A0A087Y727_POEFO Loading...

TRAF3-interacting JNK-activating modulator-like

AlphaFold DB , UniProt , Accession A0A087Y727, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 577 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
1M38.2Very low43.4Very low240 Ų240143.3 Ų143.3100%1.18271%0.708SS**  085.10-160.7173.8-158.400105.6
2E36.2Very low43.2Very low184 Ų184142.6 Ų142.686%0.8670%0.699SS**  trans-117.6117.5179.1-72.8-174.5158.900107.4L4E2-L4 PolarHBondContact O-N 3.16Å
3H43.8Very low43.9Very low192 Ų192142.5 Ų142.589%0.88970%0.696SS**  trans-72.9110.2173.5-101.9-97000108.6
4L43.1Very low44.6Very low151 Ų151140.6 Ų140.679%0.79169%0.685SS**  trans-93109163.7-90.9154.8000108.5E2 F6E2-L4 PolarHBondContact O-N 3.16Å; L4-F6 PolarHBondContact O-N 2.95Å
5D43.3Very low45.2Very low116 Ų116140.6 Ų140.662%0.6267%0.674SS**  trans-74.698.3-174.6-169.55.1000111.5G7D5-G7 PolarHBondContact O-N 3.46Å; D5-G7 PolarHBondContact OD1-N 3.02Å
6F45.4Very low46.2Very low177 Ų177137.3 Ų137.378%0.77666%0.658SS**THydrogen-bonded Turntrans-75.10.1171.4-82.1-88.8000113.3L4L4-F6 PolarHBondContact O-N 2.95Å
7G43.1Very low46.8Very low37 Ų37134.1 Ų134.138%0.38164%0.64SS.*Hα-helixtrans-70.1-32.6177.400000113D5 T9 H11D5-G7 PolarHBondContact O-N 3.46Å; D5-G7 PolarHBondContact OD1-N 3.02Å; G7-T9 PolarHBondContact O-N 2.94Å; G7-H11 VanDerWaalsContact O-CB 3.25Å; G7-H11 WeakPolarHBondContact O-CB 3.46Å; G7-H11 PolarHBondContact O-N 3.26Å
8V44.4Very low48.1Very low78 Ų78130.9 Ų130.947%0.47363%0.628SS.*Hα-helixtrans-68.1-40-169.5-175.90000112.1F12V8-F12 WeakPolarHBondContact O-CB 3.44Å; V8-F12 PolarHBondContact O-N 3.49Å
9T46.9Very low49.1Very low94 Ų94133.7 Ų133.758%0.57763%0.631SS**Hα-helixtrans-74.3-39.3-173.9-23.10000113.1G7 F12 Q13G7-T9 PolarHBondContact O-N 2.94Å; T9-F12 PolarHBondContact O-N 3.47Å; T9-Q13 PolarHBondContact O-N 3.49Å
10R48.6Very low50.2Low208 Ų208132.2 Ų132.279%0.78562%0.622SS**Hα-helixtrans-64.9-44.6173.5-114.6-179-177.6173.80.7110.9F12 Q13 E14R10-F12 PolarHBondContact O-N 3.49Å; R10-Q13 PolarHBondContact O-N 3.38Å; R10-E14 VanDerWaalsContact O-CB 3.3Å; R10-E14 WeakPolarHBondContact O-CB 3.49Å; R10-E14 PolarHBondContact O-N 3.39Å
11H44Very low51.2Low99 Ų99128.5 Ų128.546%0.45861%0.608SS.*Hα-helixtrans-70.5-20.6179.6-146-27.4000112.9G7 R15G7-H11 VanDerWaalsContact O-CB 3.25Å; G7-H11 WeakPolarHBondContact O-CB 3.46Å; G7-H11 PolarHBondContact O-N 3.26Å; H11-R15 VanDerWaalsContact O-CB 3.31Å; H11-R15 WeakPolarHBondContact O-CB 3.38Å; H11-R15 VanDerWaalsContact O-CG 3.28Å; H11-R15 WeakPolarHBondContact O-CG 3.42Å; H11-R15 PolarHBondContact O-N 3.43Å; H11-R15 PolarHBondContact O-NE 2.84Å; H11-R15 VanDerWaalsContact O-NE 3.09Å
12F41.5Very low52.9Low135 Ų135122 Ų12259%0.59258%0.579SS**Hα-helixtrans-78.6-43.6174.1-140.1-93.3000111.9V8 T9 R10 R15 E16V8-F12 WeakPolarHBondContact O-CB 3.44Å; V8-F12 PolarHBondContact O-N 3.49Å; T9-F12 PolarHBondContact O-N 3.47Å; R10-F12 PolarHBondContact O-N 3.49Å; F12-R15 PolarHBondContact O-N 3.49Å; F12-E16 PolarHBondContact O-N 2.96Å
13Q52.2Low54.6Low142 Ų142120.6 Ų120.666%0.66457%0.566SS**Hα-helixtrans-69.3-39.2176.1-76.7-174.2-19.300112.4T9 R10 E16 F17T9-Q13 PolarHBondContact O-N 3.49Å; R10-Q13 PolarHBondContact O-N 3.38Å; Q13-E16 PolarHBondContact O-N 3.49Å; Q13-F17 PolarHBondContact O-N 3.4Å
14E53.6Low56Low115 Ų115117.6 Ų117.654%0.53755%0.547SS..Hα-helixtrans-60.5-46.6173.8-161.4165-150.400110.5R10 E16 F17 D18R10-E14 VanDerWaalsContact O-CB 3.3Å; R10-E14 WeakPolarHBondContact O-CB 3.49Å; R10-E14 PolarHBondContact O-N 3.39Å; E14-E16 PolarHBondContact O-N 3.37Å; E14-F17 PolarHBondContact O-N 2.66Å; E14-D18 WeakPolarHBondContact O-CB 3.33Å; E14-D18 VanDerWaalsContact O-CG 3.23Å; E14-D18 PolarHBondContact O-N 3.34Å
15R54.1Low57.3Low141 Ų141112.2 Ų112.253%0.53253%0.525SS..Hα-helixtrans-64.2-34.8174.9-82.6-172.7-80-157.2-2.8114.2H11 F12 R19H11-R15 VanDerWaalsContact O-CB 3.31Å; H11-R15 WeakPolarHBondContact O-CB 3.38Å; H11-R15 VanDerWaalsContact O-CG 3.28Å; H11-R15 WeakPolarHBondContact O-CG 3.42Å; H11-R15 PolarHBondContact O-N 3.43Å; H11-R15 PolarHBondContact O-NE 2.84Å; H11-R15 VanDerWaalsContact O-NE 3.09Å; F12-R15 PolarHBondContact O-N 3.49Å; R15-R19 WeakPolarHBondContact O-CB 3.22Å; R15-R19 PolarHBondContact O-N 3.23Å
16E61.3Low58.8Low87 Ų87113.1 Ų113.141%0.40753%0.525SS..Hα-helixtrans-72.8-35.3178.7-156.6-165.1142.500112.1F12 Q13 E14 K20F12-E16 PolarHBondContact O-N 2.96Å; Q13-E16 PolarHBondContact O-N 3.49Å; E14-E16 PolarHBondContact O-N 3.37Å; E16-K20 WeakPolarHBondContact O-CG 3.38Å; E16-K20 PolarHBondContact O-N 3.26Å; E16-K20 WeakPolarHBondContact OE1-CE 3.07Å; E16-K20 IonicContact OE1-NZ 3.44Å; E16-K20 PolarHBondContact OE1-NZ 3.08Å
17F56.4Low59.7Low83 Ų83112.7 Ų112.736%0.36452%0.518SS..Hα-helixtrans-70.5-45173.5-177.6-94.6000111.7Q13 E14 R19 K20 V21Q13-F17 PolarHBondContact O-N 3.4Å; E14-F17 PolarHBondContact O-N 2.66Å; F17-R19 VanDerWaalsContact C-N 3.28Å; F17-R19 PolarHBondContact O-N 3.12Å; F17-K20 CarbonylContact O-C 3.6Å; F17-K20 WeakPolarHBondContact O-CA 3.37Å; F17-K20 WeakPolarHBondContact O-CB 3.46Å; F17-K20 PolarHBondContact O-N 3.42Å; F17-V21 HydrophobicContact CD1-CG2 3.85Å; F17-V21 HydrophobicContact CE1-CG2 3.45Å; F17-V21 VanDerWaalsContact CE1-CG2 3.45Å; F17-V21 HydrophobicContact CZ-CG2 3.91Å; F17-V21 WeakPolarHBondContact O-CG2 3.38Å; F17-V21 PolarHBondContact O-N 3.39Å
18D70Confident60.7Low77 Ų77118.4 Ų118.441%0.41253%0.529SS..Hα-helixtrans-58.1-42.6176.1-70.9-24.2000110.9E14 K20 V21 D22E14-D18 WeakPolarHBondContact O-CB 3.33Å; E14-D18 VanDerWaalsContact O-CG 3.23Å; E14-D18 PolarHBondContact O-N 3.34Å; D18-K20 VanDerWaalsContact C-N 3.28Å; D18-K20 PolarHBondContact O-N 3.04Å; D18-V21 CarbonylContact O-C 3.56Å; D18-V21 WeakPolarHBondContact O-CA 3.49Å; D18-V21 WeakPolarHBondContact O-CB 3.37Å; D18-V21 PolarHBondContact O-N 3.43Å; D18-D22 PolarHBondContact O-N 3.46Å
19R67.7Low61.9Low184 Ų184120 Ų12069%0.69453%0.53SS*.Hα-helixtrans-61.4-33.6173.7-156.1178.979.81734.8113.1R15 F17 Y23R15-R19 WeakPolarHBondContact O-CB 3.22Å; R15-R19 PolarHBondContact O-N 3.23Å; F17-R19 VanDerWaalsContact C-N 3.28Å; F17-R19 PolarHBondContact O-N 3.12Å; R19-Y23 WeakPolarHBondContact O-CB 3.35Å; R19-Y23 PolarHBondContact O-N 2.86Å
20K70.5Confident62.7Low103 Ų103122.9 Ų122.945%0.44853%0.532SS..Hα-helixtrans-76-24.5174-72.9170.6-172.7162.50112.5E16 F17 D18 R24E16-K20 WeakPolarHBondContact O-CG 3.38Å; E16-K20 PolarHBondContact O-N 3.26Å; E16-K20 WeakPolarHBondContact OE1-CE 3.07Å; E16-K20 IonicContact OE1-NZ 3.44Å; E16-K20 PolarHBondContact OE1-NZ 3.08Å; F17-K20 CarbonylContact O-C 3.6Å; F17-K20 WeakPolarHBondContact O-CA 3.37Å; F17-K20 WeakPolarHBondContact O-CB 3.46Å; F17-K20 PolarHBondContact O-N 3.42Å; D18-K20 VanDerWaalsContact C-N 3.28Å; D18-K20 PolarHBondContact O-N 3.04Å; K20-R24 WeakPolarHBondContact O-CB 3.41Å; K20-R24 VanDerWaalsContact O-CG 3.31Å; K20-R24 WeakPolarHBondContact O-CG 3.38Å; K20-R24 PolarHBondContact O-N 2.95Å; K20-R24 PolarHBondContact O-NE 2.91Å
