A0A096LU87_POEFO Loading...

Protein max

AlphaFold DB , UniProt , Accession A0A096LU87, 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
1M57.2Low58.1Low249 Ų249146.5 Ų146.5100%1.22780%0.796SS**  099.70-76166.3164.400106.3
2S57.5Low57.8Low114 Ų114146.5 Ų146.580%0.79779%0.794SS**  trans-139.6120164.2-1690000104.1N4S2-N4 PolarHBondContact O-N 2.75Å
3D60.4Low57.4Low145 Ų145148.5 Ų148.578%0.77580%0.795SS**  trans-61.3128.2-169.9-59.4-70.9000110.7D5D3-D5 PolarHBondContact O-N 2.71Å
4N58.9Low57.2Low160 Ų160150.1 Ų150.186%0.85680%0.795SS**  trans-74.999168.9-116.151000105.8S2 D6S2-N4 PolarHBondContact O-N 2.75Å; N4-D6 PolarHBondContact O-N 3.46Å; N4-D6 VanDerWaalsContact O-N 3.1Å
5D61.2Low56.6Low148 Ų148144.1 Ų144.179%0.79177%0.771SS**  trans-63.7110164.4-78-44.3000107.6D3 I7D3-D5 PolarHBondContact O-N 2.71Å; D5-I7 PolarHBondContact O-N 3.4Å
6D63.1Low56.4Low149 Ų149143.1 Ų143.180%0.79777%0.774SS**  trans-54.1102.2165.2-108.8-23.4000107.4N4 E8N4-D6 PolarHBondContact O-N 3.46Å; N4-D6 VanDerWaalsContact O-N 3.1Å; D6-E8 PolarHBondContact O-N 3.28Å
7I61.2Low56.3Low146 Ų146146.4 Ų146.475%0.74977%0.773SS**  trans-67.597.2158.7-93.9162.7000104.9D5 V9D5-I7 PolarHBondContact O-N 3.4Å; I7-V9 HydrophobicContact CG2-CG2 3.84Å; I7-V9 PolarHBondContact O-N 3.31Å
8E60.3Low56.2Low176 Ų176150.7 Ų150.782%0.82278%0.779SS**  trans-59.696.2158.1-68.1-141.3174.300106.2D6 D10D6-E8 PolarHBondContact O-N 3.28Å; E8-D10 PolarHBondContact O-N 3.25Å
9V57.4Low56.6Low105 Ų105149.3 Ų149.364%0.63677%0.768SS**  trans-62.692.9158.7-175.80000103.7I7 S11I7-V9 HydrophobicContact CG2-CG2 3.84Å; I7-V9 PolarHBondContact O-N 3.31Å; V9-S11 VanDerWaalsContact CG1-OG 3.26Å; V9-S11 WeakPolarHBondContact CG1-OG 3.46Å; V9-S11 PolarHBondContact O-N 3.34Å
10D51.6Low57.8Low144 Ų144144.5 Ų144.577%0.7775%0.748SS**  trans-62.278.2156.2-153.916.6000104.3E8 D12E8-D10 PolarHBondContact O-N 3.25Å; D10-D12 PolarHBondContact O-N 2.97Å
11S50.6Low59.1Low76 Ų76143 Ų14353%0.53175%0.745SS.*  trans-62.196.5164.8-64.70000100.9V9 E13V9-S11 VanDerWaalsContact CG1-OG 3.26Å; V9-S11 WeakPolarHBondContact CG1-OG 3.46Å; V9-S11 PolarHBondContact O-N 3.34Å; S11-E13 PolarHBondContact O-N 3.32Å
12D54.7Low60.4Low146 Ų146133.9 Ų133.978%0.78171%0.71SS**  trans-48.885.4146.8-89.6-37.1000104.4D10 E14D10-D12 PolarHBondContact O-N 2.97Å; D12-E14 PolarHBondContact O-N 3.28Å
13E51.7Low61.9Low173 Ų173132.3 Ų132.381%0.80869%0.692SS**  trans-61.272.5151.7-82.8-152.6155.800104.2S11 S15S11-E13 PolarHBondContact O-N 3.32Å; E13-S15 PolarHBondContact O-N 3.01Å
14E55.5Low63.4Low170 Ų170132 Ų13279%0.79468%0.684SS**  trans-65.479.6152.2-163.9174.6-172.500104.4D12D12-E14 PolarHBondContact O-N 3.28Å
15S47.9Very low65.1Low61 Ų61131.9 Ų131.943%0.42767%0.672SS.*  trans-33.5133.4170.6-1690000108.2E13 R17E13-S15 PolarHBondContact O-N 3.01Å; S15-R17 PolarHBondContact O-N 3.47Å
16P52.8Low66.8Low127 Ų127127.6 Ų127.683%0.82566%0.657SS**  trans-73.160.7177.631.9-33.4000108.9Y18P16-Y18 VanDerWaalsContact C-N 3.33Å; P16-Y18 PolarHBondContact O-N 3.19Å
17R55.3Low68.3Low200 Ų200126.2 Ų126.276%0.75565%0.645SS**  trans-76.592.7175.8-75.8-162.2-176.5-153.55.1106.2S15 H19S15-R17 PolarHBondContact O-N 3.47Å; R17-H19 VanDerWaalsContact C-N 3.35Å; R17-H19 PolarHBondContact O-N 3.13Å
18Y54.9Low70.1Confident223 Ų223125.1 Ų125.188%0.87564%0.637SS**  trans18.975.5146.1-67.1-86.4000112.9P16 S20P16-Y18 VanDerWaalsContact C-N 3.33Å; P16-Y18 PolarHBondContact O-N 3.19Å; Y18-S20 VanDerWaalsContact C-N 3.34Å; Y18-S20 PolarHBondContact O-N 3.37Å
19H64.2Low71.9Confident125 Ų125121.1 Ų121.158%0.57962%0.621SS**  trans-55111.8164.1-75.9-26000105.6R17 D23 K24R17-H19 VanDerWaalsContact C-N 3.35Å; R17-H19 PolarHBondContact O-N 3.13Å; H19-D23 HydrophobicContact CB-CB 4.03Å; H19-K24 HydrophobicContact CB-CG 4.12Å
20S80.7Confident73.8Confident53 Ų53118.9 Ų118.937%0.37161%0.613SS.*  trans-58.1157.3-179690000107.5Y18 A22 D23 K24Y18-S20 VanDerWaalsContact C-N 3.34Å; Y18-S20 PolarHBondContact O-N 3.37Å; S20-A22 PolarHBondContact O-N 3.47Å; S20-A22 WeakPolarHBondContact OG-CB 3.17Å; S20-A22 PolarHBondContact OG-N 3.31Å; S20-D23 WeakPolarHBondContact CB-OD2 3.36Å; S20-D23 PolarHBondContact N-OD2 3.49Å; S20-D23 PolarHBondContact O-N 2.9Å; S20-D23 PolarHBondContact OG-N 3.16Å; S20-D23 VanDerWaalsContact OG-N 3.14Å; S20-D23 PolarHBondContact OG-OD2 3.33Å; S20-K24 PolarHBondContact O-N 3.43Å; S20-K24 VanDerWaalsContact O-N 3.1Å
21V83.4Confident76Confident112 Ų112116.6 Ų116.668%0.67960%0.601SS**Hα-helixtrans-53.5-27.6173.1177.60000110.6R25V21-R25 VanDerWaalsContact O-CB 3.29Å; V21-R25 WeakPolarHBondContact O-CB 3.34Å; V21-R25 PolarHBondContact O-N 2.96Å; V21-R25 VanDerWaalsContact O-N 3.11Å
22A86.2Confident78.3Confident59 Ų59115.4 Ų115.449%0.48859%0.587SS.*Hα-helixtrans-67.8-43.1172.800000113S20 R25 A26S20-A22 PolarHBondContact O-N 3.47Å; S20-A22 WeakPolarHBondContact OG-CB 3.17Å; S20-A22 PolarHBondContact OG-N 3.31Å; A22-R25 WeakPolarHBondContact O-CB 3.48Å; A22-R25 PolarHBondContact O-N 2.89Å; A22-A26 WeakPolarHBondContact O-CB 3.43Å; A22-A26 PolarHBondContact O-N 3.43Å
23D88.4Confident80.4Confident80 Ų80116.4 Ų116.443%0.42858%0.58SS.*Hα-helixtrans-65.7-43.3178.6-58-42.5000111.6H19 S20 R25 A26 H27H19-D23 HydrophobicContact CB-CB 4.03Å; S20-D23 WeakPolarHBondContact CB-OD2 3.36Å; S20-D23 PolarHBondContact N-OD2 3.49Å; S20-D23 PolarHBondContact O-N 2.9Å; S20-D23 PolarHBondContact OG-N 3.16Å; S20-D23 VanDerWaalsContact OG-N 3.14Å; S20-D23 PolarHBondContact OG-OD2 3.33Å; D23-R25 VanDerWaalsContact C-N 3.29Å; D23-R25 PolarHBondContact O-N 2.95Å; D23-A26 PolarHBondContact O-N 3.15Å; D23-H27 WeakPolarHBondContact O-CB 3.21Å; D23-H27 PolarHBondContact O-N 3.29Å
24K91.9Very high82.6Confident140 Ų140114.4 Ų114.461%0.60957%0.568SS**Hα-helixtrans-60.7-40.5174.2-67.4-176.1179.9179.80111.6H19 S20 H28H19-K24 HydrophobicContact CB-CG 4.12Å; S20-K24 PolarHBondContact O-N 3.43Å; S20-K24 VanDerWaalsContact O-N 3.1Å; K24-H28 WeakPolarHBondContact O-CB 3.45Å; K24-H28 PolarHBondContact O-N 2.96Å
25R93.9Very high84.7Confident156 Ų156112.9 Ų112.959%0.58956%0.555SS**Hα-helixtrans-67.2-41.8176.5-173.9-174.6-63159.60.1111.8V21 A22 D23 H28 N29V21-R25 VanDerWaalsContact O-CB 3.29Å; V21-R25 WeakPolarHBondContact O-CB 3.34Å; V21-R25 PolarHBondContact O-N 2.96Å; V21-R25 VanDerWaalsContact O-N 3.11Å; A22-R25 WeakPolarHBondContact O-CB 3.48Å; A22-R25 PolarHBondContact O-N 2.89Å; D23-R25 VanDerWaalsContact C-N 3.29Å; D23-R25 PolarHBondContact O-N 2.95Å; R25-H28 PolarHBondContact O-N 3.28Å; R25-N29 WeakPolarHBondContact O-CB 3.36Å; R25-N29 PolarHBondContact O-N 3.1Å; R25-N29 PolarHBondContact O-ND2 2.89Å
26A96.1Very high87.1Confident58 Ų58115.9 Ų115.948%0.47956%0.557SS.*Hα-helixtrans-63.1-47.2177.500000111.1A22 D23 H28 N29 A30A22-A26 WeakPolarHBondContact O-CB 3.43Å; A22-A26 PolarHBondContact O-N 3.43Å; D23-A26 PolarHBondContact O-N 3.15Å; A26-H28 PolarHBondContact O-N 3.44Å; A26-N29 PolarHBondContact O-N 3.05Å; A26-A30 PolarHBondContact O-N 3.31Å
27H96.4Very high89.3Confident121 Ų121112.7 Ų112.756%0.5653%0.533SS*.Hα-helixtrans-59.7-47.2176.1-178.9-102.3000112D23 N29 A30 L31D23-H27 WeakPolarHBondContact O-CB 3.21Å; D23-H27 PolarHBondContact O-N 3.29Å; H27-N29 VanDerWaalsContact C-N 3.34Å; H27-N29 PolarHBondContact O-N 3.07Å; H27-A30 WeakPolarHBondContact O-CB 3.41Å; H27-A30 PolarHBondContact O-N 3.14Å; H27-L31 WeakPolarHBondContact CE1-CD1 3.42Å; H27-L31 PolarHBondContact O-N 3.48Å
