3112.4D15 F23 K37 N41 Y45 H138D15-R142 PolarHBondContact O-NE 2.86Å; D15-R142 VanDerWaalsContact O-NE 3.09Å; D15-R142 PolarHBondContact O-NH2 3.46Å; D15-R142 IonicContact OD1-NH2 3.59Å; D15-R142 PolarHBondContact OD1-NH2 3.14Å; F23-R142 HydrophobicContact CE1-CB 4.31Å; K37-R142 VanDerWaalsContact CE-C 3.49Å; K37-R142 WeakPolarHBondContact CE-O 3.2Å; N41-R142 PolarHBondContact ND2-O 3.35Å; Y45-R142 HydrophobicContact CE2-CG 4.05Å; Y45-R142 PolarHBondContact OH-NE 3.41Å; Y45-R142 PolarHBondContact OH-NH2 2.91Å; H138-R142 VanDerWaalsContact O-CB 3.26Å; H138-R142 WeakPolarHBondContact O-CB 3.36Å; H138-R142 PolarHBondContact O-N 3.19Å
143Q70.6Confident70.9Confident62 Ų6277.1 Ų77.129%0.2937%0.369SS..  trans-89.4120.2177.4-79.5-65.2-13.100111.5R22 S24 L141R22-Q143 PolarHBondContact O-N 2.98Å; S24-Q143 WeakPolarHBondContact OG-CG 3.42Å; S24-Q143 PolarHBondContact OG-NE2 3.12Å; L141-Q143 PolarHBondContact O-N 3.46Å; L141-Q143 VanDerWaalsContact O-N 3.1Å
144R64.2Low69.1Low38 Ų3879.3 Ų79.314%0.14338%0.379CS..  trans-11399.8178.7-162.4174.675163.64.2109.4S40 Y44 N148 N152S40-R144 PolarHBondContact OG-NH2 3Å; Y44-R144 VanDerWaalsContact CG-NH1 3.27Å; R144-N148 HydrophobicContact CG-CB 3.54Å; R144-N152 VanDerWaalsContact CZ-CG 3.41Å; R144-N152 VanDerWaalsContact CZ-OD1 3.29Å; R144-N152 PolarHBondContact NH1-ND2 3.43Å; R144-N152 PolarHBondContact NH1-OD1 2.7Å; R144-N152 PolarHBondContact NH2-ND2 3.45Å; R144-N152 PolarHBondContact NH2-OD1 3.29Å
145N54.2Low67.2Low135 Ų13579.5 Ų79.572%0.72238%0.378SS*.  trans-64.7151.1179.2-107.4-13.9000111.6K147 N148N145-K147 PolarHBondContact O-N 3.4Å; N145-N148 PolarHBondContact O-N 2.82Å; N145-N148 VanDerWaalsContact O-N 3.08Å
146M48.4Very low65.2Low139 Ų13982.5 Ų82.569%0.68540%0.395SS*.THydrogen-bonded Turntrans-47.6-17.9-171.8-89.715053.200117.5N148 R149M146-N148 VanDerWaalsContact C-N 3.29Å; M146-N148 PolarHBondContact O-N 2.92Å; M146-R149 WeakPolarHBondContact O-CB 3.43Å; M146-R149 PolarHBondContact O-N 3.35Å
147K44.1Very low63.4Low183 Ų18384.1 Ų84.180%0.79641%0.408SS*.Hα-helixtrans-60.1-37.4172.9-100.2-178.3172.1-176.10112.5N145 R149 L150N145-K147 PolarHBondContact O-N 3.4Å; K147-R149 VanDerWaalsContact C-N 3.32Å; K147-R149 PolarHBondContact O-N 3.2Å; K147-L150 PolarHBondContact O-N 3.24Å
148N50.9Low61.6Low28 Ų2882 Ų8215%0.1541%0.408CS..Hα-helixtrans-74.7-20.1174.5-63.336.5000112R144 N145 M146 L150 E151 N152R144-N148 HydrophobicContact CG-CB 3.54Å; N145-N148 PolarHBondContact O-N 2.82Å; N145-N148 VanDerWaalsContact O-N 3.08Å; M146-N148 VanDerWaalsContact C-N 3.29Å; M146-N148 PolarHBondContact O-N 2.92Å; N148-L150 PolarHBondContact O-N 2.84Å; N148-E151 PolarHBondContact O-N 3.27Å; N148-N152 VanDerWaalsContact O-CB 3.26Å; N148-N152 WeakPolarHBondContact O-CB 3.25Å; N148-N152 PolarHBondContact O-N 2.95Å; N148-N152 PolarHBondContact O-ND2 3.45Å