21V71.2Confident63.2Low55 Ų55116.7 Ų116.733%0.33351%0.514SS..Hα-helixtrans-76.1-45.3172.1172.50000109.9F17 D18 R24 A25F17-V21 HydrophobicContact CD1-CG2 3.85Å; F17-V21 HydrophobicContact CE1-CG2 3.45Å; F17-V21 VanDerWaalsContact CE1-CG2 3.45Å; F17-V21 HydrophobicContact CZ-CG2 3.91Å; F17-V21 WeakPolarHBondContact O-CG2 3.38Å; F17-V21 PolarHBondContact O-N 3.39Å; D18-V21 CarbonylContact O-C 3.56Å; D18-V21 WeakPolarHBondContact O-CA 3.49Å; D18-V21 WeakPolarHBondContact O-CB 3.37Å; D18-V21 PolarHBondContact O-N 3.43Å; V21-R24 CarbonylContact O-C 3.49Å; V21-R24 WeakPolarHBondContact O-CA 3.38Å; V21-R24 WeakPolarHBondContact O-CB 3.33Å; V21-R24 PolarHBondContact O-N 3.34Å; V21-R24 VanDerWaalsContact O-N 3.09Å; V21-A25 WeakPolarHBondContact O-CB 3.36Å; V21-A25 PolarHBondContact O-N 2.84Å
22D74.6Confident64Low105 Ų105121.1 Ų121.156%0.56153%0.527SS*.Hα-helixtrans-61.6-45.1177.1-68.9-23.4000111.2D18 R24 A25 E26D18-D22 PolarHBondContact O-N 3.46Å; D22-R24 VanDerWaalsContact C-N 3.27Å; D22-R24 PolarHBondContact O-N 3.29Å; D22-A25 CarbonylContact O-C 3.58Å; D22-A25 WeakPolarHBondContact O-CA 3.09Å; D22-A25 WeakPolarHBondContact O-CB 3.46Å; D22-A25 PolarHBondContact O-N 3.4Å; D22-E26 WeakPolarHBondContact O-CB 3.16Å; D22-E26 PolarHBondContact O-N 3.46Å
23Y71.3Confident64.5Low153 Ų153118.1 Ų118.160%0.653%0.534SS*.Hα-helixtrans-60.4-36.4173.9-171.9-98000112.6R19 R27R19-Y23 WeakPolarHBondContact O-CB 3.35Å; R19-Y23 PolarHBondContact O-N 2.86Å; Y23-R27 VanDerWaalsContact O-CB 3.3Å; Y23-R27 WeakPolarHBondContact O-CB 3.38Å; Y23-R27 PolarHBondContact O-N 3.39Å
24R72.4Confident64.7Low130 Ų130117.8 Ų117.849%0.49153%0.527SS..Hα-helixtrans-74.3-28.3174.7-79.4-175-95.8-174.4-8.4112.6K20 V21 D22 R28K20-R24 WeakPolarHBondContact O-CB 3.41Å; K20-R24 VanDerWaalsContact O-CG 3.31Å; K20-R24 WeakPolarHBondContact O-CG 3.38Å; K20-R24 PolarHBondContact O-N 2.95Å; K20-R24 PolarHBondContact O-NE 2.91Å; V21-R24 CarbonylContact O-C 3.49Å; V21-R24 WeakPolarHBondContact O-CA 3.38Å; V21-R24 WeakPolarHBondContact O-CB 3.33Å; V21-R24 PolarHBondContact O-N 3.34Å; V21-R24 VanDerWaalsContact O-N 3.09Å; D22-R24 VanDerWaalsContact C-N 3.27Å; D22-R24 PolarHBondContact O-N 3.29Å; R24-R28 WeakPolarHBondContact O-CG 3.42Å; R24-R28 PolarHBondContact O-N 3.35Å; R24-R28 PolarHBondContact O-NE 2.98Å
25A72Confident64.5Low38 Ų38119.9 Ų119.931%0.31454%0.542SS..Hα-helixtrans-74.1-47.7174.500000110.4V21 D22 R27 R28 E29V21-A25 WeakPolarHBondContact O-CB 3.36Å; V21-A25 PolarHBondContact O-N 2.84Å; D22-A25 CarbonylContact O-C 3.58Å; D22-A25 WeakPolarHBondContact O-CA 3.09Å; D22-A25 WeakPolarHBondContact O-CB 3.46Å; D22-A25 PolarHBondContact O-N 3.4Å; A25-R27 PolarHBondContact O-N 2.93Å; A25-R28 CarbonylContact O-C 3.48Å; A25-R28 WeakPolarHBondContact O-CA 3.39Å; A25-R28 WeakPolarHBondContact O-CB 3.38Å; A25-R28 PolarHBondContact O-N 3.2Å; A25-E29 PolarHBondContact O-N 3.46Å
26E73.7Confident64.2Low135 Ų135118.9 Ų118.963%0.63155%0.547SS*.Hα-helixtrans-60.1-42.1176.9-168.7177.3-160.900111.8D22 R28 E29 Y30D22-E26 WeakPolarHBondContact O-CB 3.16Å; D22-E26 PolarHBondContact O-N 3.46Å; E26-R28 VanDerWaalsContact C-N 3.26Å; E26-R28 PolarHBondContact O-N 2.98Å; E26-E29 WeakPolarHBondContact O-CB 3.41Å; E26-E29 PolarHBondContact O-N 3.18Å; E26-E29 VanDerWaalsContact O-N 3.17Å; E26-Y30 PolarHBondContact O-N 2.92Å
27R63.8Low63.5Low168 Ų168120.9 Ų120.963%0.63457%0.565SS**Hα-helixtrans-64.1-29.6172.9-167.6173.8177.7178.2-0.1112.8Y23 A25 L31Y23-R27 VanDerWaalsContact O-CB 3.3Å; Y23-R27 WeakPolarHBondContact O-CB 3.38Å; Y23-R27 PolarHBondContact O-N 3.39Å; A25-R27 PolarHBondContact O-N 2.93Å; R27-L31 VanDerWaalsContact O-CG 3.3Å; R27-L31 WeakPolarHBondContact O-CG 3.47Å; R27-L31 PolarHBondContact O-N 2.84Å
28R64.7Low63.1Low157 Ų157121.2 Ų121.259%0.59257%0.574SS**Hα-helixtrans-79-32.6173.2-78.5-176.8-83.4-149.24.2112.2R24 A25 E26 L31 R32R24-R28 WeakPolarHBondContact O-CG 3.42Å; R24-R28 PolarHBondContact O-N 3.35Å; R24-R28 PolarHBondContact O-NE 2.98Å; A25-R28 CarbonylContact O-C 3.48Å; A25-R28 WeakPolarHBondContact O-CA 3.39Å; A25-R28 WeakPolarHBondContact O-CB 3.38Å; A25-R28 PolarHBondContact O-N 3.2Å; E26-R28 VanDerWaalsContact C-N 3.26Å; E26-R28 PolarHBondContact O-N 2.98Å; R28-L31 PolarHBondContact O-N 3.5Å; R28-R32 PolarHBondContact O-N 2.64Å
29E69.3Low62Low110 Ų110125.9 Ų125.951%0.51460%0.598SS.*Hα-helixtrans-63.3-44.5171.8-143.881.7-124.800110.7A25 E26 L31 R32 G33A25-E29 PolarHBondContact O-N 3.46Å; E26-E29 WeakPolarHBondContact O-CB 3.41Å; E26-E29 PolarHBondContact O-N 3.18Å; E26-E29 VanDerWaalsContact O-N 3.17Å; E29-L31 PolarHBondContact O-N 3.14Å; E29-R32 WeakPolarHBondContact O-CB 3.4Å; E29-R32 PolarHBondContact O-N 3.04Å; E29-R32 IonicContact OE1-CZ 3.19Å; E29-R32 IonicContact OE1-NH1 3.13Å; E29-R32 PolarHBondContact OE1-NH1 3.38Å; E29-G33 PolarHBondContact O-N 3.37Å
30Y64.5Low60.8Low155 Ų155122.9 Ų122.961%0.60860%0.604SS**Hα-helixtrans-59.6-32.8173.8178.6-99.3000112.8E26 R34E26-Y30 PolarHBondContact O-N 2.92Å; Y30-R34 PolarHBondContact OH-NH2 3.47Å
31L59.2Low59.4Low79 Ų79128.5 Ų128.541%0.41462%0.622SS.*Hα-helixtrans-80-20175.3-67.7170.1000113.5R27 R28 E29R27-L31 VanDerWaalsContact O-CG 3.3Å; R27-L31 WeakPolarHBondContact O-CG 3.47Å; R27-L31 PolarHBondContact O-N 2.84Å; R28-L31 PolarHBondContact O-N 3.5Å; E29-L31 PolarHBondContact O-N 3.14Å
32R60.3Low57.7Low191 Ų191131.2 Ų131.272%0.72164%0.644SS**Hα-helixtrans-72.5-31.5172.9-82.3-179.5178.1170.3-3.4112.8R28 E29 R34R28-R32 PolarHBondContact O-N 2.64Å; E29-R32 WeakPolarHBondContact O-CB 3.4Å; E29-R32 PolarHBondContact O-N 3.04Å; E29-R32 IonicContact OE1-CZ 3.19Å; E29-R32 IonicContact OE1-NH1 3.13Å; E29-R32 PolarHBondContact OE1-NH1 3.38Å; R32-R34 PolarHBondContact O-N 3.31Å
33G52.9Low56Low73 Ų73132.1 Ų132.175%0.75366%0.655SS**THydrogen-bonded Turntrans-73.1-9177.600000114.2E29E29-G33 PolarHBondContact O-N 3.37Å
34R55.4Low54.8Low134 Ų134131.3 Ų131.351%0.50667%0.666SS.*SBendtrans-81.3122.5171.3-67.6-175.3176.6173-3.9108.4Y30 R32 N36Y30-R34 PolarHBondContact OH-NH2 3.47Å; R32-R34 PolarHBondContact O-N 3.31Å; R34-N36 PolarHBondContact O-N 3.27Å
35N48.4Very low53.5Low159 Ų159135.4 Ų135.485%0.8568%0.682SS**  trans-63.782.5172.7-123.3-2.5000108.9V37N35-V37 VanDerWaalsContact C-N 3.26Å; N35-V37 PolarHBondContact O-N 3.3Å
36N48.2Very low52.5Low120 Ų120140.3 Ų140.364%0.64270%0.698SS**  trans-75.187.4170.6-78.5-41.4000107R34 T38R34-N36 PolarHBondContact O-N 3.27Å; N36-T38 HydrophobicContact CB-CG2 4.49Å; N36-T38 PolarHBondContact O-N 3.31Å
37V48.3Very low51.2Low129 Ų129142 Ų14278%0.78271%0.71SS**  trans-64.585.7165.4-177.70000106.9N35N35-V37 VanDerWaalsContact C-N 3.26Å; N35-V37 PolarHBondContact O-N 3.3Å
38T47.1Very low50.7Low91 Ų91138.2 Ų138.256%0.55870%0.703SS**  trans-96.5122.7166.449.80000106.4N36 C40N36-T38 HydrophobicContact CB-CG2 4.49Å; N36-T38 PolarHBondContact O-N 3.31Å; T38-C40 PolarHBondContact O-N 3.23Å
39L47.2Very low50.4Low175 Ų175135.1 Ų135.192%0.91670%0.702SS**THydrogen-bonded Turntrans-60.53.9178.8-74.9154.7000113.9