28H97.7Very high91.3Very high123 Ų123108.3 Ų108.357%0.56952%0.521SS*.Hα-helixtrans-58-44.5175.1178.8-87.6000112.3K24 R25 A26 A30 L31 E32K24-H28 WeakPolarHBondContact O-CB 3.45Å; K24-H28 PolarHBondContact O-N 2.96Å; R25-H28 PolarHBondContact O-N 3.28Å; A26-H28 PolarHBondContact O-N 3.44Å; H28-A30 VanDerWaalsContact C-N 3.31Å; H28-A30 PolarHBondContact O-N 3.1Å; H28-L31 PolarHBondContact O-N 3.2Å; H28-E32 WeakPolarHBondContact O-CB 3.43Å; H28-E32 PolarHBondContact O-N 3.44Å
29N98.1Very high93.4Very high91 Ų91100.5 Ų100.549%0.48749%0.494SS..Hα-helixtrans-63.9-35.6177.4-73.4-14.6000112.8R25 A26 H27 R33R25-N29 WeakPolarHBondContact O-CB 3.36Å; R25-N29 PolarHBondContact O-N 3.1Å; R25-N29 PolarHBondContact O-ND2 2.89Å; A26-N29 PolarHBondContact O-N 3.05Å; H27-N29 VanDerWaalsContact C-N 3.34Å; H27-N29 PolarHBondContact O-N 3.07Å; N29-R33 WeakPolarHBondContact O-CB 3.35Å; N29-R33 PolarHBondContact O-N 2.87Å
30A97.9Very high95Very high58 Ų5898.5 Ų98.548%0.47948%0.484SS..Hα-helixtrans-66.3-47.8175.900000111.1A26 H27 H28 E32 R33 K34A26-A30 PolarHBondContact O-N 3.31Å; H27-A30 WeakPolarHBondContact O-CB 3.41Å; H27-A30 PolarHBondContact O-N 3.14Å; H28-A30 VanDerWaalsContact C-N 3.31Å; H28-A30 PolarHBondContact O-N 3.1Å; A30-E32 PolarHBondContact O-N 3.34Å; A30-R33 PolarHBondContact O-N 2.82Å; A30-K34 PolarHBondContact O-N 3.37Å
31L98.1Very high95.9Very high96 Ų96100.4 Ų100.450%0.50349%0.489SS..Hα-helixtrans-60.7-44.6177.1-71.6-179.6000112.3H27 H28 R33 K34 R35H27-L31 WeakPolarHBondContact CE1-CD1 3.42Å; H27-L31 PolarHBondContact O-N 3.48Å; H28-L31 PolarHBondContact O-N 3.2Å; L31-R33 VanDerWaalsContact C-N 3.33Å; L31-R33 PolarHBondContact O-N 3.17Å; L31-K34 WeakPolarHBondContact O-CB 3.26Å; L31-K34 PolarHBondContact O-N 3.25Å; L31-R35 PolarHBondContact O-N 3.49Å
32E98.4Very high96.6Very high52 Ų5298.9 Ų98.924%0.24348%0.484CS..Hα-helixtrans-68.6-32.8179.5173.956.5-162.200111.8H28 A30 R35 R36H28-E32 WeakPolarHBondContact O-CB 3.43Å; H28-E32 PolarHBondContact O-N 3.44Å; A30-E32 PolarHBondContact O-N 3.34Å; E32-R35 VanDerWaalsContact CD-NH1 3.28Å; E32-R35 PolarHBondContact O-N 2.97Å; E32-R35 IonicContact OE1-NH1 3.27Å; E32-R35 PolarHBondContact OE1-NH1 3.12Å; E32-R35 WeakPolarHBondContact OE2-CD 3.41Å; E32-R35 IonicContact OE2-CZ 3.82Å; E32-R35 IonicContact OE2-NH1 3.6Å; E32-R35 PolarHBondContact OE2-NH1 3Å; E32-R36 VanDerWaalsContact CG-NH1 3.29Å; E32-R36 WeakPolarHBondContact O-CG 3.46Å; E32-R36 PolarHBondContact O-N 3.5Å; E32-R36 WeakPolarHBondContact OE1-CG 3.44Å; E32-R36 IonicContact OE1-NH1 2.76Å
33R98.6Very high97.2Very high166 Ų16698 Ų9863%0.62647%0.469SS*.Hα-helixtrans-61.5-49.2170.9-173.4-179.3-62.4-149.9-0.3110.9N29 A30 L31 R35 R36 D37N29-R33 WeakPolarHBondContact O-CB 3.35Å; N29-R33 PolarHBondContact O-N 2.87Å; A30-R33 PolarHBondContact O-N 2.82Å; L31-R33 VanDerWaalsContact C-N 3.33Å; L31-R33 PolarHBondContact O-N 3.17Å; R33-R35 VanDerWaalsContact C-N 3.32Å; R33-R35 PolarHBondContact O-N 3.02Å; R33-R36 PolarHBondContact O-N 3.37Å; R33-R36 VanDerWaalsContact O-N 3.11Å; R33-D37 PolarHBondContact O-N 3.41Å
34K98.5Very high97.6Very high132 Ų13298 Ų9857%0.57447%0.466SS*.Hα-helixtrans-56-46.4175.5-174.9175.6-178.6177.60111.2A30 L31 R36 D37 H38A30-K34 PolarHBondContact O-N 3.37Å; L31-K34 WeakPolarHBondContact O-CB 3.26Å; L31-K34 PolarHBondContact O-N 3.25Å; K34-R36 PolarHBondContact O-N 3.04Å; K34-D37 PolarHBondContact O-N 2.92Å; K34-H38 PolarHBondContact O-CD2 2.87Å; K34-H38 PolarHBondContact O-N 3.48Å
35R98.7Very high97.9Very high137 Ų13794.9 Ų94.952%0.51746%0.462SS..Hα-helixtrans-57.4-45.9175177.3178.5159.3-86.5-5.6112.3L31 E32 R33 D37 H38 I39L31-R35 PolarHBondContact O-N 3.49Å; E32-R35 VanDerWaalsContact CD-NH1 3.28Å; E32-R35 PolarHBondContact O-N 2.97Å; E32-R35 IonicContact OE1-NH1 3.27Å; E32-R35 PolarHBondContact OE1-NH1 3.12Å; E32-R35 WeakPolarHBondContact OE2-CD 3.41Å; E32-R35 IonicContact OE2-CZ 3.82Å; E32-R35 IonicContact OE2-NH1 3.6Å; E32-R35 PolarHBondContact OE2-NH1 3Å; R33-R35 VanDerWaalsContact C-N 3.32Å; R33-R35 PolarHBondContact O-N 3.02Å; R35-D37 VanDerWaalsContact C-N 3.32Å; R35-D37 PolarHBondContact O-N 2.94Å; R35-H38 PolarHBondContact O-N 3.49Å; R35-I39 HydrophobicContact CG-CD1 4.08Å; R35-I39 WeakPolarHBondContact O-CG1 3.36Å; R35-I39 PolarHBondContact O-N 3.3Å
36R98.6Very high98.1Very high124 Ų12490.3 Ų90.347%0.46845%0.449SS..Hα-helixtrans-64.8-35.3178.9-74.1-169.8-58.9-107.4-1.9113E32 R33 K34 I39 K40E32-R36 VanDerWaalsContact CG-NH1 3.29Å; E32-R36 WeakPolarHBondContact O-CG 3.46Å; E32-R36 PolarHBondContact O-N 3.5Å; E32-R36 WeakPolarHBondContact OE1-CG 3.44Å; E32-R36 IonicContact OE1-NH1 2.76Å; R33-R36 PolarHBondContact O-N 3.37Å; R33-R36 VanDerWaalsContact O-N 3.11Å; K34-R36 PolarHBondContact O-N 3.04Å; R36-I39 PolarHBondContact O-N 3Å; R36-K40 WeakPolarHBondContact O-CB 3.3Å; R36-K40 PolarHBondContact O-N 2.96Å
37D98.7Very high98.1Very high60 Ų6090.4 Ų90.432%0.32144%0.437SS..Hα-helixtrans-67.3-43.4175.5-69.9-34.4000110.8R33 K34 R35 I39 K40 D41R33-D37 PolarHBondContact O-N 3.41Å; K34-D37 PolarHBondContact O-N 2.92Å; R35-D37 VanDerWaalsContact C-N 3.32Å; R35-D37 PolarHBondContact O-N 2.94Å; D37-I39 VanDerWaalsContact C-N 3.34Å; D37-I39 PolarHBondContact O-N 3.2Å; D37-K40 WeakPolarHBondContact O-CA 3.45Å; D37-K40 VanDerWaalsContact O-CB 3.3Å; D37-K40 WeakPolarHBondContact O-CB 3.44Å; D37-K40 PolarHBondContact O-N 2.94Å; D37-K40 VanDerWaalsContact O-N 3.07Å; D37-K40 IonicContact OD1-NZ 3.32Å; D37-K40 PolarHBondContact OD1-NZ 3.34Å; D37-D41 VanDerWaalsContact O-CG 3.3Å; D37-D41 PolarHBondContact O-N 3.14Å
38H98.7Very high98.2Very high109 Ų10988.3 Ų88.351%0.50543%0.43SS..Hα-helixtrans-59.6-42.9173.7-71.9-140.2000112.3K34 R35 K40 D41 S42K34-H38 PolarHBondContact O-CD2 2.87Å; K34-H38 PolarHBondContact O-N 3.48Å; R35-H38 PolarHBondContact O-N 3.49Å; H38-K40 VanDerWaalsContact C-N 3.31Å; H38-K40 PolarHBondContact O-N 3.49Å; H38-D41 PolarHBondContact O-N 3.43Å; H38-S42 PolarHBondContact O-N 3.46Å; H38-S42 PolarHBondContact O-OG 3.47Å
39I98.5Very high98.1Very high59 Ų5986.3 Ų86.330%0.30343%0.43SS..Hα-helixtrans-62.4-42.5175.5-70.5168.9000110.6R35 R36 D37 D41 S42 F43R35-I39 HydrophobicContact CG-CD1 4.08Å; R35-I39 WeakPolarHBondContact O-CG1 3.36Å; R35-I39 PolarHBondContact O-N 3.3Å; R36-I39 PolarHBondContact O-N 3Å; D37-I39 VanDerWaalsContact C-N 3.34Å; D37-I39 PolarHBondContact O-N 3.2Å; I39-D41 VanDerWaalsContact C-N 3.3Å; I39-D41 PolarHBondContact O-N 3.14Å; I39-S42 PolarHBondContact O-N 2.99Å; I39-F43 HydrophobicContact CG2-CD2 3.79Å; I39-F43 HydrophobicContact CG2-CE2 3.88Å; I39-F43 WeakPolarHBondContact O-CD2 3.37Å; I39-F43 PolarHBondContact O-N 2.7Å
40K98.1Very high98.1Very high83 Ų8382.2 Ų82.236%0.36141%0.408SS..Hα-helixtrans-59.3-43.6177.4-176-164.2-63.3153.80110.4R36 D37 H38 F43 H44R36-K40 WeakPolarHBondContact O-CB 3.3Å; R36-K40 PolarHBondContact O-N 2.96Å; D37-K40 WeakPolarHBondContact O-CA 3.45Å; D37-K40 VanDerWaalsContact O-CB 3.3Å; D37-K40 WeakPolarHBondContact O-CB 3.44Å; D37-K40 PolarHBondContact O-N 2.94Å; D37-K40 VanDerWaalsContact O-N 3.07Å; D37-K40 IonicContact OD1-NZ 3.32Å; D37-K40 PolarHBondContact OD1-NZ 3.34Å; H38-K40 VanDerWaalsContact C-N 3.31Å; H38-K40 PolarHBondContact O-N 3.49Å; K40-F43 WeakPolarHBondContact O-CB 3.41Å; K40-F43 PolarHBondContact O-N 3.45Å; K40-H44 PolarHBondContact O-N 3.32Å; K40-H44 VanDerWaalsContact O-N 3.11Å; K40-H44 PolarHBondContact O-ND1 3.03Å