149R49.4Very low59.7Low176 Ų17683 Ų8366%0.66441%0.414SS*.Hα-helixtrans-63.6-30.6175.6-78.8-176.1164.1-163.9-5.9112M146 K147 K153M146-R149 WeakPolarHBondContact O-CB 3.43Å; M146-R149 PolarHBondContact O-N 3.35Å; K147-R149 VanDerWaalsContact C-N 3.32Å; K147-R149 PolarHBondContact O-N 3.2Å; R149-K153 PolarHBondContact O-N 2.85Å
150L50.3Low57.9Low128 Ų12890 Ų9067%0.6745%0.445SS*.Hα-helixtrans-77.5-42.7177-82163.4000112.4K147 N148 N152 K153K147-L150 PolarHBondContact O-N 3.24Å; N148-L150 PolarHBondContact O-N 2.84Å; L150-N152 VanDerWaalsContact C-N 3.28Å; L150-N152 PolarHBondContact O-N 3.26Å; L150-K153 PolarHBondContact O-N 2.94Å
151E49.2Very low56.4Low125 Ų12596 Ų9658%0.58447%0.469SS*.Hα-helixtrans-63.4-34.5170.2-83.1175.2149.200112N148 K153 I154 E155N148-E151 PolarHBondContact O-N 3.27Å; E151-K153 VanDerWaalsContact C-N 3.35Å; E151-K153 PolarHBondContact O-N 3.37Å; E151-I154 WeakPolarHBondContact O-CB 3.5Å; E151-I154 PolarHBondContact O-N 3.44Å; E151-E155 PolarHBondContact O-N 3.34Å; E151-E155 VanDerWaalsContact O-N 3.17Å
152N51.3Low55.3Low21 Ų2194.1 Ų94.111%0.11246%0.46CS..Hα-helixtrans-71.7-25.4177.5-83.8-110.1000113.4R144 N148 L150 I154 E155 D156R144-N152 VanDerWaalsContact CZ-CG 3.41Å; R144-N152 VanDerWaalsContact CZ-OD1 3.29Å; R144-N152 PolarHBondContact NH1-ND2 3.43Å; R144-N152 PolarHBondContact NH1-OD1 2.7Å; R144-N152 PolarHBondContact NH2-ND2 3.45Å; R144-N152 PolarHBondContact NH2-OD1 3.29Å; N148-N152 VanDerWaalsContact O-CB 3.26Å; N148-N152 WeakPolarHBondContact O-CB 3.25Å; N148-N152 PolarHBondContact O-N 2.95Å; N148-N152 PolarHBondContact O-ND2 3.45Å; L150-N152 VanDerWaalsContact C-N 3.28Å; L150-N152 PolarHBondContact O-N 3.26Å; N152-I154 PolarHBondContact O-N 3.04Å; N152-E155 CarbonylContact O-C 3.3Å; N152-E155 PolarHBondContact O-N 2.9Å; N152-D156 WeakPolarHBondContact O-CB 3.44Å; N152-D156 PolarHBondContact O-N 3.46Å
153K55Low54.1Low152 Ų15296.9 Ų96.966%0.66148%0.478SS*.Hα-helixtrans-70.4-22.7173.9-135175.4-167.5-69.30112.1R149 L150 E151R149-K153 PolarHBondContact O-N 2.85Å; L150-K153 PolarHBondContact O-N 2.94Å; E151-K153 VanDerWaalsContact C-N 3.35Å; E151-K153 PolarHBondContact O-N 3.37Å
154I54.4Low53.8Low135 Ų13597.2 Ų97.269%0.69248%0.48SS*.Hα-helixtrans-82.6-36.2174.5-62.5171.1000109.9E151 N152E151-I154 WeakPolarHBondContact O-CB 3.5Å; E151-I154 PolarHBondContact O-N 3.44Å; N152-I154 PolarHBondContact O-N 3.04Å