40C41.5Very low49.8Very low120 Ų120140 Ų14081%0.81172%0.715SS**THydrogen-bonded Turntrans-97.48.6-173.5-60.10000114.3T38T38-C40 PolarHBondContact O-N 3.23Å
41R40.8Very low49.4Very low222 Ų222138.5 Ų138.584%0.83871%0.714SS**SBendtrans-122105.8162.1-70-168.2176.7-147.2-0.1108.7
42S36.9Very low49.5Very low112 Ų112139 Ų13978%0.78372%0.716SS**PPolyproline II helixtrans-52.8130.6175.346.30000110.7
43P37.4Very low49.6Very low123 Ų123136.7 Ų136.780%0.79971%0.711SS**PPolyproline II helixtrans-59.8138.5178.3-22.132.1000112.4
44T46.9Very low50.3Low136 Ų136136.7 Ų136.783%0.83470%0.697SS**PPolyproline II helixtrans-65.9141.1164.3140000111.2
45R45.9Very low50.9Low216 Ų216135.5 Ų135.582%0.81570%0.697SS**  trans86.3132.5179.2-63.1-179.6158.4159.6-0.1113.8
46E49.5Very low51.9Low141 Ų141132.2 Ų132.266%0.65968%0.679SS**  cis-162.5165.17.4-111.8157.3-150.100108
47L46.6Very low52.8Low170 Ų170133 Ų13389%0.8968%0.677SS**SBendtrans81.7-39.5173.1-89.484.5000123.1
48D53.8Low53.6Low89 Ų89132.7 Ų132.748%0.47667%0.667SS.*  trans-112.922.7-169.1-139-8.7000117.4R50 I52D48-R50 VanDerWaalsContact C-N 3.33Å; D48-R50 PolarHBondContact O-N 3.45Å; D48-I52 HydrophobicContact CB-CD1 4.35Å; D48-I52 WeakPolarHBondContact O-CD1 3.45Å; D48-I52 WeakPolarHBondContact O-CG1 3.47Å
49T58.3Low54.7Low92 Ų92135 Ų13556%0.56467%0.669SS**Hα-helixtrans-73.3-21.6-172.662.30000114.2K53T49-K53 WeakPolarHBondContact O-CB 3.38Å; T49-K53 WeakPolarHBondContact O-CD 3.41Å; T49-K53 WeakPolarHBondContact O-CG 3.34Å; T49-K53 PolarHBondContact O-N 2.85Å; T49-K53 VanDerWaalsContact O-N 3.1Å
50R55.9Low55.9Low213 Ų213135 Ų13580%0.80466%0.657SS**Hα-helixtrans-80.9-42.4-174.3-141.8178.3-169.5179.72.9111.6D48 T54D48-R50 VanDerWaalsContact C-N 3.33Å; D48-R50 PolarHBondContact O-N 3.45Å; R50-T54 WeakPolarHBondContact O-CB 3.48Å; R50-T54 PolarHBondContact O-N 3.06Å; R50-T54 PolarHBondContact O-OG1 3.49Å
51Q56Low56.6Low124 Ų124134.8 Ų134.858%0.57964%0.644SS**Hα-helixtrans-70-44179.9-134.2175.3800110.6K53 T54 Q55Q51-K53 PolarHBondContact O-N 3.02Å; Q51-T54 PolarHBondContact O-N 3.24Å; Q51-T54 VanDerWaalsContact O-N 3.14Å; Q51-Q55 PolarHBondContact O-N 3.1Å
52I61.6Low57.4Low89 Ų89132 Ų13246%0.45663%0.633SS.*Hα-helixtrans-63.7-43.4175.9-62.3172.3000111.2D48 T54 Q55 L56D48-I52 HydrophobicContact CB-CD1 4.35Å; D48-I52 WeakPolarHBondContact O-CD1 3.45Å; D48-I52 WeakPolarHBondContact O-CG1 3.47Å; I52-T54 VanDerWaalsContact C-N 3.29Å; I52-T54 PolarHBondContact O-N 2.99Å; I52-Q55 PolarHBondContact O-N 2.85Å; I52-L56 HydrophobicContact CG2-CD1 3.88Å; I52-L56 HydrophobicContact CG2-CG 4.31Å; I52-L56 WeakPolarHBondContact O-CB 3.36Å; I52-L56 VanDerWaalsContact O-CG 3.28Å; I52-L56 WeakPolarHBondContact O-CG 3.36Å; I52-L56 PolarHBondContact O-N 2.92Å
53K64Low58.6Low142 Ų142131 Ų13162%0.61762%0.616SS**Hα-helixtrans-62.1-37.7173.8-79.8174.9-178.3178.20112.1T49 Q51 K57T49-K53 WeakPolarHBondContact O-CB 3.38Å; T49-K53 WeakPolarHBondContact O-CD 3.41Å; T49-K53 WeakPolarHBondContact O-CG 3.34Å; T49-K53 PolarHBondContact O-N 2.85Å; T49-K53 VanDerWaalsContact O-N 3.1Å; Q51-K53 PolarHBondContact O-N 3.02Å; K53-K57 WeakPolarHBondContact O-CB 3.28Å; K53-K57 PolarHBondContact O-N 3.36Å
54T67.7Low59.9Low74 Ų74130.6 Ų130.645%0.45460%0.602SS.*Hα-helixtrans-69-42.4178.9-51.80000110.8R50 Q51 I52 K57 Q58R50-T54 WeakPolarHBondContact O-CB 3.48Å; R50-T54 PolarHBondContact O-N 3.06Å; R50-T54 PolarHBondContact O-OG1 3.49Å; Q51-T54 PolarHBondContact O-N 3.24Å; Q51-T54 VanDerWaalsContact O-N 3.14Å; I52-T54 VanDerWaalsContact C-N 3.29Å; I52-T54 PolarHBondContact O-N 2.99Å; T54-K57 PolarHBondContact O-N 3.48Å; T54-Q58 WeakPolarHBondContact O-CB 3.38Å; T54-Q58 WeakPolarHBondContact O-CG 3.41Å; T54-Q58 PolarHBondContact O-N 3.03Å
55Q67.9Low60.4Low109 Ų109129.2 Ų129.251%0.50959%0.589SS.*Hα-helixtrans-64.1-44.2173.6-76.7-170.4-7.800112.4Q51 I52 K57 Q58 K59Q51-Q55 PolarHBondContact O-N 3.1Å; I52-Q55 PolarHBondContact O-N 2.85Å; Q55-K57 VanDerWaalsContact C-N 3.29Å; Q55-K57 PolarHBondContact O-N 2.88Å; Q55-Q58 PolarHBondContact O-N 3.22Å; Q55-K59 WeakPolarHBondContact O-CB 3.32Å; Q55-K59 WeakPolarHBondContact O-CG 3.29Å; Q55-K59 PolarHBondContact O-N 2.84Å
56L68.4Low60.9Low90 Ų90122.7 Ų122.747%0.47157%0.571SS.*Hα-helixtrans-68.2-30.1177.3-70.2173.9000112.3I52 R60I52-L56 HydrophobicContact CG2-CD1 3.88Å; I52-L56 HydrophobicContact CG2-CG 4.31Å; I52-L56 WeakPolarHBondContact O-CB 3.36Å; I52-L56 VanDerWaalsContact O-CG 3.28Å; I52-L56 WeakPolarHBondContact O-CG 3.36Å; I52-L56 PolarHBondContact O-N 2.92Å; L56-R60 WeakPolarHBondContact O-CB 3.34Å; L56-R60 PolarHBondContact O-N 2.89Å; L56-R60 VanDerWaalsContact O-N 3.07Å; L56-R60 PolarHBondContact O-NE 3.16Å
57K66.6Low61.1Low137 Ų137124.9 Ų124.960%0.59657%0.573SS**Hα-helixtrans-70.1-46.3172.4-169.1176.7-179.8-1770110.5K53 T54 Q55 R60 Q61K53-K57 WeakPolarHBondContact O-CB 3.28Å; K53-K57 PolarHBondContact O-N 3.36Å; T54-K57 PolarHBondContact O-N 3.48Å; Q55-K57 VanDerWaalsContact C-N 3.29Å; Q55-K57 PolarHBondContact O-N 2.88Å; K57-R60 PolarHBondContact O-N 3.33Å; K57-Q61 WeakPolarHBondContact O-CB 3.44Å; K57-Q61 PolarHBondContact O-N 2.92Å
58Q66.5Low61.3Low122 Ų122126.1 Ų126.157%0.5757%0.566SS**Hα-helixtrans-61.7-42.7174.5-79.1178.4-14.600112.4T54 Q55 R60 Q61 W62T54-Q58 WeakPolarHBondContact O-CB 3.38Å; T54-Q58 WeakPolarHBondContact O-CG 3.41Å; T54-Q58 PolarHBondContact O-N 3.03Å; Q55-Q58 PolarHBondContact O-N 3.22Å; Q58-R60 PolarHBondContact O-N 3.45Å; Q58-Q61 PolarHBondContact O-N 2.94Å; Q58-W62 VanDerWaalsContact O-CB 3.28Å; Q58-W62 WeakPolarHBondContact O-CB 3.43Å; Q58-W62 PolarHBondContact O-N 3.47Å
59K70.2Confident60.9Low140 Ų140125.6 Ų125.661%0.60957%0.569SS**Hα-helixtrans-62.4-42.5175.5-77-175.4176.6-176.80112.1Q55 Q61 W62 E63Q55-K59 WeakPolarHBondContact O-CB 3.32Å; Q55-K59 WeakPolarHBondContact O-CG 3.29Å; Q55-K59 PolarHBondContact O-N 2.84Å; K59-Q61 VanDerWaalsContact C-N 3.35Å; K59-W62 PolarHBondContact O-N 3.31Å; K59-E63 WeakPolarHBondContact O-CB 3.21Å; K59-E63 PolarHBondContact O-N 3.37Å
60R70.8Confident59.9Low175 Ų175129.1 Ų129.166%0.6658%0.583SS**Hα-helixtrans-64.8-38.4173.2-85.1-176.7-73-160.4-1.8112.5L56 K57 Q58 F64L56-R60 WeakPolarHBondContact O-CB 3.34Å; L56-R60 PolarHBondContact O-N 2.89Å; L56-R60 VanDerWaalsContact O-N 3.07Å; L56-R60 PolarHBondContact O-NE 3.16Å; K57-R60 PolarHBondContact O-N 3.33Å; Q58-R60 PolarHBondContact O-N 3.45Å; R60-F64 WeakPolarHBondContact O-CB 3.42Å; R60-F64 PolarHBondContact O-N 3.47Å
61Q57.1Low58.8Low115 Ų115124 Ų12454%0.53758%0.58SS.*Hα-helixtrans-69.8-36.4178.3-141.4167.9-8.600111.4K57 Q58 K59 F64 L65K57-Q61 WeakPolarHBondContact O-CB 3.44Å; K57-Q61 PolarHBondContact O-N 2.92Å; Q58-Q61 PolarHBondContact O-N 2.94Å; K59-Q61 VanDerWaalsContact C-N 3.35Å; Q61-F64 PolarHBondContact O-N 3.04Å; Q61-L65 WeakPolarHBondContact O-CB 3.41Å; Q61-L65 VanDerWaalsContact O-CG 3.26Å; Q61-L65 WeakPolarHBondContact O-CG 3.34Å; Q61-L65 PolarHBondContact O-N 3.41Å