41D98.3Very high98.1Very high92 Ų9282.5 Ų82.549%0.49241%0.405SS..Hα-helixtrans-64.6-44177.5-61.9-18.6000111.3D37 H38 I39 F43 H44 S45D37-D41 VanDerWaalsContact O-CG 3.3Å; D37-D41 PolarHBondContact O-N 3.14Å; H38-D41 PolarHBondContact O-N 3.43Å; I39-D41 VanDerWaalsContact C-N 3.3Å; I39-D41 PolarHBondContact O-N 3.14Å; D41-F43 VanDerWaalsContact C-N 3.26Å; D41-F43 PolarHBondContact O-N 2.9Å; D41-H44 WeakPolarHBondContact O-CB 3.49Å; D41-H44 PolarHBondContact O-N 3.04Å; D41-S45 PolarHBondContact O-N 2.96Å; D41-S45 PolarHBondContact O-OG 3.47Å
42S98.4Very high98Very high80 Ų8081.1 Ų81.156%0.55941%0.407SS*.Hα-helixtrans-58.1-36.9173.7-63.90000113H38 I39 L46H38-S42 PolarHBondContact O-N 3.46Å; H38-S42 PolarHBondContact O-OG 3.47Å; I39-S42 PolarHBondContact O-N 2.99Å; S42-L46 WeakPolarHBondContact O-CB 3.26Å; S42-L46 PolarHBondContact O-N 3.07Å
43F98.3Very high97.9Very high40 Ų4079 Ų7918%0.17540%0.398CS..Hα-helixtrans-67.4-35.9174.1-94.6-81.5000112.8I39 K40 D41 R47 R60 I63 L64I39-F43 HydrophobicContact CG2-CD2 3.79Å; I39-F43 HydrophobicContact CG2-CE2 3.88Å; I39-F43 WeakPolarHBondContact O-CD2 3.37Å; I39-F43 PolarHBondContact O-N 2.7Å; K40-F43 WeakPolarHBondContact O-CB 3.41Å; K40-F43 PolarHBondContact O-N 3.45Å; D41-F43 VanDerWaalsContact C-N 3.26Å; D41-F43 PolarHBondContact O-N 2.9Å; F43-R47 WeakPolarHBondContact O-CB 3.21Å; F43-R47 PolarHBondContact O-N 3.41Å; F43-R60 HydrophobicContact CD1-CB 4.28Å; F43-R60 HydrophobicContact CD1-CG 3.99Å; F43-R60 HydrophobicContact CD2-CG 4.46Å; F43-R60 HydrophobicContact CE1-CB 3.75Å; F43-R60 HydrophobicContact CE1-CG 3.86Å; F43-R60 HydrophobicContact CE2-CG 4.36Å; F43-R60 HydrophobicContact CG-CG 4.29Å; F43-R60 HydrophobicContact CZ-CB 4.04Å; F43-R60 HydrophobicContact CZ-CG 4.06Å; F43-I63 HydrophobicContact CD1-CB 4.17Å; F43-I63 HydrophobicContact CD1-CD1 3.99Å; F43-I63 HydrophobicContact CD1-CG2 3.95Å; F43-I63 HydrophobicContact CE1-CB 4.42Å; F43-I63 HydrophobicContact CE1-CG2 4.37Å; F43-L64 HydrophobicContact CE1-CD1 4.42Å; F43-L64 HydrophobicContact CE1-CD2 4.02Å; F43-L64 HydrophobicContact CE1-CG 3.98Å; F43-L64 HydrophobicContact CZ-CD1 4.29Å; F43-L64 HydrophobicContact CZ-CD2 4.18Å; F43-L64 HydrophobicContact CZ-CG 4.28Å
44H97.4Very high97.5Very high81 Ų8176.6 Ų76.638%0.37539%0.394SS..Hα-helixtrans-65.4-48.8173.8-71.296.7000110.8K40 D41 L46 R47 D48K40-H44 PolarHBondContact O-N 3.32Å; K40-H44 VanDerWaalsContact O-N 3.11Å; K40-H44 PolarHBondContact O-ND1 3.03Å; D41-H44 WeakPolarHBondContact O-CB 3.49Å; D41-H44 PolarHBondContact O-N 3.04Å; H44-L46 VanDerWaalsContact C-N 3.29Å; H44-L46 PolarHBondContact O-N 3.28Å; H44-R47 WeakPolarHBondContact O-CB 3.45Å; H44-R47 PolarHBondContact O-N 3.32Å; H44-D48 VanDerWaalsContact O-CG 3.24Å; H44-D48 PolarHBondContact O-N 2.97Å
45S97.8Very high97Very high74 Ų7474.4 Ų74.452%0.51741%0.408SS..Hα-helixtrans-58.8-40.4176.7-58.20000112.4D41 D48 S49D41-S45 PolarHBondContact O-N 2.96Å; D41-S45 PolarHBondContact O-OG 3.47Å; S45-D48 PolarHBondContact O-N 3.38Å; S45-S49 PolarHBondContact O-N 2.92Å; S45-S49 VanDerWaalsContact O-N 3.16Å; S45-S49 PolarHBondContact O-OG 2.87Å
46L97.9Very high96.5Very high61 Ų6173.7 Ų73.732%0.31941%0.411SS..Hα-helixtrans-64.1-47.5175.9-18058.4000111.6S42 H44 D48 S49 V50 I63 L64 A67S42-L46 WeakPolarHBondContact O-CB 3.26Å; S42-L46 PolarHBondContact O-N 3.07Å; H44-L46 VanDerWaalsContact C-N 3.29Å; H44-L46 PolarHBondContact O-N 3.28Å; L46-D48 VanDerWaalsContact C-N 3.3Å; L46-D48 PolarHBondContact O-N 3.37Å; L46-S49 WeakPolarHBondContact O-CB 3.45Å; L46-S49 PolarHBondContact O-N 3.24Å; L46-S49 VanDerWaalsContact O-N 3.17Å; L46-V50 WeakPolarHBondContact O-CG2 3.38Å; L46-V50 PolarHBondContact O-N 3.18Å; L46-I63 HydrophobicContact CB-CG2 4.22Å; L46-I63 HydrophobicContact CD2-CG2 3.69Å; L46-I63 HydrophobicContact CG-CG2 3.76Å; L46-L64 HydrophobicContact CD2-CD2 4.28Å; L46-A67 HydrophobicContact CD1-CB 3.92Å; L46-A67 HydrophobicContact CD2-CB 4.25Å; L46-A67 HydrophobicContact CG-CB 4.25Å
47R97.6Very high96.2Very high60 Ų6078 Ų7823%0.22643%0.433CS..Hα-helixtrans-56.1-47.1177-177-161.963.7-164.1-4.2111.1F43 H44 S49 V50 L53 I63F43-R47 WeakPolarHBondContact O-CB 3.21Å; F43-R47 PolarHBondContact O-N 3.41Å; H44-R47 WeakPolarHBondContact O-CB 3.45Å; H44-R47 PolarHBondContact O-N 3.32Å; R47-S49 PolarHBondContact O-N 3.41Å; R47-V50 PolarHBondContact O-N 3.31Å; R47-V50 VanDerWaalsContact O-N 3.1Å; R47-L53 HydrophobicContact CG-CB 3.71Å; R47-L53 HydrophobicContact CG-CD1 4.31Å; R47-I63 HydrophobicContact CB-CD1 4.08Å; R47-I63 HydrophobicContact CB-CG1 4.18Å; R47-I63 HydrophobicContact CG-CD1 4.45Å; R47-I63 HydrophobicContact CG-CG1 4.35Å
48D96.9Very high96.1Very high76 Ų7676.3 Ų76.341%0.40643%0.428SS..Hα-helixtrans-69.2-21.1-176-62.6-10.1000112.1H44 S45 L46 Q54H44-D48 VanDerWaalsContact O-CG 3.24Å; H44-D48 PolarHBondContact O-N 2.97Å; S45-D48 PolarHBondContact O-N 3.38Å; L46-D48 VanDerWaalsContact C-N 3.3Å; L46-D48 PolarHBondContact O-N 3.37Å; D48-Q54 PolarHBondContact O-NE2 2.88Å
49S96.9Very high96Very high82 Ų8273.8 Ų73.857%0.57342%0.423SS*.Hα-helixtrans-82-12.2174.9-57.60000113.8S45 L46 R47S45-S49 PolarHBondContact O-N 2.92Å; S45-S49 VanDerWaalsContact O-N 3.16Å; S45-S49 PolarHBondContact O-OG 2.87Å; L46-S49 WeakPolarHBondContact O-CB 3.45Å; L46-S49 PolarHBondContact O-N 3.24Å; L46-S49 VanDerWaalsContact O-N 3.17Å; R47-S49 PolarHBondContact O-N 3.41Å
50V98Very high96Very high5 Ų577.8 Ų77.83%0.0343%0.434CS..SBendtrans-103.7109.5-179.6178.20000108.9L46 R47 A52 L53 Q54 K66 A67 Y70L46-V50 WeakPolarHBondContact O-CG2 3.38Å; L46-V50 PolarHBondContact O-N 3.18Å; R47-V50 PolarHBondContact O-N 3.31Å; R47-V50 VanDerWaalsContact O-N 3.1Å; V50-A52 PolarHBondContact O-N 3.01Å; V50-A52 VanDerWaalsContact O-N 3.09Å; V50-L53 HydrophobicContact CB-CB 4.4Å; V50-L53 HydrophobicContact CB-CD1 4.17Å; V50-L53 HydrophobicContact CB-CG 4.33Å; V50-L53 HydrophobicContact CG1-CB 4.47Å; V50-L53 HydrophobicContact CG1-CD1 4.12Å; V50-L53 HydrophobicContact CG1-CG 4.01Å; V50-L53 PolarHBondContact O-N 3.01Å; V50-Q54 PolarHBondContact O-N 3.06Å; V50-K66 HydrophobicContact CG1-CB 4.18Å; V50-A67 HydrophobicContact CG2-CB 3.96Å; V50-Y70 HydrophobicContact CG1-CG 4.45Å; V50-Y70 HydrophobicContact CG2-CD1 4.49Å
51P97.1Very high96Very high64 Ų6476.6 Ų76.642%0.41644%0.439SS..G310 helixtrans-54.6-36.6-172.4-29.535.8000114.7L53 Q54 Y70P51-L53 PolarHBondContact O-N 2.99Å; P51-Q54 PolarHBondContact O-N 2.76Å; P51-Y70 VanDerWaalsContact CD-CZ 3.43Å; P51-Y70 HydrophobicContact CG-CE1 4.35Å; P51-Y70 HydrophobicContact CG-CE2 3.94Å
52A95.9Very high96Very high66 Ų6677 Ų7755%0.54544%0.438SS..G310 helixtrans-70.2-9.5-179.500000114.4V50V50-A52 PolarHBondContact O-N 3.01Å; V50-A52 VanDerWaalsContact O-N 3.09Å
53L96Very high96Very high9 Ų973.7 Ų73.75%0.04741%0.414CS..G310 helixtrans-114-3.2-178.6-63.7-177.6000113.2R47 V50 P51 G55 E56 A58 I63 K66R47-L53 HydrophobicContact CG-CB 3.71Å; R47-L53 HydrophobicContact CG-CD1 4.31Å; V50-L53 HydrophobicContact CB-CB 4.4Å; V50-L53 HydrophobicContact CB-CD1 4.17Å; V50-L53 HydrophobicContact CB-CG 4.33Å; V50-L53 HydrophobicContact CG1-CB 4.47Å; V50-L53 HydrophobicContact CG1-CD1 4.12Å; V50-L53 HydrophobicContact CG1-CG 4.01Å; V50-L53 PolarHBondContact O-N 3.01Å; P51-L53 PolarHBondContact O-N 2.99Å; L53-G55 PolarHBondContact O-N 3.43Å; L53-E56 PolarHBondContact O-N 3.32Å; L53-A58 HydrophobicContact CD2-CB 3.89Å; L53-I63 HydrophobicContact CD1-CB 4.28Å; L53-I63 HydrophobicContact CD1-CG1 4.03Å; L53-I63 HydrophobicContact CD1-CG2 4.49Å; L53-K66 HydrophobicContact CD1-CB 3.84Å; L53-K66 HydrophobicContact CD1-CG 4.42Å; L53-K66 HydrophobicContact CD2-CB 4.21Å; L53-K66 HydrophobicContact CD2-CG 3.93Å; L53-K66 HydrophobicContact CG-CB 4.01Å; L53-K66 HydrophobicContact CG-CG 4.28Å