155E53.4Low54Low65 Ų6595.9 Ų95.930%0.30448%0.478SS..Hα-helixtrans-77.9-24.1172.4-69.1-172.6151.600114.2R11 E151 N152 V157 G158 L159R11-E155 IonicContact CZ-OE1 3.93Å; R11-E155 IonicContact CZ-OE2 3.37Å; R11-E155 IonicContact NH1-OE1 2.73Å; R11-E155 PolarHBondContact NH1-OE1 3.33Å; R11-E155 IonicContact NH1-OE2 2.84Å; R11-E155 VanDerWaalsContact NH2-CD 3.26Å; R11-E155 IonicContact NH2-OE1 2.99Å; R11-E155 PolarHBondContact NH2-OE1 3.4Å; R11-E155 IonicContact NH2-OE2 2.94Å; R11-E155 PolarHBondContact NH2-OE2 3.23Å; E151-E155 PolarHBondContact O-N 3.34Å; E151-E155 VanDerWaalsContact O-N 3.17Å; N152-E155 CarbonylContact O-C 3.3Å; N152-E155 PolarHBondContact O-N 2.9Å; E155-V157 PolarHBondContact O-N 2.85Å; E155-G158 CarbonylContact O-C 3.58Å; E155-G158 WeakPolarHBondContact O-CA 3.49Å; E155-G158 PolarHBondContact O-N 2.98Å; E155-L159 PolarHBondContact O-N 3.18Å
156D52.2Low54.8Low85 Ų8593 Ų9346%0.45547%0.465SS..Hα-helixtrans-58.7-29.7176.9-17453.8000112.4N152 G158 L159N152-D156 WeakPolarHBondContact O-CB 3.44Å; N152-D156 PolarHBondContact O-N 3.46Å; D156-G158 VanDerWaalsContact C-N 3.27Å; D156-G158 PolarHBondContact O-N 2.96Å; D156-L159 PolarHBondContact O-N 3.26Å
157V53.5Low56Low117 Ų11790.5 Ų90.571%0.70945%0.454SS*.Hα-helixtrans-70.8-24.7173.3-175.20000111.7E155E155-V157 PolarHBondContact O-N 2.85Å
158G52.7Low57.3Low46 Ų4683.4 Ų83.447%0.47442%0.424SS..Hα-helixtrans-91-29.2173.400000114.4E155 D156 K160 K161E155-G158 CarbonylContact O-C 3.58Å; E155-G158 WeakPolarHBondContact O-CA 3.49Å; E155-G158 PolarHBondContact O-N 2.98Å; D156-G158 VanDerWaalsContact C-N 3.27Å; D156-G158 PolarHBondContact O-N 2.96Å; G158-K160 VanDerWaalsContact C-N 3.33Å; G158-K160 PolarHBondContact O-N 2.88Å; G158-K161 PolarHBondContact O-N 3.11Å
159L51Low58.4Low40 Ų4086.5 Ų86.521%0.20944%0.441CS..Hα-helixtrans-66.6-24.9-175.6-94.4158.1000115M43 E155 D156 K161 T162M43-L159 HydrophobicContact CE-CD2 3.82Å; E155-L159 PolarHBondContact O-N 3.18Å; D156-L159 PolarHBondContact O-N 3.26Å; L159-K161 PolarHBondContact O-N 3.02Å; L159-T162 PolarHBondContact O-N 3.48Å
160K52.8Low59.7Low148 Ų14882.8 Ų82.864%0.64343%0.434SS*.THydrogen-bonded Turntrans-58.2-7.3175.5-70.6-172.3175.4-170.30114.5G158G158-K160 VanDerWaalsContact C-N 3.33Å; G158-K160 PolarHBondContact O-N 2.88Å
161K56.3Low60.9Low138 Ų13881.8 Ų81.860%0.643%0.428SS*.THydrogen-bonded Turntrans-106-3.1-177.1-62.9-175.1-178.8177.90115.3G158 L159G158-K161 PolarHBondContact O-N 3.11Å; L159-K161 PolarHBondContact O-N 3.02Å
162T61.8Low62.2Low14 Ų1480.3 Ų80.39%0.08642%0.424CS..SBendtrans-94.6152.3-178.473.40000112.4L159 M164 G165 V166L159-T162 PolarHBondContact O-N 3.48Å; T162-M164 VanDerWaalsContact C-N 3.29Å; T162-M164 PolarHBondContact O-N 3.27Å; T162-G165 WeakPolarHBondContact O-CA 3.06Å; T162-G165 PolarHBondContact O-N 2.97Å; T162-G165 PolarHBondContact OG1-N 3.31Å; T162-V166 PolarHBondContact O-N 3.49Å; T162-V166 VanDerWaalsContact O-N 3.08Å