62W57.1Low58.3Low163 Ų163124 Ų12462%0.61759%0.591SS**Hα-helixtrans-69.5-45.3175.1-171.685.7000111.8Q58 K59 F64 L65 N66Q58-W62 VanDerWaalsContact O-CB 3.28Å; Q58-W62 WeakPolarHBondContact O-CB 3.43Å; Q58-W62 PolarHBondContact O-N 3.47Å; K59-W62 PolarHBondContact O-N 3.31Å; W62-F64 VanDerWaalsContact C-N 3.3Å; W62-F64 PolarHBondContact O-N 3.47Å; W62-L65 PolarHBondContact O-N 3.22Å; W62-N66 WeakPolarHBondContact CH2-ND2 3.37Å; W62-N66 WeakPolarHBondContact CZ2-ND2 3.47Å; W62-N66 WeakPolarHBondContact CZ3-ND2 3.33Å; W62-N66 WeakPolarHBondContact O-CB 3.41Å; W62-N66 PolarHBondContact O-N 2.86Å
63E62Low56.8Low91 Ų91128.3 Ų128.343%0.42561%0.61SS.*Hα-helixtrans-58.6-41.8170.1-97.4-105.615900111.8K59 L65 N66 R67K59-E63 WeakPolarHBondContact O-CB 3.21Å; K59-E63 PolarHBondContact O-N 3.37Å; E63-L65 VanDerWaalsContact C-N 3.34Å; E63-L65 PolarHBondContact O-N 3.49Å; E63-N66 PolarHBondContact O-N 2.99Å; E63-R67 WeakPolarHBondContact O-CB 3.28Å; E63-R67 VanDerWaalsContact O-CG 3.27Å; E63-R67 WeakPolarHBondContact O-CG 3.46Å; E63-R67 PolarHBondContact O-N 3.43Å; E63-R67 IonicContact OE1-NH2 3.93Å; E63-R67 IonicContact OE2-CZ 2.64Å; E63-R67 IonicContact OE2-NE 3.75Å; E63-R67 PolarHBondContact OE2-NE 3.23Å; E63-R67 IonicContact OE2-NH2 2.82Å; E63-R67 PolarHBondContact OE2-NH2 3.1Å
64F65.2Low55.7Low114 Ų114127.3 Ų127.350%0.562%0.617SS.*Hα-helixtrans-63.4-38.4177.3-177.1-92.3000112.3R60 Q61 W62 R68R60-F64 WeakPolarHBondContact O-CB 3.42Å; R60-F64 PolarHBondContact O-N 3.47Å; Q61-F64 PolarHBondContact O-N 3.04Å; W62-F64 VanDerWaalsContact C-N 3.3Å; W62-F64 PolarHBondContact O-N 3.47Å; F64-R68 PolarHBondContact O-N 3.33Å
65L56.7Low54Low107 Ų107133 Ų13356%0.5664%0.639SS**Hα-helixtrans-74-39.4176-71.5168.6000112.3Q61 W62 E63 R68 S69Q61-L65 WeakPolarHBondContact O-CB 3.41Å; Q61-L65 VanDerWaalsContact O-CG 3.26Å; Q61-L65 WeakPolarHBondContact O-CG 3.34Å; Q61-L65 PolarHBondContact O-N 3.41Å; W62-L65 PolarHBondContact O-N 3.22Å; E63-L65 VanDerWaalsContact C-N 3.34Å; E63-L65 PolarHBondContact O-N 3.49Å; L65-R68 PolarHBondContact O-N 2.99Å; L65-S69 PolarHBondContact O-N 2.88Å; L65-S69 VanDerWaalsContact O-N 3.12Å; L65-S69 PolarHBondContact O-OG 2.85Å
66N56.5Low52.5Low80 Ų80133.1 Ų133.143%0.42865%0.651SS.*Hα-helixtrans-63.8-40.2175.1-94.99.1000112.4W62 E63 R68W62-N66 WeakPolarHBondContact CH2-ND2 3.37Å; W62-N66 WeakPolarHBondContact CZ2-ND2 3.47Å; W62-N66 WeakPolarHBondContact CZ3-ND2 3.33Å; W62-N66 WeakPolarHBondContact O-CB 3.41Å; W62-N66 PolarHBondContact O-N 2.86Å; E63-N66 PolarHBondContact O-N 2.99Å; N66-R68 PolarHBondContact O-N 3.33Å
67R54.9Low50.9Low187 Ų187134.1 Ų134.171%0.70667%0.666SS**Hα-helixtrans-71.2-19179-71.4177.8-173.2-124.21.4113.4E63E63-R67 WeakPolarHBondContact O-CB 3.28Å; E63-R67 VanDerWaalsContact O-CG 3.27Å; E63-R67 WeakPolarHBondContact O-CG 3.46Å; E63-R67 PolarHBondContact O-N 3.43Å; E63-R67 IonicContact OE1-NH2 3.93Å; E63-R67 IonicContact OE2-CZ 2.64Å; E63-R67 IonicContact OE2-NE 3.75Å; E63-R67 PolarHBondContact OE2-NE 3.23Å; E63-R67 IonicContact OE2-NH2 2.82Å; E63-R67 PolarHBondContact OE2-NH2 3.1Å
68R51.1Low49.5Very low195 Ų195137.4 Ų137.474%0.73668%0.68SS**Hα-helixtrans-98-15.6178.8-88.6-175.7163-162.8-4.6114.3F64 L65 N66 L70F64-R68 PolarHBondContact O-N 3.33Å; L65-R68 PolarHBondContact O-N 2.99Å; N66-R68 PolarHBondContact O-N 3.33Å; R68-L70 PolarHBondContact O-N 3.32Å
69S44.2Very low47.8Very low78 Ų78135.6 Ų135.655%0.54568%0.68SS.*  trans-96.78617839.70000110.5L65L65-S69 PolarHBondContact O-N 2.88Å; L65-S69 VanDerWaalsContact O-N 3.12Å; L65-S69 PolarHBondContact O-OG 2.85Å
70L37.6Very low46.2Very low166 Ų166137 Ų13787%0.86969%0.692SS**  trans-102.788.1165.9-71.4173.8000109.4R68R68-L70 PolarHBondContact O-N 3.32Å
71S33.5Very low44.6Very low106 Ų106135.1 Ų135.174%0.74169%0.694SS**  trans-163.5135.8147.4-169.70000110.2
72P45Very low43.6Very low125 Ų125135 Ų13581%0.81271%0.705SS**  trans-91106178.134.1-25.6000110
73E30.1Very low42.6Very low179 Ų179132.7 Ų132.784%0.83671%0.713SS**  trans-113.8131.7160.9-116.3-176.2175.200109.9Q75E73-Q75 PolarHBondContact O-N 3.37Å
74P41.1Very low41.4Very low120 Ų120134.1 Ų134.178%0.77973%0.729SS**  trans-82101.8-173.532.2-29.9000109.4S76P74-S76 PolarHBondContact O-N 2.87Å
75Q32.3Very low40.4Very low195 Ų195136.1 Ų136.191%0.91175%0.745SS**  trans-77.595.3166.8-80-174.5-3.500110.4E73 S77E73-Q75 PolarHBondContact O-N 3.37Å; Q75-S77 PolarHBondContact O-N 3.4Å
76S35.9Very low39.6Very low110 Ų110137.1 Ų137.177%0.76975%0.75SS**  trans-67.6107.3155.355.90000109.9P74P74-S76 PolarHBondContact O-N 2.87Å
77S34.9Very low39Very low111 Ų111144 Ų14478%0.77677%0.772SS**  trans173.6112.7136.538.20000108.8Q75 C79Q75-S77 PolarHBondContact O-N 3.4Å; S77-C79 PolarHBondContact O-N 3.33Å; S77-C79 VanDerWaalsContact O-N 3.08Å
78K37.3Very low38.5Very low206 Ų206140.4 Ų140.490%0.89678%0.775SS**  trans-61.7109.4171.5-71.4172.1177.5174.40108.3I80K78-I80 PolarHBondContact O-N 2.96Å
79C30.4Very low38Very low84 Ų84136 Ų13657%0.56877%0.765SS**  trans-76.3111161.8-173.70000107.9S77 I81S77-C79 PolarHBondContact O-N 3.33Å; S77-C79 VanDerWaalsContact O-N 3.08Å; C79-I81 PolarHBondContact O-N 3.01Å
80I37.4Very low38.4Very low169 Ų169135.9 Ų135.987%0.86776%0.764SS**THydrogen-bonded Turntrans-73.454.4173.7-51.4171.2000108.7K78K78-I80 PolarHBondContact O-N 2.96Å
81I37.6Very low38.7Very low136 Ų136136.2 Ų136.270%0.69776%0.762SS**THydrogen-bonded Turntrans-143.18.7170.1-45.6172000111.5C79C79-I81 PolarHBondContact O-N 3.01Å
82C34.6Very low39.2Very low112 Ų112134.4 Ų134.476%0.75775%0.749SS**SBendtrans-102.913.2179.1-61.60000114
83S36.4Very low39Very low115 Ų115132.5 Ų132.580%0.80473%0.729SS**SBendtrans-13564.1179.3-550000111
84T37.2Very low39.9Very low122 Ų122129.1 Ų129.175%0.74872%0.716SS**  trans-157.2121.5156.44.10000109.6L86T84-L86 PolarHBondContact O-N 3.15Å
85D44.4Very low40Very low155 Ų155131.8 Ų131.883%0.82971%0.712SS**  trans-59113.4173.5-70.8-51.4000110.8Y87D85-Y87 PolarHBondContact O-N 2.94Å
86L40.4Very low40.3Very low128 Ų128130.3 Ų130.367%0.6770%0.698SS**  trans-98.257.3176.5-89164.1000111.2T84 L89T84-L86 PolarHBondContact O-N 3.15Å; L86-L89 HydrophobicContact CD2-CD1 3.88Å
87Y42.5Very low40.6Very low226 Ų226131.5 Ų131.589%0.88670%0.695SS**  trans-97.310.1176.5-108.7-81.3000115.1D85D85-Y87 PolarHBondContact O-N 2.94Å
88S43.9Very low40.7Very low111 Ų111135.8 Ų135.878%0.77670%0.696SS**SBendtrans-143.124.6-174.464.20000117.9
89L40.7Very low40.4Very low101 Ų101135.4 Ų135.453%0.52969%0.689SS.*  trans-117.6126.4176.8-88.6135.2000113.2L86 H93L86-L89 HydrophobicContact CD2-CD1 3.88Å; L89-H93 HydrophobicContact CD2-CB 3.98Å
90S54Low40.6Very low76 Ų76136.4 Ų136.453%0.53170%0.696SS.*  trans-64.5149.7-179.975.20000112.7S92 H93S90-S92 PolarHBondContact O-N 3.3Å; S90-S92 PolarHBondContact OG-OG 2.86Å; S90-H93 PolarHBondContact O-N 3.3Å
91E43.1Very low40.6Very low174 Ų174139.6 Ų139.681%0.81370%0.697SS**Hα-helixtrans-52.6-22.9-174.9-151.7167.8-171.200114.1H93E91-H93 PolarHBondContact O-N 2.8Å
