A0A096M2M5_POEFO Loading...

ADP-ribosylation factor-like protein 2-binding protein

Plays a role as an effector of the ADP-ribosylation factor-like protein 2, ARL2.

AlphaFold DB , UniProt , Accession A0A096M2M5, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 160 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
1E37.2Very low49.9Very low251 Ų251144 Ų144100%1.17375%0.748SS**  01160-77.1-17289.500108.2
2T45.9Very low49.8Very low149 Ų149145.3 Ų145.391%0.91474%0.744SS**  trans-97.5102.9179.2-34.50000106.1
3G46Very low50.4Low52 Ų52138.8 Ų138.854%0.53673%0.725SS.*  trans-69.2148.8-178.400000112.1V5G3-V5 PolarHBondContact O-N 2.69Å
4P52.5Low51Low129 Ų129133.1 Ų133.184%0.83871%0.709SS**  trans-83.493.1177.333.9-27.8000108.4
5V51.3Low51.5Low105 Ų105128.7 Ų128.764%0.63669%0.693SS**  trans-125.831.4177.8-160.80000111.1G3G3-V5 PolarHBondContact O-N 2.69Å
6R52.2Low52Low195 Ų195125.5 Ų125.574%0.73668%0.682SS**SBendtrans-122-11.7-174-151.7174.3-179.7-149.5-4.8116.2
7M52.6Low52.8Low167 Ų167121.7 Ų121.782%0.82367%0.667SS**Hα-helixtrans-92-25.4-176.1-82.5171.8170.400114.5L11M7-L11 PolarHBondContact O-N 3.2Å
8E50.2Low53.9Low138 Ų138118.6 Ų118.665%0.64566%0.655SS**Hα-helixtrans-78.1-34.4-177.361.6-163.2130.600113F12E8-F12 PolarHBondContact O-N 3.26Å; E8-F12 VanDerWaalsContact O-N 3.16Å
9E53Low55.1Low151 Ų151115.6 Ų115.671%0.70665%0.648SS**Hα-helixtrans-71.1-38.3178.2-155.9174.816500111.6A13E9-A13 WeakPolarHBondContact O-CB 3.4Å; E9-A13 PolarHBondContact O-N 3.41Å
10E52.3Low55.9Low123 Ų123112.6 Ų112.658%0.57564%0.638SS**Hα-helixtrans-68.1-36.3175.7-69.4-174.3127.900112.4A14E10-A14 VanDerWaalsContact O-CB 3.27Å; E10-A14 WeakPolarHBondContact O-CB 3.24Å; E10-A14 PolarHBondContact O-N 3.12Å
11L55.2Low56.9Low124 Ų124111.3 Ų111.365%0.64963%0.627SS**Hα-helixtrans-71.5-36.6178.3-169.370.4000112.2M7 S15M7-L11 PolarHBondContact O-N 3.2Å; L11-S15 WeakPolarHBondContact O-CB 3.44Å; L11-S15 PolarHBondContact O-N 2.92Å; L11-S15 VanDerWaalsContact O-N 3.13Å; L11-S15 PolarHBondContact O-OG 2.95Å
12F49.3Very low59.1Low160 Ų160101.8 Ų101.870%0.70259%0.591SS**Hα-helixtrans-71.2-43.4176.5-171.9-99000111.6E8 S15 C16E8-F12 PolarHBondContact O-N 3.26Å; E8-F12 VanDerWaalsContact O-N 3.16Å; F12-S15 PolarHBondContact O-N 2.86Å; F12-C16 WeakPolarHBondContact O-CB 3.27Å; F12-C16 PolarHBondContact O-N 3.29Å
13A58.1Low60.8Low60 Ų6097.4 Ų97.450%0.49657%0.57SS.*Hα-helixtrans-62.4-44.6175.600000112E9 S15 C16 S17E9-A13 WeakPolarHBondContact O-CB 3.4Å; E9-A13 PolarHBondContact O-N 3.41Å; A13-S15 PolarHBondContact O-N 2.64Å; A13-C16 PolarHBondContact O-N 2.95Å; A13-S17 PolarHBondContact O-N 3.35Å
14A58.4Low62.6Low60 Ų6095 Ų9550%0.49655%0.545SS..Hα-helixtrans-64.2-37.5177.600000112.9E10 S18E10-A14 VanDerWaalsContact O-CB 3.27Å; E10-A14 WeakPolarHBondContact O-CB 3.24Å; E10-A14 PolarHBondContact O-N 3.12Å; A14-S18 PolarHBondContact O-N 3.39Å; A14-S18 VanDerWaalsContact O-N 3.14Å
15S58.7Low64.2Low67 Ų6793.5 Ų93.547%0.46953%0.53SS..Hα-helixtrans-73.5-30.2177.6-570000112.9L11 F12 A13 S18 A19L11-S15 WeakPolarHBondContact O-CB 3.44Å; L11-S15 PolarHBondContact O-N 2.92Å; L11-S15 VanDerWaalsContact O-N 3.13Å; L11-S15 PolarHBondContact O-OG 2.95Å; F12-S15 PolarHBondContact O-N 2.86Å; A13-S15 PolarHBondContact O-N 2.64Å; S15-S18 PolarHBondContact O-OG 3.46Å; S15-A19 WeakPolarHBondContact O-CB 3.37Å; S15-A19 PolarHBondContact O-N 3.46Å
16C59.6Low66Low77 Ų7792.7 Ų92.752%0.5253%0.525SS..Hα-helixtrans-72.3-40.7174.6-163.40000110.9F12 A13 A19 A20F12-C16 WeakPolarHBondContact O-CB 3.27Å; F12-C16 PolarHBondContact O-N 3.29Å; A13-C16 PolarHBondContact O-N 2.95Å; C16-A19 PolarHBondContact O-N 2.64Å; C16-A20 WeakPolarHBondContact O-CB 3.03Å; C16-A20 PolarHBondContact O-N 2.8Å
17S65.4Low67.7Low61 Ų6184 Ų8443%0.42749%0.493SS..Hα-helixtrans-59.4-49.1175-161.40000111.4A13 A19 A20 E21A13-S17 PolarHBondContact O-N 3.35Å; S17-A19 VanDerWaalsContact C-N 3.32Å; S17-A19 PolarHBondContact O-N 2.75Å; S17-A20 PolarHBondContact O-N 3.16Å; S17-A20 VanDerWaalsContact O-N 3.16Å; S17-E21 WeakPolarHBondContact O-CG 3.37Å; S17-E21 PolarHBondContact O-N 3.38Å
18S72Confident69.4Low65 Ų6576.7 Ų76.746%0.45546%0.457SS..Hα-helixtrans-66.9-31.8-17968.60000113.6A14 S15 A22A14-S18 PolarHBondContact O-N 3.39Å; A14-S18 VanDerWaalsContact O-N 3.14Å; S15-S18 PolarHBondContact O-OG 3.46Å; S18-A22 WeakPolarHBondContact O-CB 3.49Å; S18-A22 PolarHBondContact O-N 2.76Å; S18-A22 VanDerWaalsContact O-N 3.07Å
19A76.2Confident71.3Confident63 Ų6371.9 Ų71.952%0.52144%0.444SS..Hα-helixtrans-70.9-36.4174.200000112.1S15 C16 S17 A23S15-A19 WeakPolarHBondContact O-CB 3.37Å; S15-A19 PolarHBondContact O-N 3.46Å; C16-A19 PolarHBondContact O-N 2.64Å; S17-A19 VanDerWaalsContact C-N 3.32Å; S17-A19 PolarHBondContact O-N 2.75Å; A19-A23 WeakPolarHBondContact O-CB 3.43Å; A19-A23 PolarHBondContact O-N 3.18Å; A19-A23 VanDerWaalsContact O-N 3.11Å
20A73Confident73.1Confident54 Ų5465.4 Ų65.445%0.44642%0.416SS..Hα-helixtrans-69.5-43.8175.800000111.8C16 S17 A23 F24C16-A20 WeakPolarHBondContact O-CB 3.03Å; C16-A20 PolarHBondContact O-N 2.8Å; S17-A20 PolarHBondContact O-N 3.16Å; S17-A20 VanDerWaalsContact O-N 3.16Å; A20-A23 WeakPolarHBondContact O-CB 3.45Å; A20-A23 PolarHBondContact O-N 3.05Å; A20-F24 PolarHBondContact O-N 3.27Å
21E76.9Confident74.9Confident87 Ų8759.6 Ų59.641%0.40739%0.389SS..Hα-helixtrans-58.5-49.1174.2-71.3168.8158.900111S17 A23 F24 D25S17-E21 WeakPolarHBondContact O-CG 3.37Å; S17-E21 PolarHBondContact O-N 3.38Å; E21-A23 PolarHBondContact O-N 2.6Å; E21-F24 WeakPolarHBondContact O-CB 3.08Å; E21-F24 PolarHBondContact O-N 2.98Å; E21-F24 VanDerWaalsContact O-N 3.07Å; E21-D25 PolarHBondContact O-N 3.18Å
22A82.2Confident76.6Confident50 Ų5056.4 Ų56.441%0.41337%0.372SS..Hα-helixtrans-62.1-31.5177.100000113.3S18 T26S18-A22 WeakPolarHBondContact O-CB 3.49Å; S18-A22 PolarHBondContact O-N 2.76Å; S18-A22 VanDerWaalsContact O-N 3.07Å; A22-T26 WeakPolarHBondContact O-CB 3.38Å; A22-T26 PolarHBondContact O-N 3.07Å; A22-T26 VanDerWaalsContact O-N 3.1Å; A22-T26 PolarHBondContact O-OG1 3.03Å
23A81.6Confident78.6Confident57 Ų5753.6 Ų53.647%0.47136%0.361SS..Hα-helixtrans-71-38.2175.200000111.7A19 A20 E21 T26 L27A19-A23 WeakPolarHBondContact O-CB 3.43Å; A19-A23 PolarHBondContact O-N 3.18Å; A19-A23 VanDerWaalsContact O-N 3.11Å; A20-A23 WeakPolarHBondContact O-CB 3.45Å; A20-A23 PolarHBondContact O-N 3.05Å; E21-A23 PolarHBondContact O-N 2.6Å; A23-T26 PolarHBondContact O-N 3.04Å; A23-L27 WeakPolarHBondContact O-CB 3.18Å; A23-L27 PolarHBondContact O-N 3.16Å
24F84.4Confident80.1Confident3 Ų351.3 Ų51.31%0.01334%0.34CS..Hα-helixtrans-63.3-48.2173.2-176.5-110.7000111.5A20 E21 T26 L27 I28 L99 H103 V107A20-F24 PolarHBondContact O-N 3.27Å; E21-F24 WeakPolarHBondContact O-CB 3.08Å; E21-F24 PolarHBondContact O-N 2.98Å; E21-F24 VanDerWaalsContact O-N 3.07Å; F24-T26 VanDerWaalsContact C-N 3.28Å; F24-T26 PolarHBondContact O-N 3.22Å; F24-L27 WeakPolarHBondContact O-CA 3.39Å; F24-L27 WeakPolarHBondContact O-CB 3.23Å; F24-L27 PolarHBondContact O-N 3.15Å; F24-I28 HydrophobicContact CD1-CG1 4.18Å; F24-I28 HydrophobicContact CD2-CG1 4.33Å; F24-I28 HydrophobicContact CE1-CD1 4.32Å; F24-I28 HydrophobicContact CE1-CG1 3.76Å; F24-I28 HydrophobicContact CE2-CD1 3.91Å; F24-I28 HydrophobicContact CE2-CG1 3.98Å; F24-I28 HydrophobicContact CG-CG1 4.46Å; F24-I28 HydrophobicContact CZ-CD1 3.73Å; F24-I28 HydrophobicContact CZ-CG1 3.68Å; F24-I28 WeakPolarHBondContact O-CG1 3.2Å; F24-I28 PolarHBondContact O-N 3.47Å; F24-L99 HydrophobicContact CB-CD2 4.05Å; F24-L99 HydrophobicContact CD2-CB 4.46Å; F24-L99 HydrophobicContact CD2-CD2 3.46Å; F24-L99 VanDerWaalsContact CD2-CD2 3.46Å; F24-L99 HydrophobicContact CD2-CG 3.53Å; F24-L99 HydrophobicContact CE2-CD2 4.3Å; F24-L99 HydrophobicContact CE2-CG 3.99Å; F24-L99 HydrophobicContact CG-CD2 4.15Å; F24-L99 HydrophobicContact CG-CG 4.26Å; F24-H103 HydrophobicContact CD1-CB 3.97Å; F24-H103 HydrophobicContact CE1-CB 3.37Å; F24-H103 HydrophobicContact CE2-CB 4.28Å; F24-H103 HydrophobicContact CZ-CB 3.53Å; F24-V107 HydrophobicContact CE1-CG2 3.92Å; F24-V107 HydrophobicContact CZ-CG2 3.58Å
25D86.6Confident81.6Confident97 Ų9749.2 Ų49.252%0.51932%0.321SS..Hα-helixtrans-56.1-44.1176.3-73.3-24.5000111.9E21 L27 I28 G29E21-D25 PolarHBondContact O-N 3.18Å; D25-L27 VanDerWaalsContact C-N 3.29Å; D25-L27 PolarHBondContact O-N 2.98Å; D25-I28 PolarHBondContact O-N 3.39Å; D25-G29 PolarHBondContact O-N 2.84Å
26T87.7Confident83.1Confident87 Ų8752.9 Ų52.953%0.53433%0.332SS..Hα-helixtrans-62.2-40.3177.4-59.60000111.1A22 A23 F24 G29 C30A22-T26 WeakPolarHBondContact O-CB 3.38Å; A22-T26 PolarHBondContact O-N 3.07Å; A22-T26 VanDerWaalsContact O-N 3.1Å; A22-T26 PolarHBondContact O-OG1 3.03Å; A23-T26 PolarHBondContact O-N 3.04Å; F24-T26 VanDerWaalsContact C-N 3.28Å; F24-T26 PolarHBondContact O-N 3.22Å; T26-G29 PolarHBondContact O-N 2.88Å; T26-C30 PolarHBondContact O-N 3.48Å; T26-C30 PolarHBondContact O-SG 3.06Å
27L87.8Confident84.6Confident12 Ų1253.3 Ų53.36%0.06333%0.326CS..Hα-helixtrans-66.9-48.8179.6-175.4163.5000111.1A23 F24 D25 G29 C30 I31 I88 F91 F96A23-L27 WeakPolarHBondContact O-CB 3.18Å; A23-L27 PolarHBondContact O-N 3.16Å; F24-L27 WeakPolarHBondContact O-CA 3.39Å; F24-L27 WeakPolarHBondContact O-CB 3.23Å; F24-L27 PolarHBondContact O-N 3.15Å; D25-L27 VanDerWaalsContact C-N 3.29Å; D25-L27 PolarHBondContact O-N 2.98Å; L27-G29 VanDerWaalsContact C-N 3.26Å; L27-G29 PolarHBondContact O-N 2.76Å; L27-C30 WeakPolarHBondContact O-CB 3.21Å; L27-C30 PolarHBondContact O-N 3.11Å; L27-I31 HydrophobicContact CD2-CD1 3.52Å; L27-I31 HydrophobicContact CD2-CG1 4.2Å; L27-I31 WeakPolarHBondContact O-CG1 3.18Å; L27-I31 PolarHBondContact O-N 2.98Å; L27-I88 HydrophobicContact CB-CD1 3.8Å; L27-I88 HydrophobicContact CD1-CD1 3.91Å; L27-I88 HydrophobicContact CG-CD1 3.7Å; L27-F91 HydrophobicContact CD1-CD2 4.21Å; L27-F91 HydrophobicContact CD1-CE2 3.77Å; L27-F91 HydrophobicContact CG-CE2 4.42Å; L27-F96 HydrophobicContact CD1-CD2 3.72Å; L27-F96 HydrophobicContact CD1-CE2 4.3Å; L27-F96 HydrophobicContact CD1-CG 4.47Å; L27-F96 HydrophobicContact CD2-CD2 3.45Å; L27-F96 VanDerWaalsContact CD2-CD2 3.45Å; L27-F96 HydrophobicContact CD2-CE2 3.14Å; L27-F96 HydrophobicContact CD2-CG 4.46Å; L27-F96 HydrophobicContact CD2-CZ 3.93Å; L27-F96 HydrophobicContact CG-CD2 4.25Å; L27-F96 HydrophobicContact CG-CE2 4.36Å
28I89.4Confident86Confident14 Ų1457.1 Ų57.17%0.07234%0.342CS..Hα-helixtrans-59.9-40.2175.7-63.2-58.4000110.5F24 D25 C30 I31 L32 L100 V107F24-I28 HydrophobicContact CD1-CG1 4.18Å; F24-I28 HydrophobicContact CD2-CG1 4.33Å; F24-I28 HydrophobicContact CE1-CD1 4.32Å; F24-I28 HydrophobicContact CE1-CG1 3.76Å; F24-I28 HydrophobicContact CE2-CD1 3.91Å; F24-I28 HydrophobicContact CE2-CG1 3.98Å; F24-I28 HydrophobicContact CG-CG1 4.46Å; F24-I28 HydrophobicContact CZ-CD1 3.73Å; F24-I28 HydrophobicContact CZ-CG1 3.68Å; F24-I28 WeakPolarHBondContact O-CG1 3.2Å; F24-I28 PolarHBondContact O-N 3.47Å; D25-I28 PolarHBondContact O-N 3.39Å; I28-C30 VanDerWaalsContact C-N 3.34Å; I28-C30 PolarHBondContact O-N 3.22Å; I28-I31 PolarHBondContact O-N 3.19Å; I28-L32 HydrophobicContact CG2-CD1 4.25Å; I28-L32 WeakPolarHBondContact O-CB 3.23Å; I28-L32 PolarHBondContact O-N 2.92Å; I28-L100 HydrophobicContact CD1-CD1 4.19Å; I28-V107 HydrophobicContact CD1-CG1 4.32Å; I28-V107 HydrophobicContact CD1-CG2 3.75Å; I28-V107 HydrophobicContact CG1-CG2 4.13Å
29G89.7Confident86.9Confident37 Ų3759.7 Ų59.738%0.38135%0.351SS..Hα-helixtrans-59.5-39.5172.700000113.7D25 T26 L27 E33D25-G29 PolarHBondContact O-N 2.84Å; T26-G29 PolarHBondContact O-N 2.88Å; L27-G29 VanDerWaalsContact C-N 3.26Å; L27-G29 PolarHBondContact O-N 2.76Å; G29-E33 PolarHBondContact O-N 3.41Å; G29-E33 VanDerWaalsContact O-N 3.09Å
30C90.6Very high87.7Confident16 Ų1657.5 Ų57.511%0.10833%0.33CS..Hα-helixtrans-66.8-40.8174.9-66.40000112.1T26 L27 I28 E33 I34 Y83 L84T26-C30 PolarHBondContact O-N 3.48Å; T26-C30 PolarHBondContact O-SG 3.06Å; L27-C30 WeakPolarHBondContact O-CB 3.21Å; L27-C30 PolarHBondContact O-N 3.11Å; I28-C30 VanDerWaalsContact C-N 3.34Å; I28-C30 PolarHBondContact O-N 3.22Å; C30-E33 PolarHBondContact O-N 2.86Å; C30-I34 VanDerWaalsContact O-CD1 3.26Å; C30-I34 WeakPolarHBondContact O-CD1 3.37Å; C30-I34 WeakPolarHBondContact O-CG1 3.41Å; C30-I34 PolarHBondContact O-N 3.18Å; C30-Y83 HydrophobicContact CB-CE1 4.31Å; C30-L84 HydrophobicContact CB-CD2 3.93Å