163P61.3Low63.5Low60 Ų6084.7 Ų84.739%0.3944%0.444SS..Hα-helixtrans-57.5-40.7-177.9-28.538.2000113.7M5 G165 V166 I167M5-P163 HydrophobicContact CB-CG 4.17Å; M5-P163 HydrophobicContact CE-CG 4.14Å; M5-P163 HydrophobicContact CG-CG 3.63Å; M5-P163 HydrophobicContact SD-CB 4.39Å; M5-P163 HydrophobicContact SD-CG 3.33Å; M5-P163 WeakPolarHBondContact SD-CG 3.34Å; P163-G165 VanDerWaalsContact C-N 3.34Å; P163-V166 PolarHBondContact O-N 2.98Å; P163-I167 WeakPolarHBondContact O-CG1 3.26Å; P163-I167 PolarHBondContact O-N 3.43Å
164M64.2Low64.7Low68 Ų6882.9 Ų82.934%0.33544%0.438SS..Hα-helixtrans-71.7-32.4178.2-169.972.1-173.500111.5M43 T162 V166 I167 M168M43-M164 HydrophobicContact CE-CB 4.13Å; M43-M164 HydrophobicContact CE-CG 4.03Å; M43-M164 HydrophobicContact SD-CB 3.96Å; M43-M164 HydrophobicContact SD-CE 4.44Å; M43-M164 HydrophobicContact SD-CG 3.23Å; M43-M164 WeakPolarHBondContact SD-CG 3.26Å; T162-M164 VanDerWaalsContact C-N 3.29Å; T162-M164 PolarHBondContact O-N 3.27Å; M164-V166 VanDerWaalsContact C-N 3.32Å; M164-V166 PolarHBondContact O-N 3.09Å; M164-I167 PolarHBondContact O-N 2.94Å; M164-M168 HydrophobicContact CE-CE 4.02Å; M164-M168 WeakPolarHBondContact O-CG 3.3Å; M164-M168 PolarHBondContact O-N 3.49Å
165G66.8Low65.9Low10 Ų1081.5 Ų81.510%0.10343%0.429CS..Hα-helixtrans-61.1-42.1172.300000111.6T162 P163 M168 D169T162-G165 WeakPolarHBondContact O-CA 3.06Å; T162-G165 PolarHBondContact O-N 2.97Å; T162-G165 PolarHBondContact OG1-N 3.31Å; P163-G165 VanDerWaalsContact C-N 3.34Å; G165-M168 PolarHBondContact O-N 3.32Å; G165-D169 PolarHBondContact O-N 3.23Å
166V72.6Confident67.2Low74 Ų7483.5 Ų83.545%0.44844%0.438SS..Hα-helixtrans-65.1-41.6174.4178.30000111.8T162 P163 M164 M168 D169 L170T162-V166 PolarHBondContact O-N 3.49Å; T162-V166 VanDerWaalsContact O-N 3.08Å; P163-V166 PolarHBondContact O-N 2.98Å; M164-V166 VanDerWaalsContact C-N 3.32Å; M164-V166 PolarHBondContact O-N 3.09Å; V166-M168 VanDerWaalsContact C-N 3.27Å; V166-M168 PolarHBondContact O-N 3.26Å; V166-D169 PolarHBondContact O-N 2.98Å; V166-L170 HydrophobicContact CG1-CD1 4.22Å; V166-L170 VanDerWaalsContact O-CG 3.24Å; V166-L170 WeakPolarHBondContact O-CG 3.25Å; V166-L170 PolarHBondContact O-N 2.88Å; V166-L170 VanDerWaalsContact O-N 3.09Å
167I72.6Confident68.8Low88 Ų8885.5 Ų85.545%0.45144%0.443SS..Hα-helixtrans-61.5-38.8175.9-68.1166.8000110.6P163 M164 L170 L171P163-I167 WeakPolarHBondContact O-CG1 3.26Å; P163-I167 PolarHBondContact O-N 3.43Å; M164-I167 PolarHBondContact O-N 2.94Å; I167-L170 WeakPolarHBondContact O-CB 3.42Å; I167-L170 PolarHBondContact O-N 3.32Å; I167-L171 HydrophobicContact CG2-CD1 4.22Å; I167-L171 WeakPolarHBondContact O-CG 3.45Å; I167-L171 PolarHBondContact O-N 2.95Å