92S43.9Very low40.3Very low68 Ų68138 Ų13848%0.47670%0.699SS.*Hα-helixtrans-68.9-25.6176.168.80000114.6S90S90-S92 PolarHBondContact O-N 3.3Å; S90-S92 PolarHBondContact OG-OG 2.86Å
93H41.8Very low40.5Very low85 Ų85142.3 Ų142.339%0.39470%0.704SS.*Hα-helixtrans-84.1-30.5-179.5-87-139.4000112.9L89 S90 E91 Y95 R96 L97L89-H93 HydrophobicContact CD2-CB 3.98Å; S90-H93 PolarHBondContact O-N 3.3Å; E91-H93 PolarHBondContact O-N 2.8Å; H93-Y95 VanDerWaalsContact C-N 3.34Å; H93-Y95 PolarHBondContact O-N 2.84Å; H93-R96 PolarHBondContact NE2-NH2 3.32Å; H93-R96 VanDerWaalsContact NE2-NH2 3.16Å; H93-R96 PolarHBondContact O-N 2.87Å; H93-L97 PolarHBondContact O-N 2.97Å
94L48.3Very low40.2Very low107 Ų107142.3 Ų142.356%0.5670%0.704SS**Hα-helixtrans-67.7-34175.6-75.3166.6000112.1R96 L97 Y98L94-R96 PolarHBondContact O-N 3.32Å; L94-L97 PolarHBondContact O-N 2.73Å; L94-Y98 PolarHBondContact O-N 2.88Å
95Y42.1Very low39.9Very low177 Ų177143.7 Ų143.769%0.69470%0.702SS**Hα-helixtrans-71.2-28.5178.4-153.7-96000113.2H93 R99H93-Y95 VanDerWaalsContact C-N 3.34Å; H93-Y95 PolarHBondContact O-N 2.84Å; Y95-R99 PolarHBondContact O-N 3.35Å
96R40.1Very low39.4Very low164 Ų164144 Ų14462%0.61970%0.696SS**Hα-helixtrans-72.6-35.5175.8-95.5-169.4-79.2-152.21.6113.3H93 L94 R99 S100H93-R96 PolarHBondContact NE2-NH2 3.32Å; H93-R96 VanDerWaalsContact NE2-NH2 3.16Å; H93-R96 PolarHBondContact O-N 2.87Å; L94-R96 PolarHBondContact O-N 3.32Å; R96-R99 PolarHBondContact O-N 2.79Å; R96-S100 PolarHBondContact O-OG 3.08Å
97L40.7Very low39.3Very low134 Ų134143.7 Ų143.770%0.70270%0.702SS**Hα-helixtrans-70.8-34.3177.5-72.2168.3000112H93 L94H93-L97 PolarHBondContact O-N 2.97Å; L94-L97 PolarHBondContact O-N 2.73Å
98Y38.7Very low38.6Very low202 Ų202141 Ų14179%0.79270%0.702SS**Hα-helixtrans-71.7-29176.8-121.3-95.1000113.4L94 S100L94-Y98 PolarHBondContact O-N 2.88Å; Y98-S100 VanDerWaalsContact C-N 3.35Å; Y98-S100 PolarHBondContact O-N 3.37Å
99R31.1Very low38Very low198 Ų198141.6 Ų141.675%0.74770%0.701SS**Hα-helixtrans-75.3-21.6-178.6-154.3173.6-149.8-168.56.3113.9Y95 R96Y95-R99 PolarHBondContact O-N 3.35Å; R96-R99 PolarHBondContact O-N 2.79Å
100S33.6Very low37.2Very low104 Ų104146.6 Ų146.673%0.72772%0.719SS**THydrogen-bonded Turntrans-82.4-10.3-175.8-55.60000113.9R96 Y98R96-S100 PolarHBondContact O-OG 3.08Å; Y98-S100 VanDerWaalsContact C-N 3.35Å; Y98-S100 PolarHBondContact O-N 3.37Å
101R36.5Very low35.9Very low237 Ų237148.2 Ų148.289%0.89473%0.726SS**THydrogen-bonded Turntrans-90.4-6-180-160.7173178.9-169.7-0114.1
102S33.3Very low35.2Very low103 Ų103148.6 Ų148.672%0.7273%0.727SS**SBendtrans-97.45.2-172.5-174.60000115.3
103K38.4Very low34.3Very low201 Ų201155.9 Ų155.987%0.87474%0.744SS**  trans-13387.2179.1-75.5-172.6176.4-176.10111.9
104S29.7Very low33.5Very low116 Ų116159.7 Ų159.781%0.81177%0.767SS**  trans-166.588.2152.1-178.30000109.1
105E31.3Very low32.4Very low150 Ų150159.8 Ų159.870%0.70178%0.776SS**  trans-49.7159.1150.2-74.5-172.3145.300110.3
106K32.8Very low31.6Very low162 Ų162156.7 Ų156.770%0.70478%0.781SS**  cis-169.2171.412.6-113.7161.4-169.1150.30107
107P39.8Very low31Very low121 Ų121152.5 Ų152.579%0.78678%0.781SS**  trans-88.7150.2-171.635.4-31.2000113
108L27.1Very low30.5Very low169 Ų169153.8 Ų153.889%0.88579%0.789SS**  trans-117.7116.6165.8-164.975.9000110.4
109T30Very low30Very low125 Ų125147.5 Ų147.577%0.76779%0.785SS**  trans-58.8135.9163.723.40000111.6
110K25.5Very low29.8Very low205 Ų205146 Ų14689%0.89179%0.786SS**  trans-147.1108.7146.8-144.1172.4-174.3177.60112.2
111T26.3Very low29.6Very low111 Ų111148 Ų14868%0.68178%0.784SS**  trans-52.8140.6160.9-550000111.8
112Q27.6Very low29.1Very low182 Ų182145.7 Ų145.785%0.8578%0.783SS**  trans-145.3107.5137.5-119.5172.211.200109.7
113R25.1Very low28.7Very low221 Ų221147.3 Ų147.383%0.83478%0.781SS**  trans-74.6142.1153.2-67.2-178.5-151.41756.3107.1
114L24.7Very low28.2Very low165 Ų165146 Ų14686%0.86478%0.782SS**  trans-135.6123.2136.3-92.2116.9000108.2
115S26.3Very low28.2Very low108 Ų108147.1 Ų147.176%0.75578%0.778SS**  trans-96.4165.5167.31570000108.1
116S25.3Very low28Very low113 Ų113146.1 Ų146.179%0.7978%0.782SS**  trans113.3138.1156.7-1700000112.9
117A27.9Very low28.3Very low76 Ų76143.6 Ų143.663%0.62878%0.783SS**  cis-172.9162.4-17.300000106.9
118D29.5Very low27.6Very low161 Ų161146.2 Ų146.286%0.86178%0.784SS**  trans71.7132.9152.1-78.9-15.8000124
119G27.5Very low27.5Very low69 Ų69149.6 Ų149.671%0.71179%0.785SS**  trans144.480.2145.500000117
120H28Very low27.3Very low167 Ų167147.3 Ų147.377%0.77379%0.787SS**  trans3.6156.5144.7-69.5-87.2000120.3
121Q28Very low27.5Very low146 Ų146142.4 Ų142.468%0.68278%0.778SS**  cis170.9140-5.9171.2165.76.400107.1
122E26.3Very low27.5Very low188 Ų188144 Ų14488%0.87978%0.783SS**  trans170.3101.2143.5-100.3-177.5173.400109
123M26.2Very low27.5Very low137 Ų137142.1 Ų142.168%0.67579%0.788SS**  61.697.384.8-89.2-160.177.200116.8L125M123-L125 HydrophobicContact CE-CD2 4.11Å; M123-L125 HydrophobicContact CE-CG 4.38Å
124I28.3Very low27.6Very low173 Ų173139.6 Ų139.689%0.88779%0.79SS**  -141.4145.2127.7-59.8-171.1000108.2
125L28.1Very low27.8Very low141 Ų141136.4 Ų136.474%0.73878%0.782SS**  trans-77.6148.2-154.3-65149.6000117.5M123M123-L125 HydrophobicContact CE-CD2 4.11Å; M123-L125 HydrophobicContact CE-CG 4.38Å
126T28.2Very low27.9Very low128 Ų128138.6 Ų138.679%0.78579%0.785SS**  trans-65.6179.416539.30000114.4
127P38.8Very low28.1Very low110 Ų110139.7 Ų139.771%0.71478%0.782SS**  cis-147.316022.239.9-17.3000121
128E25.1Very low28.4Very low175 Ų175145.4 Ų145.482%0.81879%0.792SS**  trans48121.8136.9-65.8-86.4143.900122.4
129R25.6Very low28.6Very low241 Ų241148.8 Ų148.891%0.90979%0.793SS**  146.6130.9109.9-173.3178.7-85.4-145.7-2.2112.1
130G25.6Very low28.9Very low77 Ų77150.2 Ų150.279%0.79480%0.798SS**  trans140.6105.7152.500000116.3
131S29Very low29.2Very low101 Ų101149.9 Ų149.971%0.70680%0.801SS**  trans-62.4163.5171.2-162.10000113.5
132D27Very low29.5Very low146 Ų146150 Ų15078%0.78181%0.806SS**  trans94.697.1154.3-50.2-28000118.5
133C27.9Very low29.7Very low142 Ų142152.7 Ų152.796%0.95981%0.808SS**  trans-97.7108.5156.9-74.50000110.2
134L27.1Very low29.9Very low168 Ų168151.5 Ų151.588%0.8881%0.813SS**  trans-83.3116.1174.7-164.674.7000110N136L134-N136 PolarHBondContact O-N 3.14Å
135S29Very low29.8Very low98 Ų98152.7 Ų152.769%0.68582%0.815SS**  trans-71.4112172.9153.20000110.6
136N26.8Very low29.8Very low153 Ų153151.4 Ų151.482%0.81882%0.818SS**  trans-98.9102.2177.9-144.41.7000110.2L134L134-N136 PolarHBondContact O-N 3.14Å
137N31.3Very low29.7Very low136 Ų136151.7 Ų151.773%0.72782%0.82SS**  trans-95.8115.2177-96-25000110.6
138K32.3Very low29.3Very low197 Ų197152.5 Ų152.586%0.85783%0.825SS**  trans-106.528-171.7-145.2-177.9-173.2-1760114.6
139W34.3Very low29.3Very low232 Ų232149 Ų14988%0.87983%0.826SS**  trans-108.93.4-174.6-72.5108.8000115.6
140A33.8Very low29.4Very low98 Ų98144 Ų14481%0.8182%0.822SS**THydrogen-bonded Turntrans-96.120.2-170.500000116.2
141L35.6Very low29.5Very low161 Ų161149.6 Ų149.684%0.84383%0.825SS**THydrogen-bonded Turntrans-123.210.2-175.8-81.6170.1000116.1