31I90.9Very high88.6Confident0 Ų058.7 Ų58.70%033%0.326CS..Hα-helixtrans-62.9-47.5177.2-68.2177.9000110L27 I28 E33 I34 I35 L80 L84 F96 I111 L115L27-I31 HydrophobicContact CD2-CD1 3.52Å; L27-I31 HydrophobicContact CD2-CG1 4.2Å; L27-I31 WeakPolarHBondContact O-CG1 3.18Å; L27-I31 PolarHBondContact O-N 2.98Å; I28-I31 PolarHBondContact O-N 3.19Å; I31-E33 VanDerWaalsContact C-N 3.29Å; I31-E33 PolarHBondContact O-N 3.36Å; I31-I34 PolarHBondContact O-N 2.94Å; I31-I35 HydrophobicContact CG2-CD1 3.42Å; I31-I35 VanDerWaalsContact CG2-CD1 3.42Å; I31-I35 HydrophobicContact CG2-CG1 4.07Å; I31-I35 WeakPolarHBondContact O-CG1 3.48Å; I31-I35 PolarHBondContact O-N 3.29Å; I31-L80 HydrophobicContact CG1-CD1 4.41Å; I31-L84 HydrophobicContact CD1-CD1 4.14Å; I31-L84 HydrophobicContact CG1-CD1 3.98Å; I31-L84 HydrophobicContact CG1-CD2 3.85Å; I31-L84 HydrophobicContact CG1-CG 4.46Å; I31-F96 HydrophobicContact CD1-CE1 4.19Å; I31-F96 HydrophobicContact CD1-CE2 3.97Å; I31-F96 HydrophobicContact CD1-CZ 3.45Å; I31-F96 VanDerWaalsContact CD1-CZ 3.45Å; I31-I111 HydrophobicContact CG2-CG2 4.1Å; I31-L115 HydrophobicContact CD1-CD1 4.12Å; I31-L115 HydrophobicContact CD1-CD2 4.26Å; I31-L115 HydrophobicContact CG2-CD1 4.38Å; I31-L115 HydrophobicContact CG2-CD2 4.14Å
32L90.8Very high89.4Confident57 Ų5758.4 Ų58.430%0.29833%0.327SS..Hα-helixtrans-53.2-46.2175.8-90.3170.4000112.6I28 I34 I35 M36 I111I28-L32 HydrophobicContact CG2-CD1 4.25Å; I28-L32 WeakPolarHBondContact O-CB 3.23Å; I28-L32 PolarHBondContact O-N 2.92Å; L32-I34 VanDerWaalsContact C-N 3.34Å; L32-I34 PolarHBondContact O-N 3.39Å; L32-I35 PolarHBondContact O-N 2.91Å; L32-M36 WeakPolarHBondContact O-CB 3.36Å; L32-M36 WeakPolarHBondContact O-CG 3.37Å; L32-M36 PolarHBondContact O-N 2.88Å; L32-I111 HydrophobicContact CD1-CD1 4.06Å; L32-I111 HydrophobicContact CD2-CD1 3.15Å; L32-I111 HydrophobicContact CD2-CG1 3.93Å; L32-I111 HydrophobicContact CG-CD1 3.56Å
33E90.4Very high90.1Very high102 Ų10258.7 Ų58.748%0.47732%0.323SS..Hα-helixtrans-55.2-49.7178.5-172.1179.6-159.600111.1G29 C30 I31 M36 E37 Y83 K87G29-E33 PolarHBondContact O-N 3.41Å; G29-E33 VanDerWaalsContact O-N 3.09Å; C30-E33 PolarHBondContact O-N 2.86Å; I31-E33 VanDerWaalsContact C-N 3.29Å; I31-E33 PolarHBondContact O-N 3.36Å; E33-M36 PolarHBondContact O-N 2.91Å; E33-E37 WeakPolarHBondContact O-CG 3.3Å; E33-E37 PolarHBondContact O-N 3.43Å; E33-Y83 PolarHBondContact OE2-OH 3.22Å; E33-K87 IonicContact OE2-NZ 2.75Å
34I90.6Very high90.7Very high12 Ų1257 Ų576%0.06231%0.305CS..Hα-helixtrans-68.5-45.8-177.2-57.7152.2000111.5C30 I31 L32 M36 E37 F40 L80 Y83C30-I34 VanDerWaalsContact O-CD1 3.26Å; C30-I34 WeakPolarHBondContact O-CD1 3.37Å; C30-I34 WeakPolarHBondContact O-CG1 3.41Å; C30-I34 PolarHBondContact O-N 3.18Å; I31-I34 PolarHBondContact O-N 2.94Å; L32-I34 VanDerWaalsContact C-N 3.34Å; L32-I34 PolarHBondContact O-N 3.39Å; I34-M36 PolarHBondContact O-N 3.35Å; I34-E37 VanDerWaalsContact O-CB 3.31Å; I34-E37 WeakPolarHBondContact O-CB 3.33Å; I34-E37 PolarHBondContact O-N 3.09Å; I34-F40 HydrophobicContact CG2-CD2 4Å; I34-F40 VanDerWaalsContact O-CB 3.31Å; I34-F40 WeakPolarHBondContact O-CB 3.37Å; I34-L80 HydrophobicContact CB-CD1 4.3Å; I34-L80 HydrophobicContact CD1-CD1 3.37Å; I34-L80 HydrophobicContact CG1-CD1 4.47Å; I34-L80 HydrophobicContact CG2-CD1 4.17Å; I34-Y83 HydrophobicContact CD1-CD1 3.01Å; I34-Y83 HydrophobicContact CD1-CD2 4.33Å; I34-Y83 HydrophobicContact CD1-CE1 3.36Å; I34-Y83 HydrophobicContact CD1-CG 3.52Å; I34-Y83 HydrophobicContact CG1-CD1 3.58Å; I34-Y83 HydrophobicContact CG1-CD2 4.19Å; I34-Y83 HydrophobicContact CG1-CE1 3.51Å; I34-Y83 HydrophobicContact CG1-CE2 4.2Å; I34-Y83 HydrophobicContact CG1-CG 3.87Å
35I89.2Confident91.2Very high16 Ų1663.3 Ų63.38%0.08233%0.329CS..Hα-helixtrans-63.6-32.7-177.7-65.8179.1000110.2I31 L32 E37 Q41 I111 M114I31-I35 HydrophobicContact CG2-CD1 3.42Å; I31-I35 VanDerWaalsContact CG2-CD1 3.42Å; I31-I35 HydrophobicContact CG2-CG1 4.07Å; I31-I35 WeakPolarHBondContact O-CG1 3.48Å; I31-I35 PolarHBondContact O-N 3.29Å; L32-I35 PolarHBondContact O-N 2.91Å; I35-E37 VanDerWaalsContact C-N 3.27Å; I35-E37 PolarHBondContact O-N 3.28Å; I35-Q41 WeakPolarHBondContact O-CG 3.27Å; I35-Q41 PolarHBondContact O-NE2 2.92Å; I35-I111 HydrophobicContact CD1-CG2 4.15Å; I35-M114 HydrophobicContact CD1-CE 3.65Å; I35-M114 HydrophobicContact CD1-SD 3.78Å; I35-M114 HydrophobicContact CG1-CE 3.7Å; I35-M114 HydrophobicContact CG1-SD 4.18Å; I35-M114 HydrophobicContact CG2-CE 4.11Å; I35-M114 HydrophobicContact CG2-SD 3.68Å
36M89.2Confident91.6Very high144 Ų14462.4 Ų62.471%0.70933%0.327SS*.THydrogen-bonded Turntrans-77.2-8.1176.3-69.4-175.569.300114L32 E33 I34L32-M36 WeakPolarHBondContact O-CB 3.36Å; L32-M36 WeakPolarHBondContact O-CG 3.37Å; L32-M36 PolarHBondContact O-N 2.88Å; E33-M36 PolarHBondContact O-N 2.91Å; I34-M36 PolarHBondContact O-N 3.35Å
37E92.4Very high92.1Very high85 Ų8558.5 Ų58.540%0.39730%0.303SS..SBendtrans-67.8135.4177-67-178.1-170.400111.4E33 I34 I35 D39 F40 Q41E33-E37 WeakPolarHBondContact O-CG 3.3Å; E33-E37 PolarHBondContact O-N 3.43Å; I34-E37 VanDerWaalsContact O-CB 3.31Å; I34-E37 WeakPolarHBondContact O-CB 3.33Å; I34-E37 PolarHBondContact O-N 3.09Å; I35-E37 VanDerWaalsContact C-N 3.27Å; I35-E37 PolarHBondContact O-N 3.28Å; E37-D39 PolarHBondContact O-N 3.18Å; E37-F40 HydrophobicContact CB-CB 4.36Å; E37-F40 PolarHBondContact O-N 2.8Å; E37-F40 VanDerWaalsContact O-N 3.11Å; E37-Q41 PolarHBondContact O-N 3.06Å
38D93.4Very high92.5Very high142 Ų14258.5 Ų58.576%0.75930%0.303SS*.Hα-helixtrans-57.1-37.1179.8-73.1-38.4000112.3L42D38-L42 WeakPolarHBondContact O-CB 3.25Å; D38-L42 PolarHBondContact O-N 2.93Å
39D92.7Very high92.8Very high118 Ų11860.7 Ų60.763%0.63131%0.314SS*.Hα-helixtrans-66.3-42.8179.4-75.8-14.3000110.9E37 L42 V43E37-D39 PolarHBondContact O-N 3.18Å; D39-L42 PolarHBondContact O-N 2.69Å; D39-V43 WeakPolarHBondContact O-CB 3.4Å; D39-V43 WeakPolarHBondContact O-CG2 3.47Å; D39-V43 PolarHBondContact O-N 2.76Å
40F92Very high93.1Very high18 Ų1866.2 Ų66.28%0.07932%0.324CS..Hα-helixtrans-62.6-50.6176.8-174.8-80.4000110.9I34 E37 L42 V43 Q44 L76 M114 F118I34-F40 HydrophobicContact CG2-CD2 4Å; I34-F40 VanDerWaalsContact O-CB 3.31Å; I34-F40 WeakPolarHBondContact O-CB 3.37Å; E37-F40 HydrophobicContact CB-CB 4.36Å; E37-F40 PolarHBondContact O-N 2.8Å; E37-F40 VanDerWaalsContact O-N 3.11Å; F40-L42 VanDerWaalsContact C-N 3.3Å; F40-L42 PolarHBondContact O-N 2.92Å; F40-V43 PolarHBondContact O-N 3.42Å; F40-Q44 HydrophobicContact CE1-CB 4.41Å; F40-Q44 PolarHBondContact O-N 2.9Å; F40-L76 HydrophobicContact CD2-CD2 4.12Å; F40-L76 HydrophobicContact CE1-CD2 4.08Å; F40-L76 HydrophobicContact CE2-CB 4.34Å; F40-L76 HydrophobicContact CE2-CD2 3.61Å; F40-L76 HydrophobicContact CZ-CB 4.24Å; F40-L76 HydrophobicContact CZ-CD2 3.57Å; F40-L76 HydrophobicContact CZ-CG 4.38Å; F40-M114 HydrophobicContact CD1-CE 4.34Å; F40-M114 HydrophobicContact CE1-CE 3.14Å; F40-M114 HydrophobicContact CE1-SD 4.28Å; F40-M114 HydrophobicContact CE2-CE 4.39Å; F40-M114 HydrophobicContact CZ-CE 3.17Å; F40-F118 HydrophobicContact CZ-CZ 4.45Å
41Q91.8Very high93.4Very high79 Ų7966.3 Ų66.337%0.36932%0.323SS..Hα-helixtrans-60.3-39.4178.6-70.7-66.7-41.700112.1I35 E37 R45I35-Q41 WeakPolarHBondContact O-CG 3.27Å; I35-Q41 PolarHBondContact O-NE2 2.92Å; E37-Q41 PolarHBondContact O-N 3.06Å; Q41-R45 VanDerWaalsContact O-CB 3.23Å; Q41-R45 WeakPolarHBondContact O-CB 3.19Å; Q41-R45 PolarHBondContact O-N 3.43Å
42L94.7Very high93.6Very high81 Ų8168.8 Ų68.842%0.42433%0.333SS..Hα-helixtrans-64.9-44.4176.4178.162.8000111.6D38 D39 F40 T46D38-L42 WeakPolarHBondContact O-CB 3.25Å; D38-L42 PolarHBondContact O-N 2.93Å; D39-L42 PolarHBondContact O-N 2.69Å; F40-L42 VanDerWaalsContact C-N 3.3Å; F40-L42 PolarHBondContact O-N 2.92Å; L42-T46 VanDerWaalsContact O-CB 3.24Å; L42-T46 WeakPolarHBondContact O-CB 3.48Å; L42-T46 PolarHBondContact O-N 3.41Å; L42-T46 PolarHBondContact O-OG1 3.4Å
43V95.4Very high93.7Very high55 Ų5571 Ų7133%0.33334%0.344SS..Hα-helixtrans-62.4-49.9177.9171.50000110.2D39 F40 T46 F47 L75 L76D39-V43 WeakPolarHBondContact O-CB 3.4Å; D39-V43 WeakPolarHBondContact O-CG2 3.47Å; D39-V43 PolarHBondContact O-N 2.76Å; F40-V43 PolarHBondContact O-N 3.42Å; V43-T46 PolarHBondContact O-N 3.37Å; V43-F47 WeakPolarHBondContact O-CB 3.44Å; V43-F47 PolarHBondContact O-N 2.97Å; V43-L75 HydrophobicContact CG1-CD1 4.25Å; V43-L75 HydrophobicContact CG1-CD2 3.41Å; V43-L75 VanDerWaalsContact CG1-CD2 3.41Å; V43-L75 HydrophobicContact CG1-CG 3.56Å; V43-L76 HydrophobicContact CB-CD2 4.3Å; V43-L76 HydrophobicContact CG1-CD2 3.77Å; V43-L76 HydrophobicContact CG1-CG 4.44Å
44Q94.1Very high93.9Very high22 Ų2270.1 Ų70.110%0.10334%0.34CS..Hα-helixtrans-59.5-50.4178.2-172-1754000111.4F40 T46 F47 L48 L76F40-Q44 HydrophobicContact CE1-CB 4.41Å; F40-Q44 PolarHBondContact O-N 2.9Å; Q44-T46 VanDerWaalsContact C-N 3.35Å; Q44-T46 PolarHBondContact O-N 2.89Å; Q44-F47 WeakPolarHBondContact O-CB 3.2Å; Q44-F47 PolarHBondContact O-N 3.17Å; Q44-L48 HydrophobicContact CG-CD1 4.29Å; Q44-L48 WeakPolarHBondContact O-CG 3.5Å; Q44-L48 PolarHBondContact O-N 2.85Å; Q44-L76 HydrophobicContact CB-CD1 4.01Å; Q44-L76 HydrophobicContact CB-CD2 4.21Å; Q44-L76 HydrophobicContact CG-CD1 3.97Å
45R94.9Very high94.1Very high136 Ų13669.5 Ų69.551%0.51334%0.337SS..Hα-helixtrans-60.3-43.7179.1-177.9176.962.8-158-6.6112.3Q41 F47 L48 D49Q41-R45 VanDerWaalsContact O-CB 3.23Å; Q41-R45 WeakPolarHBondContact O-CB 3.19Å; Q41-R45 PolarHBondContact O-N 3.43Å; R45-F47 VanDerWaalsContact C-N 3.28Å; R45-F47 PolarHBondContact O-N 3.36Å; R45-L48 PolarHBondContact O-N 3.14Å; R45-D49 WeakPolarHBondContact O-CB 3.33Å; R45-D49 PolarHBondContact O-N 3.35Å
46T96.6Very high94.1Very high77 Ų7772.9 Ų72.947%0.47235%0.352SS..Hα-helixtrans-63.2-38.8178.8-58.60000111.1L42 V43 Q44 R50L42-T46 VanDerWaalsContact O-CB 3.24Å; L42-T46 WeakPolarHBondContact O-CB 3.48Å; L42-T46 PolarHBondContact O-N 3.41Å; L42-T46 PolarHBondContact O-OG1 3.4Å; V43-T46 PolarHBondContact O-N 3.37Å; Q44-T46 VanDerWaalsContact C-N 3.35Å; Q44-T46 PolarHBondContact O-N 2.89Å; T46-R50 WeakPolarHBondContact O-CB 3.31Å; T46-R50 PolarHBondContact O-N 3.25Å; T46-R50 VanDerWaalsContact O-N 3.12Å
47F96.6Very high94.1Very high6 Ų674.5 Ų74.53%0.02636%0.358CS..Hα-helixtrans-64.1-47.6175.1-175-93.7000111.7V43 Q44 R45 R50 H51 I68 E71 Y72 L75 F124 F128V43-F47 WeakPolarHBondContact O-CB 3.44Å; V43-F47 PolarHBondContact O-N 2.97Å; Q44-F47 WeakPolarHBondContact O-CB 3.2Å; Q44-F47 PolarHBondContact O-N 3.17Å; R45-F47 VanDerWaalsContact C-N 3.28Å; R45-F47 PolarHBondContact O-N 3.36Å; F47-R50 PolarHBondContact O-N 2.98Å; F47-H51 AromaticContact CE2-CD2 3.8Å; F47-H51 AromaticContact CZ-CD2 3.94Å; F47-H51 PolarHBondContact O-CD2 3.46Å; F47-H51 PolarHBondContact O-N 3.28Å; F47-I68 HydrophobicContact CE1-CG2 3.98Å; F47-I68 HydrophobicContact CZ-CG2 3.55Å; F47-I68 WeakPolarHBondContact CZ-O 3.33Å; F47-E71 HydrophobicContact CE2-CB 4Å; F47-E71 HydrophobicContact CE2-CG 3.77Å; F47-E71 HydrophobicContact CZ-CB 4.34Å; F47-Y72 AromaticContact CD1-CD2 3.72Å; F47-Y72 HydrophobicContact CD1-CD2 3.72Å; F47-Y72 AromaticContact CE1-CD2 3.58Å; F47-Y72 HydrophobicContact CE1-CD2 3.58Å; F47-Y72 HydrophobicContact CE1-CG 4.1Å; F47-Y72 HydrophobicContact CZ-CD2 4.37Å; F47-L75 HydrophobicContact CB-CD2 4.01Å; F47-L75 HydrophobicContact CD2-CD2 3.72Å; F47-L75 HydrophobicContact CG-CD2 4.12Å; F47-F124 HydrophobicContact CE1-CE2 4.47Å; F47-F128 AromaticContact CD1-CZ 3.93Å; F47-F128 HydrophobicContact CD1-CZ 3.93Å; F47-F128 AromaticContact CE1-CE2 3.97Å; F47-F128 HydrophobicContact CE1-CE2 3.97Å; F47-F128 AromaticContact CE1-CZ 3.63Å; F47-F128 HydrophobicContact CE1-CZ 3.63Å
48L96.1Very high94Very high11 Ų1172.8 Ų72.86%0.05836%0.355CS..Hα-helixtrans-60.7-48.5176.9-66.6177.1000111.6Q44 R45 R50 H51 Y52 M127 F128 Y131Q44-L48 HydrophobicContact CG-CD1 4.29Å; Q44-L48 WeakPolarHBondContact O-CG 3.5Å; Q44-L48 PolarHBondContact O-N 2.85Å; R45-L48 PolarHBondContact O-N 3.14Å; L48-R50 PolarHBondContact O-N 3.18Å; L48-H51 PolarHBondContact O-N 2.86Å; L48-H51 VanDerWaalsContact O-N 3.09Å; L48-Y52 WeakPolarHBondContact O-CB 3.41Å; L48-Y52 PolarHBondContact O-N 2.99Å; L48-M127 HydrophobicContact CD2-CE 3.72Å; L48-M127 HydrophobicContact CD2-CG 4.46Å; L48-M127 HydrophobicContact CD2-SD 4.13Å; L48-F128 HydrophobicContact CB-CE1 4.43Å; L48-F128 HydrophobicContact CD2-CD1 3.91Å; L48-F128 HydrophobicContact CD2-CD2 4.36Å; L48-F128 HydrophobicContact CD2-CE1 3.59Å; L48-F128 HydrophobicContact CD2-CE2 4.01Å; L48-F128 HydrophobicContact CD2-CG 4.32Å; L48-F128 HydrophobicContact CD2-CZ 3.64Å; L48-Y131 HydrophobicContact CB-CD1 3.95Å; L48-Y131 HydrophobicContact CB-CD2 4.15Å; L48-Y131 HydrophobicContact CB-CE1 3.74Å; L48-Y131 HydrophobicContact CB-CE2 3.93Å; L48-Y131 HydrophobicContact CB-CG 4.13Å; L48-Y131 HydrophobicContact CD1-CD2 3.6Å; L48-Y131 HydrophobicContact CD1-CE2 3.74Å; L48-Y131 HydrophobicContact CD1-CG 4.13Å; L48-Y131 HydrophobicContact CG-CD2 4.44Å; L48-Y131 HydrophobicContact CG-CE2 4.5Å