54Q92.1Very high96Very high114 Ų11475.8 Ų75.853%0.53343%0.427SS..THydrogen-bonded Turntrans-66127.7-178.5-72.5180-11.900110.3D48 V50 P51 E56D48-Q54 PolarHBondContact O-NE2 2.88Å; V50-Q54 PolarHBondContact O-N 3.06Å; P51-Q54 PolarHBondContact O-N 2.76Å; Q54-E56 PolarHBondContact O-N 2.84Å
55G87.3Confident96.1Very high86 Ų8676.4 Ų76.489%0.88743%0.433SS*.THydrogen-bonded Turntrans77.1-0.9-179.900000115.1L53L53-G55 PolarHBondContact O-N 3.43Å
56E87.6Confident96.1Very high122 Ų12276.6 Ų76.657%0.5742%0.424SS*.SBendtrans-105.2150.4-179.6-66.3-168.9-178.900113L53 Q54 A58L53-E56 PolarHBondContact O-N 3.32Å; Q54-E56 PolarHBondContact O-N 2.84Å; E56-A58 PolarHBondContact O-N 3.41Å
57K93.4Very high96.1Very high214 Ų21474.1 Ų74.193%0.9341%0.413SS*.  trans-80.2105.9169.7-70.6-176.9179.4176.40108.8
58A95.4Very high96.2Very high26 Ų2675 Ų7522%0.21543%0.425CS..  trans-114.6138.8178.400000111.8L53 E56 Q62 I63L53-A58 HydrophobicContact CD2-CB 3.89Å; E56-A58 PolarHBondContact O-N 3.41Å; A58-Q62 HydrophobicContact CB-CB 4.45Å; A58-I63 HydrophobicContact CB-CD1 4.43Å; A58-I63 HydrophobicContact CB-CG1 3.84Å
59S97.7Very high96.3Very high56 Ų5676 Ų7639%0.39243%0.427SS..  trans-71.7162.3171.268.90000111.6A61 Q62 I63S59-A61 VanDerWaalsContact C-N 3.28Å; S59-A61 PolarHBondContact O-N 3.3Å; S59-Q62 PolarHBondContact O-N 2.87Å; S59-Q62 WeakPolarHBondContact OG-CG 3.45Å; S59-Q62 PolarHBondContact OG-N 3.28Å; S59-Q62 PolarHBondContact OG-OE1 3.19Å; S59-I63 WeakPolarHBondContact O-CG1 3.49Å; S59-I63 PolarHBondContact O-N 3.47Å
60R97.9Very high96.4Very high143 Ų14375.8 Ų75.854%0.5441%0.414SS..Hα-helixtrans-57.1-40.3177.6-71.8-172.7176.592.60.8112.8F43 I63 L64F43-R60 HydrophobicContact CD1-CB 4.28Å; F43-R60 HydrophobicContact CD1-CG 3.99Å; F43-R60 HydrophobicContact CD2-CG 4.46Å; F43-R60 HydrophobicContact CE1-CB 3.75Å; F43-R60 HydrophobicContact CE1-CG 3.86Å; F43-R60 HydrophobicContact CE2-CG 4.36Å; F43-R60 HydrophobicContact CG-CG 4.29Å; F43-R60 HydrophobicContact CZ-CB 4.04Å; F43-R60 HydrophobicContact CZ-CG 4.06Å; R60-I63 PolarHBondContact O-N 3.45Å; R60-L64 WeakPolarHBondContact O-CG 3.28Å; R60-L64 PolarHBondContact O-N 2.88Å; R60-L64 VanDerWaalsContact O-N 3.16Å
61A98.4Very high96.4Very high58 Ų5879.7 Ų79.748%0.47943%0.434SS..Hα-helixtrans-62.5-50.7177.300000110.9S59 I63 L64 D65S59-A61 VanDerWaalsContact C-N 3.28Å; S59-A61 PolarHBondContact O-N 3.3Å; A61-I63 VanDerWaalsContact C-N 3.29Å; A61-I63 PolarHBondContact O-N 3.1Å; A61-L64 PolarHBondContact O-N 3.15Å; A61-D65 VanDerWaalsContact O-CG 3.29Å; A61-D65 PolarHBondContact O-N 3.49Å
62Q98.2Very high96.5Very high100 Ų10081.8 Ų81.847%0.46744%0.438SS..Hα-helixtrans-59.4-38177.4-70.4168.3-61.200112.8A58 S59 L64 D65 K66A58-Q62 HydrophobicContact CB-CB 4.45Å; S59-Q62 PolarHBondContact O-N 2.87Å; S59-Q62 WeakPolarHBondContact OG-CG 3.45Å; S59-Q62 PolarHBondContact OG-N 3.28Å; S59-Q62 PolarHBondContact OG-OE1 3.19Å; Q62-L64 VanDerWaalsContact C-N 3.34Å; Q62-D65 PolarHBondContact O-N 3.5Å; Q62-K66 WeakPolarHBondContact O-CB 3.44Å; Q62-K66 WeakPolarHBondContact O-CG 3.44Å; Q62-K66 PolarHBondContact O-N 3.36Å
63I98.4Very high96.6Very high10 Ų1083.9 Ų83.95%0.05143%0.433CS..Hα-helixtrans-59.9-46.1175.5-67.6165.1000110.6F43 L46 R47 L53 A58 S59 R60 A61 A67F43-I63 HydrophobicContact CD1-CB 4.17Å; F43-I63 HydrophobicContact CD1-CD1 3.99Å; F43-I63 HydrophobicContact CD1-CG2 3.95Å; F43-I63 HydrophobicContact CE1-CB 4.42Å; F43-I63 HydrophobicContact CE1-CG2 4.37Å; L46-I63 HydrophobicContact CB-CG2 4.22Å; L46-I63 HydrophobicContact CD2-CG2 3.69Å; L46-I63 HydrophobicContact CG-CG2 3.76Å; R47-I63 HydrophobicContact CB-CD1 4.08Å; R47-I63 HydrophobicContact CB-CG1 4.18Å; R47-I63 HydrophobicContact CG-CD1 4.45Å; R47-I63 HydrophobicContact CG-CG1 4.35Å; L53-I63 HydrophobicContact CD1-CB 4.28Å; L53-I63 HydrophobicContact CD1-CG1 4.03Å; L53-I63 HydrophobicContact CD1-CG2 4.49Å; A58-I63 HydrophobicContact CB-CD1 4.43Å; A58-I63 HydrophobicContact CB-CG1 3.84Å; S59-I63 WeakPolarHBondContact O-CG1 3.49Å; S59-I63 PolarHBondContact O-N 3.47Å; R60-I63 PolarHBondContact O-N 3.45Å; A61-I63 VanDerWaalsContact C-N 3.29Å; A61-I63 PolarHBondContact O-N 3.1Å; I63-A67 WeakPolarHBondContact O-CB 3.42Å; I63-A67 PolarHBondContact O-N 3.27Å
64L98.6Very high96.7Very high84 Ų8485.9 Ų85.944%0.4444%0.443SS..Hα-helixtrans-66.1-47.6178.9-64173.4000111.4F43 L46 R60 A61 Q62 K66 A67 T68F43-L64 HydrophobicContact CE1-CD1 4.42Å; F43-L64 HydrophobicContact CE1-CD2 4.02Å; F43-L64 HydrophobicContact CE1-CG 3.98Å; F43-L64 HydrophobicContact CZ-CD1 4.29Å; F43-L64 HydrophobicContact CZ-CD2 4.18Å; F43-L64 HydrophobicContact CZ-CG 4.28Å; L46-L64 HydrophobicContact CD2-CD2 4.28Å; R60-L64 WeakPolarHBondContact O-CG 3.28Å; R60-L64 PolarHBondContact O-N 2.88Å; R60-L64 VanDerWaalsContact O-N 3.16Å; A61-L64 PolarHBondContact O-N 3.15Å; Q62-L64 VanDerWaalsContact C-N 3.34Å; L64-K66 PolarHBondContact O-N 3.31Å; L64-A67 PolarHBondContact O-N 3.37Å; L64-T68 PolarHBondContact O-N 3.03Å; L64-T68 PolarHBondContact O-OG1 3.35Å
65D98.6Very high97.1Very high94 Ų9489.3 Ų89.350%0.50345%0.451SS..Hα-helixtrans-59.1-49.7-179.3-65-26000111A61 Q62 A67 T68 E69A61-D65 VanDerWaalsContact O-CG 3.29Å; A61-D65 PolarHBondContact O-N 3.49Å; Q62-D65 PolarHBondContact O-N 3.5Å; D65-A67 PolarHBondContact O-N 3.5Å; D65-T68 PolarHBondContact O-N 2.97Å; D65-E69 WeakPolarHBondContact O-CG 3.36Å; D65-E69 PolarHBondContact O-N 3.46Å
66K98.4Very high97.6Very high79 Ų7993 Ų9334%0.34344%0.438SS..Hα-helixtrans-69.4-33.2179.3-67.6-65.1172.4-161.50113.2V50 L53 Q62 L64 E69 Y70V50-K66 HydrophobicContact CG1-CB 4.18Å; L53-K66 HydrophobicContact CD1-CB 3.84Å; L53-K66 HydrophobicContact CD1-CG 4.42Å; L53-K66 HydrophobicContact CD2-CB 4.21Å; L53-K66 HydrophobicContact CD2-CG 3.93Å; L53-K66 HydrophobicContact CG-CB 4.01Å; L53-K66 HydrophobicContact CG-CG 4.28Å; Q62-K66 WeakPolarHBondContact O-CB 3.44Å; Q62-K66 WeakPolarHBondContact O-CG 3.44Å; Q62-K66 PolarHBondContact O-N 3.36Å; L64-K66 PolarHBondContact O-N 3.31Å; K66-E69 WeakPolarHBondContact CD-OE2 3.44Å; K66-E69 IonicContact NZ-OE1 2.7Å; K66-E69 IonicContact NZ-OE2 2.76Å; K66-E69 PolarHBondContact NZ-OE2 3.09Å; K66-Y70 VanDerWaalsContact O-CB 3.22Å; K66-Y70 WeakPolarHBondContact O-CB 3.31Å; K66-Y70 PolarHBondContact O-N 2.77Å
67A98.6Very high98.1Very high9 Ų991 Ų917%0.07443%0.427CS..Hα-helixtrans-64.1-44171.800000111.3L46 V50 I63 L64 D65 Y70 I71L46-A67 HydrophobicContact CD1-CB 3.92Å; L46-A67 HydrophobicContact CD2-CB 4.25Å; L46-A67 HydrophobicContact CG-CB 4.25Å; V50-A67 HydrophobicContact CG2-CB 3.96Å; I63-A67 WeakPolarHBondContact O-CB 3.42Å; I63-A67 PolarHBondContact O-N 3.27Å; L64-A67 PolarHBondContact O-N 3.37Å; D65-A67 PolarHBondContact O-N 3.5Å; A67-Y70 PolarHBondContact O-N 3.37Å; A67-I71 VanDerWaalsContact O-CG1 3.29Å; A67-I71 WeakPolarHBondContact O-CG1 3.34Å; A67-I71 PolarHBondContact O-N 3.41Å