142L32.7Very low29.3Very low148 Ų148153.7 Ų153.778%0.77583%0.833SS**SBendtrans-93-0.9-179-127.385.3000115.5
143W31.6Very low29.2Very low244 Ų244156.4 Ų156.492%0.92484%0.841SS**  trans-131.476-178.4-62100.9000111.1
144S30.4Very low29.1Very low112 Ų112159.7 Ų159.778%0.78384%0.839SS**  trans-138.599.5161-71.70000108.6
145E25.6Very low29.1Very low198 Ų198155 Ų15593%0.92583%0.831SS**  trans-77.9127.1170.3-154.7166-159.600108.2
146S29.1Very low28.9Very low114 Ų114160 Ų16080%0.79784%0.844SS**  trans-88.6115.5-174.944.30000111.6
147T25.3Very low28.8Very low135 Ų135157.2 Ų157.283%0.82884%0.842SS**PPolyproline II helixtrans-82.4135.616344.10000110.8
148P31Very low28.6Very low127 Ų127160.8 Ų160.883%0.82585%0.846SS**PPolyproline II helixtrans-83.6127.6174.331.5-29.3000111
149A24.4Very low28.4Very low102 Ų102158.3 Ų158.384%0.84384%0.835SS**PPolyproline II helixtrans-88.5124.1172.600000110.8
150T27.1Very low28.1Very low134 Ų134154.8 Ų154.882%0.82283%0.828SS**PPolyproline II helixtrans-77.2135.6161.943.70000111.1
151K27.9Very low27.6Very low195 Ų195155.9 Ų155.985%0.84883%0.825SS**  trans-177.8112.5140.9-99.2168.2-174.4-171.90107.7
152E25.5Very low27.3Very low188 Ų188152.7 Ų152.788%0.87982%0.816SS**  61.1100.893.5-111-170.4163.800114
153E24.6Very low26.9Very low202 Ų202151.9 Ų151.994%0.94482%0.817SS**  trans-158141.4134.6-133.4179.4176.600112.2
154K26Very low26.7Very low211 Ų211145.9 Ų145.992%0.91781%0.813SS**  trans-85.6150.1-177.3-84.7169.7168.21700111.5
155G26.1Very low26.5Very low71 Ų71144.8 Ų144.873%0.73281%0.811SS**  trans15184.9147.600000118.8
156Q26Very low26.7Very low201 Ų201141.6 Ų141.694%0.93981%0.805SS**  trans33.1121139.8-74.8176.4-24.500122.2
157A25.1Very low26.4Very low96 Ų96144.2 Ų144.279%0.79381%0.805SS**  141.9120.7103.300000116.2
158R26.1Very low26.5Very low211 Ų211143.6 Ų143.680%0.79680%0.801SS**  trans81.4113.8130.9-151.6173.3-162.2-167.13.8121.4
159K29Very low26.3Very low145 Ų145142.4 Ų142.463%0.6380%0.795SS**  trans81.5121.6137.1-83.6-178.6178.2-171.10121.7
160Q28Very low26.6Very low157 Ų157147.3 Ų147.373%0.73480%0.801SS**  85.5111.9123.7-80.9-177.9-15.900121.5
161T23.1Very low26.6Very low121 Ų121149.1 Ų149.174%0.74280%0.8SS**  85.2129.9128.8-30.70000120
162S29.2Very low26.5Very low95 Ų95151 Ų15166%0.66480%0.801SS**  trans105.399.2142-570000119.1
163T24.6Very low26.5Very low130 Ų130152.8 Ų152.880%0.79880%0.8SS**  38.5119.5121.818.90000120.4
164S25.9Very low26.7Very low118 Ų118152.5 Ų152.583%0.82580%0.796SS**  161.5132.2102.652.90000112.5
165A27.2Very low26.7Very low90 Ų90148.6 Ų148.674%0.74479%0.79SS**  trans165.994.9151.900000107.8
166T28.6Very low26.9Very low130 Ų130153.4 Ų153.480%0.79879%0.793SS**  59.290.397.5-420000111.6
167E24.7Very low27Very low170 Ų170151.9 Ų151.979%0.79479%0.792SS**  46118.298-75.2-168.2174.200112.8
168T25.8Very low27.1Very low122 Ų122153.5 Ų153.575%0.74879%0.792SS**  -178.5124.563.35.60000106
169S27.4Very low27.2Very low102 Ų102148 Ų14871%0.71379%0.786SS**  104.712185.865.30000113.3
170Q31.8Very low27.3Very low205 Ų205147.9 Ų147.996%0.95880%0.797SS**  trans-150.2126.1138.3-108.5-178.714.300110.6
171H27.3Very low27.4Very low172 Ų172147.2 Ų147.280%0.79680%0.799SS**  trans-75136.7-167.6-107.8-66.8000113.1
172R25.7Very low27.5Very low234 Ų234148.2 Ų148.288%0.88381%0.805SS**  trans-104.3117.2157.9-172.6176.5-175.7167.21.9108
173R25.6Very low27.6Very low226 Ų226149 Ų14985%0.85381%0.805SS**  trans-97129.1168.9-80.7-171.3178.6-174.60.7110.3
174K27.1Very low27.9Very low195 Ų195150.6 Ų150.685%0.84881%0.809SS**  trans-91.4149.7165.8-85.5176.9171.6176.80109.1
175T26.8Very low28.1Very low130 Ų130154.2 Ų154.280%0.79881%0.81SS**  trans-157.198.8150.5-21.70000104.9
176Q29.5Very low28.3Very low171 Ų171156.4 Ų156.480%0.79981%0.814SS**  63.699.879.4-155.9176.916.400111.8
177N29.3Very low28.2Very low170 Ų170155.1 Ų155.191%0.90982%0.817SS**  trans-126.6132.2164.1-89.1-7.5000110.1
178T27.6Very low28.5Very low130 Ų130152.9 Ų152.980%0.79882%0.815SS**  trans-78.8141.6-168.6-53.60000111.8
179S28.1Very low28.8Very low96 Ų96153.2 Ų153.267%0.67181%0.811SS**  trans-88141.2167.372.20000111.2
180T30.5Very low28.8Very low141 Ų141156.5 Ų156.587%0.86582%0.815SS**  trans-141.4128.6146.741.20000110
181N29Very low28.7Very low143 Ų143154.5 Ų154.577%0.76581%0.805SS**  trans-76.8151.3-178.8-67.5-43.3000111.7
182T26.8Very low28.7Very low142 Ų142155.1 Ų155.187%0.87181%0.806SS**  trans-167.5103.8132.69.50000113.2
183V29.9Very low28.9Very low112 Ų112149.5 Ų149.568%0.67980%0.802SS**  trans12.6124.7137.6-173.80000118
184N31.6Very low29.4Very low164 Ų164144.5 Ų144.588%0.87780%0.802SS**  -158.7142.8122.3-91-24.9000113.7
185K31Very low29.8Very low193 Ų193139.5 Ų139.584%0.83980%0.797SS**  trans-71.6153.2-164.6-77.6166168.5170.90114.6
186T29.8Very low30.3Very low136 Ų136142.2 Ų142.283%0.83480%0.801SS**  trans-54144.3161.538.20000113.9
187A27.2Very low30.6Very low104 Ų104139.9 Ų139.986%0.8680%0.798SS**  trans-142.1128.5152.100000109.3
188T30.4Very low30.9Very low123 Ų123140.6 Ų140.676%0.75580%0.796SS**  trans-90.1130.6-169.3-36.50000110.4
189I32.2Very low31.5Very low129 Ų129143.9 Ų143.966%0.66280%0.799SS**  trans39.3122.7140.6-53.3172.6000118.3
190H27.7Very low32.1Very low170 Ų170147.5 Ų147.579%0.78780%0.803SS**  -173.1127.8111.3-100.1-60.9000114.9
191Q29.1Very low32.8Very low163 Ų163147.7 Ų147.776%0.76280%0.797SS**  trans88.4131.1132.5-131.2173.61100121.6
192K27.8Very low33.1Very low186 Ų186152 Ų15281%0.80980%0.803SS**  trans100.1134149.7-90168-177.3177.50121
193S30.2Very low33.9Very low115 Ų115154.2 Ų154.280%0.80480%0.8SS**  trans84.796.7153.866.10000119.6
194S36.1Very low34.4Very low121 Ų121156.4 Ų156.485%0.84680%0.803SS**  trans-49.6153139.8166.20000111.6
195A35.4Very low34.9Very low91 Ų91156.3 Ų156.375%0.75280%0.801SS**  trans9362169.800000118.1
196Q36.4Very low35.5Very low186 Ų186151.9 Ų151.987%0.86979%0.794SS**  trans-1547.3154.8-139.8172.6-14.200117.6
197T36.2Very low36.3Very low122 Ų122151.8 Ų151.875%0.74879%0.793SS**SBendtrans-90.7-8-172.1-3.50000115.4
198E35.6Very low36.9Very low185 Ų185155 Ų15586%0.86479%0.791SS**THydrogen-bonded Turntrans-86.9-11.9-174.8-71.5-175.7160.200114.8
199K41.4Very low37.9Very low200 Ų200155.9 Ų155.987%0.8780%0.796SS**THydrogen-bonded Turntrans-92-3.7-179-73.6-174.5179.5178.30115.3
200K40.4Very low38.2Very low172 Ų172158.5 Ų158.575%0.74881%0.805SS**SBendtrans-99-12.6-176.1-155.1169.1-178.6-179.10114.9
201I44.4Very low38.9Very low144 Ų144155.8 Ų155.874%0.73881%0.805SS**THydrogen-bonded Turntrans-85.2-13.2-175.8-62.8173000112.8
202R34.9Very low40Very low234 Ų234151.5 Ų151.588%0.88381%0.805SS**THydrogen-bonded Turntrans-93.33.5-173.6-96.8-174.6178-131.31.7116.7
203K43.9Very low40.9Very low188 Ų188151.8 Ų151.882%0.81781%0.807SS**SBendtrans-114.57.8-173.3-93.5-173175.7-1750116.9
204E41Very low41.7Very low158 Ų158152.7 Ų152.774%0.73881%0.807SS**  trans-12431.1-176.6-70.5-179.9-177.700113.9