49D96Very high93.7Very high60 Ų6073.9 Ų73.932%0.32136%0.361SS..Hα-helixtrans-57.1-33.5177.7-86.4-37.4000112.8R45 Y52 Y131 K135R45-D49 WeakPolarHBondContact O-CB 3.33Å; R45-D49 PolarHBondContact O-N 3.35Å; D49-Y52 VanDerWaalsContact O-CD1 3.27Å; D49-Y52 WeakPolarHBondContact O-CD1 3.44Å; D49-Y52 WeakPolarHBondContact O-CE1 3.31Å; D49-Y131 VanDerWaalsContact CG-OH 3.28Å; D49-Y131 PolarHBondContact OD1-OH 3.01Å; D49-K135 WeakPolarHBondContact OD1-CE 3.46Å; D49-K135 IonicContact OD1-NZ 3.74Å; D49-K135 PolarHBondContact OD1-NZ 3.26Å; D49-K135 IonicContact OD2-NZ 3.8Å
50R97Very high93.6Very high154 Ų15475.7 Ų75.758%0.58137%0.366SS*.Hα-helixtrans-73.9-31.4179178.2176.9147.5-155.2-20.9112.9T46 F47 L48 E71T46-R50 WeakPolarHBondContact O-CB 3.31Å; T46-R50 PolarHBondContact O-N 3.25Å; T46-R50 VanDerWaalsContact O-N 3.12Å; F47-R50 PolarHBondContact O-N 2.98Å; L48-R50 PolarHBondContact O-N 3.18Å; R50-E71 IonicContact CZ-OE1 3.54Å; R50-E71 IonicContact CZ-OE2 3.45Å; R50-E71 IonicContact NH1-OE1 3.98Å; R50-E71 PolarHBondContact NH1-OE1 3.43Å; R50-E71 VanDerWaalsContact NH2-CD 3.28Å; R50-E71 IonicContact NH2-OE1 2.6Å; R50-E71 PolarHBondContact NH2-OE1 3.48Å; R50-E71 IonicContact NH2-OE2 2.69Å; R50-E71 PolarHBondContact NH2-OE2 3.03Å
51H96.2Very high93.6Very high18 Ų1878 Ų788%0.08338%0.379CS..Hα-helixtrans-116.5-12.4-166.5-73.7-70.6000115.2F47 L48 L53 E54 I68 E71 F128F47-H51 AromaticContact CE2-CD2 3.8Å; F47-H51 AromaticContact CZ-CD2 3.94Å; F47-H51 PolarHBondContact O-CD2 3.46Å; F47-H51 PolarHBondContact O-N 3.28Å; L48-H51 PolarHBondContact O-N 2.86Å; L48-H51 VanDerWaalsContact O-N 3.09Å; H51-L53 PolarHBondContact O-N 2.87Å; H51-E54 WeakPolarHBondContact O-CB 3.37Å; H51-E54 PolarHBondContact O-N 3.41Å; H51-I68 HydrophobicContact CB-CG2 4Å; H51-E71 IonicContact NE2-OE2 2.69Å; H51-F128 HydrophobicContact CB-CE1 3.59Å; H51-F128 HydrophobicContact CB-CZ 3.67Å
52Y94.6Very high93.7Very high52 Ų5277.3 Ų77.320%0.20438%0.375CS..THydrogen-bonded Turntrans-58.5-28.6-171.680.2-82.7000115.1L48 D49 E54 F55 Y131 R132 K135L48-Y52 WeakPolarHBondContact O-CB 3.41Å; L48-Y52 PolarHBondContact O-N 2.99Å; D49-Y52 VanDerWaalsContact O-CD1 3.27Å; D49-Y52 WeakPolarHBondContact O-CD1 3.44Å; D49-Y52 WeakPolarHBondContact O-CE1 3.31Å; Y52-E54 VanDerWaalsContact C-N 3.28Å; Y52-E54 PolarHBondContact O-N 3.34Å; Y52-F55 PolarHBondContact O-N 3.18Å; Y52-Y131 HydrophobicContact CD1-CE1 4.46Å; Y52-Y131 HydrophobicContact CG-CD1 4.21Å; Y52-Y131 HydrophobicContact CG-CE1 4.39Å; Y52-R132 HydrophobicContact CD2-CB 3.89Å; Y52-R132 HydrophobicContact CD2-CG 3.88Å; Y52-R132 HydrophobicContact CE2-CG 4.43Å; Y52-K135 HydrophobicContact CE2-CB 4.32Å
53L94.1Very high93.6Very high102 Ų10281.3 Ų81.353%0.53440%0.396SS..THydrogen-bonded Turntrans-71.5-20.7177.3-68.4175.1000113.6H51 F55H51-L53 PolarHBondContact O-N 2.87Å; L53-F55 VanDerWaalsContact C-N 3.31Å
54E94.8Very high93.5Very high84 Ų8480.5 Ų80.539%0.39339%0.393SS..THydrogen-bonded Turntrans-70.5-32.5176.9-70-65.8135.300111.3H51 Y52 K62 Y65 I68H51-E54 WeakPolarHBondContact O-CB 3.37Å; H51-E54 PolarHBondContact O-N 3.41Å; Y52-E54 VanDerWaalsContact C-N 3.28Å; Y52-E54 PolarHBondContact O-N 3.34Å; E54-K62 PolarHBondContact O-NZ 3.09Å; E54-Y65 VanDerWaalsContact O-CE1 3.3Å; E54-Y65 WeakPolarHBondContact O-CE1 3.2Å; E54-Y65 PolarHBondContact O-OH 3.46Å; E54-I68 HydrophobicContact CB-CD1 4.08Å; E54-I68 HydrophobicContact CG-CD1 4.14Å
55F93.9Very high93.6Very high0 Ų079.5 Ų79.50%039%0.388CS..  trans-85.4131.7-173.3-71.7-95.1000112.4Y52 L53 Y65 I68 F124 K125 F128 R132Y52-F55 PolarHBondContact O-N 3.18Å; L53-F55 VanDerWaalsContact C-N 3.31Å; F55-Y65 WeakPolarHBondContact CA-OH 3.35Å; F55-Y65 HydrophobicContact CD1-CD1 4.01Å; F55-Y65 HydrophobicContact CD1-CD2 4.3Å; F55-Y65 AromaticContact CD1-CE1 3.86Å; F55-Y65 HydrophobicContact CD1-CE1 3.86Å; F55-Y65 HydrophobicContact CD1-CE2 4.15Å; F55-Y65 HydrophobicContact CD1-CG 4.24Å; F55-Y65 AromaticContact CD1-CZ 3.94Å; F55-Y65 HydrophobicContact CD2-CE1 4.49Å; F55-Y65 AromaticContact CE1-CD1 3.74Å; F55-Y65 HydrophobicContact CE1-CD1 3.74Å; F55-Y65 HydrophobicContact CE1-CD2 4.1Å; F55-Y65 HydrophobicContact CE1-CE1 4.08Å; F55-Y65 HydrophobicContact CE1-CE2 4.42Å; F55-Y65 AromaticContact CE1-CG 3.76Å; F55-Y65 HydrophobicContact CE1-CG 3.76Å; F55-Y65 HydrophobicContact CE2-CD1 4.42Å; F55-Y65 HydrophobicContact CG-CD1 4.47Å; F55-Y65 HydrophobicContact CG-CE1 4.08Å; F55-Y65 AromaticContact CZ-CD1 3.94Å; F55-Y65 HydrophobicContact CZ-CD1 3.94Å; F55-Y65 HydrophobicContact CZ-CE1 4.48Å; F55-Y65 HydrophobicContact CZ-CG 4.23Å; F55-I68 HydrophobicContact CE2-CD1 4.02Å; F55-I68 HydrophobicContact CE2-CG2 4.1Å; F55-I68 HydrophobicContact CZ-CB 4.47Å; F55-I68 HydrophobicContact CZ-CD1 4.42Å; F55-I68 HydrophobicContact CZ-CG2 4.28Å; F55-F124 HydrophobicContact CE1-CD1 4.35Å; F55-F124 AromaticContact CE1-CE1 3.8Å; F55-F124 HydrophobicContact CE1-CE1 3.8Å; F55-F124 HydrophobicContact CZ-CD1 4.42Å; F55-F124 AromaticContact CZ-CE1 3.49Å; F55-F124 HydrophobicContact CZ-CE1 3.49Å; F55-F124 VanDerWaalsContact CZ-CE1 3.49Å; F55-F124 AromaticContact CZ-CZ 3.88Å; F55-F124 HydrophobicContact CZ-CZ 3.88Å; F55-K125 HydrophobicContact CD1-CG 4.12Å; F55-F128 HydrophobicContact CB-CB 3.71Å; F55-F128 HydrophobicContact CB-CG 4.41Å; F55-F128 HydrophobicContact CD1-CB 3.81Å; F55-F128 HydrophobicContact CD1-CD2 4.35Å; F55-F128 HydrophobicContact CD1-CG 4.22Å; F55-F128 HydrophobicContact CD2-CB 3.65Å; F55-F128 AromaticContact CD2-CD1 3.62Å; F55-F128 HydrophobicContact CD2-CD1 3.62Å; F55-F128 AromaticContact CD2-CD2 3.81Å; F55-F128 HydrophobicContact CD2-CD2 3.81Å; F55-F128 HydrophobicContact CD2-CE1 4.12Å; F55-F128 HydrophobicContact CD2-CE2 4.32Å; F55-F128 AromaticContact CD2-CG 3.41Å; F55-F128 HydrophobicContact CD2-CG 3.41Å; F55-F128 VanDerWaalsContact CD2-CG 3.41Å; F55-F128 HydrophobicContact CD2-CZ 4.44Å; F55-F128 HydrophobicContact CE1-CB 4.34Å; F55-F128 HydrophobicContact CE1-CD2 4.05Å; F55-F128 HydrophobicContact CE1-CG 4.37Å; F55-F128 HydrophobicContact CE2-CB 4.21Å; F55-F128 AromaticContact CE2-CD1 3.93Å; F55-F128 HydrophobicContact CE2-CD1 3.93Å; F55-F128 AromaticContact CE2-CD2 3.47Å; F55-F128 HydrophobicContact CE2-CD2 3.47Å; F55-F128 VanDerWaalsContact CE2-CD2 3.47Å; F55-F128 HydrophobicContact CE2-CE1 4.06Å; F55-F128 AromaticContact CE2-CE2 3.66Å; F55-F128 HydrophobicContact CE2-CE2 3.66Å; F55-F128 AromaticContact CE2-CG 3.6Å; F55-F128 HydrophobicContact CE2-CG 3.6Å; F55-F128 AromaticContact CE2-CZ 3.93Å; F55-F128 HydrophobicContact CE2-CZ 3.93Å; F55-F128 HydrophobicContact CG-CB 3.43Å; F55-F128 VanDerWaalsContact CG-CB 3.43Å; F55-F128 HydrophobicContact CG-CD1 4.29Å; F55-F128 HydrophobicContact CG-CD2 4.24Å; F55-F128 AromaticContact CG-CG 3.75Å; F55-F128 HydrophobicContact CG-CG 3.75Å; F55-F128 AromaticContact CZ-CD2 3.61Å; F55-F128 HydrophobicContact CZ-CD2 3.61Å; F55-F128 AromaticContact CZ-CE2 3.93Å; F55-F128 HydrophobicContact CZ-CE2 3.93Å; F55-F128 HydrophobicContact CZ-CG 4.09Å; F55-R132 WeakPolarHBondContact O-CD 3.42Å; F55-R132 PolarHBondContact O-NH1 3.18Å
56E90.3Very high93.5Very high86 Ų8676.8 Ų76.840%0.40239%0.387SS..  trans-120.2146-178.5-68.1173.7-166.800110.7S58 K62 Y65E56-S58 PolarHBondContact O-N 3.05Å; E56-K62 VanDerWaalsContact CD-NZ 3.3Å; E56-K62 VanDerWaalsContact OE1-CE 3.25Å; E56-K62 WeakPolarHBondContact OE1-CE 3.47Å; E56-K62 IonicContact OE1-NZ 3.91Å; E56-K62 PolarHBondContact OE1-NZ 3.12Å; E56-Y65 PolarHBondContact N-OH 3.3Å; E56-Y65 VanDerWaalsContact N-OH 3.1Å
57E89.1Confident93.5Very high178 Ų17879.1 Ų79.183%0.83240%0.395SS*.SBendtrans-77.265.2171.8-167.7-177.1-171.200109.7V129E57-V129 HydrophobicContact CB-CG1 4.03Å; E57-V129 HydrophobicContact CG-CG1 4.09Å
58S89.9Confident93.6Very high49 Ų4979.3 Ų79.334%0.34340%0.397SS..SBendtrans-135.5148.9178.7173.50000108.9E56 E60 K125E56-S58 PolarHBondContact O-N 3.05Å; S58-E60 PolarHBondContact O-N 3.03Å; S58-E60 PolarHBondContact OG-N 3.36Å; S58-K125 WeakPolarHBondContact O-CE 3.49Å; S58-K125 PolarHBondContact O-NZ 3.03Å
59D86.2Confident93.6Very high165 Ų16580.3 Ų80.388%0.88240%0.4SS*.SBendtrans-66.4-21.7174.3-65.6-30.6000112.4
60E90.8Very high93.5Very high157 Ų15781.3 Ų81.373%0.73441%0.406SS*.PPolyproline II helixtrans-78132.1179-168.8174.617900111.9S58S58-E60 PolarHBondContact O-N 3.03Å; S58-E60 PolarHBondContact OG-N 3.36Å
61N92.3Very high93.5Very high66 Ų6677 Ų7735%0.35339%0.393SS..PPolyproline II helixtrans-100.7127.9179.5-67.3-32.6000111.1Y65 K125N61-Y65 HydrophobicContact CB-CD2 4.06Å; N61-Y65 HydrophobicContact CB-CE2 4.48Å; N61-K125 PolarHBondContact OD1-NZ 3.27Å
62K93.4Very high93.5Very high65 Ų6576.2 Ų76.228%0.28339%0.389SS..PPolyproline II helixtrans-74.1147.2173.6-61.1178.1-175.1167.90110.2E54 E56 S64 Y65E54-K62 PolarHBondContact O-NZ 3.09Å; E56-K62 VanDerWaalsContact CD-NZ 3.3Å; E56-K62 VanDerWaalsContact OE1-CE 3.25Å; E56-K62 WeakPolarHBondContact OE1-CE 3.47Å; E56-K62 IonicContact OE1-NZ 3.91Å; E56-K62 PolarHBondContact OE1-NZ 3.12Å; K62-S64 PolarHBondContact O-N 3.31Å; K62-Y65 HydrophobicContact CB-CD1 3.9Å; K62-Y65 HydrophobicContact CB-CD2 4.42Å; K62-Y65 HydrophobicContact CB-CE1 3.77Å; K62-Y65 HydrophobicContact CB-CE2 4.31Å; K62-Y65 HydrophobicContact CB-CG 4.22Å; K62-Y65 HydrophobicContact CD-CE1 3.77Å; K62-Y65 HydrophobicContact CG-CE1 3.95Å; K62-Y65 HydrophobicContact CG-CE2 4.41Å; K62-Y65 WeakPolarHBondContact O-CB 3.45Å; K62-Y65 PolarHBondContact O-N 3.42Å
63L92.6Very high93.4Very high165 Ų16574.8 Ų74.886%0.86439%0.385SS*.Hα-helixtrans-59.6-28.1173.7-67.5174.5000112.8Y65L63-Y65 PolarHBondContact O-N 3.01Å
64S94.4Very high93.4Very high38 Ų3875 Ų7527%0.26638%0.383SS..Hα-helixtrans-63.7-27.917650.60000112.8K62 T66 L67 I68K62-S64 PolarHBondContact O-N 3.31Å; S64-T66 VanDerWaalsContact C-N 3.3Å; S64-T66 PolarHBondContact O-N 3.19Å; S64-L67 PolarHBondContact O-N 3.46Å; S64-L67 VanDerWaalsContact O-N 3.12Å; S64-I68 WeakPolarHBondContact O-CG1 3.4Å; S64-I68 PolarHBondContact O-N 3.14Å; S64-I68 VanDerWaalsContact O-N 3.09Å
65Y95.6Very high93.4Very high1 Ų174.3 Ų74.30%0.00438%0.382CS..Hα-helixtrans-62.1-37.4-176.6-62.9-9.5000112.3E54 F55 E56 N61 K62 L63 L67 I68 F69 F121E54-Y65 VanDerWaalsContact O-CE1 3.3Å; E54-Y65 WeakPolarHBondContact O-CE1 3.2Å; E54-Y65 PolarHBondContact O-OH 3.46Å; F55-Y65 WeakPolarHBondContact CA-OH 3.35Å; F55-Y65 HydrophobicContact CD1-CD1 4.01Å; F55-Y65 HydrophobicContact CD1-CD2 4.3Å; F55-Y65 AromaticContact CD1-CE1 3.86Å; F55-Y65 HydrophobicContact CD1-CE1 3.86Å; F55-Y65 HydrophobicContact CD1-CE2 4.15Å; F55-Y65 HydrophobicContact CD1-CG 4.24Å; F55-Y65 AromaticContact CD1-CZ 3.94Å; F55-Y65 HydrophobicContact CD2-CE1 4.49Å; F55-Y65 AromaticContact CE1-CD1 3.74Å; F55-Y65 HydrophobicContact CE1-CD1 3.74Å; F55-Y65 HydrophobicContact CE1-CD2 4.1Å; F55-Y65 HydrophobicContact CE1-CE1 4.08Å; F55-Y65 HydrophobicContact CE1-CE2 4.42Å; F55-Y65 AromaticContact CE1-CG 3.76Å; F55-Y65 HydrophobicContact CE1-CG 3.76Å; F55-Y65 HydrophobicContact CE2-CD1 4.42Å; F55-Y65 HydrophobicContact CG-CD1 4.47Å; F55-Y65 HydrophobicContact CG-CE1 4.08Å; F55-Y65 AromaticContact CZ-CD1 3.94Å; F55-Y65 HydrophobicContact CZ-CD1 3.94Å; F55-Y65 HydrophobicContact CZ-CE1 4.48Å; F55-Y65 HydrophobicContact CZ-CG 4.23Å; E56-Y65 PolarHBondContact N-OH 3.3Å; E56-Y65 VanDerWaalsContact N-OH 3.1Å; N61-Y65 HydrophobicContact CB-CD2 4.06Å; N61-Y65 HydrophobicContact CB-CE2 4.48Å; K62-Y65 HydrophobicContact CB-CD1 3.9Å; K62-Y65 HydrophobicContact CB-CD2 4.42Å; K62-Y65 HydrophobicContact CB-CE1 3.77Å; K62-Y65 HydrophobicContact CB-CE2 4.31Å; K62-Y65 HydrophobicContact CB-CG 4.22Å; K62-Y65 HydrophobicContact CD-CE1 3.77Å; K62-Y65 HydrophobicContact CG-CE1 3.95Å; K62-Y65 HydrophobicContact CG-CE2 4.41Å; K62-Y65 WeakPolarHBondContact O-CB 3.45Å; K62-Y65 PolarHBondContact O-N 3.42Å; L63-Y65 PolarHBondContact O-N 3.01Å; Y65-L67 VanDerWaalsContact C-N 3.33Å; Y65-L67 PolarHBondContact O-N 3.45Å; Y65-I68 PolarHBondContact O-N 3.38Å; Y65-F69 WeakPolarHBondContact O-CB 3.39Å; Y65-F69 PolarHBondContact O-N 3.1Å; Y65-F121 AromaticContact CD2-CZ 3.97Å; Y65-F121 HydrophobicContact CD2-CZ 3.97Å; Y65-F121 HydrophobicContact CG-CZ 4.27Å
66T94.1Very high93.3Very high79 Ų7974.4 Ų74.449%0.48538%0.383SS..Hα-helixtrans-64-39.2177.2-53.60000112S64 N70S64-T66 VanDerWaalsContact C-N 3.3Å; S64-T66 PolarHBondContact O-N 3.19Å; T66-N70 VanDerWaalsContact O-CG 3.24Å; T66-N70 PolarHBondContact O-N 2.91Å; T66-N70 PolarHBondContact O-ND2 3.45Å