168M70.9Confident70.2Confident33 Ų3384.5 Ų84.516%0.16343%0.432CS..Hα-helixtrans-71.7-41.7178.7-74.5-163.2147.400113.4I39 M43 M164 G165 V166 L170 L171 D172I39-M168 HydrophobicContact CB-CE 3.76Å; I39-M168 HydrophobicContact CD1-CE 4.2Å; I39-M168 HydrophobicContact CG1-CE 3.6Å; I39-M168 HydrophobicContact CG2-CE 3.22Å; I39-M168 HydrophobicContact CG2-SD 3.53Å; I39-M168 VanDerWaalsContact CG2-SD 3.53Å; M43-M168 HydrophobicContact CE-SD 4.2Å; M43-M168 HydrophobicContact CG-CE 4.25Å; M43-M168 HydrophobicContact CG-SD 3.42Å; M43-M168 WeakPolarHBondContact CG-SD 3.3Å; M43-M168 HydrophobicContact SD-CE 4.3Å; M43-M168 HydrophobicContact SD-CG 4.3Å; M43-M168 HydrophobicContact SD-SD 3.41Å; M164-M168 HydrophobicContact CE-CE 4.02Å; M164-M168 WeakPolarHBondContact O-CG 3.3Å; M164-M168 PolarHBondContact O-N 3.49Å; G165-M168 PolarHBondContact O-N 3.32Å; V166-M168 VanDerWaalsContact C-N 3.27Å; V166-M168 PolarHBondContact O-N 3.26Å; M168-L170 PolarHBondContact O-N 2.91Å; M168-L171 PolarHBondContact O-N 3.23Å; M168-D172 WeakPolarHBondContact O-CB 3.22Å; M168-D172 PolarHBondContact O-N 3.45Å
169D75.3Confident71.7Confident94 Ų9485.8 Ų85.850%0.50343%0.428SS..Hα-helixtrans-56.5-37.4171.4-95.512.7000111.1G165 V166 Q173G165-D169 PolarHBondContact O-N 3.23Å; V166-D169 PolarHBondContact O-N 2.98Å; D169-Q173 WeakPolarHBondContact O-CB 3.17Å; D169-Q173 WeakPolarHBondContact O-CG 3.46Å; D169-Q173 PolarHBondContact O-N 3.08Å
170L76.6Confident73.3Confident98 Ų9890.6 Ų90.651%0.51345%0.448SS..Hα-helixtrans-69.8-34176.6-70.3169.3000112.9V166 I167 M168 Q174V166-L170 HydrophobicContact CG1-CD1 4.22Å; V166-L170 VanDerWaalsContact O-CG 3.24Å; V166-L170 WeakPolarHBondContact O-CG 3.25Å; V166-L170 PolarHBondContact O-N 2.88Å; V166-L170 VanDerWaalsContact O-N 3.09Å; I167-L170 WeakPolarHBondContact O-CB 3.42Å; I167-L170 PolarHBondContact O-N 3.32Å; M168-L170 PolarHBondContact O-N 2.91Å; L170-Q174 VanDerWaalsContact O-CG 3.3Å; L170-Q174 WeakPolarHBondContact O-CG 2.78Å; L170-Q174 PolarHBondContact O-N 2.84Å
171L74.5Confident74.8Confident107 Ų10788.5 Ų88.556%0.5644%0.442SS*.Hα-helixtrans-73.8-40.4175.9-70.5171.6000111.6I167 M168 Q174 E175I167-L171 HydrophobicContact CG2-CD1 4.22Å; I167-L171 WeakPolarHBondContact O-CG 3.45Å; I167-L171 PolarHBondContact O-N 2.95Å; M168-L171 PolarHBondContact O-N 3.23Å; L171-Q174 WeakPolarHBondContact O-CB 3.44Å; L171-Q174 PolarHBondContact O-N 2.85Å; L171-Q174 VanDerWaalsContact O-N 3.11Å; L171-E175 PolarHBondContact O-N 2.87Å