205I41Very low42.9Very low163 Ų163152.2 Ų152.284%0.83680%0.799SS**SBendtrans-98.3-8.5172.4-63.4175.4000111.9
206S44.7Very low44.3Very low99 Ų99151.8 Ų151.869%0.69279%0.787SS**SBendtrans-115.8100.3175.958.80000109.6
207V46.4Very low46.5Very low134 Ų134149.2 Ų149.281%0.81277%0.773SS**  trans153.8108.8144.5168.90000106.1
208Q40.2Very low48.7Very low173 Ų173150.3 Ų150.381%0.80877%0.77SS**  trans174.597.5140.3-95.1163.620.600109.8
209T50.2Low51.1Low140 Ų140145 Ų14586%0.85975%0.752SS**  trans-136.492.4145.937.70000106.3
210E39.8Very low53.4Low184 Ų184139.5 Ų139.586%0.8673%0.73SS**SBendtrans-166.4128.9152.5-110.5166.6-165.800109.7
211S42.8Very low55.6Low113 Ų113135.2 Ų135.279%0.7972%0.718SS**SBendtrans45.693.9168.9630000119.1F213S211-F213 PolarHBondContact O-N 3.46Å
212G52.1Low57.9Low74 Ų74133.3 Ų133.376%0.76371%0.706SS**SBend68.429.7117.100000120.6
213F45.2Very low60.6Low192 Ų192128.6 Ų128.684%0.84269%0.688SS**  trans-146.6105.6155-83.8-84.7000109.6S211 T215S211-F213 PolarHBondContact O-N 3.46Å; F213-T215 VanDerWaalsContact C-N 3.3Å; F213-T215 PolarHBondContact O-N 2.83Å
214V47.3Very low63Low134 Ų134124.4 Ų124.481%0.81267%0.674SS**  trans-69.895.4164179.20000106.2V216V214-V216 HydrophobicContact CG1-CG2 4.11Å; V214-V216 PolarHBondContact O-N 3.41Å
215T61.3Low65.5Low110 Ų110120.1 Ų120.168%0.67566%0.662SS**  trans-71.687.5170.848.90000107.5F213 K217F213-T215 VanDerWaalsContact C-N 3.3Å; F213-T215 PolarHBondContact O-N 2.83Å; T215-K217 PolarHBondContact O-N 3.17Å; T215-K217 VanDerWaalsContact O-N 3.1Å
216V64.8Low68.1Low83 Ų83117.3 Ų117.350%0.50365%0.649SS.*  trans-57.7119.3171.8-177.30000106.7V214 E218 E220 V221V214-V216 HydrophobicContact CG1-CG2 4.11Å; V214-V216 PolarHBondContact O-N 3.41Å; V216-E218 PolarHBondContact O-N 3.39Å; V216-E220 HydrophobicContact CG1-CB 4.1Å; V216-V221 HydrophobicContact CB-CG2 4.42Å; V216-V221 HydrophobicContact CG1-CG2 3.61Å
217K81.9Confident70.6Confident132 Ų132118.9 Ų118.957%0.57464%0.64SS**  trans-63.9138.2-178.5-64.7180179.8-179.70108T215 S219 E220 V221T215-K217 PolarHBondContact O-N 3.17Å; T215-K217 VanDerWaalsContact O-N 3.1Å; K217-S219 PolarHBondContact O-N 2.93Å; K217-S219 VanDerWaalsContact O-N 3.08Å; K217-E220 HydrophobicContact CB-CG 4.21Å; K217-E220 WeakPolarHBondContact O-CA 3.38Å; K217-E220 WeakPolarHBondContact O-CB 3.47Å; K217-E220 PolarHBondContact O-N 2.93Å; K217-V221 PolarHBondContact O-N 3.24Å
218E83Confident72.9Confident145 Ų145117.7 Ų117.768%0.67863%0.628SS**Hα-helixtrans-54.7-32.4178.7-168.4-179.1171.600112V216 E220 V221 Q222V216-E218 PolarHBondContact O-N 3.39Å; E218-E220 VanDerWaalsContact C-N 3.31Å; E218-E220 PolarHBondContact O-N 3.41Å; E218-V221 PolarHBondContact O-N 2.89Å; E218-Q222 WeakPolarHBondContact O-CB 3.46Å; E218-Q222 VanDerWaalsContact O-CG 3.31Å; E218-Q222 WeakPolarHBondContact O-CG 3.07Å; E218-Q222 PolarHBondContact O-N 2.94Å; E218-Q222 PolarHBondContact OE1-NE2 3.05Å
219S87.2Confident75.5Confident72 Ų72115.8 Ų115.850%0.50362%0.62SS.*Hα-helixtrans-63.7-30.3173.4580000114.2K217 R223K217-S219 PolarHBondContact O-N 2.93Å; K217-S219 VanDerWaalsContact O-N 3.08Å; S219-R223 VanDerWaalsContact O-CB 3.25Å; S219-R223 WeakPolarHBondContact O-CB 3.38Å; S219-R223 PolarHBondContact O-N 3.46Å
220E87.9Confident77.6Confident86 Ų86112.4 Ų112.440%0.40259%0.594SS.*Hα-helixtrans-77.2-35.8175.7-66.1-17714700111.6V216 K217 E218 R223 L224V216-E220 HydrophobicContact CG1-CB 4.1Å; K217-E220 HydrophobicContact CB-CG 4.21Å; K217-E220 WeakPolarHBondContact O-CA 3.38Å; K217-E220 WeakPolarHBondContact O-CB 3.47Å; K217-E220 PolarHBondContact O-N 2.93Å; E218-E220 VanDerWaalsContact C-N 3.31Å; E218-E220 PolarHBondContact O-N 3.41Å; E220-R223 PolarHBondContact O-N 3.48Å; E220-L224 WeakPolarHBondContact O-CB 3.43Å; E220-L224 PolarHBondContact O-N 2.7Å
221V88.5Confident80.2Confident82 Ų82105.9 Ų105.950%0.49757%0.572SS.*Hα-helixtrans-66-44.1173-177.40000110.7V216 K217 E218 L224 S225V216-V221 HydrophobicContact CB-CG2 4.42Å; V216-V221 HydrophobicContact CG1-CG2 3.61Å; K217-V221 PolarHBondContact O-N 3.24Å; E218-V221 PolarHBondContact O-N 2.89Å; V221-L224 PolarHBondContact O-N 3.15Å; V221-S225 PolarHBondContact O-N 3.36Å
222Q90.8Very high82.8Confident104 Ų104105.1 Ų105.149%0.48656%0.558SS.*Hα-helixtrans-62-46.1174.9-72.7165.8-2.200111.1E218 L224 S225 D226E218-Q222 WeakPolarHBondContact O-CB 3.46Å; E218-Q222 VanDerWaalsContact O-CG 3.31Å; E218-Q222 WeakPolarHBondContact O-CG 3.07Å; E218-Q222 PolarHBondContact O-N 2.94Å; E218-Q222 PolarHBondContact OE1-NE2 3.05Å; Q222-L224 VanDerWaalsContact C-N 3.3Å; Q222-L224 PolarHBondContact O-N 3.31Å; Q222-S225 VanDerWaalsContact O-CB 3.3Å; Q222-S225 WeakPolarHBondContact O-CB 3.39Å; Q222-S225 PolarHBondContact O-N 2.97Å; Q222-S225 VanDerWaalsContact O-N 3.08Å; Q222-D226 PolarHBondContact O-N 3.32Å
223R93.3Very high84.8Confident135 Ų135108.3 Ų108.351%0.50955%0.548SS..Hα-helixtrans-60.8-37.7175.4-175.2175.366.5173.6-2.3112.6S219 E220 D226 Y227S219-R223 VanDerWaalsContact O-CB 3.25Å; S219-R223 WeakPolarHBondContact O-CB 3.38Å; S219-R223 PolarHBondContact O-N 3.46Å; E220-R223 PolarHBondContact O-N 3.48Å; R223-D226 PolarHBondContact O-N 2.96Å; R223-Y227 HydrophobicContact CG-CD2 4.06Å; R223-Y227 HydrophobicContact CG-CE2 3.52Å; R223-Y227 WeakPolarHBondContact O-CD2 3.49Å; R223-Y227 PolarHBondContact O-N 3.02Å; R223-Y227 VanDerWaalsContact O-N 3.09Å
224L93.6Very high87.3Confident100 Ų100105.2 Ų105.252%0.52453%0.53SS..Hα-helixtrans-65.8-40.9174178.762000111.5E220 V221 Q222 D226 Y227 L228E220-L224 WeakPolarHBondContact O-CB 3.43Å; E220-L224 PolarHBondContact O-N 2.7Å; V221-L224 PolarHBondContact O-N 3.15Å; Q222-L224 VanDerWaalsContact C-N 3.3Å; Q222-L224 PolarHBondContact O-N 3.31Å; L224-D226 VanDerWaalsContact C-N 3.34Å; L224-D226 PolarHBondContact O-N 3.47Å; L224-Y227 PolarHBondContact O-N 3Å; L224-L228 HydrophobicContact CD1-CD1 4.39Å; L224-L228 HydrophobicContact CD1-CG 4.27Å; L224-L228 HydrophobicContact CG-CD1 4.12Å; L224-L228 HydrophobicContact CG-CG 4.43Å; L224-L228 WeakPolarHBondContact O-CB 3.33Å; L224-L228 WeakPolarHBondContact O-CG 3.39Å; L224-L228 PolarHBondContact O-N 2.92Å
225S93.9Very high89.6Confident67 Ų67103.6 Ų103.647%0.46951%0.514SS..Hα-helixtrans-58.7-45.4175-167.20000111.5V221 Q222 Y227 L228 Q229V221-S225 PolarHBondContact O-N 3.36Å; Q222-S225 VanDerWaalsContact O-CB 3.3Å; Q222-S225 WeakPolarHBondContact O-CB 3.39Å; Q222-S225 PolarHBondContact O-N 2.97Å; Q222-S225 VanDerWaalsContact O-N 3.08Å; S225-Y227 PolarHBondContact O-N 3.16Å; S225-L228 PolarHBondContact O-N 3.35Å; S225-Q229 WeakPolarHBondContact O-CB 3.31Å; S225-Q229 PolarHBondContact O-N 3.34Å
226D95.2Very high91.3Very high105 Ų105102.6 Ų102.656%0.56150%0.501SS*.Hα-helixtrans-60.5-43.8176-67.8-25.6000111.9Q222 R223 L224 Q229 E230Q222-D226 PolarHBondContact O-N 3.32Å; R223-D226 PolarHBondContact O-N 2.96Å; L224-D226 VanDerWaalsContact C-N 3.34Å; L224-D226 PolarHBondContact O-N 3.47Å; D226-Q229 PolarHBondContact O-N 2.79Å; D226-E230 WeakPolarHBondContact O-CB 3.37Å; D226-E230 PolarHBondContact O-N 3.24Å