67L96.1Very high93.4Very high126 Ų12671.8 Ų71.866%0.6637%0.371SS*.Hα-helixtrans-67.7-41.1178.1-63.2177.5000111.1S64 Y65 N70 E71S64-L67 PolarHBondContact O-N 3.46Å; S64-L67 VanDerWaalsContact O-N 3.12Å; Y65-L67 VanDerWaalsContact C-N 3.33Å; Y65-L67 PolarHBondContact O-N 3.45Å; L67-N70 PolarHBondContact O-N 3.05Å; L67-E71 PolarHBondContact O-N 2.76Å
68I97.4Very high93.4Very high10 Ų1067.2 Ų67.25%0.05135%0.348CS..Hα-helixtrans-67.8-41.7178.1-58.5166.3000110.1F47 H51 E54 F55 S64 Y65 N70 E71 Y72 F124 F128F47-I68 HydrophobicContact CE1-CG2 3.98Å; F47-I68 HydrophobicContact CZ-CG2 3.55Å; F47-I68 WeakPolarHBondContact CZ-O 3.33Å; H51-I68 HydrophobicContact CB-CG2 4Å; E54-I68 HydrophobicContact CB-CD1 4.08Å; E54-I68 HydrophobicContact CG-CD1 4.14Å; F55-I68 HydrophobicContact CE2-CD1 4.02Å; F55-I68 HydrophobicContact CE2-CG2 4.1Å; F55-I68 HydrophobicContact CZ-CB 4.47Å; F55-I68 HydrophobicContact CZ-CD1 4.42Å; F55-I68 HydrophobicContact CZ-CG2 4.28Å; S64-I68 WeakPolarHBondContact O-CG1 3.4Å; S64-I68 PolarHBondContact O-N 3.14Å; S64-I68 VanDerWaalsContact O-N 3.09Å; Y65-I68 PolarHBondContact O-N 3.38Å; I68-N70 PolarHBondContact O-N 3.17Å; I68-E71 PolarHBondContact O-N 3.02Å; I68-Y72 PolarHBondContact O-N 3.25Å; I68-F124 HydrophobicContact CG2-CZ 4.11Å; I68-F128 HydrophobicContact CG2-CE2 4.43Å; I68-F128 HydrophobicContact CG2-CZ 4.37Å
69F96.4Very high93.4Very high31 Ų3168 Ų6814%0.13635%0.352CS..Hα-helixtrans-59.2-45.2175.6-178.1-110.1000112.3Y65 E71 Y72 V73 T117 F118 F121 F124Y65-F69 WeakPolarHBondContact O-CB 3.39Å; Y65-F69 PolarHBondContact O-N 3.1Å; F69-E71 VanDerWaalsContact C-N 3.32Å; F69-E71 PolarHBondContact O-N 2.69Å; F69-Y72 WeakPolarHBondContact O-CB 3.32Å; F69-Y72 PolarHBondContact O-N 3Å; F69-V73 HydrophobicContact CE1-CG2 4.14Å; F69-V73 HydrophobicContact CE2-CG2 4.39Å; F69-V73 HydrophobicContact CZ-CG2 4.07Å; F69-V73 PolarHBondContact O-N 3.16Å; F69-T117 WeakPolarHBondContact CE2-O 3.03Å; F69-F118 WeakPolarHBondContact CZ-O 3.47Å; F69-F121 HydrophobicContact CB-CD2 4.22Å; F69-F121 HydrophobicContact CB-CE2 4.36Å; F69-F121 HydrophobicContact CD2-CD2 4.27Å; F69-F121 HydrophobicContact CG-CD2 4.09Å; F69-F124 HydrophobicContact CB-CD1 4.19Å; F69-F124 HydrophobicContact CB-CE1 3.74Å; F69-F124 HydrophobicContact CB-CZ 4.02Å; F69-F124 HydrophobicContact CD2-CB 3.88Å; F69-F124 AromaticContact CD2-CD1 3.5Å; F69-F124 HydrophobicContact CD2-CD1 3.5Å; F69-F124 AromaticContact CD2-CD2 3.72Å; F69-F124 HydrophobicContact CD2-CD2 3.72Å; F69-F124 AromaticContact CD2-CE1 3.83Å; F69-F124 HydrophobicContact CD2-CE1 3.83Å; F69-F124 HydrophobicContact CD2-CE2 4.04Å; F69-F124 AromaticContact CD2-CG 3.42Å; F69-F124 HydrophobicContact CD2-CG 3.42Å; F69-F124 VanDerWaalsContact CD2-CG 3.42Å; F69-F124 HydrophobicContact CD2-CZ 4.09Å; F69-F124 HydrophobicContact CE2-CB 3.83Å; F69-F124 HydrophobicContact CE2-CD1 4.32Å; F69-F124 HydrophobicContact CE2-CD2 4.22Å; F69-F124 AromaticContact CE2-CG 3.89Å; F69-F124 HydrophobicContact CE2-CG 3.89Å; F69-F124 HydrophobicContact CG-CD1 4.27Å; F69-F124 HydrophobicContact CG-CE1 4.28Å
70N95.2Very high93.6Very high82 Ų8260.2 Ų60.244%0.43931%0.31SS..Hα-helixtrans-63.2-39.8175.8-67.5-24.7000111.6T66 L67 I68 Y72 V73 E74T66-N70 VanDerWaalsContact O-CG 3.24Å; T66-N70 PolarHBondContact O-N 2.91Å; T66-N70 PolarHBondContact O-ND2 3.45Å; L67-N70 PolarHBondContact O-N 3.05Å; I68-N70 PolarHBondContact O-N 3.17Å; N70-Y72 VanDerWaalsContact C-N 3.32Å; N70-Y72 PolarHBondContact O-N 3.24Å; N70-V73 PolarHBondContact O-N 2.83Å; N70-E74 VanDerWaalsContact O-CG 3.23Å; N70-E74 WeakPolarHBondContact O-CG 3.23Å; N70-E74 PolarHBondContact O-N 2.98Å
71E96.3Very high93.5Very high64 Ų6455.2 Ų55.230%0.29929%0.287SS..Hα-helixtrans-62.3-40.1174.4-168179.7167.400111.6F47 R50 H51 L67 I68 F69 E74 L75F47-E71 HydrophobicContact CE2-CB 4Å; F47-E71 HydrophobicContact CE2-CG 3.77Å; F47-E71 HydrophobicContact CZ-CB 4.34Å; R50-E71 IonicContact CZ-OE1 3.54Å; R50-E71 IonicContact CZ-OE2 3.45Å; R50-E71 IonicContact NH1-OE1 3.98Å; R50-E71 PolarHBondContact NH1-OE1 3.43Å; R50-E71 VanDerWaalsContact NH2-CD 3.28Å; R50-E71 IonicContact NH2-OE1 2.6Å; R50-E71 PolarHBondContact NH2-OE1 3.48Å; R50-E71 IonicContact NH2-OE2 2.69Å; R50-E71 PolarHBondContact NH2-OE2 3.03Å; H51-E71 IonicContact NE2-OE2 2.69Å; L67-E71 PolarHBondContact O-N 2.76Å; I68-E71 PolarHBondContact O-N 3.02Å; F69-E71 VanDerWaalsContact C-N 3.32Å; F69-E71 PolarHBondContact O-N 2.69Å; E71-E74 PolarHBondContact O-N 2.6Å; E71-L75 WeakPolarHBondContact O-CB 3.34Å; E71-L75 PolarHBondContact O-N 3.5Å
72Y95.8Very high93.3Very high0 Ų057.3 Ų57.30%029%0.294CS..Hα-helixtrans-59.9-49176.2179.9-103.4000112.1F47 I68 F69 N70 E74 L75 L76 T117 F118 F124 M127F47-Y72 AromaticContact CD1-CD2 3.72Å; F47-Y72 HydrophobicContact CD1-CD2 3.72Å; F47-Y72 AromaticContact CE1-CD2 3.58Å; F47-Y72 HydrophobicContact CE1-CD2 3.58Å; F47-Y72 HydrophobicContact CE1-CG 4.1Å; F47-Y72 HydrophobicContact CZ-CD2 4.37Å; I68-Y72 PolarHBondContact O-N 3.25Å; F69-Y72 WeakPolarHBondContact O-CB 3.32Å; F69-Y72 PolarHBondContact O-N 3Å; N70-Y72 VanDerWaalsContact C-N 3.32Å; N70-Y72 PolarHBondContact O-N 3.24Å; Y72-E74 PolarHBondContact O-N 3.06Å; Y72-L75 PolarHBondContact O-N 2.99Å; Y72-L76 HydrophobicContact CD2-CD1 3.59Å; Y72-L76 HydrophobicContact CE2-CD1 3.22Å; Y72-L76 PolarHBondContact O-N 3.06Å; Y72-T117 WeakPolarHBondContact CE1-OG1 3.25Å; Y72-T117 PolarHBondContact OH-OG1 3.46Å; Y72-F118 HydrophobicContact CD1-CD1 4.02Å; Y72-F118 HydrophobicContact CD1-CE1 4.29Å; Y72-F118 AromaticContact CE1-CD1 3.35Å; Y72-F118 HydrophobicContact CE1-CD1 3.35Å; Y72-F118 AromaticContact CE1-CE1 3.48Å; Y72-F118 HydrophobicContact CE1-CE1 3.48Å; Y72-F118 VanDerWaalsContact CE1-CE1 3.48Å; Y72-F118 HydrophobicContact CE1-CG 4.48Å; Y72-F118 AromaticContact CZ-CE1 3.69Å; Y72-F124 AromaticContact CD1-CD2 3.73Å; Y72-F124 HydrophobicContact CD1-CD2 3.73Å; Y72-F124 AromaticContact CD1-CE2 3.79Å; Y72-F124 HydrophobicContact CD1-CE2 3.79Å; Y72-F124 HydrophobicContact CD2-CD2 4.43Å; Y72-F124 AromaticContact CD2-CE2 3.96Å; Y72-F124 HydrophobicContact CD2-CE2 3.96Å; Y72-F124 HydrophobicContact CE1-CD2 4.05Å; Y72-F124 HydrophobicContact CE1-CE2 4.44Å; Y72-F124 AromaticContact CG-CD2 3.95Å; Y72-F124 HydrophobicContact CG-CD2 3.95Å; Y72-F124 AromaticContact CG-CE2 3.51Å; Y72-F124 HydrophobicContact CG-CE2 3.51Å; Y72-M127 HydrophobicContact CE2-CE 3.88Å
73V92.8Very high93.1Very high22 Ų2256.5 Ų56.513%0.13329%0.29CS..Iπ-helixtrans-58.8-47.7176.6160.30000111.4F69 N70 L75 E77 K78F69-V73 HydrophobicContact CE1-CG2 4.14Å; F69-V73 HydrophobicContact CE2-CG2 4.39Å; F69-V73 HydrophobicContact CZ-CG2 4.07Å; F69-V73 PolarHBondContact O-N 3.16Å; N70-V73 PolarHBondContact O-N 2.83Å; V73-L75 VanDerWaalsContact C-N 3.28Å; V73-L75 PolarHBondContact O-N 3.43Å; V73-E77 HydrophobicContact CG1-CB 4.26Å; V73-E77 WeakPolarHBondContact CG1-OE2 3.29Å; V73-E77 WeakPolarHBondContact O-CA 3.49Å; V73-E77 VanDerWaalsContact O-CB 3.29Å; V73-E77 WeakPolarHBondContact O-CB 3.04Å; V73-E77 PolarHBondContact O-N 2.83Å; V73-K78 PolarHBondContact O-N 3.45Å
74E94.5Very high92.9Very high106 Ų10648.6 Ų48.650%0.49525%0.249SC..Iπ-helixtrans-63.1-35.5178.5-67.2-70.7147.700112.8N70 E71 Y72 K78N70-E74 VanDerWaalsContact O-CG 3.23Å; N70-E74 WeakPolarHBondContact O-CG 3.23Å; N70-E74 PolarHBondContact O-N 2.98Å; E71-E74 PolarHBondContact O-N 2.6Å; Y72-E74 PolarHBondContact O-N 3.06Å; E74-K78 WeakPolarHBondContact OE1-CE 3.48Å; E74-K78 IonicContact OE1-NZ 3.79Å; E74-K78 PolarHBondContact OE1-NZ 3.03Å; E74-K78 WeakPolarHBondContact OE2-CD 3.32Å; E74-K78 VanDerWaalsContact OE2-CE 3.25Å; E74-K78 WeakPolarHBondContact OE2-CE 3.39Å; E74-K78 IonicContact OE2-NZ 2.83Å; E74-K78 PolarHBondContact OE2-NZ 2.94Å
75L94.7Very high92.6Very high71 Ų7151.1 Ų51.137%0.37226%0.257SS..Iπ-helixtrans-83.3-33.1-173.5-165.980.5000113.1V43 F47 E71 Y72 V73 P79V43-L75 HydrophobicContact CG1-CD1 4.25Å; V43-L75 HydrophobicContact CG1-CD2 3.41Å; V43-L75 VanDerWaalsContact CG1-CD2 3.41Å; V43-L75 HydrophobicContact CG1-CG 3.56Å; F47-L75 HydrophobicContact CB-CD2 4.01Å; F47-L75 HydrophobicContact CD2-CD2 3.72Å; F47-L75 HydrophobicContact CG-CD2 4.12Å; E71-L75 WeakPolarHBondContact O-CB 3.34Å; E71-L75 PolarHBondContact O-N 3.5Å; Y72-L75 PolarHBondContact O-N 2.99Å; V73-L75 VanDerWaalsContact C-N 3.28Å; V73-L75 PolarHBondContact O-N 3.43Å; L75-P79 WeakPolarHBondContact O-CG 3.26Å
76L91.8Very high92.3Very high2 Ų258.5 Ų58.51%0.0129%0.29CS..Iπ-helixtrans-123.1-42.6-170.1-68.5168.3000113.6F40 V43 Q44 Y72 L80 F118F40-L76 HydrophobicContact CD2-CD2 4.12Å; F40-L76 HydrophobicContact CE1-CD2 4.08Å; F40-L76 HydrophobicContact CE2-CB 4.34Å; F40-L76 HydrophobicContact CE2-CD2 3.61Å; F40-L76 HydrophobicContact CZ-CB 4.24Å; F40-L76 HydrophobicContact CZ-CD2 3.57Å; F40-L76 HydrophobicContact CZ-CG 4.38Å; V43-L76 HydrophobicContact CB-CD2 4.3Å; V43-L76 HydrophobicContact CG1-CD2 3.77Å; V43-L76 HydrophobicContact CG1-CG 4.44Å; Q44-L76 HydrophobicContact CB-CD1 4.01Å; Q44-L76 HydrophobicContact CB-CD2 4.21Å; Q44-L76 HydrophobicContact CG-CD1 3.97Å; Y72-L76 HydrophobicContact CD2-CD1 3.59Å; Y72-L76 HydrophobicContact CE2-CD1 3.22Å; Y72-L76 PolarHBondContact O-N 3.06Å; L76-L80 WeakPolarHBondContact O-CB 3.33Å; L76-L80 PolarHBondContact O-N 3.41Å; L76-F118 HydrophobicContact CB-CE1 3.65Å; L76-F118 HydrophobicContact CB-CZ 4.11Å
77E91.5Very high91.8Very high31 Ų3159.9 Ų59.915%0.14529%0.289CS..Iπ-helixtrans-70.4-48.4179.1-170.4-161.1163.500110.9V73 L80 E81 F118V73-E77 HydrophobicContact CG1-CB 4.26Å; V73-E77 WeakPolarHBondContact CG1-OE2 3.29Å; V73-E77 WeakPolarHBondContact O-CA 3.49Å; V73-E77 VanDerWaalsContact O-CB 3.29Å; V73-E77 WeakPolarHBondContact O-CB 3.04Å; V73-E77 PolarHBondContact O-N 2.83Å; E77-L80 WeakPolarHBondContact O-CB 3.36Å; E77-L80 PolarHBondContact O-N 3.19Å; E77-L80 VanDerWaalsContact O-N 3.16Å; E77-E81 PolarHBondContact O-N 3.33Å; E77-F118 HydrophobicContact CB-CB 4.13Å; E77-F118 HydrophobicContact CB-CD1 3.68Å; E77-F118 HydrophobicContact CB-CD2 4.43Å; E77-F118 HydrophobicContact CB-CE1 4.21Å; E77-F118 HydrophobicContact CB-CG 3.83Å; E77-F118 HydrophobicContact CG-CB 3.86Å; E77-F118 HydrophobicContact CG-CD1 4.29Å; E77-F118 HydrophobicContact CG-CD2 4.29Å; E77-F118 HydrophobicContact CG-CG 3.91Å
78K89.8Confident91.2Very high82 Ų8255.8 Ų55.836%0.35727%0.267SS..Hα-helixtrans-61.8-45.5-175.9-73-167.1178.5178.70114V73 E74 L80 E81 E82V73-K78 PolarHBondContact O-N 3.45Å; E74-K78 WeakPolarHBondContact OE1-CE 3.48Å; E74-K78 IonicContact OE1-NZ 3.79Å; E74-K78 PolarHBondContact OE1-NZ 3.03Å; E74-K78 WeakPolarHBondContact OE2-CD 3.32Å; E74-K78 VanDerWaalsContact OE2-CE 3.25Å; E74-K78 WeakPolarHBondContact OE2-CE 3.39Å; E74-K78 IonicContact OE2-NZ 2.83Å; E74-K78 PolarHBondContact OE2-NZ 2.94Å; K78-L80 VanDerWaalsContact C-N 3.26Å; K78-L80 PolarHBondContact O-N 2.89Å; K78-E81 PolarHBondContact O-N 3.46Å; K78-E82 WeakPolarHBondContact O-CG 3.35Å; K78-E82 PolarHBondContact O-N 3.09Å
79P90.1Very high90.4Very high66 Ų6661.3 Ų61.343%0.42930%0.303SS..Hα-helixtrans-62-36.1175.4-25.637.4000112.7L75 Y83L75-P79 WeakPolarHBondContact O-CG 3.26Å; P79-Y83 WeakPolarHBondContact O-CB 3.44Å; P79-Y83 PolarHBondContact O-N 2.95Å
80L89.8Confident89.7Confident1 Ų163.7 Ų63.71%0.00534%0.337CS..Hα-helixtrans-63.5-49.5174.8177.363.5000110.9I31 I34 L76 E77 K78 E82 Y83 L84 L115 F118I31-L80 HydrophobicContact CG1-CD1 4.41Å; I34-L80 HydrophobicContact CB-CD1 4.3Å; I34-L80 HydrophobicContact CD1-CD1 3.37Å; I34-L80 HydrophobicContact CG1-CD1 4.47Å; I34-L80 HydrophobicContact CG2-CD1 4.17Å; L76-L80 WeakPolarHBondContact O-CB 3.33Å; L76-L80 PolarHBondContact O-N 3.41Å; E77-L80 WeakPolarHBondContact O-CB 3.36Å; E77-L80 PolarHBondContact O-N 3.19Å; E77-L80 VanDerWaalsContact O-N 3.16Å; K78-L80 VanDerWaalsContact C-N 3.26Å; K78-L80 PolarHBondContact O-N 2.89Å; L80-E82 PolarHBondContact O-N 3.35Å; L80-Y83 PolarHBondContact O-N 2.9Å; L80-L84 HydrophobicContact CD1-CD1 4.38Å; L80-L84 HydrophobicContact CD1-CG 4.45Å; L80-L84 HydrophobicContact CG-CD1 4.29Å; L80-L84 WeakPolarHBondContact O-CG 3.42Å; L80-L84 PolarHBondContact O-N 3.42Å; L80-L115 HydrophobicContact CD2-CD2 3.85Å; L80-F118 HydrophobicContact CD2-CD2 4.35Å; L80-F118 HydrophobicContact CD2-CE2 3.62Å; L80-F118 HydrophobicContact CD2-CZ 4.34Å
81E88.9Confident89.1Confident51 Ų5161 Ų6124%0.23832%0.322CS..Hα-helixtrans-57-47.6175.8-176.3-177.1-168.600111.2E77 K78 Y83 L84 M85 F91 M93E77-E81 PolarHBondContact O-N 3.33Å; K78-E81 PolarHBondContact O-N 3.46Å; E81-Y83 VanDerWaalsContact C-N 3.3Å; E81-Y83 PolarHBondContact O-N 2.59Å; E81-L84 PolarHBondContact O-N 3.37Å; E81-M85 HydrophobicContact CG-CE 3.67Å; E81-M85 HydrophobicContact CG-SD 4.34Å; E81-M85 WeakPolarHBondContact O-CB 3.32Å; E81-M85 WeakPolarHBondContact O-CG 3.45Å; E81-M85 PolarHBondContact O-N 2.74Å; E81-M85 WeakPolarHBondContact OE1-CE 3.28Å; E81-F91 HydrophobicContact CG-CE1 4.43Å; E81-M93 HydrophobicContact CG-SD 4.41Å