172D77.3Confident76.1Confident93 Ų9387.3 Ų87.350%0.49744%0.439SS..Hα-helixtrans-65.4-42.4177.5-161.845.8000111M168 Q174 E175 E176M168-D172 WeakPolarHBondContact O-CB 3.22Å; M168-D172 PolarHBondContact O-N 3.45Å; D172-Q174 VanDerWaalsContact C-N 3.25Å; D172-Q174 PolarHBondContact O-N 2.81Å; D172-E175 PolarHBondContact O-N 2.72Å; D172-E176 PolarHBondContact O-N 2.86Å
173Q77.6Confident77.3Confident113 Ų11391.5 Ų91.553%0.52846%0.461SS..Hα-helixtrans-62.6-29.4171.2-79.2-167.8-19.300113.8D169 K177D169-Q173 WeakPolarHBondContact O-CB 3.17Å; D169-Q173 WeakPolarHBondContact O-CG 3.46Å; D169-Q173 PolarHBondContact O-N 3.08Å; Q173-K177 WeakPolarHBondContact O-CB 3.42Å; Q173-K177 VanDerWaalsContact O-CG 3.29Å; Q173-K177 WeakPolarHBondContact O-CG 3.38Å; Q173-K177 PolarHBondContact O-N 3.41Å
174Q80.1Confident78.5Confident114 Ų11495.2 Ų95.253%0.53347%0.471SS..Hα-helixtrans-71.1-43.9173.5-81-84.2-51.900110.7L170 L171 D172 K177 I178L170-Q174 VanDerWaalsContact O-CG 3.3Å; L170-Q174 WeakPolarHBondContact O-CG 2.78Å; L170-Q174 PolarHBondContact O-N 2.84Å; L171-Q174 WeakPolarHBondContact O-CB 3.44Å; L171-Q174 PolarHBondContact O-N 2.85Å; L171-Q174 VanDerWaalsContact O-N 3.11Å; D172-Q174 VanDerWaalsContact C-N 3.25Å; D172-Q174 PolarHBondContact O-N 2.81Å; Q174-K177 PolarHBondContact O-N 3.49Å; Q174-I178 VanDerWaalsContact O-CG1 3.31Å; Q174-I178 WeakPolarHBondContact O-CG1 3.27Å; Q174-I178 PolarHBondContact O-N 3.42Å
175E79.8Confident79.5Confident106 Ų10696.4 Ų96.450%0.49548%0.478SS..Hα-helixtrans-62.4-46.5178.2-167.8171.5168.800111.8L171 D172 K177 I178 N179L171-E175 PolarHBondContact O-N 2.87Å; D172-E175 PolarHBondContact O-N 2.72Å; E175-K177 VanDerWaalsContact C-N 3.3Å; E175-K177 PolarHBondContact O-N 2.98Å; E175-I178 PolarHBondContact O-N 3.44Å; E175-N179 VanDerWaalsContact O-CG 3.32Å; E175-N179 PolarHBondContact O-N 3.04Å; E175-N179 PolarHBondContact O-ND2 3.19Å
176E81.9Confident80.3Confident108 Ų108101.9 Ų101.951%0.50550%0.501SS..Hα-helixtrans-60-37.7175.3-79-163.8158.500113.1D172 K180D172-E176 PolarHBondContact O-N 2.86Å; E176-K180 WeakPolarHBondContact O-CG 3.37Å; E176-K180 PolarHBondContact O-N 2.95Å
177K84.4Confident80.8Confident127 Ų127104.3 Ų104.355%0.55251%0.511SS*.Hα-helixtrans-67.7-40.5177.4-80.7178.7-179-179.20111.6Q173 Q174 E175 K180 I181Q173-K177 WeakPolarHBondContact O-CB 3.42Å; Q173-K177 VanDerWaalsContact O-CG 3.29Å; Q173-K177 WeakPolarHBondContact O-CG 3.38Å; Q173-K177 PolarHBondContact O-N 3.41Å; Q174-K177 PolarHBondContact O-N 3.49Å; E175-K177 VanDerWaalsContact C-N 3.3Å; E175-K177 PolarHBondContact O-N 2.98Å; K177-K180 PolarHBondContact O-N 3.34Å; K177-I181 WeakPolarHBondContact O-CD1 3.2Å; K177-I181 VanDerWaalsContact O-CG1 3.26Å; K177-I181 WeakPolarHBondContact O-CG1 3.43Å; K177-I181 PolarHBondContact O-N 3.33Å; K177-I181 VanDerWaalsContact O-N 3.07Å