68T98.8Very high98.4Very high77 Ų7785.3 Ų85.347%0.47241%0.407SS..Hα-helixtrans-61.8-47.5175.9-63.60000111.5L64 D65 Y70 I71 Q72L64-T68 PolarHBondContact O-N 3.03Å; L64-T68 PolarHBondContact O-OG1 3.35Å; D65-T68 PolarHBondContact O-N 2.97Å; T68-Y70 VanDerWaalsContact C-N 3.32Å; T68-Y70 PolarHBondContact O-N 3.22Å; T68-I71 PolarHBondContact O-N 3.2Å; T68-Q72 WeakPolarHBondContact O-CG 3.41Å; T68-Q72 PolarHBondContact O-N 3.47Å; T68-Q72 VanDerWaalsContact O-N 3.1Å
69E98.6Very high98.5Very high98 Ų9889.4 Ų89.446%0.45842%0.421SS..Hα-helixtrans-57-45.9174.8-74.4176.1-166.900111.5D65 K66 Q72 Y73D65-E69 WeakPolarHBondContact O-CG 3.36Å; D65-E69 PolarHBondContact O-N 3.46Å; K66-E69 WeakPolarHBondContact CD-OE2 3.44Å; K66-E69 IonicContact NZ-OE1 2.7Å; K66-E69 IonicContact NZ-OE2 2.76Å; K66-E69 PolarHBondContact NZ-OE2 3.09Å; E69-Q72 PolarHBondContact O-N 2.81Å; E69-Y73 WeakPolarHBondContact O-CB 3.32Å; E69-Y73 PolarHBondContact O-N 2.94Å
70Y98.8Very high98.6Very high77 Ų7789.9 Ų89.930%0.30242%0.422SS..Hα-helixtrans-65.9-41-178-174.3-121.3000112.4V50 P51 K66 A67 T68 Q72 Y73 M74V50-Y70 HydrophobicContact CG1-CG 4.45Å; V50-Y70 HydrophobicContact CG2-CD1 4.49Å; P51-Y70 VanDerWaalsContact CD-CZ 3.43Å; P51-Y70 HydrophobicContact CG-CE1 4.35Å; P51-Y70 HydrophobicContact CG-CE2 3.94Å; K66-Y70 VanDerWaalsContact O-CB 3.22Å; K66-Y70 WeakPolarHBondContact O-CB 3.31Å; K66-Y70 PolarHBondContact O-N 2.77Å; A67-Y70 PolarHBondContact O-N 3.37Å; T68-Y70 VanDerWaalsContact C-N 3.32Å; T68-Y70 PolarHBondContact O-N 3.22Å; Y70-Q72 VanDerWaalsContact C-N 3.35Å; Y70-Q72 PolarHBondContact O-N 2.93Å; Y70-Y73 HydrophobicContact CD2-CD1 4.07Å; Y70-Y73 HydrophobicContact CE2-CD1 4.11Å; Y70-Y73 HydrophobicContact CE2-CE1 4.46Å; Y70-Y73 PolarHBondContact O-N 3.46Å; Y70-M74 HydrophobicContact CD1-CG 4.37Å; Y70-M74 HydrophobicContact CD2-CG 4.1Å; Y70-M74 HydrophobicContact CE1-CG 3.99Å; Y70-M74 HydrophobicContact CE2-CG 3.68Å; Y70-M74 HydrophobicContact CE2-SD 3.87Å; Y70-M74 HydrophobicContact CG-CG 4.42Å; Y70-M74 WeakPolarHBondContact O-CB 3.42Å; Y70-M74 WeakPolarHBondContact O-CG 3.48Å; Y70-M74 PolarHBondContact O-N 3.28Å
71I98.7Very high98.6Very high88 Ų8887.2 Ų87.245%0.45142%0.415SS..Hα-helixtrans-60-46.1174-70165000110.6A67 T68 Y73 M74 R75A67-I71 VanDerWaalsContact O-CG1 3.29Å; A67-I71 WeakPolarHBondContact O-CG1 3.34Å; A67-I71 PolarHBondContact O-N 3.41Å; T68-I71 PolarHBondContact O-N 3.2Å; I71-Y73 VanDerWaalsContact C-N 3.35Å; I71-Y73 PolarHBondContact O-N 3.49Å; I71-M74 PolarHBondContact O-N 2.9Å; I71-R75 WeakPolarHBondContact O-CB 3.32Å; I71-R75 VanDerWaalsContact O-CG 3.29Å; I71-R75 WeakPolarHBondContact O-CG 3.4Å; I71-R75 PolarHBondContact O-N 3.16Å
72Q98.8Very high98.7Very high107 Ų10788.8 Ų88.850%0.541%0.413SS..Hα-helixtrans-64.6-39.8178.4-68.8177.410.600112.2T68 E69 Y70 R76T68-Q72 WeakPolarHBondContact O-CG 3.41Å; T68-Q72 PolarHBondContact O-N 3.47Å; T68-Q72 VanDerWaalsContact O-N 3.1Å; E69-Q72 PolarHBondContact O-N 2.81Å; Y70-Q72 VanDerWaalsContact C-N 3.35Å; Y70-Q72 PolarHBondContact O-N 2.93Å; Q72-R76 PolarHBondContact O-N 2.95Å; Q72-R76 PolarHBondContact O-NE 3.1Å
73Y98.6Very high98.7Very high110 Ų11088.3 Ų88.343%0.43141%0.411SS..Hα-helixtrans-61-51.7173.9167.6-102.4000111.4E69 Y70 I71 R75 R76 K77E69-Y73 WeakPolarHBondContact O-CB 3.32Å; E69-Y73 PolarHBondContact O-N 2.94Å; Y70-Y73 HydrophobicContact CD2-CD1 4.07Å; Y70-Y73 HydrophobicContact CE2-CD1 4.11Å; Y70-Y73 HydrophobicContact CE2-CE1 4.46Å; Y70-Y73 PolarHBondContact O-N 3.46Å; I71-Y73 VanDerWaalsContact C-N 3.35Å; I71-Y73 PolarHBondContact O-N 3.49Å; Y73-R75 VanDerWaalsContact C-N 3.31Å; Y73-R75 PolarHBondContact O-N 2.9Å; Y73-R76 PolarHBondContact O-N 2.94Å; Y73-R76 VanDerWaalsContact O-N 3.15Å; Y73-K77 HydrophobicContact CE1-CD 4.05Å; Y73-K77 WeakPolarHBondContact O-CB 3.38Å; Y73-K77 PolarHBondContact O-N 3.4Å
74M98.8Very high98.7Very high52 Ų5291.4 Ų91.426%0.25643%0.427SS..Hα-helixtrans-63.2-36-178.8-72.7-57.5-63.900112.4Y70 I71 K77 N78Y70-M74 HydrophobicContact CD1-CG 4.37Å; Y70-M74 HydrophobicContact CD2-CG 4.1Å; Y70-M74 HydrophobicContact CE1-CG 3.99Å; Y70-M74 HydrophobicContact CE2-CG 3.68Å; Y70-M74 HydrophobicContact CE2-SD 3.87Å; Y70-M74 HydrophobicContact CG-CG 4.42Å; Y70-M74 WeakPolarHBondContact O-CB 3.42Å; Y70-M74 WeakPolarHBondContact O-CG 3.48Å; Y70-M74 PolarHBondContact O-N 3.28Å; I71-M74 PolarHBondContact O-N 2.9Å; M74-K77 PolarHBondContact O-N 2.91Å; M74-K77 HydrophobicContact SD-CD 4.26Å; M74-N78 VanDerWaalsContact O-CB 3.31Å; M74-N78 WeakPolarHBondContact O-CB 3.35Å; M74-N78 PolarHBondContact O-N 3.26Å
75R98.8Very high98.7Very high185 Ų18591 Ų9170%0.69843%0.425SS*.Hα-helixtrans-60.1-48.3172.5-76.3175.9178.7-171.60.3112I71 Y73 H79I71-R75 WeakPolarHBondContact O-CB 3.32Å; I71-R75 VanDerWaalsContact O-CG 3.29Å; I71-R75 WeakPolarHBondContact O-CG 3.4Å; I71-R75 PolarHBondContact O-N 3.16Å; Y73-R75 VanDerWaalsContact C-N 3.31Å; Y73-R75 PolarHBondContact O-N 2.9Å; R75-H79 WeakPolarHBondContact O-CB 3.43Å; R75-H79 PolarHBondContact O-N 3.4Å
76R98.7Very high98.7Very high164 Ų16490 Ų9062%0.61942%0.419SS*.Hα-helixtrans-63.3-45.8177.1-73.2-178.1-72.6163.3-4.6111.5Q72 Y73 N78 H79 T80Q72-R76 PolarHBondContact O-N 2.95Å; Q72-R76 PolarHBondContact O-NE 3.1Å; Y73-R76 PolarHBondContact O-N 2.94Å; Y73-R76 VanDerWaalsContact O-N 3.15Å; R76-N78 PolarHBondContact O-N 3.16Å; R76-H79 WeakPolarHBondContact O-CB 3.22Å; R76-H79 PolarHBondContact O-N 2.71Å; R76-T80 PolarHBondContact O-N 2.99Å; R76-T80 PolarHBondContact O-OG1 3.32Å
77K98.6Very high98.7Very high80 Ų8089.4 Ų89.435%0.34842%0.42SS..Hα-helixtrans-59.3-47.9178.4-175.3-179.9-178.7176.30112.1Y73 M74 H79 T80 H81Y73-K77 HydrophobicContact CE1-CD 4.05Å; Y73-K77 WeakPolarHBondContact O-CB 3.38Å; Y73-K77 PolarHBondContact O-N 3.4Å; M74-K77 PolarHBondContact O-N 2.91Å; M74-K77 HydrophobicContact SD-CD 4.26Å; K77-H79 VanDerWaalsContact C-N 3.28Å; K77-H79 PolarHBondContact O-N 3.27Å; K77-T80 PolarHBondContact O-N 3.17Å; K77-H81 VanDerWaalsContact CE-NE2 3.26Å; K77-H81 WeakPolarHBondContact CE-NE2 3.29Å; K77-H81 PolarHBondContact O-N 3.18Å
78N98.8Very high98.8Very high94 Ų9493.6 Ų93.650%0.50344%0.441SS..Hα-helixtrans-63.1-36.6177-72.6-5000111.7M74 R76 H81 Q82M74-N78 VanDerWaalsContact O-CB 3.31Å; M74-N78 WeakPolarHBondContact O-CB 3.35Å; M74-N78 PolarHBondContact O-N 3.26Å; R76-N78 PolarHBondContact O-N 3.16Å; N78-H81 PolarHBondContact O-N 2.99Å; N78-Q82 WeakPolarHBondContact O-CB 3.29Å; N78-Q82 PolarHBondContact O-N 2.8Å
79H98.8Very high98.8Very high113 Ų11396.1 Ų96.152%0.52345%0.445SS..Hα-helixtrans-63.8-46.4175.8-176.962.5000112.1R75 R76 K77 Q82 Q83R75-H79 WeakPolarHBondContact O-CB 3.43Å; R75-H79 PolarHBondContact O-N 3.4Å; R76-H79 WeakPolarHBondContact O-CB 3.22Å; R76-H79 PolarHBondContact O-N 2.71Å; K77-H79 VanDerWaalsContact C-N 3.28Å; K77-H79 PolarHBondContact O-N 3.27Å; H79-Q82 PolarHBondContact O-N 3.16Å; H79-Q83 PolarHBondContact NE2-NE2 3.06Å; H79-Q83 WeakPolarHBondContact O-CG 3.47Å; H79-Q83 PolarHBondContact O-N 3.4Å
80T98.8Very high98.8Very high65 Ų6598.5 Ų98.540%0.39945%0.45SS..Hα-helixtrans-60.6-47.1174.7-59.30000111.4R76 K77 Q82 Q83 D84R76-T80 PolarHBondContact O-N 2.99Å; R76-T80 PolarHBondContact O-OG1 3.32Å; K77-T80 PolarHBondContact O-N 3.17Å; T80-Q82 VanDerWaalsContact C-N 3.26Å; T80-Q82 PolarHBondContact O-N 3.49Å; T80-Q83 WeakPolarHBondContact O-CB 3.49Å; T80-Q83 PolarHBondContact O-N 2.97Å; T80-D84 VanDerWaalsContact O-CG 3.26Å; T80-D84 PolarHBondContact O-N 3.28Å