82E88.9Confident88.5Confident110 Ų11061.9 Ų61.951%0.51433%0.328SS..Hα-helixtrans-60.8-38.4178-77.3-170.3-168.900112.8K78 L80 K86K78-E82 WeakPolarHBondContact O-CG 3.35Å; K78-E82 PolarHBondContact O-N 3.09Å; L80-E82 PolarHBondContact O-N 3.35Å; E82-K86 WeakPolarHBondContact O-CD 3.35Å; E82-K86 VanDerWaalsContact O-CG 3.24Å; E82-K86 WeakPolarHBondContact O-CG 3.28Å; E82-K86 PolarHBondContact O-N 3.2Å; E82-K86 VanDerWaalsContact O-N 3.17Å; E82-K86 IonicContact OE2-NZ 3.02Å; E82-K86 PolarHBondContact OE2-NZ 2.96Å
83Y88Confident87.7Confident48 Ų4863.2 Ų63.219%0.18834%0.335CS..Hα-helixtrans-66.4-46.7176.3-178.4-83.5000111C30 E33 I34 P79 L80 E81 M85 K86 K87C30-Y83 HydrophobicContact CB-CE1 4.31Å; E33-Y83 PolarHBondContact OE2-OH 3.22Å; I34-Y83 HydrophobicContact CD1-CD1 3.01Å; I34-Y83 HydrophobicContact CD1-CD2 4.33Å; I34-Y83 HydrophobicContact CD1-CE1 3.36Å; I34-Y83 HydrophobicContact CD1-CG 3.52Å; I34-Y83 HydrophobicContact CG1-CD1 3.58Å; I34-Y83 HydrophobicContact CG1-CD2 4.19Å; I34-Y83 HydrophobicContact CG1-CE1 3.51Å; I34-Y83 HydrophobicContact CG1-CE2 4.2Å; I34-Y83 HydrophobicContact CG1-CG 3.87Å; P79-Y83 WeakPolarHBondContact O-CB 3.44Å; P79-Y83 PolarHBondContact O-N 2.95Å; L80-Y83 PolarHBondContact O-N 2.9Å; E81-Y83 VanDerWaalsContact C-N 3.3Å; E81-Y83 PolarHBondContact O-N 2.59Å; Y83-M85 VanDerWaalsContact C-N 3.33Å; Y83-M85 PolarHBondContact O-N 3.43Å; Y83-K86 WeakPolarHBondContact O-CB 3.42Å; Y83-K86 PolarHBondContact O-N 3.26Å; Y83-K86 VanDerWaalsContact O-N 3.11Å; Y83-K87 HydrophobicContact CD1-CG 3.93Å; Y83-K87 HydrophobicContact CE1-CD 4.39Å; Y83-K87 HydrophobicContact CE1-CG 3.61Å; Y83-K87 PolarHBondContact O-N 3.35Å; Y83-K87 VanDerWaalsContact OH-CE 3.25Å; Y83-K87 WeakPolarHBondContact OH-CE 3.35Å; Y83-K87 PolarHBondContact OH-NZ 2.83Å
84L88.5Confident87.3Confident0 Ų065 Ų650%035%0.352CS..Hα-helixtrans-61.8-41.6178.8-67.1175.6000111.5C30 I31 L80 E81 K86 K87 I88 F91C30-L84 HydrophobicContact CB-CD2 3.93Å; I31-L84 HydrophobicContact CD1-CD1 4.14Å; I31-L84 HydrophobicContact CG1-CD1 3.98Å; I31-L84 HydrophobicContact CG1-CD2 3.85Å; I31-L84 HydrophobicContact CG1-CG 4.46Å; L80-L84 HydrophobicContact CD1-CD1 4.38Å; L80-L84 HydrophobicContact CD1-CG 4.45Å; L80-L84 HydrophobicContact CG-CD1 4.29Å; L80-L84 WeakPolarHBondContact O-CG 3.42Å; L80-L84 PolarHBondContact O-N 3.42Å; E81-L84 PolarHBondContact O-N 3.37Å; L84-K86 VanDerWaalsContact C-N 3.29Å; L84-K86 PolarHBondContact O-N 3.15Å; L84-K87 PolarHBondContact O-N 3.47Å; L84-I88 WeakPolarHBondContact O-CB 3.47Å; L84-I88 PolarHBondContact O-N 3.16Å; L84-F91 HydrophobicContact CB-CD1 4.15Å; L84-F91 HydrophobicContact CB-CD2 4.24Å; L84-F91 HydrophobicContact CB-CE1 3.92Å; L84-F91 HydrophobicContact CB-CE2 4.01Å; L84-F91 HydrophobicContact CB-CG 4.3Å; L84-F91 HydrophobicContact CB-CZ 3.84Å; L84-F91 HydrophobicContact CD1-CE1 4.3Å; L84-F91 HydrophobicContact CD1-CE2 4.04Å; L84-F91 HydrophobicContact CD1-CZ 3.63Å; L84-F91 HydrophobicContact CG-CZ 4.38Å
85M88.6Confident86.7Confident90 Ų9063.4 Ų63.444%0.44335%0.352SS..Hα-helixtrans-61.5-34.4174.2-73.8-174.6179.500113.5E81 Y83 F91E81-M85 HydrophobicContact CG-CE 3.67Å; E81-M85 HydrophobicContact CG-SD 4.34Å; E81-M85 WeakPolarHBondContact O-CB 3.32Å; E81-M85 WeakPolarHBondContact O-CG 3.45Å; E81-M85 PolarHBondContact O-N 2.74Å; E81-M85 WeakPolarHBondContact OE1-CE 3.28Å; Y83-M85 VanDerWaalsContact C-N 3.33Å; Y83-M85 PolarHBondContact O-N 3.43Å; M85-F91 HydrophobicContact CE-CD1 4.46Å; M85-F91 HydrophobicContact CG-CB 4.35Å; M85-F91 HydrophobicContact CG-CD1 3.71Å; M85-F91 HydrophobicContact CG-CG 4.47Å
86K88.3Confident86.2Confident157 Ų15760.4 Ų60.468%0.68334%0.336SS*.Hα-helixtrans-73.2-34.2176.7-73163.6-170.2153.30112E82 Y83 L84E82-K86 WeakPolarHBondContact O-CD 3.35Å; E82-K86 VanDerWaalsContact O-CG 3.24Å; E82-K86 WeakPolarHBondContact O-CG 3.28Å; E82-K86 PolarHBondContact O-N 3.2Å; E82-K86 VanDerWaalsContact O-N 3.17Å; E82-K86 IonicContact OE2-NZ 3.02Å; E82-K86 PolarHBondContact OE2-NZ 2.96Å; Y83-K86 WeakPolarHBondContact O-CB 3.42Å; Y83-K86 PolarHBondContact O-N 3.26Å; Y83-K86 VanDerWaalsContact O-N 3.11Å; L84-K86 VanDerWaalsContact C-N 3.29Å; L84-K86 PolarHBondContact O-N 3.15Å
87K84.6Confident85.8Confident108 Ų10862.7 Ų62.747%0.4735%0.35SS..Hα-helixtrans-84.5-34.9-177.6-71.1-73.3-179.3123.80113.1E33 Y83 L84E33-K87 IonicContact OE2-NZ 2.75Å; Y83-K87 HydrophobicContact CD1-CG 3.93Å; Y83-K87 HydrophobicContact CE1-CD 4.39Å; Y83-K87 HydrophobicContact CE1-CG 3.61Å; Y83-K87 PolarHBondContact O-N 3.35Å; Y83-K87 VanDerWaalsContact OH-CE 3.25Å; Y83-K87 WeakPolarHBondContact OH-CE 3.35Å; Y83-K87 PolarHBondContact OH-NZ 2.83Å; L84-K87 PolarHBondContact O-N 3.47Å
88I83Confident85.5Confident40 Ų4067.1 Ų67.121%0.20537%0.371CS..SBendtrans-117.4102.4-172.8-54.7175.7000108.8L27 L84 G90 F91L27-I88 HydrophobicContact CB-CD1 3.8Å; L27-I88 HydrophobicContact CD1-CD1 3.91Å; L27-I88 HydrophobicContact CG-CD1 3.7Å; L84-I88 WeakPolarHBondContact O-CB 3.47Å; L84-I88 PolarHBondContact O-N 3.16Å; I88-G90 PolarHBondContact O-N 3.41Å; I88-F91 HydrophobicContact CB-CB 4.1Å; I88-F91 HydrophobicContact CB-CD2 4.42Å; I88-F91 HydrophobicContact CD1-CD2 4.24Å; I88-F91 HydrophobicContact CG2-CB 4.25Å; I88-F91 VanDerWaalsContact O-CB 3.28Å; I88-F91 WeakPolarHBondContact O-CB 3.46Å; I88-F91 PolarHBondContact O-N 2.92Å; I88-F91 VanDerWaalsContact O-N 3.11Å
89P81.8Confident85.2Confident125 Ų12565.5 Ų65.581%0.81237%0.366SS*.THydrogen-bonded Turntrans-59.6127.8177-22.933.3000111.6F91P89-F91 VanDerWaalsContact C-N 3.33Å
90G81.4Confident85Confident82 Ų8262.7 Ų62.785%0.84535%0.347SS*.THydrogen-bonded Turntrans79.512.8-178.900000114.5I88 N92I88-G90 PolarHBondContact O-N 3.41Å; G90-N92 PolarHBondContact O-N 3.02Å
91F83.1Confident84.8Confident26 Ų2666.8 Ų66.811%0.11437%0.368CS..  trans-53137.8172.5-177.9-97.8000111.9L27 E81 L84 M85 I88 P89 M93 F96L27-F91 HydrophobicContact CD1-CD2 4.21Å; L27-F91 HydrophobicContact CD1-CE2 3.77Å; L27-F91 HydrophobicContact CG-CE2 4.42Å; E81-F91 HydrophobicContact CG-CE1 4.43Å; L84-F91 HydrophobicContact CB-CD1 4.15Å; L84-F91 HydrophobicContact CB-CD2 4.24Å; L84-F91 HydrophobicContact CB-CE1 3.92Å; L84-F91 HydrophobicContact CB-CE2 4.01Å; L84-F91 HydrophobicContact CB-CG 4.3Å; L84-F91 HydrophobicContact CB-CZ 3.84Å; L84-F91 HydrophobicContact CD1-CE1 4.3Å; L84-F91 HydrophobicContact CD1-CE2 4.04Å; L84-F91 HydrophobicContact CD1-CZ 3.63Å; L84-F91 HydrophobicContact CG-CZ 4.38Å; M85-F91 HydrophobicContact CE-CD1 4.46Å; M85-F91 HydrophobicContact CG-CB 4.35Å; M85-F91 HydrophobicContact CG-CD1 3.71Å; M85-F91 HydrophobicContact CG-CG 4.47Å; I88-F91 HydrophobicContact CB-CB 4.1Å; I88-F91 HydrophobicContact CB-CD2 4.42Å; I88-F91 HydrophobicContact CD1-CD2 4.24Å; I88-F91 HydrophobicContact CG2-CB 4.25Å; I88-F91 VanDerWaalsContact O-CB 3.28Å; I88-F91 WeakPolarHBondContact O-CB 3.46Å; I88-F91 PolarHBondContact O-N 2.92Å; I88-F91 VanDerWaalsContact O-N 3.11Å; P89-F91 VanDerWaalsContact C-N 3.33Å; F91-M93 HydrophobicContact CE1-CB 4.39Å; F91-M93 HydrophobicContact CE1-SD 3.48Å; F91-M93 WeakPolarHBondContact CE1-SD 3.5Å; F91-M93 HydrophobicContact CZ-SD 3.43Å; F91-M93 WeakPolarHBondContact CZ-SD 3.43Å; F91-F96 HydrophobicContact CE2-CB 3.85Å; F91-F96 HydrophobicContact CE2-CG 4.12Å; F91-F96 HydrophobicContact CZ-CB 3.86Å; F91-F96 HydrophobicContact CZ-CD1 4.23Å; F91-F96 HydrophobicContact CZ-CG 4.07Å
92N81.9Confident84.7Confident81 Ų8171.4 Ų71.443%0.43339%0.389SS..  trans-137.8125.7176.1179.9-80.1000109.2G90 A94 S95 F96G90-N92 PolarHBondContact O-N 3.02Å; N92-A94 VanDerWaalsContact C-N 3.33Å; N92-A94 PolarHBondContact O-N 2.81Å; N92-A94 WeakPolarHBondContact OD1-CA 3.37Å; N92-A94 WeakPolarHBondContact OD1-CB 3.24Å; N92-A94 PolarHBondContact OD1-N 3.3Å; N92-S95 PolarHBondContact O-N 3.13Å; N92-S95 PolarHBondContact OD1-N 3.22Å; N92-F96 PolarHBondContact O-N 2.67Å
93M80.7Confident84.5Confident29 Ų2967.9 Ų67.914%0.14337%0.373CS..Hα-helixtrans-65.3-36-174.6-152.556.4173.800112.7E81 F91 S95 F96 T97E81-M93 HydrophobicContact CG-SD 4.41Å; F91-M93 HydrophobicContact CE1-CB 4.39Å; F91-M93 HydrophobicContact CE1-SD 3.48Å; F91-M93 WeakPolarHBondContact CE1-SD 3.5Å; F91-M93 HydrophobicContact CZ-SD 3.43Å; F91-M93 WeakPolarHBondContact CZ-SD 3.43Å; M93-S95 PolarHBondContact O-N 3.11Å; M93-F96 HydrophobicContact CE-CD1 3.86Å; M93-F96 HydrophobicContact CE-CE1 4.06Å; M93-F96 WeakPolarHBondContact O-CB 3.25Å; M93-F96 PolarHBondContact O-N 2.91Å; M93-F96 HydrophobicContact SD-CD1 3.68Å; M93-F96 HydrophobicContact SD-CE1 4.44Å; M93-F96 HydrophobicContact SD-CG 4.49Å; M93-T97 PolarHBondContact O-N 2.88Å; M93-T97 PolarHBondContact O-OG1 3.03Å
94A82.5Confident84.3Confident59 Ų5970.9 Ų70.949%0.48839%0.387SS..Hα-helixtrans-69.3-33.4178.200000113.2N92 Q98N92-A94 VanDerWaalsContact C-N 3.33Å; N92-A94 PolarHBondContact O-N 2.81Å; N92-A94 WeakPolarHBondContact OD1-CA 3.37Å; N92-A94 WeakPolarHBondContact OD1-CB 3.24Å; N92-A94 PolarHBondContact OD1-N 3.3Å; A94-Q98 PolarHBondContact O-N 3.21Å; A94-Q98 PolarHBondContact O-NE2 2.95Å
95S83.4Confident84.2Confident72 Ų7279.4 Ų79.450%0.50343%0.426SS..Hα-helixtrans-69.9-40.1170.9-62.90000111.3N92 M93 Q98 L99N92-S95 PolarHBondContact O-N 3.13Å; N92-S95 PolarHBondContact OD1-N 3.22Å; M93-S95 PolarHBondContact O-N 3.11Å; S95-Q98 PolarHBondContact O-N 3.36Å; S95-L99 PolarHBondContact O-N 3.17Å; S95-L99 VanDerWaalsContact O-N 3.1Å
96F84.2Confident84.1Confident9 Ų980.4 Ų80.44%0.03943%0.43CS..Hα-helixtrans-61.6-46.8176.1167.8-116.1000112.2L27 I31 F91 N92 M93 Q98 L99 L100 L115L27-F96 HydrophobicContact CD1-CD2 3.72Å; L27-F96 HydrophobicContact CD1-CE2 4.3Å; L27-F96 HydrophobicContact CD1-CG 4.47Å; L27-F96 HydrophobicContact CD2-CD2 3.45Å; L27-F96 VanDerWaalsContact CD2-CD2 3.45Å; L27-F96 HydrophobicContact CD2-CE2 3.14Å; L27-F96 HydrophobicContact CD2-CG 4.46Å; L27-F96 HydrophobicContact CD2-CZ 3.93Å; L27-F96 HydrophobicContact CG-CD2 4.25Å; L27-F96 HydrophobicContact CG-CE2 4.36Å; I31-F96 HydrophobicContact CD1-CE1 4.19Å; I31-F96 HydrophobicContact CD1-CE2 3.97Å; I31-F96 HydrophobicContact CD1-CZ 3.45Å; I31-F96 VanDerWaalsContact CD1-CZ 3.45Å; F91-F96 HydrophobicContact CE2-CB 3.85Å; F91-F96 HydrophobicContact CE2-CG 4.12Å; F91-F96 HydrophobicContact CZ-CB 3.86Å; F91-F96 HydrophobicContact CZ-CD1 4.23Å; F91-F96 HydrophobicContact CZ-CG 4.07Å; N92-F96 PolarHBondContact O-N 2.67Å; M93-F96 HydrophobicContact CE-CD1 3.86Å; M93-F96 HydrophobicContact CE-CE1 4.06Å; M93-F96 WeakPolarHBondContact O-CB 3.25Å; M93-F96 PolarHBondContact O-N 2.91Å; M93-F96 HydrophobicContact SD-CD1 3.68Å; M93-F96 HydrophobicContact SD-CE1 4.44Å; M93-F96 HydrophobicContact SD-CG 4.49Å; F96-Q98 VanDerWaalsContact C-N 3.27Å; F96-Q98 PolarHBondContact O-N 3.43Å; F96-L99 PolarHBondContact O-N 3.31Å; F96-L99 VanDerWaalsContact O-N 3.14Å; F96-L100 HydrophobicContact CE1-CD2 4.3Å; F96-L100 HydrophobicContact CE2-CB 4.14Å; F96-L100 HydrophobicContact CE2-CD1 4.24Å; F96-L100 HydrophobicContact CZ-CB 4.29Å; F96-L100 HydrophobicContact CZ-CD1 4.14Å; F96-L100 HydrophobicContact CZ-CD2 4Å; F96-L100 HydrophobicContact CZ-CG 4.38Å; F96-L100 WeakPolarHBondContact O-CB 3.36Å; F96-L100 PolarHBondContact O-N 3.39Å; F96-L115 HydrophobicContact CZ-CD1 4.09Å
97T83.7Confident84.1Confident49 Ų4973.2 Ų73.230%0.30140%0.399SS..Hα-helixtrans-58.3-39.9178.7-51.70000112.1M93 L100 M101M93-T97 PolarHBondContact O-N 2.88Å; M93-T97 PolarHBondContact O-OG1 3.03Å; T97-L100 PolarHBondContact O-N 2.89Å; T97-M101 WeakPolarHBondContact O-CG 3.49Å; T97-M101 PolarHBondContact O-N 3.17Å; T97-M101 VanDerWaalsContact O-N 3.13Å
98Q84.3Confident84.3Confident124 Ų12471.3 Ų71.358%0.57940%0.398SS*.Hα-helixtrans-63.2-48.5175.9-76.6168.873.700111.3A94 S95 F96 L100 M101 E102A94-Q98 PolarHBondContact O-N 3.21Å; A94-Q98 PolarHBondContact O-NE2 2.95Å; S95-Q98 PolarHBondContact O-N 3.36Å; F96-Q98 VanDerWaalsContact C-N 3.27Å; F96-Q98 PolarHBondContact O-N 3.43Å; Q98-L100 VanDerWaalsContact C-N 3.32Å; Q98-L100 PolarHBondContact O-N 2.84Å; Q98-M101 PolarHBondContact O-N 3.4Å; Q98-M101 VanDerWaalsContact O-N 3.15Å; Q98-E102 WeakPolarHBondContact O-CG 3.1Å; Q98-E102 PolarHBondContact O-N 3.43Å