178I84.8Confident80.9Confident95 Ų95107.8 Ų107.849%0.48752%0.523SS..Hα-helixtrans-63.6-45.9177.4-69.8166.6000109.8Q174 E175 K180 I181 Q182Q174-I178 VanDerWaalsContact O-CG1 3.31Å; Q174-I178 WeakPolarHBondContact O-CG1 3.27Å; Q174-I178 PolarHBondContact O-N 3.42Å; E175-I178 PolarHBondContact O-N 3.44Å; I178-K180 PolarHBondContact O-N 3.4Å; I178-I181 PolarHBondContact O-N 3.38Å; I178-Q182 PolarHBondContact O-N 3.08Å
179N83.5Confident80.8Confident74 Ų74113.2 Ų113.240%0.39655%0.552SS.*Hα-helixtrans-62.2-43.7178.9-67.1-19.3000111.8E175 I181 Q182 D183E175-N179 VanDerWaalsContact O-CG 3.32Å; E175-N179 PolarHBondContact O-N 3.04Å; E175-N179 PolarHBondContact O-ND2 3.19Å; N179-I181 VanDerWaalsContact C-N 3.32Å; N179-I181 PolarHBondContact O-N 2.82Å; N179-Q182 WeakPolarHBondContact O-CB 3.38Å; N179-Q182 PolarHBondContact O-N 3.18Å; N179-D183 PolarHBondContact O-N 2.95Å
180K84.7Confident79.6Confident141 Ų141118.9 Ų118.961%0.61358%0.576SS**Hα-helixtrans-62.4-35.8174.8-79.6175.4179.7163.50113.7E176 K177 I178 F184E176-K180 WeakPolarHBondContact O-CG 3.37Å; E176-K180 PolarHBondContact O-N 2.95Å; K177-K180 PolarHBondContact O-N 3.34Å; I178-K180 PolarHBondContact O-N 3.4Å; K180-F184 WeakPolarHBondContact O-CB 3.46Å; K180-F184 PolarHBondContact O-N 3Å
181I83.1Confident79.8Confident103 Ų103120 Ų12053%0.52858%0.579SS.*Hα-helixtrans-68.2-41.4176-71.1165.8000110K177 I178 N179 F184 I185K177-I181 WeakPolarHBondContact O-CD1 3.2Å; K177-I181 VanDerWaalsContact O-CG1 3.26Å; K177-I181 WeakPolarHBondContact O-CG1 3.43Å; K177-I181 PolarHBondContact O-N 3.33Å; K177-I181 VanDerWaalsContact O-N 3.07Å; I178-I181 PolarHBondContact O-N 3.38Å; N179-I181 VanDerWaalsContact C-N 3.32Å; N179-I181 PolarHBondContact O-N 2.82Å; I181-F184 PolarHBondContact O-N 2.82Å; I181-I185 HydrophobicContact CG2-CD1 3.83Å; I181-I185 HydrophobicContact CG2-CG1 4.5Å; I181-I185 VanDerWaalsContact O-CG1 3.27Å; I181-I185 WeakPolarHBondContact O-CG1 3.32Å; I181-I185 PolarHBondContact O-N 2.7Å
182Q84.8Confident80.1Confident114 Ų114120.6 Ų120.653%0.53358%0.58SS.*Hα-helixtrans-63.7-48178.2-168.1168.3-15.200111.3I178 N179 F184 I185 E186I178-Q182 PolarHBondContact O-N 3.08Å; N179-Q182 WeakPolarHBondContact O-CB 3.38Å; N179-Q182 PolarHBondContact O-N 3.18Å; Q182-F184 VanDerWaalsContact C-N 3.29Å; Q182-F184 PolarHBondContact O-N 3Å; Q182-I185 PolarHBondContact O-N 2.76Å; Q182-I185 VanDerWaalsContact O-N 3.16Å; Q182-E186 WeakPolarHBondContact O-CB 3.46Å; Q182-E186 PolarHBondContact O-N 2.73Å
183D86.5Confident80.2Confident102 Ų102122.2 Ų122.255%0.54558%0.584SS.*Hα-helixtrans-58.6-40.2174.4-69.6-12.8000111.8N179 E186 N187N179-D183 PolarHBondContact O-N 2.95Å; D183-E186 PolarHBondContact O-N 3Å; D183-N187 VanDerWaalsContact O-CB 3.25Å; D183-N187 WeakPolarHBondContact O-CB 3.39Å; D183-N187 PolarHBondContact O-N 3.1Å