81H98.8Very high98.7Very high87 Ų87100.2 Ų100.240%0.40346%0.461SS..Hα-helixtrans-60.2-36.4176.5-70.1-26000112.8K77 N78 D84 I85K77-H81 VanDerWaalsContact CE-NE2 3.26Å; K77-H81 WeakPolarHBondContact CE-NE2 3.29Å; K77-H81 PolarHBondContact O-N 3.18Å; N78-H81 PolarHBondContact O-N 2.99Å; H81-D84 IonicContact ND1-OD2 2.71Å; H81-D84 PolarHBondContact O-N 2.78Å; H81-I85 WeakPolarHBondContact O-CB 3.5Å; H81-I85 WeakPolarHBondContact O-CD1 3.35Å; H81-I85 WeakPolarHBondContact O-CG1 3.36Å; H81-I85 PolarHBondContact O-N 3.33Å
82Q98.9Very high98.7Very high91 Ų91100.1 Ų100.143%0.42546%0.461SS..Hα-helixtrans-65.8-40.2175.2-170.558.75800111.8N78 H79 T80 I85 D86N78-Q82 WeakPolarHBondContact O-CB 3.29Å; N78-Q82 PolarHBondContact O-N 2.8Å; H79-Q82 PolarHBondContact O-N 3.16Å; T80-Q82 VanDerWaalsContact C-N 3.26Å; T80-Q82 PolarHBondContact O-N 3.49Å; Q82-I85 PolarHBondContact O-N 2.94Å; Q82-D86 PolarHBondContact NE2-OD1 2.9Å; Q82-D86 PolarHBondContact O-N 3.41Å
83Q98.8Very high98.7Very high90 Ų9097.6 Ų97.642%0.42146%0.459SS..Hα-helixtrans-61.1-46.8173.5-69.8174.9-23.800111.4H79 T80 I85 D86 D87H79-Q83 PolarHBondContact NE2-NE2 3.06Å; H79-Q83 WeakPolarHBondContact O-CG 3.47Å; H79-Q83 PolarHBondContact O-N 3.4Å; T80-Q83 WeakPolarHBondContact O-CB 3.49Å; T80-Q83 PolarHBondContact O-N 2.97Å; Q83-I85 VanDerWaalsContact C-N 3.3Å; Q83-I85 PolarHBondContact O-N 2.95Å; Q83-D86 PolarHBondContact O-N 3.3Å; Q83-D86 VanDerWaalsContact O-N 3.14Å; Q83-D87 WeakPolarHBondContact O-CB 3.33Å; Q83-D87 PolarHBondContact O-N 2.93Å
84D98.8Very high98.7Very high76 Ų7696.7 Ų96.741%0.40646%0.461SS..Hα-helixtrans-58.9-43.3177.8-60-28.7000111.2T80 H81 D86 D87 L88T80-D84 VanDerWaalsContact O-CG 3.26Å; T80-D84 PolarHBondContact O-N 3.28Å; H81-D84 IonicContact ND1-OD2 2.71Å; H81-D84 PolarHBondContact O-N 2.78Å; D84-D86 PolarHBondContact O-N 3.11Å; D84-D87 PolarHBondContact O-N 3.02Å; D84-L88 WeakPolarHBondContact O-CB 3.33Å; D84-L88 VanDerWaalsContact O-CG 3.26Å; D84-L88 WeakPolarHBondContact O-CG 3.3Å; D84-L88 PolarHBondContact O-N 3.28Å
85I98.8Very high98.7Very high76 Ų7698.7 Ų98.739%0.3947%0.472SS..Hα-helixtrans-60.2-45.9176.1-72.8164.7000110.9H81 Q82 Q83 K89H81-I85 WeakPolarHBondContact O-CB 3.5Å; H81-I85 WeakPolarHBondContact O-CD1 3.35Å; H81-I85 WeakPolarHBondContact O-CG1 3.36Å; H81-I85 PolarHBondContact O-N 3.33Å; Q82-I85 PolarHBondContact O-N 2.94Å; Q83-I85 VanDerWaalsContact C-N 3.3Å; Q83-I85 PolarHBondContact O-N 2.95Å; I85-K89 HydrophobicContact CG2-CD 4.09Å; I85-K89 WeakPolarHBondContact O-CB 3.16Å; I85-K89 VanDerWaalsContact O-CG 3.28Å; I85-K89 WeakPolarHBondContact O-CG 3.43Å; I85-K89 PolarHBondContact O-N 2.93Å
86D98.8Very high98.6Very high71 Ų7196 Ų9638%0.3847%0.467SS..Hα-helixtrans-69.6-36.9-176.9-66.2-20.5000111.7Q82 Q83 D84 K89 R90Q82-D86 PolarHBondContact NE2-OD1 2.9Å; Q82-D86 PolarHBondContact O-N 3.41Å; Q83-D86 PolarHBondContact O-N 3.3Å; Q83-D86 VanDerWaalsContact O-N 3.14Å; D84-D86 PolarHBondContact O-N 3.11Å; D86-K89 PolarHBondContact O-N 3.3Å; D86-R90 PolarHBondContact O-N 2.97Å
87D98.8Very high98.5Very high68 Ų6894.5 Ų94.536%0.36447%0.467SS..Hα-helixtrans-68.1-43.8175.5-75-16.4000111.8Q83 D84 K89 R90 Q91Q83-D87 WeakPolarHBondContact O-CB 3.33Å; Q83-D87 PolarHBondContact O-N 2.93Å; D84-D87 PolarHBondContact O-N 3.02Å; D87-K89 VanDerWaalsContact C-N 3.35Å; D87-K89 PolarHBondContact O-N 3.45Å; D87-R90 WeakPolarHBondContact O-CB 3.35Å; D87-R90 PolarHBondContact O-N 3.3Å; D87-R90 IonicContact OD1-CZ 3.81Å; D87-R90 IonicContact OD1-NH1 3.44Å; D87-R90 PolarHBondContact OD1-NH1 2.99Å; D87-R90 IonicContact OD1-NH2 2.99Å; D87-R90 PolarHBondContact OD1-NH2 3.3Å; D87-Q91 WeakPolarHBondContact O-CG 3.38Å; D87-Q91 PolarHBondContact O-N 3.24Å
88L98.8Very high98.4Very high96 Ų9696.1 Ų96.150%0.50348%0.476SS..Hα-helixtrans-62.8-40.4174.8-74.8171.5000111.9D84 R90 Q91 N92D84-L88 WeakPolarHBondContact O-CB 3.33Å; D84-L88 VanDerWaalsContact O-CG 3.26Å; D84-L88 WeakPolarHBondContact O-CG 3.3Å; D84-L88 PolarHBondContact O-N 3.28Å; L88-R90 VanDerWaalsContact C-N 3.32Å; L88-R90 PolarHBondContact O-N 3.48Å; L88-Q91 PolarHBondContact O-N 2.76Å; L88-N92 WeakPolarHBondContact O-CB 3.43Å; L88-N92 PolarHBondContact O-N 3.46Å
89K98.7Very high98.3Very high130 Ų13095.2 Ų95.257%0.56547%0.474SS*.Hα-helixtrans-60.5-42.1173.7-78.3173.8179.2174.60111.9I85 D86 D87 N92 A93I85-K89 HydrophobicContact CG2-CD 4.09Å; I85-K89 WeakPolarHBondContact O-CB 3.16Å; I85-K89 VanDerWaalsContact O-CG 3.28Å; I85-K89 WeakPolarHBondContact O-CG 3.43Å; I85-K89 PolarHBondContact O-N 2.93Å; D86-K89 PolarHBondContact O-N 3.3Å; D87-K89 VanDerWaalsContact C-N 3.35Å; D87-K89 PolarHBondContact O-N 3.45Å; K89-N92 PolarHBondContact O-N 3.23Å; K89-A93 WeakPolarHBondContact O-CB 3.49Å; K89-A93 PolarHBondContact O-N 3.21Å
90R98.6Very high98.1Very high148 Ų14898.7 Ų98.756%0.55848%0.482SS*.Hα-helixtrans-63.6-44.1176.8-166.3-173.2-55.3111.97.9111.2D86 D87 L88 A93 L94D86-R90 PolarHBondContact O-N 2.97Å; D87-R90 WeakPolarHBondContact O-CB 3.35Å; D87-R90 PolarHBondContact O-N 3.3Å; D87-R90 IonicContact OD1-CZ 3.81Å; D87-R90 IonicContact OD1-NH1 3.44Å; D87-R90 PolarHBondContact OD1-NH1 2.99Å; D87-R90 IonicContact OD1-NH2 2.99Å; D87-R90 PolarHBondContact OD1-NH2 3.3Å; L88-R90 VanDerWaalsContact C-N 3.32Å; L88-R90 PolarHBondContact O-N 3.48Å; R90-A93 PolarHBondContact O-N 3.47Å; R90-L94 WeakPolarHBondContact O-CG 3.41Å; R90-L94 PolarHBondContact O-N 3.11Å; R90-L94 VanDerWaalsContact O-N 3.14Å
91Q98.6Very high97.8Very high113 Ų11398.1 Ų98.153%0.52849%0.485SS..Hα-helixtrans-62.7-46.3177-71.6178-0.800111.8D87 L88 A93 L94 L95D87-Q91 WeakPolarHBondContact O-CG 3.38Å; D87-Q91 PolarHBondContact O-N 3.24Å; L88-Q91 PolarHBondContact O-N 2.76Å; Q91-A93 VanDerWaalsContact C-N 3.35Å; Q91-A93 PolarHBondContact O-N 3.35Å; Q91-L94 PolarHBondContact O-N 3.07Å; Q91-L95 WeakPolarHBondContact O-CG 3.48Å; Q91-L95 PolarHBondContact O-N 2.97Å
92N98.6Very high97.5Very high87 Ų8799.4 Ų99.447%0.46549%0.494SS..Hα-helixtrans-59.8-44.2176.7-78-15.9000111.8L88 K89 L94 L95 E96L88-N92 WeakPolarHBondContact O-CB 3.43Å; L88-N92 PolarHBondContact O-N 3.46Å; K89-N92 PolarHBondContact O-N 3.23Å; N92-L94 VanDerWaalsContact C-N 3.3Å; N92-L94 PolarHBondContact O-N 2.93Å; N92-L95 PolarHBondContact O-N 3.01Å; N92-L95 VanDerWaalsContact O-N 3.17Å; N92-E96 WeakPolarHBondContact O-CB 3.42Å; N92-E96 VanDerWaalsContact O-CG 3.3Å; N92-E96 WeakPolarHBondContact O-CG 3.47Å; N92-E96 PolarHBondContact O-N 2.99Å
93A98.4Very high97.2Very high54 Ų54101 Ų10145%0.44650%0.501SS..Hα-helixtrans-59.9-39.6177.100000112.6K89 R90 Q91 Q97K89-A93 WeakPolarHBondContact O-CB 3.49Å; K89-A93 PolarHBondContact O-N 3.21Å; R90-A93 PolarHBondContact O-N 3.47Å; Q91-A93 VanDerWaalsContact C-N 3.35Å; Q91-A93 PolarHBondContact O-N 3.35Å; A93-Q97 WeakPolarHBondContact O-CB 3.41Å; A93-Q97 PolarHBondContact O-N 3.34Å
94L98.2Very high96.6Very high91 Ų91104.9 Ų104.948%0.47652%0.517SS..Hα-helixtrans-66.6-42.3175.6-69.8173.8000111.9R90 Q91 N92 Q97 Q98R90-L94 WeakPolarHBondContact O-CG 3.41Å; R90-L94 PolarHBondContact O-N 3.11Å; R90-L94 VanDerWaalsContact O-N 3.14Å; Q91-L94 PolarHBondContact O-N 3.07Å; N92-L94 VanDerWaalsContact C-N 3.3Å; N92-L94 PolarHBondContact O-N 2.93Å; L94-Q97 PolarHBondContact O-N 3.41Å; L94-Q98 WeakPolarHBondContact O-CG 3.39Å; L94-Q98 PolarHBondContact O-N 3.39Å