99L83.4Confident84.5Confident48 Ų4875.2 Ų75.225%0.25142%0.419SS..Hα-helixtrans-62.5-39.8179.8-166.866.3000111.8F24 S95 F96 M101 E102 H103F24-L99 HydrophobicContact CB-CD2 4.05Å; F24-L99 HydrophobicContact CD2-CB 4.46Å; F24-L99 HydrophobicContact CD2-CD2 3.46Å; F24-L99 VanDerWaalsContact CD2-CD2 3.46Å; F24-L99 HydrophobicContact CD2-CG 3.53Å; F24-L99 HydrophobicContact CE2-CD2 4.3Å; F24-L99 HydrophobicContact CE2-CG 3.99Å; F24-L99 HydrophobicContact CG-CD2 4.15Å; F24-L99 HydrophobicContact CG-CG 4.26Å; S95-L99 PolarHBondContact O-N 3.17Å; S95-L99 VanDerWaalsContact O-N 3.1Å; F96-L99 PolarHBondContact O-N 3.31Å; F96-L99 VanDerWaalsContact O-N 3.14Å; L99-M101 VanDerWaalsContact C-N 3.31Å; L99-M101 PolarHBondContact O-N 3.24Å; L99-E102 PolarHBondContact O-N 2.97Å; L99-H103 VanDerWaalsContact CD1-CD2 3.5Å; L99-H103 WeakPolarHBondContact CD1-CD2 3.4Å; L99-H103 PolarHBondContact O-CD2 3.2Å; L99-H103 PolarHBondContact O-N 3.36Å
100L86.3Confident84.8Confident8 Ų876 Ų764%0.04242%0.417CS..Hα-helixtrans-61.1-38.5175.5-174.168.6000112I28 F96 T97 Q98 K104 V107 F112 L115I28-L100 HydrophobicContact CD1-CD1 4.19Å; F96-L100 HydrophobicContact CE1-CD2 4.3Å; F96-L100 HydrophobicContact CE2-CB 4.14Å; F96-L100 HydrophobicContact CE2-CD1 4.24Å; F96-L100 HydrophobicContact CZ-CB 4.29Å; F96-L100 HydrophobicContact CZ-CD1 4.14Å; F96-L100 HydrophobicContact CZ-CD2 4Å; F96-L100 HydrophobicContact CZ-CG 4.38Å; F96-L100 WeakPolarHBondContact O-CB 3.36Å; F96-L100 PolarHBondContact O-N 3.39Å; T97-L100 PolarHBondContact O-N 2.89Å; Q98-L100 VanDerWaalsContact C-N 3.32Å; Q98-L100 PolarHBondContact O-N 2.84Å; L100-K104 WeakPolarHBondContact O-CA 3.4Å; L100-K104 PolarHBondContact O-N 3Å; L100-K104 VanDerWaalsContact O-N 3.15Å; L100-V107 HydrophobicContact CD1-CG2 3.95Å; L100-F112 HydrophobicContact CD1-CD2 4.15Å; L100-F112 HydrophobicContact CD2-CD2 4.5Å; L100-F112 HydrophobicContact CD2-CE2 4.49Å; L100-F112 HydrophobicContact CG-CD2 4.08Å; L100-F112 HydrophobicContact CG-CE2 4.02Å; L100-L115 HydrophobicContact CD1-CD1 4Å; L100-L115 HydrophobicContact CD2-CB 4.08Å; L100-L115 HydrophobicContact CD2-CD1 3.93Å
101M85.8Confident85.1Confident87 Ų8772.8 Ų72.843%0.42938%0.38SS..Hα-helixtrans-72.9-35.8176.8-67.2-59.9107.500112.6T97 Q98 L99 F112T97-M101 WeakPolarHBondContact O-CG 3.49Å; T97-M101 PolarHBondContact O-N 3.17Å; T97-M101 VanDerWaalsContact O-N 3.13Å; Q98-M101 PolarHBondContact O-N 3.4Å; Q98-M101 VanDerWaalsContact O-N 3.15Å; L99-M101 VanDerWaalsContact C-N 3.31Å; L99-M101 PolarHBondContact O-N 3.24Å; M101-F112 HydrophobicContact CE-CE2 3.41Å; M101-F112 VanDerWaalsContact CE-CE2 3.41Å; M101-F112 HydrophobicContact CE-CZ 3.37Å; M101-F112 HydrophobicContact SD-CE2 4.44Å; M101-F112 HydrophobicContact SD-CZ 4.07Å
102E86.3Confident85.5Confident148 Ų14873 Ų7369%0.69238%0.381SS*.Hα-helixtrans-68.6-38.8177.6-73.5179.2172.300112.1Q98 L99Q98-E102 WeakPolarHBondContact O-CG 3.1Å; Q98-E102 PolarHBondContact O-N 3.43Å; L99-E102 PolarHBondContact O-N 2.97Å
103H84.7Confident85.9Confident36 Ų3673.4 Ų73.417%0.16738%0.383CS..THydrogen-bonded Turntrans-105.224.7-177.5-65.7-87.2000113.5F24 L99 E105 E106F24-H103 HydrophobicContact CD1-CB 3.97Å; F24-H103 HydrophobicContact CE1-CB 3.37Å; F24-H103 HydrophobicContact CE2-CB 4.28Å; F24-H103 HydrophobicContact CZ-CB 3.53Å; L99-H103 VanDerWaalsContact CD1-CD2 3.5Å; L99-H103 WeakPolarHBondContact CD1-CD2 3.4Å; L99-H103 PolarHBondContact O-CD2 3.2Å; L99-H103 PolarHBondContact O-N 3.36Å; H103-E105 PolarHBondContact O-N 3.22Å; H103-E106 IonicContact CE1-OE1 3.82Å; H103-E106 IonicContact CG-OE1 2.84Å; H103-E106 IonicContact ND1-OE1 2.8Å; H103-E106 PolarHBondContact ND1-OE1 2.82Å; H103-E106 IonicContact ND1-OE2 3.78Å; H103-E106 WeakPolarHBondContact O-CB 3.47Å; H103-E106 PolarHBondContact O-N 3Å
104K84.6Confident86.4Confident110 Ų11073 Ų7348%0.47838%0.381SS..G310 helixtrans-54.1-31.4-176.171.6175.2-171.4168.90113.8L100 E106 V107 F112L100-K104 WeakPolarHBondContact O-CA 3.4Å; L100-K104 PolarHBondContact O-N 3Å; L100-K104 VanDerWaalsContact O-N 3.15Å; K104-E106 PolarHBondContact O-N 3.07Å; K104-V107 PolarHBondContact O-N 3.12Å; K104-F112 HydrophobicContact CB-CD2 4.16Å; K104-F112 HydrophobicContact CB-CE2 3.61Å; K104-F112 HydrophobicContact CB-CZ 4.07Å
105E86.5Confident86.8Confident179 Ų17970.6 Ų70.684%0.83636%0.36SS*.G310 helixtrans-75.8-13.1-177.3-58.3-171.6168.500112.7H103H103-E105 PolarHBondContact O-N 3.22Å
106E86Confident87.2Confident112 Ų11269.3 Ų69.352%0.52335%0.347SS..G310 helixtrans-96.5-12.7179.7-60.9172.4-139.800112.1H103 K104H103-E106 IonicContact CE1-OE1 3.82Å; H103-E106 IonicContact CG-OE1 2.84Å; H103-E106 IonicContact ND1-OE1 2.8Å; H103-E106 PolarHBondContact ND1-OE1 2.82Å; H103-E106 IonicContact ND1-OE2 3.78Å; H103-E106 WeakPolarHBondContact O-CB 3.47Å; H103-E106 PolarHBondContact O-N 3Å; K104-E106 PolarHBondContact O-N 3.07Å
107V87.6Confident87.6Confident5 Ų569.1 Ų69.13%0.0335%0.347CS..SBendtrans-95.6132.6-179.7-175.70000109.5F24 I28 L100 K104 D109 I111 F112F24-V107 HydrophobicContact CE1-CG2 3.92Å; F24-V107 HydrophobicContact CZ-CG2 3.58Å; I28-V107 HydrophobicContact CD1-CG1 4.32Å; I28-V107 HydrophobicContact CD1-CG2 3.75Å; I28-V107 HydrophobicContact CG1-CG2 4.13Å; L100-V107 HydrophobicContact CD1-CG2 3.95Å; K104-V107 PolarHBondContact O-N 3.12Å; V107-D109 PolarHBondContact O-N 2.98Å; V107-I111 HydrophobicContact CG1-CB 4.12Å; V107-I111 HydrophobicContact CG1-CG2 4.18Å; V107-F112 HydrophobicContact CB-CB 4.49Å; V107-F112 HydrophobicContact CG1-CB 4.1Å
108P88.6Confident88Confident68 Ų6867.1 Ų67.144%0.44233%0.334SS..  trans-54.3130.9172.2-25.631.7000112.2D110 I111 F112P108-D110 VanDerWaalsContact C-N 3.32Å; P108-D110 PolarHBondContact O-N 3.42Å; P108-I111 HydrophobicContact CB-CD1 3.63Å; P108-I111 HydrophobicContact CB-CG1 4.18Å; P108-I111 HydrophobicContact CG-CD1 3.54Å; P108-I111 WeakPolarHBondContact O-CB 3.24Å; P108-I111 PolarHBondContact O-N 3.06Å; P108-F112 PolarHBondContact O-N 3.38Å; P108-F112 VanDerWaalsContact O-N 3.07Å
109D88.5Confident88.2Confident123 Ų12365.3 Ų65.366%0.65833%0.331SS*.Hα-helixtrans-48.8-49.5-174-64.9-15.1000112.5V107 I111 F112 D113V107-D109 PolarHBondContact O-N 2.98Å; D109-I111 PolarHBondContact O-N 3.44Å; D109-I111 VanDerWaalsContact O-N 3.13Å; D109-F112 PolarHBondContact O-N 2.86Å; D109-D113 WeakPolarHBondContact O-CB 3.49Å; D109-D113 PolarHBondContact O-N 2.83Å
110D86.9Confident88.6Confident142 Ų14266.1 Ų66.176%0.75934%0.336SS*.Hα-helixtrans-56.8-34.3-179.7-61.7-21.6000113.5P108 M114P108-D110 VanDerWaalsContact C-N 3.32Å; P108-D110 PolarHBondContact O-N 3.42Å; D110-M114 VanDerWaalsContact O-CB 3.28Å; D110-M114 WeakPolarHBondContact O-CB 3.43Å; D110-M114 PolarHBondContact O-N 2.88Å
111I89.1Confident88.9Confident13 Ų1368 Ų687%0.06734%0.344CS..Hα-helixtrans-77.7-43.5178.7-57.5162.2000109.6I31 L32 I35 V107 P108 D109 M114 L115I31-I111 HydrophobicContact CG2-CG2 4.1Å; L32-I111 HydrophobicContact CD1-CD1 4.06Å; L32-I111 HydrophobicContact CD2-CD1 3.15Å; L32-I111 HydrophobicContact CD2-CG1 3.93Å; L32-I111 HydrophobicContact CG-CD1 3.56Å; I35-I111 HydrophobicContact CD1-CG2 4.15Å; V107-I111 HydrophobicContact CG1-CB 4.12Å; V107-I111 HydrophobicContact CG1-CG2 4.18Å; P108-I111 HydrophobicContact CB-CD1 3.63Å; P108-I111 HydrophobicContact CB-CG1 4.18Å; P108-I111 HydrophobicContact CG-CD1 3.54Å; P108-I111 WeakPolarHBondContact O-CB 3.24Å; P108-I111 PolarHBondContact O-N 3.06Å; D109-I111 PolarHBondContact O-N 3.44Å; D109-I111 VanDerWaalsContact O-N 3.13Å; I111-M114 PolarHBondContact O-N 3.44Å; I111-L115 HydrophobicContact CG2-CD1 3.89Å; I111-L115 HydrophobicContact CG2-CG 4.28Å; I111-L115 WeakPolarHBondContact O-CB 3.44Å; I111-L115 VanDerWaalsContact O-CG 3.24Å; I111-L115 WeakPolarHBondContact O-CG 3.49Å; I111-L115 PolarHBondContact O-N 2.91Å
112F90.4Very high89.3Confident31 Ų3169.1 Ų69.114%0.13635%0.349CS..Hα-helixtrans-60.8-48.3179-177.8-89.2000110.7L100 M101 K104 V107 P108 D109 M114 L115 L116L100-F112 HydrophobicContact CD1-CD2 4.15Å; L100-F112 HydrophobicContact CD2-CD2 4.5Å; L100-F112 HydrophobicContact CD2-CE2 4.49Å; L100-F112 HydrophobicContact CG-CD2 4.08Å; L100-F112 HydrophobicContact CG-CE2 4.02Å; M101-F112 HydrophobicContact CE-CE2 3.41Å; M101-F112 VanDerWaalsContact CE-CE2 3.41Å; M101-F112 HydrophobicContact CE-CZ 3.37Å; M101-F112 HydrophobicContact SD-CE2 4.44Å; M101-F112 HydrophobicContact SD-CZ 4.07Å; K104-F112 HydrophobicContact CB-CD2 4.16Å; K104-F112 HydrophobicContact CB-CE2 3.61Å; K104-F112 HydrophobicContact CB-CZ 4.07Å; V107-F112 HydrophobicContact CB-CB 4.49Å; V107-F112 HydrophobicContact CG1-CB 4.1Å; P108-F112 PolarHBondContact O-N 3.38Å; P108-F112 VanDerWaalsContact O-N 3.07Å; D109-F112 PolarHBondContact O-N 2.86Å; F112-M114 VanDerWaalsContact C-N 3.31Å; F112-M114 PolarHBondContact O-N 2.75Å; F112-L115 PolarHBondContact O-N 3.05Å; F112-L116 HydrophobicContact CE1-CD2 4.34Å; F112-L116 WeakPolarHBondContact O-CB 3.36Å; F112-L116 PolarHBondContact O-N 3.34Å
113D90.6Very high89.7Confident90 Ų9062.8 Ų62.848%0.48132%0.323SS..Hα-helixtrans-60-44.2178.1-70.9-18.5000110.8D109 L116 T117D109-D113 WeakPolarHBondContact O-CB 3.49Å; D109-D113 PolarHBondContact O-N 2.83Å; D113-L116 WeakPolarHBondContact O-CB 3.28Å; D113-L116 PolarHBondContact O-N 3.36Å; D113-T117 VanDerWaalsContact O-CG2 3.28Å; D113-T117 WeakPolarHBondContact O-CG2 3.29Å; D113-T117 PolarHBondContact O-N 3.19Å; D113-T117 VanDerWaalsContact O-N 3.15Å
114M90.4Very high90.2Very high21 Ų2161.1 Ų61.110%0.10332%0.315CS..Hα-helixtrans-61.8-45.8175.4-175.2-177.8143.800112.3I35 F40 D110 I111 F112 L116 T117 F118I35-M114 HydrophobicContact CD1-CE 3.65Å; I35-M114 HydrophobicContact CD1-SD 3.78Å; I35-M114 HydrophobicContact CG1-CE 3.7Å; I35-M114 HydrophobicContact CG1-SD 4.18Å; I35-M114 HydrophobicContact CG2-CE 4.11Å; I35-M114 HydrophobicContact CG2-SD 3.68Å; F40-M114 HydrophobicContact CD1-CE 4.34Å; F40-M114 HydrophobicContact CE1-CE 3.14Å; F40-M114 HydrophobicContact CE1-SD 4.28Å; F40-M114 HydrophobicContact CE2-CE 4.39Å; F40-M114 HydrophobicContact CZ-CE 3.17Å; D110-M114 VanDerWaalsContact O-CB 3.28Å; D110-M114 WeakPolarHBondContact O-CB 3.43Å; D110-M114 PolarHBondContact O-N 2.88Å; I111-M114 PolarHBondContact O-N 3.44Å; F112-M114 VanDerWaalsContact C-N 3.31Å; F112-M114 PolarHBondContact O-N 2.75Å; M114-L116 VanDerWaalsContact C-N 3.28Å; M114-L116 PolarHBondContact O-N 3.41Å; M114-T117 WeakPolarHBondContact O-CB 3.35Å; M114-T117 PolarHBondContact O-N 3.07Å; M114-T117 PolarHBondContact O-OG1 3.11Å; M114-F118 HydrophobicContact CE-CE2 4.41Å; M114-F118 HydrophobicContact CE-CZ 3.99Å
115L91.2Very high90.7Very high7 Ų756.9 Ų56.94%0.03730%0.296CS..Hα-helixtrans-64-36177.2-71.3170.8000111.6I31 L80 F96 L100 I111 F112 T117 F118I31-L115 HydrophobicContact CD1-CD1 4.12Å; I31-L115 HydrophobicContact CD1-CD2 4.26Å; I31-L115 HydrophobicContact CG2-CD1 4.38Å; I31-L115 HydrophobicContact CG2-CD2 4.14Å; L80-L115 HydrophobicContact CD2-CD2 3.85Å; F96-L115 HydrophobicContact CZ-CD1 4.09Å; L100-L115 HydrophobicContact CD1-CD1 4Å; L100-L115 HydrophobicContact CD2-CB 4.08Å; L100-L115 HydrophobicContact CD2-CD1 3.93Å; I111-L115 HydrophobicContact CG2-CD1 3.89Å; I111-L115 HydrophobicContact CG2-CG 4.28Å; I111-L115 WeakPolarHBondContact O-CB 3.44Å; I111-L115 VanDerWaalsContact O-CG 3.24Å; I111-L115 WeakPolarHBondContact O-CG 3.49Å; I111-L115 PolarHBondContact O-N 2.91Å; F112-L115 PolarHBondContact O-N 3.05Å; L115-T117 PolarHBondContact O-N 2.83Å; L115-F118 HydrophobicContact CD2-CD2 4.18Å; L115-F118 HydrophobicContact CD2-CE2 4.04Å; L115-F118 WeakPolarHBondContact O-CB 3.28Å; L115-F118 PolarHBondContact O-N 2.84Å; L115-F118 VanDerWaalsContact O-N 3.12Å
116L91.3Very high91.1Very high46 Ų4653.9 Ų53.924%0.24128%0.282CS..Hα-helixtrans-61.1-36.4177.2-171.961.5000110.9F112 D113 M114 F118 T119 D120 A123F112-L116 HydrophobicContact CE1-CD2 4.34Å; F112-L116 WeakPolarHBondContact O-CB 3.36Å; F112-L116 PolarHBondContact O-N 3.34Å; D113-L116 WeakPolarHBondContact O-CB 3.28Å; D113-L116 PolarHBondContact O-N 3.36Å; M114-L116 VanDerWaalsContact C-N 3.28Å; M114-L116 PolarHBondContact O-N 3.41Å; L116-F118 PolarHBondContact O-N 3.02Å; L116-T119 PolarHBondContact O-N 3.42Å; L116-T119 PolarHBondContact O-OG1 2.79Å; L116-D120 HydrophobicContact CD1-CB 3.83Å; L116-D120 HydrophobicContact CG-CB 3.89Å; L116-D120 WeakPolarHBondContact O-CB 3.43Å; L116-D120 PolarHBondContact O-N 3.42Å; L116-A123 HydrophobicContact CB-CB 4.37Å; L116-A123 HydrophobicContact CD2-CB 3.98Å; L116-A123 HydrophobicContact CG-CB 3.84Å
117T93.9Very high91.5Very high5 Ų550 Ų503%0.03126%0.264CS..Hα-helixtrans-60-18.2176.273.30000114.7F69 Y72 D113 M114 L115 A123 M127F69-T117 WeakPolarHBondContact CE2-O 3.03Å; Y72-T117 WeakPolarHBondContact CE1-OG1 3.25Å; Y72-T117 PolarHBondContact OH-OG1 3.46Å; D113-T117 VanDerWaalsContact O-CG2 3.28Å; D113-T117 WeakPolarHBondContact O-CG2 3.29Å; D113-T117 PolarHBondContact O-N 3.19Å; D113-T117 VanDerWaalsContact O-N 3.15Å; M114-T117 WeakPolarHBondContact O-CB 3.35Å; M114-T117 PolarHBondContact O-N 3.07Å; M114-T117 PolarHBondContact O-OG1 3.11Å; L115-T117 PolarHBondContact O-N 2.83Å; T117-A123 HydrophobicContact CG2-CB 4.44Å; T117-M127 HydrophobicContact CG2-CB 4.2Å; T117-M127 HydrophobicContact CG2-SD 4.06Å