184F86.1Confident80.4Confident138 Ų138122.7 Ų122.761%0.60559%0.587SS**Hα-helixtrans-67.1-37.4177.5-176.5-95.4000112.9K180 I181 Q182 K188K180-F184 WeakPolarHBondContact O-CB 3.46Å; K180-F184 PolarHBondContact O-N 3Å; I181-F184 PolarHBondContact O-N 2.82Å; Q182-F184 VanDerWaalsContact C-N 3.29Å; Q182-F184 PolarHBondContact O-N 3Å; F184-K188 HydrophobicContact CE1-CD 4.25Å; F184-K188 WeakPolarHBondContact O-CB 3.47Å; F184-K188 PolarHBondContact O-N 3.03Å
185I85.2Confident80.4Confident93 Ų93123.3 Ų123.348%0.47759%0.591SS.*Hα-helixtrans-67.9-44.3176.7-70.4166.4000110I181 Q182 N187 K188 L189I181-I185 HydrophobicContact CG2-CD1 3.83Å; I181-I185 HydrophobicContact CG2-CG1 4.5Å; I181-I185 VanDerWaalsContact O-CG1 3.27Å; I181-I185 WeakPolarHBondContact O-CG1 3.32Å; I181-I185 PolarHBondContact O-N 2.7Å; Q182-I185 PolarHBondContact O-N 2.76Å; Q182-I185 VanDerWaalsContact O-N 3.16Å; I185-N187 PolarHBondContact O-N 3.07Å; I185-K188 PolarHBondContact O-N 3.23Å; I185-L189 HydrophobicContact CG2-CD1 3.98Å; I185-L189 PolarHBondContact O-N 3.29Å
186E84.6Confident80.5Confident125 Ų125124.4 Ų124.458%0.58460%0.597SS**Hα-helixtrans-64.9-40.5-178.1-155.8164.6-152.100111.5Q182 D183 K188 L189Q182-E186 WeakPolarHBondContact O-CB 3.46Å; Q182-E186 PolarHBondContact O-N 2.73Å; D183-E186 PolarHBondContact O-N 3Å; E186-K188 VanDerWaalsContact C-N 3.26Å; E186-K188 PolarHBondContact O-N 3.23Å; E186-L189 PolarHBondContact O-N 3.16Å
187N82.3Confident80.3Confident125 Ų125125.6 Ų125.667%0.66860%0.604SS**THydrogen-bonded Turntrans-74.3-12178.5-150.26.1000114D183 I185D183-N187 VanDerWaalsContact O-CB 3.25Å; D183-N187 WeakPolarHBondContact O-CB 3.39Å; D183-N187 PolarHBondContact O-N 3.1Å; I185-N187 PolarHBondContact O-N 3.07Å
188K76Confident80Confident160 Ų160125.5 Ų125.570%0.69661%0.608SS**THydrogen-bonded Turntrans-99.1-10.1175.8-146.5-172.9-170.8-164.90113F184 I185 E186F184-K188 HydrophobicContact CE1-CD 4.25Å; F184-K188 WeakPolarHBondContact O-CB 3.47Å; F184-K188 PolarHBondContact O-N 3.03Å; I185-K188 PolarHBondContact O-N 3.23Å; E186-K188 VanDerWaalsContact C-N 3.26Å; E186-K188 PolarHBondContact O-N 3.23Å
189L67.8Low79.6Confident147 Ų147128 Ų12877%0.7762%0.618SS**  trans-99.8-6.7179.2-113.1132.6000112.8I185 E186I185-L189 HydrophobicContact CG2-CD1 3.98Å; I185-L189 PolarHBondContact O-N 3.29Å; E186-L189 PolarHBondContact O-N 3.16Å
190Q51.1Low79.3Confident214 Ų214132.9 Ų132.9100%164%0.638SS**  trans-93.10162.2-70.6-173.2-31.200110.4

Retrieved 190 of 190 residues in 106.3 ms (Link to these results)

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