95L98Very high95.9Very high94 Ų94105.3 Ų105.349%0.49252%0.522SS..Hα-helixtrans-66.2-43.9177.7-70173.4000111.6Q91 N92 Q97 Q98 V99Q91-L95 WeakPolarHBondContact O-CG 3.48Å; Q91-L95 PolarHBondContact O-N 2.97Å; N92-L95 PolarHBondContact O-N 3.01Å; N92-L95 VanDerWaalsContact O-N 3.17Å; L95-Q97 VanDerWaalsContact C-N 3.28Å; L95-Q97 PolarHBondContact O-N 3.03Å; L95-Q98 WeakPolarHBondContact O-CB 3.41Å; L95-Q98 PolarHBondContact O-N 3.03Å; L95-Q98 VanDerWaalsContact O-N 3.12Å; L95-V99 WeakPolarHBondContact O-CG2 3.38Å; L95-V99 PolarHBondContact O-N 3.26Å
96E97.6Very high94.9Very high127 Ų127109.3 Ų109.359%0.59354%0.536SS*.Hα-helixtrans-58.6-40.2174.3-74.5173.4-166.400111.7N92 R100N92-E96 WeakPolarHBondContact O-CB 3.42Å; N92-E96 VanDerWaalsContact O-CG 3.3Å; N92-E96 WeakPolarHBondContact O-CG 3.47Å; N92-E96 PolarHBondContact O-N 2.99Å; E96-R100 WeakPolarHBondContact O-CB 3.47Å; E96-R100 PolarHBondContact O-N 3.46Å
97Q96.6Very high93.5Very high133 Ų133107.9 Ų107.962%0.62154%0.538SS*.Hα-helixtrans-64-42.5174.6-173.8-17910.100111.9A93 L94 L95 R100 A101A93-Q97 WeakPolarHBondContact O-CB 3.41Å; A93-Q97 PolarHBondContact O-N 3.34Å; L94-Q97 PolarHBondContact O-N 3.41Å; L95-Q97 VanDerWaalsContact C-N 3.28Å; L95-Q97 PolarHBondContact O-N 3.03Å; Q97-R100 PolarHBondContact O-N 2.89Å; Q97-A101 WeakPolarHBondContact O-CB 3.46Å; Q97-A101 PolarHBondContact O-N 2.9Å
98Q96.4Very high91.9Very high114 Ų114107.4 Ų107.453%0.53354%0.54SS..Hα-helixtrans-64.7-45.1177.4-71.6173.923.600111.8L94 L95 R100 A101 L102L94-Q98 WeakPolarHBondContact O-CG 3.39Å; L94-Q98 PolarHBondContact O-N 3.39Å; L95-Q98 WeakPolarHBondContact O-CB 3.41Å; L95-Q98 PolarHBondContact O-N 3.03Å; L95-Q98 VanDerWaalsContact O-N 3.12Å; Q98-R100 PolarHBondContact O-N 3.03Å; Q98-A101 PolarHBondContact O-N 3.25Å; Q98-L102 WeakPolarHBondContact O-CG 3.48Å; Q98-L102 PolarHBondContact O-N 2.98Å
99V96.3Very high90.1Very high76 Ų76106.5 Ų106.546%0.46154%0.539SS..Hα-helixtrans-57.8-50.5176.2170.30000110.1L95 A101 L102 E103L95-V99 WeakPolarHBondContact O-CG2 3.38Å; L95-V99 PolarHBondContact O-N 3.26Å; V99-A101 VanDerWaalsContact C-N 3.3Å; V99-A101 PolarHBondContact O-N 3.46Å; V99-L102 PolarHBondContact O-N 3.4Å; V99-L102 VanDerWaalsContact O-N 3.14Å; V99-E103 HydrophobicContact CG1-CG 4.34Å; V99-E103 WeakPolarHBondContact O-CG 3.29Å; V99-E103 PolarHBondContact O-N 3.17Å
100R95.5Very high88.2Confident185 Ų185107 Ų10770%0.69854%0.543SS*.Hα-helixtrans-58.9-40.2178.3-173.2-177.1-61.9-150.80.4112.7E96 Q97 Q98 K104E96-R100 WeakPolarHBondContact O-CB 3.47Å; E96-R100 PolarHBondContact O-N 3.46Å; Q97-R100 PolarHBondContact O-N 2.89Å; Q98-R100 PolarHBondContact O-N 3.03Å; R100-K104 PolarHBondContact O-N 3.5Å; R100-K104 VanDerWaalsContact O-N 3.1Å
101A93Very high86.2Confident54 Ų54105 Ų10545%0.44654%0.543SS..Hα-helixtrans-65.5-43.3177.300000111.7Q97 Q98 V99 K104 V105Q97-A101 WeakPolarHBondContact O-CB 3.46Å; Q97-A101 PolarHBondContact O-N 2.9Å; Q98-A101 PolarHBondContact O-N 3.25Å; V99-A101 VanDerWaalsContact C-N 3.3Å; V99-A101 PolarHBondContact O-N 3.46Å; A101-K104 PolarHBondContact O-N 3.36Å; A101-V105 WeakPolarHBondContact O-CG2 3.4Å; A101-V105 PolarHBondContact O-N 2.89Å; A101-V105 VanDerWaalsContact O-N 3.1Å
102L92Very high84.2Confident113 Ų113106.4 Ų106.459%0.59255%0.549SS*.Hα-helixtrans-66.8-39.2177.9-71.3172000112.5Q98 V99 K104 V105 K106Q98-L102 WeakPolarHBondContact O-CG 3.48Å; Q98-L102 PolarHBondContact O-N 2.98Å; V99-L102 PolarHBondContact O-N 3.4Å; V99-L102 VanDerWaalsContact O-N 3.14Å; L102-K104 VanDerWaalsContact C-N 3.33Å; L102-V105 PolarHBondContact O-N 2.93Å; L102-K106 PolarHBondContact O-N 3.42Å
103E91.6Very high82.1Confident126 Ų126106.4 Ų106.459%0.58955%0.552SS**Hα-helixtrans-61.3-41.9173.7-72.9173.3164.400111.5V99 V105 K106 G107V99-E103 HydrophobicContact CG1-CG 4.34Å; V99-E103 WeakPolarHBondContact O-CG 3.29Å; V99-E103 PolarHBondContact O-N 3.17Å; E103-V105 PolarHBondContact O-N 3.24Å; E103-K106 PolarHBondContact O-N 3.48Å; E103-G107 PolarHBondContact O-N 3.24Å
104K87.2Confident80Confident171 Ų171110.1 Ų110.174%0.74357%0.565SS**Hα-helixtrans-62.3-42.1175.6-172.2179180-177.50112.1R100 A101 L102 S108R100-K104 PolarHBondContact O-N 3.5Å; R100-K104 VanDerWaalsContact O-N 3.1Å; A101-K104 PolarHBondContact O-N 3.36Å; L102-K104 VanDerWaalsContact C-N 3.33Å; K104-S108 PolarHBondContact O-N 2.89Å; K104-S108 PolarHBondContact O-OG 2.99Å; K104-S108 VanDerWaalsContact O-OG 3.07Å
105V83.6Confident77.8Confident85 Ų85115.1 Ų115.152%0.51558%0.579SS.*Hα-helixtrans-68.2-44.8177.7174.60000111.3A101 L102 E103 G107 S108 T109A101-V105 WeakPolarHBondContact O-CG2 3.4Å; A101-V105 PolarHBondContact O-N 2.89Å; A101-V105 VanDerWaalsContact O-N 3.1Å; L102-V105 PolarHBondContact O-N 2.93Å; E103-V105 PolarHBondContact O-N 3.24Å; V105-G107 VanDerWaalsContact C-N 3.33Å; V105-G107 PolarHBondContact O-N 3.42Å; V105-S108 WeakPolarHBondContact CA-OG 3.46Å; V105-S108 PolarHBondContact O-N 3.42Å; V105-S108 PolarHBondContact O-OG 2.97Å; V105-T109 PolarHBondContact O-N 3.39Å; V105-T109 PolarHBondContact O-OG1 3.14Å
106K77.8Confident75.5Confident160 Ų160115.3 Ų115.370%0.69659%0.588SS**Hα-helixtrans-60.6-42.3175.6-81.8-176.7173.3179.40112.1L102 E103 T109 Q110L102-K106 PolarHBondContact O-N 3.42Å; E103-K106 PolarHBondContact O-N 3.48Å; K106-T109 PolarHBondContact O-N 3.01Å; K106-Q110 WeakPolarHBondContact O-CG 3.38Å; K106-Q110 PolarHBondContact O-N 2.81Å; K106-Q110 VanDerWaalsContact O-N 3.16Å
107G68.9Low73Confident40 Ų40113.3 Ų113.341%0.41259%0.588SS.*Hα-helixtrans-62.4-41.5175.800000112.9E103 V105 I111E103-G107 PolarHBondContact O-N 3.24Å; V105-G107 VanDerWaalsContact C-N 3.33Å; V105-G107 PolarHBondContact O-N 3.42Å; G107-I111 WeakPolarHBondContact O-CG1 3.42Å; G107-I111 PolarHBondContact O-N 3Å
108S65.6Low71.2Confident58 Ų58112.6 Ų112.641%0.40660%0.595SS.*Hα-helixtrans-73.4-33.3178.255.20000113.7K104 V105 I111 Q112K104-S108 PolarHBondContact O-N 2.89Å; K104-S108 PolarHBondContact O-OG 2.99Å; K104-S108 VanDerWaalsContact O-OG 3.07Å; V105-S108 WeakPolarHBondContact CA-OG 3.46Å; V105-S108 PolarHBondContact O-N 3.42Å; V105-S108 PolarHBondContact O-OG 2.97Å; S108-I111 PolarHBondContact O-N 3.24Å; S108-Q112 PolarHBondContact O-N 3.38Å; S108-Q112 VanDerWaalsContact O-N 3.15Å
109T61.6Low69Low77 Ų77113.8 Ų113.847%0.47261%0.605SS.*Hα-helixtrans-66.4-40.4174.2-54.70000112V105 K106 I111 Q112 T113V105-T109 PolarHBondContact O-N 3.39Å; V105-T109 PolarHBondContact O-OG1 3.14Å; K106-T109 PolarHBondContact O-N 3.01Å; T109-I111 VanDerWaalsContact C-N 3.34Å; T109-I111 PolarHBondContact O-N 3.11Å; T109-Q112 PolarHBondContact O-N 3.1Å; T109-T113 PolarHBondContact O-N 2.88Å; T109-T113 VanDerWaalsContact O-N 3.13Å; T109-T113 PolarHBondContact O-OG1 2.86Å
110Q58.8Low66.8Low142 Ų142115.6 Ų115.666%0.66462%0.621SS**Hα-helixtrans-63.9-37175.4-75.3-119.1-11.200112.9K106 T113 N114K106-Q110 WeakPolarHBondContact O-CG 3.38Å; K106-Q110 PolarHBondContact O-N 2.81Å; K106-Q110 VanDerWaalsContact O-N 3.16Å; Q110-T113 PolarHBondContact O-OG1 2.84Å; Q110-N114 PolarHBondContact O-N 2.84Å
111I55.6Low64.7Low106 Ų106110.1 Ų110.154%0.54461%0.61SS.*Hα-helixtrans-65.7-41.5175.8-62.2-88.8000110.2G107 S108 T109 N114 Y115G107-I111 WeakPolarHBondContact O-CG1 3.42Å; G107-I111 PolarHBondContact O-N 3Å; S108-I111 PolarHBondContact O-N 3.24Å; T109-I111 VanDerWaalsContact C-N 3.34Å; T109-I111 PolarHBondContact O-N 3.11Å; I111-N114 PolarHBondContact O-N 2.99Å; I111-Y115 HydrophobicContact CG2-CD2 3.87Å; I111-Y115 HydrophobicContact CG2-CE2 3.9Å; I111-Y115 WeakPolarHBondContact O-CD2 3.26Å; I111-Y115 PolarHBondContact O-N 2.73Å