118F91.5Very high91.9Very high7 Ų749.7 Ų49.73%0.03126%0.263CS..Hα-helixtrans-76.5-28175.1-62.1-45.9000112.7F40 F69 Y72 L76 E77 L80 M114 L115 L116F40-F118 HydrophobicContact CZ-CZ 4.45Å; F69-F118 WeakPolarHBondContact CZ-O 3.47Å; Y72-F118 HydrophobicContact CD1-CD1 4.02Å; Y72-F118 HydrophobicContact CD1-CE1 4.29Å; Y72-F118 AromaticContact CE1-CD1 3.35Å; Y72-F118 HydrophobicContact CE1-CD1 3.35Å; Y72-F118 AromaticContact CE1-CE1 3.48Å; Y72-F118 HydrophobicContact CE1-CE1 3.48Å; Y72-F118 VanDerWaalsContact CE1-CE1 3.48Å; Y72-F118 HydrophobicContact CE1-CG 4.48Å; Y72-F118 AromaticContact CZ-CE1 3.69Å; L76-F118 HydrophobicContact CB-CE1 3.65Å; L76-F118 HydrophobicContact CB-CZ 4.11Å; E77-F118 HydrophobicContact CB-CB 4.13Å; E77-F118 HydrophobicContact CB-CD1 3.68Å; E77-F118 HydrophobicContact CB-CD2 4.43Å; E77-F118 HydrophobicContact CB-CE1 4.21Å; E77-F118 HydrophobicContact CB-CG 3.83Å; E77-F118 HydrophobicContact CG-CB 3.86Å; E77-F118 HydrophobicContact CG-CD1 4.29Å; E77-F118 HydrophobicContact CG-CD2 4.29Å; E77-F118 HydrophobicContact CG-CG 3.91Å; L80-F118 HydrophobicContact CD2-CD2 4.35Å; L80-F118 HydrophobicContact CD2-CE2 3.62Å; L80-F118 HydrophobicContact CD2-CZ 4.34Å; M114-F118 HydrophobicContact CE-CE2 4.41Å; M114-F118 HydrophobicContact CE-CZ 3.99Å; L115-F118 HydrophobicContact CD2-CD2 4.18Å; L115-F118 HydrophobicContact CD2-CE2 4.04Å; L115-F118 WeakPolarHBondContact O-CB 3.28Å; L115-F118 PolarHBondContact O-N 2.84Å; L115-F118 VanDerWaalsContact O-N 3.12Å; L116-F118 PolarHBondContact O-N 3.02Å
119T88.9Confident92.2Very high86 Ų8647.9 Ų47.953%0.52825%0.25SS..Hα-helixtrans-114.7-26.4-172.1630000113.5L116L116-T119 PolarHBondContact O-N 3.42Å; L116-T119 PolarHBondContact O-OG1 2.79Å
120D91.9Very high92.4Very high64 Ų6447.7 Ų47.734%0.34225%0.246SC..  trans-108.8115.2-177.9-169.4-67.1000110.4L116 M122 A123 F124L116-D120 HydrophobicContact CD1-CB 3.83Å; L116-D120 HydrophobicContact CG-CB 3.89Å; L116-D120 WeakPolarHBondContact O-CB 3.43Å; L116-D120 PolarHBondContact O-N 3.42Å; D120-M122 VanDerWaalsContact C-N 3.29Å; D120-M122 PolarHBondContact O-N 3.03Å; D120-M122 VanDerWaalsContact OD1-CA 3.29Å; D120-M122 WeakPolarHBondContact OD1-CA 3.48Å; D120-M122 VanDerWaalsContact OD1-CB 3.28Å; D120-M122 WeakPolarHBondContact OD1-CB 3.46Å; D120-M122 PolarHBondContact OD1-N 3.01Å; D120-A123 HydrophobicContact CB-CB 3.99Å; D120-A123 PolarHBondContact O-N 3.46Å; D120-A123 PolarHBondContact OD1-N 3.1Å; D120-F124 WeakPolarHBondContact O-CB 3.37Å; D120-F124 PolarHBondContact O-N 2.88Å
121F93.3Very high92.7Very high48 Ų4843 Ų4321%0.21122%0.217CC..Hα-helixtrans-65.6-31.5-179.9176.4-96000112.9Y65 F69 F124 K125Y65-F121 AromaticContact CD2-CZ 3.97Å; Y65-F121 HydrophobicContact CD2-CZ 3.97Å; Y65-F121 HydrophobicContact CG-CZ 4.27Å; F69-F121 HydrophobicContact CB-CD2 4.22Å; F69-F121 HydrophobicContact CB-CE2 4.36Å; F69-F121 HydrophobicContact CD2-CD2 4.27Å; F69-F121 HydrophobicContact CG-CD2 4.09Å; F121-F124 HydrophobicContact CD2-CD1 4.14Å; F121-F124 HydrophobicContact CE2-CD1 4.18Å; F121-F124 HydrophobicContact CE2-CE1 4.38Å; F121-K125 HydrophobicContact CE1-CD 4.5Å; F121-K125 WeakPolarHBondContact O-CB 3.47Å; F121-K125 PolarHBondContact O-N 3.39Å
122M92.9Very high92.9Very high110 Ų11045.1 Ų45.154%0.54223%0.225SC..Hα-helixtrans-71.8-44.3178.6-64.5-60175.200110.6D120 F124 K125 E126D120-M122 VanDerWaalsContact C-N 3.29Å; D120-M122 PolarHBondContact O-N 3.03Å; D120-M122 VanDerWaalsContact OD1-CA 3.29Å; D120-M122 WeakPolarHBondContact OD1-CA 3.48Å; D120-M122 VanDerWaalsContact OD1-CB 3.28Å; D120-M122 WeakPolarHBondContact OD1-CB 3.46Å; D120-M122 PolarHBondContact OD1-N 3.01Å; M122-F124 VanDerWaalsContact C-N 3.3Å; M122-F124 PolarHBondContact O-N 3.45Å; M122-K125 PolarHBondContact O-N 3.3Å; M122-K125 VanDerWaalsContact O-N 3.16Å; M122-E126 WeakPolarHBondContact O-CB 3.35Å; M122-E126 PolarHBondContact O-N 3.48Å
123A94.7Very high93Very high16 Ų1644.8 Ų44.813%0.13223%0.228CC..Hα-helixtrans-59-43.1172.900000111.4L116 T117 D120 K125 E126 M127L116-A123 HydrophobicContact CB-CB 4.37Å; L116-A123 HydrophobicContact CD2-CB 3.98Å; L116-A123 HydrophobicContact CG-CB 3.84Å; T117-A123 HydrophobicContact CG2-CB 4.44Å; D120-A123 HydrophobicContact CB-CB 3.99Å; D120-A123 PolarHBondContact O-N 3.46Å; D120-A123 PolarHBondContact OD1-N 3.1Å; A123-K125 PolarHBondContact O-N 3.3Å; A123-E126 PolarHBondContact O-N 3.46Å; A123-M127 PolarHBondContact O-N 2.95Å
124F95.8Very high93Very high0 Ų043.6 Ų43.60%023%0.23CC..Hα-helixtrans-59.8-44.2173.9166.8-99.5000113.4F47 F55 I68 F69 Y72 D120 F121 M122 M127 F128F47-F124 HydrophobicContact CE1-CE2 4.47Å; F55-F124 HydrophobicContact CE1-CD1 4.35Å; F55-F124 AromaticContact CE1-CE1 3.8Å; F55-F124 HydrophobicContact CE1-CE1 3.8Å; F55-F124 HydrophobicContact CZ-CD1 4.42Å; F55-F124 AromaticContact CZ-CE1 3.49Å; F55-F124 HydrophobicContact CZ-CE1 3.49Å; F55-F124 VanDerWaalsContact CZ-CE1 3.49Å; F55-F124 AromaticContact CZ-CZ 3.88Å; F55-F124 HydrophobicContact CZ-CZ 3.88Å; I68-F124 HydrophobicContact CG2-CZ 4.11Å; F69-F124 HydrophobicContact CB-CD1 4.19Å; F69-F124 HydrophobicContact CB-CE1 3.74Å; F69-F124 HydrophobicContact CB-CZ 4.02Å; F69-F124 HydrophobicContact CD2-CB 3.88Å; F69-F124 AromaticContact CD2-CD1 3.5Å; F69-F124 HydrophobicContact CD2-CD1 3.5Å; F69-F124 AromaticContact CD2-CD2 3.72Å; F69-F124 HydrophobicContact CD2-CD2 3.72Å; F69-F124 AromaticContact CD2-CE1 3.83Å; F69-F124 HydrophobicContact CD2-CE1 3.83Å; F69-F124 HydrophobicContact CD2-CE2 4.04Å; F69-F124 AromaticContact CD2-CG 3.42Å; F69-F124 HydrophobicContact CD2-CG 3.42Å; F69-F124 VanDerWaalsContact CD2-CG 3.42Å; F69-F124 HydrophobicContact CD2-CZ 4.09Å; F69-F124 HydrophobicContact CE2-CB 3.83Å; F69-F124 HydrophobicContact CE2-CD1 4.32Å; F69-F124 HydrophobicContact CE2-CD2 4.22Å; F69-F124 AromaticContact CE2-CG 3.89Å; F69-F124 HydrophobicContact CE2-CG 3.89Å; F69-F124 HydrophobicContact CG-CD1 4.27Å; F69-F124 HydrophobicContact CG-CE1 4.28Å; Y72-F124 AromaticContact CD1-CD2 3.73Å; Y72-F124 HydrophobicContact CD1-CD2 3.73Å; Y72-F124 AromaticContact CD1-CE2 3.79Å; Y72-F124 HydrophobicContact CD1-CE2 3.79Å; Y72-F124 HydrophobicContact CD2-CD2 4.43Å; Y72-F124 AromaticContact CD2-CE2 3.96Å; Y72-F124 HydrophobicContact CD2-CE2 3.96Å; Y72-F124 HydrophobicContact CE1-CD2 4.05Å; Y72-F124 HydrophobicContact CE1-CE2 4.44Å; Y72-F124 AromaticContact CG-CD2 3.95Å; Y72-F124 HydrophobicContact CG-CD2 3.95Å; Y72-F124 AromaticContact CG-CE2 3.51Å; Y72-F124 HydrophobicContact CG-CE2 3.51Å; D120-F124 WeakPolarHBondContact O-CB 3.37Å; D120-F124 PolarHBondContact O-N 2.88Å; F121-F124 HydrophobicContact CD2-CD1 4.14Å; F121-F124 HydrophobicContact CE2-CD1 4.18Å; F121-F124 HydrophobicContact CE2-CE1 4.38Å; M122-F124 VanDerWaalsContact C-N 3.3Å; M122-F124 PolarHBondContact O-N 3.45Å; F124-M127 HydrophobicContact CD2-CE 3.87Å; F124-M127 HydrophobicContact CE2-CE 4.25Å; F124-F128 HydrophobicContact CD2-CD2 4.41Å; F124-F128 HydrophobicContact CD2-CE2 4.29Å; F124-F128 HydrophobicContact CE1-CD2 4.19Å; F124-F128 HydrophobicContact CE1-CE2 4.21Å; F124-F128 AromaticContact CE2-CD2 3.95Å; F124-F128 HydrophobicContact CE2-CD2 3.95Å; F124-F128 AromaticContact CE2-CE2 3.46Å; F124-F128 HydrophobicContact CE2-CE2 3.46Å; F124-F128 VanDerWaalsContact CE2-CE2 3.46Å; F124-F128 AromaticContact CZ-CD2 3.83Å; F124-F128 HydrophobicContact CZ-CD2 3.83Å; F124-F128 AromaticContact CZ-CE2 3.41Å; F124-F128 HydrophobicContact CZ-CE2 3.41Å; F124-F128 VanDerWaalsContact CZ-CE2 3.41Å; F124-F128 PolarHBondContact O-N 2.95Å
125K95.1Very high92.9Very high21 Ų2147.6 Ų47.69%0.09125%0.247CC..Hα-helixtrans-65.4-43.9177.4175.5-177.5175.5-1770111F55 S58 N61 F121 M122 A123 F128 V129F55-K125 HydrophobicContact CD1-CG 4.12Å; S58-K125 WeakPolarHBondContact O-CE 3.49Å; S58-K125 PolarHBondContact O-NZ 3.03Å; N61-K125 PolarHBondContact OD1-NZ 3.27Å; F121-K125 HydrophobicContact CE1-CD 4.5Å; F121-K125 WeakPolarHBondContact O-CB 3.47Å; F121-K125 PolarHBondContact O-N 3.39Å; M122-K125 PolarHBondContact O-N 3.3Å; M122-K125 VanDerWaalsContact O-N 3.16Å; A123-K125 PolarHBondContact O-N 3.3Å; K125-F128 WeakPolarHBondContact O-CB 3.41Å; K125-F128 PolarHBondContact O-N 2.99Å; K125-F128 VanDerWaalsContact O-N 3.14Å; K125-V129 WeakPolarHBondContact O-CG2 3.45Å; K125-V129 PolarHBondContact O-N 3.5Å
126E94.6Very high92.8Very high117 Ų11750.9 Ų50.955%0.54726%0.262SS..Hα-helixtrans-59.9-46.4179.1-173.7161.7-144.800110.9M122 A123 F128 V129 E130M122-E126 WeakPolarHBondContact O-CB 3.35Å; M122-E126 PolarHBondContact O-N 3.48Å; A123-E126 PolarHBondContact O-N 3.46Å; E126-F128 PolarHBondContact O-N 3.39Å; E126-F128 VanDerWaalsContact O-N 3.17Å; E126-V129 PolarHBondContact O-N 2.81Å; E126-E130 HydrophobicContact CG-CG 4.37Å; E126-E130 WeakPolarHBondContact O-CG 3.44Å; E126-E130 PolarHBondContact O-N 3.14Å
127M95.1Very high92.4Very high29 Ų2951.9 Ų51.914%0.14328%0.284CS..Hα-helixtrans-50.5-43.5172.5177-169.159.200112.2L48 Y72 T117 A123 F124 Y131L48-M127 HydrophobicContact CD2-CE 3.72Å; L48-M127 HydrophobicContact CD2-CG 4.46Å; L48-M127 HydrophobicContact CD2-SD 4.13Å; Y72-M127 HydrophobicContact CE2-CE 3.88Å; T117-M127 HydrophobicContact CG2-CB 4.2Å; T117-M127 HydrophobicContact CG2-SD 4.06Å; A123-M127 PolarHBondContact O-N 2.95Å; F124-M127 HydrophobicContact CD2-CE 3.87Å; F124-M127 HydrophobicContact CE2-CE 4.25Å; M127-Y131 WeakPolarHBondContact O-CB 3.37Å; M127-Y131 PolarHBondContact O-N 3.39Å
128F95.8Very high91.7Very high0 Ų059.1 Ų59.10%031%0.31CS..Hα-helixtrans-70.2-38.4177.7-93.6-70.2000113.6F47 L48 H51 F55 I68 F124 K125 E126 R132F47-F128 AromaticContact CD1-CZ 3.93Å; F47-F128 HydrophobicContact CD1-CZ 3.93Å; F47-F128 AromaticContact CE1-CE2 3.97Å; F47-F128 HydrophobicContact CE1-CE2 3.97Å; F47-F128 AromaticContact CE1-CZ 3.63Å; F47-F128 HydrophobicContact CE1-CZ 3.63Å; L48-F128 HydrophobicContact CB-CE1 4.43Å; L48-F128 HydrophobicContact CD2-CD1 3.91Å; L48-F128 HydrophobicContact CD2-CD2 4.36Å; L48-F128 HydrophobicContact CD2-CE1 3.59Å; L48-F128 HydrophobicContact CD2-CE2 4.01Å; L48-F128 HydrophobicContact CD2-CG 4.32Å; L48-F128 HydrophobicContact CD2-CZ 3.64Å; H51-F128 HydrophobicContact CB-CE1 3.59Å; H51-F128 HydrophobicContact CB-CZ 3.67Å; F55-F128 HydrophobicContact CB-CB 3.71Å; F55-F128 HydrophobicContact CB-CG 4.41Å; F55-F128 HydrophobicContact CD1-CB 3.81Å; F55-F128 HydrophobicContact CD1-CD2 4.35Å; F55-F128 HydrophobicContact CD1-CG 4.22Å; F55-F128 HydrophobicContact CD2-CB 3.65Å; F55-F128 AromaticContact CD2-CD1 3.62Å; F55-F128 HydrophobicContact CD2-CD1 3.62Å; F55-F128 AromaticContact CD2-CD2 3.81Å; F55-F128 HydrophobicContact CD2-CD2 3.81Å; F55-F128 HydrophobicContact CD2-CE1 4.12Å; F55-F128 HydrophobicContact CD2-CE2 4.32Å; F55-F128 AromaticContact CD2-CG 3.41Å; F55-F128 HydrophobicContact CD2-CG 3.41Å; F55-F128 VanDerWaalsContact CD2-CG 3.41Å; F55-F128 HydrophobicContact CD2-CZ 4.44Å; F55-F128 HydrophobicContact CE1-CB 4.34Å; F55-F128 HydrophobicContact CE1-CD2 4.05Å; F55-F128 HydrophobicContact CE1-CG 4.37Å; F55-F128 HydrophobicContact CE2-CB 4.21Å; F55-F128 AromaticContact CE2-CD1 3.93Å; F55-F128 HydrophobicContact CE2-CD1 3.93Å; F55-F128 AromaticContact CE2-CD2 3.47Å; F55-F128 HydrophobicContact CE2-CD2 3.47Å; F55-F128 VanDerWaalsContact CE2-CD2 3.47Å; F55-F128 HydrophobicContact CE2-CE1 4.06Å; F55-F128 AromaticContact CE2-CE2 3.66Å; F55-F128 HydrophobicContact CE2-CE2 3.66Å; F55-F128 AromaticContact CE2-CG 3.6Å; F55-F128 HydrophobicContact CE2-CG 3.6Å; F55-F128 AromaticContact CE2-CZ 3.93Å; F55-F128 HydrophobicContact CE2-CZ 3.93Å; F55-F128 HydrophobicContact CG-CB 3.43Å; F55-F128 VanDerWaalsContact CG-CB 3.43Å; F55-F128 HydrophobicContact CG-CD1 4.29Å; F55-F128 HydrophobicContact CG-CD2 4.24Å; F55-F128 AromaticContact CG-CG 3.75Å; F55-F128 HydrophobicContact CG-CG 3.75Å; F55-F128 AromaticContact CZ-CD2 3.61Å; F55-F128 HydrophobicContact CZ-CD2 3.61Å; F55-F128 AromaticContact CZ-CE2 3.93Å; F55-F128 HydrophobicContact CZ-CE2 3.93Å; F55-F128 HydrophobicContact CZ-CG 4.09Å; I68-F128 HydrophobicContact CG2-CE2 4.43Å; I68-F128 HydrophobicContact CG2-CZ 4.37Å; F124-F128 HydrophobicContact CD2-CD2 4.41Å; F124-F128 HydrophobicContact CD2-CE2 4.29Å; F124-F128 HydrophobicContact CE1-CD2 4.19Å; F124-F128 HydrophobicContact CE1-CE2 4.21Å; F124-F128 AromaticContact CE2-CD2 3.95Å; F124-F128 HydrophobicContact CE2-CD2 3.95Å; F124-F128 AromaticContact CE2-CE2 3.46Å; F124-F128 HydrophobicContact CE2-CE2 3.46Å; F124-F128 VanDerWaalsContact CE2-CE2 3.46Å; F124-F128 AromaticContact CZ-CD2 3.83Å; F124-F128 HydrophobicContact CZ-CD2 3.83Å; F124-F128 AromaticContact CZ-CE2 3.41Å; F124-F128 HydrophobicContact CZ-CE2 3.41Å; F124-F128 VanDerWaalsContact CZ-CE2 3.41Å; F124-F128 PolarHBondContact O-N 2.95Å; K125-F128 WeakPolarHBondContact O-CB 3.41Å; K125-F128 PolarHBondContact O-N 2.99Å; K125-F128 VanDerWaalsContact O-N 3.14Å; E126-F128 PolarHBondContact O-N 3.39Å; E126-F128 VanDerWaalsContact O-N 3.17Å; F128-R132 VanDerWaalsContact O-CB 3.27Å; F128-R132 WeakPolarHBondContact O-CB 3.32Å; F128-R132 PolarHBondContact O-N 2.9Å
129V93.9Very high90.3Very high29 Ų2960.3 Ų60.318%0.17633%0.325CS..Hα-helixtrans-64.5-45.4176.5171.40000110.2E57 K125 E126 R132 A133E57-V129 HydrophobicContact CB-CG1 4.03Å; E57-V129 HydrophobicContact CG-CG1 4.09Å; K125-V129 WeakPolarHBondContact O-CG2 3.45Å; K125-V129 PolarHBondContact O-N 3.5Å; E126-V129 PolarHBondContact O-N 2.81Å; V129-R132 PolarHBondContact O-N 2.97Å; V129-A133 WeakPolarHBondContact O-CB 3.43Å; V129-A133 PolarHBondContact O-N 3.07Å
130E92.7Very high88.8Confident120 Ų12064 Ų6456%0.56134%0.341SS*.Hα-helixtrans-62.8-47175.2-69.9-177.7162.200111.8E126 R132 A133 A134E126-E130 HydrophobicContact CG-CG 4.37Å; E126-E130 WeakPolarHBondContact O-CG 3.44Å; E126-E130 PolarHBondContact O-N 3.14Å; E130-R132 VanDerWaalsContact C-N 3.3Å; E130-R132 PolarHBondContact O-N 3.29Å; E130-A133 WeakPolarHBondContact O-CB 3.42Å; E130-A133 PolarHBondContact O-N 3.22Å; E130-A133 VanDerWaalsContact O-N 3.14Å; E130-A134 WeakPolarHBondContact O-CB 3.32Å; E130-A134 PolarHBondContact O-N 3.1Å
131Y94Very high86.8Confident43 Ų4365.8 Ų65.817%0.16935%0.35CS..Hα-helixtrans-59.3-43177.5-172.2-93.2000111.8L48 D49 Y52 M127 A134 K135L48-Y131 HydrophobicContact CB-CD1 3.95Å; L48-Y131 HydrophobicContact CB-CD2 4.15Å; L48-Y131 HydrophobicContact CB-CE1 3.74Å; L48-Y131 HydrophobicContact CB-CE2 3.93Å; L48-Y131 HydrophobicContact CB-CG 4.13Å; L48-Y131 HydrophobicContact CD1-CD2 3.6Å; L48-Y131 HydrophobicContact CD1-CE2 3.74Å; L48-Y131 HydrophobicContact CD1-CG 4.13Å; L48-Y131 HydrophobicContact CG-CD2 4.44Å; L48-Y131 HydrophobicContact CG-CE2 4.5Å; D49-Y131 VanDerWaalsContact CG-OH 3.28Å; D49-Y131 PolarHBondContact OD1-OH 3.01Å; Y52-Y131 HydrophobicContact CD1-CE1 4.46Å; Y52-Y131 HydrophobicContact CG-CD1 4.21Å; Y52-Y131 HydrophobicContact CG-CE1 4.39Å; M127-Y131 WeakPolarHBondContact O-CB 3.37Å; M127-Y131 PolarHBondContact O-N 3.39Å; Y131-A134 PolarHBondContact O-N 3.48Å; Y131-K135 HydrophobicContact CD1-CG 4.05Å; Y131-K135 HydrophobicContact CE1-CD 4.32Å; Y131-K135 HydrophobicContact CE1-CG 3.74Å; Y131-K135 WeakPolarHBondContact O-CB 3.49Å; Y131-K135 WeakPolarHBondContact O-CG 3.47Å; Y131-K135 PolarHBondContact O-N 3.38Å; Y131-K135 WeakPolarHBondContact OH-CE 3.36Å; Y131-K135 PolarHBondContact OH-NZ 3.07Å
132R93.1Very high84.8Confident58 Ų5869.3 Ų69.322%0.21937%0.371CS..Hα-helixtrans-62.8-45.6174.4177.1174.2-176.4-174.7-0.2111.5Y52 F55 F128 V129 E130 A134 K135 E136Y52-R132 HydrophobicContact CD2-CB 3.89Å; Y52-R132 HydrophobicContact CD2-CG 3.88Å; Y52-R132 HydrophobicContact CE2-CG 4.43Å; F55-R132 WeakPolarHBondContact O-CD 3.42Å; F55-R132 PolarHBondContact O-NH1 3.18Å; F128-R132 VanDerWaalsContact O-CB 3.27Å; F128-R132 WeakPolarHBondContact O-CB 3.32Å; F128-R132 PolarHBondContact O-N 2.9Å; V129-R132 PolarHBondContact O-N 2.97Å; E130-R132 VanDerWaalsContact C-N 3.3Å; E130-R132 PolarHBondContact O-N 3.29Å; R132-A134 VanDerWaalsContact C-N 3.33Å; R132-A134 PolarHBondContact O-N 3.24Å; R132-K135 PolarHBondContact O-N 2.97Å; R132-E136 HydrophobicContact CG-CG 4.45Å; R132-E136 WeakPolarHBondContact CG-OE1 3.34Å; R132-E136 IonicContact CZ-OE1 2.64Å; R132-E136 IonicContact NE-OE1 3.19Å; R132-E136 PolarHBondContact NE-OE1 3.01Å; R132-E136 IonicContact NH2-OE1 3.59Å; R132-E136 PolarHBondContact NH2-OE1 3.11Å; R132-E136 WeakPolarHBondContact O-CB 3.46Å; R132-E136 WeakPolarHBondContact O-CG 3.5Å; R132-E136 PolarHBondContact O-N 3.41Å
133A91.6Very high83Confident24 Ų2468.1 Ų68.120%0.19837%0.373CS..Hα-helixtrans-59.4-44.8177.400000111.1V129 E130 E136 G137 R138 G139V129-A133 WeakPolarHBondContact O-CB 3.43Å; V129-A133 PolarHBondContact O-N 3.07Å; E130-A133 WeakPolarHBondContact O-CB 3.42Å; E130-A133 PolarHBondContact O-N 3.22Å; E130-A133 VanDerWaalsContact O-N 3.14Å; A133-E136 PolarHBondContact O-N 3.15Å; A133-G137 PolarHBondContact O-N 3.15Å; A133-R138 HydrophobicContact CB-CB 4.2Å; A133-R138 CarbonylContact O-C 3.53Å; A133-R138 WeakPolarHBondContact O-CA 3.4Å; A133-R138 PolarHBondContact O-N 2.95Å; A133-G139 PolarHBondContact O-N 3.41Å
134A90.5Very high81Confident64 Ų6474.2 Ų74.253%0.52940%0.399SS..Hα-helixtrans-60.5-46.6175.400000112.3E130 Y131 R132 E136 G137E130-A134 WeakPolarHBondContact O-CB 3.32Å; E130-A134 PolarHBondContact O-N 3.1Å; Y131-A134 PolarHBondContact O-N 3.48Å; R132-A134 VanDerWaalsContact C-N 3.33Å; R132-A134 PolarHBondContact O-N 3.24Å; A134-E136 VanDerWaalsContact C-N 3.32Å; A134-E136 PolarHBondContact O-N 3.13Å; A134-G137 PolarHBondContact O-N 3.5Å; A134-G137 VanDerWaalsContact O-N 3.16Å
135K89.6Confident78.9Confident106 Ų10681 Ų8146%0.46144%0.435SS..Hα-helixtrans-62.6-35.3177.7-77.2-74.2-172.71630113.6D49 Y52 Y131 R132 G137D49-K135 WeakPolarHBondContact OD1-CE 3.46Å; D49-K135 IonicContact OD1-NZ 3.74Å; D49-K135 PolarHBondContact OD1-NZ 3.26Å; D49-K135 IonicContact OD2-NZ 3.8Å; Y52-K135 HydrophobicContact CE2-CB 4.32Å; Y131-K135 HydrophobicContact CD1-CG 4.05Å; Y131-K135 HydrophobicContact CE1-CD 4.32Å; Y131-K135 HydrophobicContact CE1-CG 3.74Å; Y131-K135 WeakPolarHBondContact O-CB 3.49Å; Y131-K135 WeakPolarHBondContact O-CG 3.47Å; Y131-K135 PolarHBondContact O-N 3.38Å; Y131-K135 WeakPolarHBondContact OH-CE 3.36Å; Y131-K135 PolarHBondContact OH-NZ 3.07Å; R132-K135 PolarHBondContact O-N 2.97Å; K135-G137 VanDerWaalsContact C-N 3.27Å
136E89.6Confident76.9Confident75 Ų7586.8 Ų86.835%0.3547%0.466SS..THydrogen-bonded Turntrans-87.86.5179.3-65.7-173.9-153.300113R132 A133 A134 R138R132-E136 HydrophobicContact CG-CG 4.45Å; R132-E136 WeakPolarHBondContact CG-OE1 3.34Å; R132-E136 IonicContact CZ-OE1 2.64Å; R132-E136 IonicContact NE-OE1 3.19Å; R132-E136 PolarHBondContact NE-OE1 3.01Å; R132-E136 IonicContact NH2-OE1 3.59Å; R132-E136 PolarHBondContact NH2-OE1 3.11Å; R132-E136 WeakPolarHBondContact O-CB 3.46Å; R132-E136 WeakPolarHBondContact O-CG 3.5Å; R132-E136 PolarHBondContact O-N 3.41Å; A133-E136 PolarHBondContact O-N 3.15Å; A134-E136 VanDerWaalsContact C-N 3.32Å; A134-E136 PolarHBondContact O-N 3.13Å; E136-R138 PolarHBondContact O-N 3.03Å; E136-R138 IonicContact OE1-NH2 2.64Å; E136-R138 IonicContact OE2-CZ 2.88Å; E136-R138 IonicContact OE2-NH1 2.76Å; E136-R138 PolarHBondContact OE2-NH1 2.83Å; E136-R138 IonicContact OE2-NH2 3.46Å; E136-R138 PolarHBondContact OE2-NH2 3.28Å
137G82.3Confident74.9Confident68 Ų6888.1 Ų88.170%0.70148%0.476SS*.THydrogen-bonded Turntrans69.420.7179.500000113.9A133 A134 K135A133-G137 PolarHBondContact O-N 3.15Å; A134-G137 PolarHBondContact O-N 3.5Å; A134-G137 VanDerWaalsContact O-N 3.16Å; K135-G137 VanDerWaalsContact C-N 3.27Å
138R78.1Confident73.1Confident156 Ų15692.5 Ų92.559%0.58951%0.505SS*.  trans-96.2-7.5172.9-63.2-159.3-74.7-92.42.1113.2A133 E136A133-R138 HydrophobicContact CB-CB 4.2Å; A133-R138 CarbonylContact O-C 3.53Å; A133-R138 WeakPolarHBondContact O-CA 3.4Å; A133-R138 PolarHBondContact O-N 2.95Å; E136-R138 PolarHBondContact O-N 3.03Å; E136-R138 IonicContact OE1-NH2 2.64Å; E136-R138 IonicContact OE2-CZ 2.88Å; E136-R138 IonicContact OE2-NH1 2.76Å; E136-R138 PolarHBondContact OE2-NH1 2.83Å; E136-R138 IonicContact OE2-NH2 3.46Å; E136-R138 PolarHBondContact OE2-NH2 3.28Å
139G63.5Low71.8Confident33 Ų3398 Ų9834%0.3454%0.539SS..SBendtrans-69.3160.1173.200000112.5A133 D141A133-G139 PolarHBondContact O-N 3.41Å; G139-D141 PolarHBondContact O-N 3.4Å; G139-D141 VanDerWaalsContact O-N 3.17Å
140L56.4Low70.1Confident163 Ų163101.9 Ų101.985%0.85356%0.564SS**  trans-56.6119.1177.8-68.2169.6000110.3L142L140-L142 VanDerWaalsContact C-N 3.32Å; L140-L142 PolarHBondContact O-N 3.02Å
141D50.4Low68.5Low101 Ų101104.3 Ų104.354%0.5458%0.58SS.*  trans-73.685.9172.1179.122.7000109.5G139 S143 Q144G139-D141 PolarHBondContact O-N 3.4Å; G139-D141 VanDerWaalsContact O-N 3.17Å; D141-S143 PolarHBondContact O-N 3.16Å; D141-S143 WeakPolarHBondContact OD1-CB 3.38Å; D141-S143 PolarHBondContact OD1-N 3.36Å; D141-S143 PolarHBondContact OD1-OG 2.91Å; D141-S143 PolarHBondContact OD2-OG 3.14Å; D141-S143 VanDerWaalsContact OD2-OG 3.07Å; D141-Q144 PolarHBondContact O-N 2.78Å
142L51.5Low67.2Low123 Ų123109.2 Ų109.264%0.64461%0.609SS**G310 helixtrans-64.5-4.4177.3-65.1172.8000113.2L140 Q144 D145L140-L142 VanDerWaalsContact C-N 3.32Å; L140-L142 PolarHBondContact O-N 3.02Å; L142-Q144 PolarHBondContact O-N 3.19Å; L142-D145 PolarHBondContact O-N 2.97Å
143S55.7Low65.5Low85 Ų85111.7 Ų111.759%0.59463%0.633SS**G310 helixtrans-65.1-15.7174.777.60000113.2D141D141-S143 PolarHBondContact O-N 3.16Å; D141-S143 WeakPolarHBondContact OD1-CB 3.38Å; D141-S143 PolarHBondContact OD1-N 3.36Å; D141-S143 PolarHBondContact OD1-OG 2.91Å; D141-S143 PolarHBondContact OD2-OG 3.14Å; D141-S143 VanDerWaalsContact OD2-OG 3.07Å
144Q52.2Low63.8Low144 Ų144114.8 Ų114.867%0.67366%0.658SS**G310 helixtrans-89.1-19.7176.8-58.8-153.72000114.7D141 L142D141-Q144 PolarHBondContact O-N 2.78Å; L142-Q144 PolarHBondContact O-N 3.19Å
145D50.8Low62Low143 Ų143115.3 Ų115.377%0.76567%0.67SS**THydrogen-bonded Turntrans-88.7-15.1-178.4-87-19.8000113.5L142 L147L142-D145 PolarHBondContact O-N 2.97Å; D145-L147 PolarHBondContact O-N 3.31Å
146L53.8Low60.5Low142 Ų142116.3 Ų116.374%0.74369%0.69SS**  trans-96.753.6175.4-15275.4000112.2V148L146-V148 VanDerWaalsContact C-N 3.34Å; L146-V148 PolarHBondContact O-N 2.98Å
147L51.5Low58.7Low144 Ų144117.5 Ų117.575%0.75471%0.713SS**  trans-73.790.1167.7-74.2174000109.7D145 T149D145-L147 PolarHBondContact O-N 3.31Å; L147-T149 VanDerWaalsContact C-N 3.32Å; L147-T149 PolarHBondContact O-N 3.13Å
148V59.1Low57.1Low122 Ų122117.5 Ų117.574%0.73971%0.713SS**  trans-62.997.2166-179.20000107.7L146 P150L146-V148 VanDerWaalsContact C-N 3.34Å; L146-V148 PolarHBondContact O-N 2.98Å; V148-P150 VanDerWaalsContact O-CD 3.23Å; V148-P150 WeakPolarHBondContact O-CD 3.27Å
149T67.9Low55.5Low116 Ų116119.1 Ų119.171%0.71273%0.727SS**  trans-77.7115.3172.1-48.60000107.4L147 L151L147-T149 VanDerWaalsContact C-N 3.32Å; L147-T149 PolarHBondContact O-N 3.13Å; T149-L151 PolarHBondContact O-N 3.38Å
150P57.6Low54.4Low110 Ų110130.5 Ų130.571%0.71477%0.772SS**  trans-63.1124.2175.824-31.5000109.6V148 N152V148-P150 VanDerWaalsContact O-CD 3.23Å; V148-P150 WeakPolarHBondContact O-CD 3.27Å; P150-N152 PolarHBondContact O-N 3.45Å
151L58.8Low54.3Low171 Ų171128.9 Ų128.990%0.89577%0.767SS**  trans-65.3103.8172.1-114.2133.2000108.1T149 P153T149-L151 PolarHBondContact O-N 3.38Å; L151-P153 WeakPolarHBondContact O-CD 3.34Å
152N67.3Low54.5Low145 Ų145130.4 Ų130.478%0.77578%0.779SS**  trans-69.9113.7173.3-169.519.9000108.3P150 A154P150-N152 PolarHBondContact O-N 3.45Å; N152-A154 PolarHBondContact O-N 3.16Å
153P56.8Low54.7Low110 Ų110130.8 Ų130.871%0.71479%0.787SS**  trans-68.7106.6174.427.3-29.7000107.7L151 G155L151-P153 WeakPolarHBondContact O-CD 3.34Å; P153-G155 PolarHBondContact O-N 3Å; P153-G155 VanDerWaalsContact O-N 3.15Å
154A55.6Low54.6Low89 Ų89133.5 Ų133.574%0.73680%0.798SS**  trans-49.7123.7173.500000109.3N152 S156N152-A154 PolarHBondContact O-N 3.16Å; A154-S156 PolarHBondContact O-N 3.37Å; A154-S156 VanDerWaalsContact O-N 3.16Å
155G53.4Low54.8Low75 Ų75132.8 Ų132.877%0.77381%0.806SS**  trans-51.1119.7-177.700000111.4P153 A157P153-G155 PolarHBondContact O-N 3Å; P153-G155 VanDerWaalsContact O-N 3.15Å; G155-A157 VanDerWaalsContact C-N 3.26Å; G155-A157 PolarHBondContact O-N 3.02Å
156S57.6Low55Low127 Ų127132.1 Ų132.189%0.88881%0.809SS**  trans-70.186.1163.4-26.20000107.8A154A154-S156 PolarHBondContact O-N 3.37Å; A154-S156 VanDerWaalsContact O-N 3.16Å
157A52.1Low55.1Low100 Ų100131.4 Ų131.483%0.82681%0.814SS**  trans-101.498.8155.800000104.7G155G155-A157 VanDerWaalsContact C-N 3.26Å; G155-A157 PolarHBondContact O-N 3.02Å
158G50Low55.4Low69 Ų69130.5 Ų130.571%0.71182%0.818SS**  102.198.558.700000105.6Q160G158-Q160 PolarHBondContact O-N 3.2Å
159H43.5Very low55.1Low190 Ų190131.2 Ų131.288%0.8883%0.825SS**  trans-54.9130.7173.7-81.468.7000110.7
160Q40.7Very low53.9Low272 Ų272132.5 Ų132.5100%1.27184%0.835SS**  -169.60126.2-103.6168.690.800110.6G158G158-Q160 PolarHBondContact O-N 3.2Å

Retrieved 160 of 160 residues in 456.4 ms (Link to these results)