112Q56.3Low62.6Low142 Ų142113.4 Ų113.466%0.66462%0.62SS**Hα-helixtrans-67.9-35178.9-72.5-174.511.800113.7S108 T109 N114 Y115 S116S108-Q112 PolarHBondContact O-N 3.38Å; S108-Q112 VanDerWaalsContact O-N 3.15Å; T109-Q112 PolarHBondContact O-N 3.1Å; Q112-N114 VanDerWaalsContact C-N 3.32Å; Q112-Y115 PolarHBondContact O-N 2.72Å; Q112-S116 PolarHBondContact O-N 2.71Å
113T55.6Low60.5Low87 Ų87119.2 Ų119.253%0.53464%0.636SS.*Hα-helixtrans-70.7-26.8175.851.10000113.1T109 Q110T109-T113 PolarHBondContact O-N 2.88Å; T109-T113 VanDerWaalsContact O-N 3.13Å; T109-T113 PolarHBondContact O-OG1 2.86Å; Q110-T113 PolarHBondContact O-OG1 2.84Å
114N54.6Low59Low132 Ų132118.2 Ų118.271%0.70664%0.638SS**Hα-helixtrans-81-20176.6-92.843.1000114.3Q110 I111 Q112Q110-N114 PolarHBondContact O-N 2.84Å; I111-N114 PolarHBondContact O-N 2.99Å; Q112-N114 VanDerWaalsContact C-N 3.32Å
115Y51.9Low57.4Low196 Ų196115.9 Ų115.977%0.76963%0.634SS**Hα-helixtrans-102.8-6.9177.5-72.1-71.3000114.1I111 Q112I111-Y115 HydrophobicContact CG2-CD2 3.87Å; I111-Y115 HydrophobicContact CG2-CE2 3.9Å; I111-Y115 WeakPolarHBondContact O-CD2 3.26Å; I111-Y115 PolarHBondContact O-N 2.73Å; Q112-Y115 PolarHBondContact O-N 2.72Å
116S49.7Very low56Low98 Ų98118.3 Ų118.369%0.68565%0.651SS**  trans-103.770.1167.2-70.10000111Q112Q112-S116 PolarHBondContact O-N 2.71Å
117S44.1Very low55Low85 Ų85119.5 Ų119.559%0.59466%0.657SS**  trans-129.292.2154.3-167.10000108.9
118P59.4Low54.3Low118 Ų118121.6 Ų121.677%0.76668%0.678SS**SBendtrans-81.2117.4143.931.6-20.2000106.7
119D50.2Low53.5Low139 Ų139123.8 Ų123.874%0.74369%0.694SS**  trans64.979.3160.5-164.121.8000116.9S121D119-S121 PolarHBondContact O-N 2.63Å; D119-S121 PolarHBondContact OD1-N 2.85Å
120S49.3Very low53.1Low114 Ų114124.7 Ų124.780%0.79771%0.709SS**  trans-90.669.9155.4-170.40000110.1L122S120-L122 PolarHBondContact O-N 2.64Å
121S52.2Low52.8Low69 Ų69124.8 Ų124.848%0.48372%0.719SS.*  trans-36.4121.2153.7-178.90000113D119D119-S121 PolarHBondContact O-N 2.63Å; D119-S121 PolarHBondContact OD1-N 2.85Å
122L49.3Very low52.5Low123 Ų123124.9 Ų124.964%0.64473%0.729SS**  trans72.3115.7143.7-58.7170.2000120.8S120S120-L122 PolarHBondContact O-N 2.64Å
123Y48.3Very low52.1Low235 Ų235122.4 Ų122.492%0.92273%0.733SS**  -138.593.2115.2-100.7-86.4000108.9
124T59.7Low51.6Low105 Ų105127.7 Ų127.764%0.64475%0.749SS**  trans-108.5124.1163.755.50000107.8
125N52.4Low52Low123 Ų123128.6 Ų128.666%0.65875%0.754SS**  trans-65154.7167.9-94.97.7000109.3K127N125-K127 CarbonylContact O-C 3.43Å; N125-K127 PolarHBondContact O-N 2.86Å
126P55.6Low52Low135 Ų135121.8 Ų121.888%0.87774%0.743SS**SBendtrans-63.38.1-178.824.7-33.9000115.1
127K56.5Low51.6Low185 Ų185119.8 Ų119.880%0.80474%0.737SS**SBendtrans-122.893.5168.3-60.8-163.7178.6-172.90106.3N125 S129N125-K127 CarbonylContact O-C 3.43Å; N125-K127 PolarHBondContact O-N 2.86Å; K127-S129 VanDerWaalsContact C-N 3.28Å; K127-S129 PolarHBondContact O-N 2.67Å
128G54Low52Low84 Ų84121.5 Ų121.587%0.86675%0.749SS**  trans-58.474.7-168.300000115.9
129S48.8Very low51.3Low105 Ų105122.6 Ų122.673%0.73475%0.749SS**  trans-115.6120.5171.9-154.80000108.7K127 V131K127-S129 VanDerWaalsContact C-N 3.28Å; K127-S129 PolarHBondContact O-N 2.67Å; S129-V131 PolarHBondContact O-N 2.84Å
130A52.2Low51.2Low95 Ų95121.3 Ų121.379%0.78575%0.751SS**  trans-64.3127.6173.400000109.7
131V52.4Low51.2Low145 Ų145121.4 Ų121.488%0.87975%0.752SS**  trans-89.2101.8169.5-73.20000108.3S129S129-V131 PolarHBondContact O-N 2.84Å
132S50.3Low51.1Low108 Ų108124.1 Ų124.176%0.75577%0.771SS**  trans-91.9132.5175.949.10000111.7
133A48.3Very low51.1Low90 Ų90127.5 Ų127.574%0.74478%0.783SS**  trans56.5105.5143.600000119.3D135A133-D135 PolarHBondContact O-N 2.97Å
134F45Very low51.1Low198 Ų198122 Ų12287%0.86878%0.779SS**  trans-76.5100144.1175.1-103.6000107.5
135D62.1Low50.7Low151 Ų151125.9 Ų125.981%0.80779%0.79SS**  trans-86.9101164.6179.750.2000107.3A133A133-D135 PolarHBondContact O-N 2.97Å
136G51.8Low50.5Low52 Ų52124.9 Ų124.954%0.53680%0.798SS.*  trans-122.17817600000108.8
137G41.1Very low50.3Low56 Ų56127 Ų12758%0.57780%0.796SS**  trans-69.5153.8177.600000114
138S53Low50.4Low121 Ų121126.6 Ų126.685%0.84680%0.798SS**  trans54.5152.6145-54.60000117.9
139D45.3Very low50.5Low142 Ų142127.5 Ų127.576%0.75979%0.788SS**  cis-168158.24471.5000105.4
140S48.5Very low51Low111 Ų111128.2 Ų128.278%0.77679%0.791SS**  trans171.6104.8144.2-93.90000112.9
141S48.4Very low50.9Low117 Ų117130 Ų13082%0.81879%0.791SS**  trans25.9123.7137.1-56.30000121.4
142S49.1Very low51.3Low126 Ų126134.9 Ų134.988%0.88179%0.794SS**  trans-59.7130.7152.4-62.20000111.6
143E50.1Low51.8Low194 Ų194139.2 Ų139.291%0.90780%0.799SS**  trans-121.2124.2156-103.2-175.6110.900109.6
144S48.4Very low52.2Low119 Ų119144.9 Ų144.983%0.83281%0.807SS**  trans-90.1116.7174.443.60000109.3
145E50.3Low52.4Low186 Ų186142.8 Ų142.887%0.86981%0.805SS**  trans-88.5125.6169.2-68.8-154.6130.600111.1
146A49.2Very low51.8Low102 Ų102145.2 Ų145.284%0.84380%0.802SS**  trans-94.9114.616500000108.3
147E51.1Low52Low179 Ų179151 Ų15184%0.83682%0.817SS**  trans-82.3111.8173.6-92.9-92.1147.400110.1
148E58.2Low52.3Low177 Ų177155 Ų15583%0.82782%0.821SS**PPolyproline II helixtrans-90144.3165.7-131.9-156.9139.600109.7
149P56.3Low52Low104 Ų104153.4 Ų153.468%0.67582%0.815SS**PPolyproline II helixtrans-82147.1-171.432-31.2000113T151P149-T151 PolarHBondContact O-N 2.95Å
150P60.4Low52.5Low120 Ų120156.1 Ų156.178%0.77985%0.845SS**PPolyproline II helixtrans-75.6122.6-178.227.8-33000112.9R152P150-R152 PolarHBondContact O-N 3.1Å
151T49.1Very low52.7Low131 Ų131158.4 Ų158.480%0.80485%0.848SS**PPolyproline II helixtrans-72.4116.1167.150.60000110.6P149P149-T151 PolarHBondContact O-N 2.95Å
152R61.6Low52.9Low248 Ų248160.5 Ų160.594%0.93685%0.85SS**PPolyproline II helixtrans-94.3117.3169.8-80.5-173.7166.2178.6-2.5111.3P150P150-R152 PolarHBondContact O-N 3.1Å
153K59.6Low53.1Low199 Ų199162.4 Ų162.487%0.86585%0.848SS**PPolyproline II helixtrans-66.6138.7177.8-67.6174177174.60111.7
154K56.5Low53.3Low210 Ų210160.6 Ų160.691%0.91385%0.845SS**PPolyproline II helixtrans-64.5129.3168-70.9179174.3-179.70110.1
155L50.3Low53.6Low154 Ų154163.2 Ų163.281%0.80685%0.846SS**  trans-102.4115.8160.7-143.195000108.2M157L155-M157 HydrophobicContact CD2-CE 4.18Å
156R49.9Very low53.8Low202 Ų202161.7 Ų161.776%0.76284%0.844SS**  trans-86.4124169.2176.5167.8178.5166.4-4.4107E158R156-E158 HydrophobicContact CG-CG 4.42Å; R156-E158 IonicContact CZ-OE1 3.63Å; R156-E158 VanDerWaalsContact CZ-OE1 3.27Å; R156-E158 IonicContact NE-OE1 2.9Å; R156-E158 PolarHBondContact NE-OE1 3.22Å; R156-E158 IonicContact NH2-OE1 2.89Å; R156-E158 PolarHBondContact NH2-OE1 3.49Å
157M54.9Low54.1Low172 Ų172165.9 Ų165.985%0.84784%0.844SS**  trans-111.9113.5163.5-88.6178.4171.400107.9L155L155-M157 HydrophobicContact CD2-CE 4.18Å
158E47.1Very low54.4Low142 Ų142164.9 Ų164.966%0.66485%0.845SS**  trans-79.5165.7166.6-75.6-78.915200110.2R156R156-E158 HydrophobicContact CG-CG 4.42Å; R156-E158 IonicContact CZ-OE1 3.63Å; R156-E158 VanDerWaalsContact CZ-OE1 3.27Å; R156-E158 IonicContact NE-OE1 2.9Å; R156-E158 PolarHBondContact NE-OE1 3.22Å; R156-E158 IonicContact NH2-OE1 2.89Å; R156-E158 PolarHBondContact NH2-OE1 3.49Å
159A46.7Very low54Low87 Ų87163.9 Ų163.972%0.71985%0.846SS**  trans-68.2160.2-166.100000116.9
160S56Low53.8Low198 Ų198169.4 Ų169.4100%1.38586%0.862SS**  trans-151.20133-760000109

Retrieved 160 of 160 residues in 266.6 ms (Link to these results)