227Y96.8Very high92.8Very high132 Ų132100.2 Ų100.252%0.51849%0.487SS..Hα-helixtrans-65.7-39.4176.9-72.1-42.8000112.9R223 L224 S225 E230 A231R223-Y227 HydrophobicContact CG-CD2 4.06Å; R223-Y227 HydrophobicContact CG-CE2 3.52Å; R223-Y227 WeakPolarHBondContact O-CD2 3.49Å; R223-Y227 PolarHBondContact O-N 3.02Å; R223-Y227 VanDerWaalsContact O-N 3.09Å; L224-Y227 PolarHBondContact O-N 3Å; S225-Y227 PolarHBondContact O-N 3.16Å; Y227-E230 PolarHBondContact O-N 2.78Å; Y227-A231 VanDerWaalsContact O-CB 3.27Å; Y227-A231 WeakPolarHBondContact O-CB 3.28Å; Y227-A231 PolarHBondContact O-N 2.89Å
228L95.7Very high93.5Very high108 Ų10898.5 Ų98.557%0.56549%0.487SS*.Hα-helixtrans-66.3-41.2176.5-73.4173.8000111.2L224 S225 A231 L232L224-L228 HydrophobicContact CD1-CD1 4.39Å; L224-L228 HydrophobicContact CD1-CG 4.27Å; L224-L228 HydrophobicContact CG-CD1 4.12Å; L224-L228 HydrophobicContact CG-CG 4.43Å; L224-L228 WeakPolarHBondContact O-CB 3.33Å; L224-L228 WeakPolarHBondContact O-CG 3.39Å; L224-L228 PolarHBondContact O-N 2.92Å; S225-L228 PolarHBondContact O-N 3.35Å; L228-A231 PolarHBondContact O-N 3.41Å; L228-L232 WeakPolarHBondContact O-CB 3.3Å; L228-L232 PolarHBondContact O-N 2.87Å
229Q94.5Very high94.2Very high134 Ų13497.2 Ų97.263%0.62648%0.48SS*.Hα-helixtrans-66.1-39.7176.6-169.7169.7-16.400111.6S225 D226 L232 W233S225-Q229 WeakPolarHBondContact O-CB 3.31Å; S225-Q229 PolarHBondContact O-N 3.34Å; D226-Q229 PolarHBondContact O-N 2.79Å; Q229-L232 PolarHBondContact O-N 2.94Å; Q229-W233 PolarHBondContact O-N 3.13Å
230E94.6Very high94.7Very high68 Ų68100.5 Ų100.532%0.31849%0.485SS..Hα-helixtrans-65.8-41.8173.8-167-172.9-159.500111.9D226 Y227 W233 R234D226-E230 WeakPolarHBondContact O-CB 3.37Å; D226-E230 PolarHBondContact O-N 3.24Å; Y227-E230 PolarHBondContact O-N 2.78Å; E230-W233 PolarHBondContact O-N 3.45Å; E230-R234 WeakPolarHBondContact O-CG 3.47Å; E230-R234 PolarHBondContact O-N 2.96Å; E230-R234 IonicContact OE1-CZ 2.98Å; E230-R234 IonicContact OE1-NE 2.7Å; E230-R234 IonicContact OE1-NH1 3.13Å; E230-R234 IonicContact OE1-NH2 3.94Å; E230-R234 PolarHBondContact OE1-NH2 3.24Å; E230-R234 IonicContact OE2-CZ 3.99Å; E230-R234 VanDerWaalsContact OE2-CZ 3.28Å; E230-R234 IonicContact OE2-NH1 2.88Å; E230-R234 PolarHBondContact OE2-NH1 2.87Å; E230-R234 IonicContact OE2-NH2 3.94Å; E230-R234 PolarHBondContact OE2-NH2 3.04Å; E230-R234 VanDerWaalsContact OE2-NH2 3.13Å
231A94Very high95.2Very high48 Ų48102.9 Ų102.940%0.39749%0.494SS..Hα-helixtrans-61.9-44.7176.900000111.3Y227 L228 W233 R234 E235Y227-A231 VanDerWaalsContact O-CB 3.27Å; Y227-A231 WeakPolarHBondContact O-CB 3.28Å; Y227-A231 PolarHBondContact O-N 2.89Å; L228-A231 PolarHBondContact O-N 3.41Å; A231-W233 PolarHBondContact O-N 2.8Å; A231-R234 PolarHBondContact O-N 2.78Å; A231-E235 WeakPolarHBondContact O-CB 3.36Å; A231-E235 PolarHBondContact O-N 3.42Å
232L96.8Very high95.6Very high96 Ų96104 Ų10450%0.50350%0.496SS..Hα-helixtrans-63.1-42.6177.8-171.3133.5000111.6L228 Q229 E235 E236L228-L232 WeakPolarHBondContact O-CB 3.3Å; L228-L232 PolarHBondContact O-N 2.87Å; Q229-L232 PolarHBondContact O-N 2.94Å; L232-E235 WeakPolarHBondContact O-CB 3.4Å; L232-E235 PolarHBondContact O-N 2.99Å; L232-E236 WeakPolarHBondContact CD2-OE1 3.38Å; L232-E236 WeakPolarHBondContact O-CG 3.38Å; L232-E236 PolarHBondContact O-N 3.2Å
233W95.4Very high95.9Very high142 Ų142101.6 Ų101.654%0.53849%0.494SS..Hα-helixtrans-64.6-40.9175.8-176.989000113Q229 E230 A231 E235 E236 T237Q229-W233 PolarHBondContact O-N 3.13Å; E230-W233 PolarHBondContact O-N 3.45Å; A231-W233 PolarHBondContact O-N 2.8Å; W233-E235 VanDerWaalsContact C-N 3.32Å; W233-E235 PolarHBondContact O-N 2.95Å; W233-E236 PolarHBondContact O-N 3.5Å; W233-T237 WeakPolarHBondContact O-CB 3.37Å; W233-T237 PolarHBondContact O-N 3.34Å; W233-T237 PolarHBondContact O-OG1 3.07Å
234R97.1Very high96.1Very high127 Ų12798.7 Ų98.748%0.47949%0.492SS..Hα-helixtrans-61.5-42.5173.6-74.9177.8179.5131.2-3.2111E230 A231 T237 V238E230-R234 WeakPolarHBondContact O-CG 3.47Å; E230-R234 PolarHBondContact O-N 2.96Å; E230-R234 IonicContact OE1-CZ 2.98Å; E230-R234 IonicContact OE1-NE 2.7Å; E230-R234 IonicContact OE1-NH1 3.13Å; E230-R234 IonicContact OE1-NH2 3.94Å; E230-R234 PolarHBondContact OE1-NH2 3.24Å; E230-R234 IonicContact OE2-CZ 3.99Å; E230-R234 VanDerWaalsContact OE2-CZ 3.28Å; E230-R234 IonicContact OE2-NH1 2.88Å; E230-R234 PolarHBondContact OE2-NH1 2.87Å; E230-R234 IonicContact OE2-NH2 3.94Å; E230-R234 PolarHBondContact OE2-NH2 3.04Å; E230-R234 VanDerWaalsContact OE2-NH2 3.13Å; A231-R234 PolarHBondContact O-N 2.78Å; R234-T237 PolarHBondContact O-N 3.32Å; R234-V238 VanDerWaalsContact O-CG2 3.31Å; R234-V238 WeakPolarHBondContact O-CG2 3.42Å; R234-V238 PolarHBondContact O-N 3.33Å
235E96.4Very high96.3Very high99 Ų9999.2 Ų99.246%0.46350%0.495SS..Hα-helixtrans-62.1-48.7177.6-169.3-170.7161.100111.5A231 L232 W233 T237 V238 K239A231-E235 WeakPolarHBondContact O-CB 3.36Å; A231-E235 PolarHBondContact O-N 3.42Å; L232-E235 WeakPolarHBondContact O-CB 3.4Å; L232-E235 PolarHBondContact O-N 2.99Å; W233-E235 VanDerWaalsContact C-N 3.32Å; W233-E235 PolarHBondContact O-N 2.95Å; E235-T237 VanDerWaalsContact C-N 3.29Å; E235-T237 PolarHBondContact O-N 3.12Å; E235-V238 PolarHBondContact O-N 3.28Å; E235-K239 HydrophobicContact CG-CD 4.44Å; E235-K239 WeakPolarHBondContact O-CG 3.49Å; E235-K239 PolarHBondContact O-N 2.86Å; E235-K239 WeakPolarHBondContact OE1-CE 3.4Å; E235-K239 IonicContact OE1-NZ 2.91Å; E235-K239 PolarHBondContact OE1-NZ 3.25Å
236E96.4Very high96.4Very high89 Ų8999.6 Ų99.642%0.41649%0.494SS..Hα-helixtrans-59-40.7176.4-74.3-177.3-179.700112.3L232 W233 K239 K240L232-E236 WeakPolarHBondContact CD2-OE1 3.38Å; L232-E236 WeakPolarHBondContact O-CG 3.38Å; L232-E236 PolarHBondContact O-N 3.2Å; W233-E236 PolarHBondContact O-N 3.5Å; E236-K239 PolarHBondContact O-N 3.44Å; E236-K240 WeakPolarHBondContact O-CG 3.29Å; E236-K240 PolarHBondContact O-N 3.42Å
237T96.6Very high96.5Very high34 Ų34100.1 Ų100.121%0.20949%0.493CS..Hα-helixtrans-66.5-42.1178.1-58.70000111.5W233 R234 E235 K240 K241W233-T237 WeakPolarHBondContact O-CB 3.37Å; W233-T237 PolarHBondContact O-N 3.34Å; W233-T237 PolarHBondContact O-OG1 3.07Å; R234-T237 PolarHBondContact O-N 3.32Å; E235-T237 VanDerWaalsContact C-N 3.29Å; E235-T237 PolarHBondContact O-N 3.12Å; T237-K240 PolarHBondContact O-N 3.25Å; T237-K241 HydrophobicContact CG2-CD 4.4Å; T237-K241 WeakPolarHBondContact O-CG 3.33Å; T237-K241 PolarHBondContact O-N 3.05Å
238V96.7Very high96.6Very high95 Ų9598.5 Ų98.558%0.57649%0.492SS*.Hα-helixtrans-64.4-42.2175.3170.10000110.5R234 E235 K240 K241 L242R234-V238 VanDerWaalsContact O-CG2 3.31Å; R234-V238 WeakPolarHBondContact O-CG2 3.42Å; R234-V238 PolarHBondContact O-N 3.33Å; E235-V238 PolarHBondContact O-N 3.28Å; V238-K240 PolarHBondContact O-N 3.26Å; V238-K241 PolarHBondContact O-N 2.9Å; V238-L242 WeakPolarHBondContact O-CB 3.38Å; V238-L242 PolarHBondContact O-N 3.07Å
239K97.6Very high96.7Very high119 Ų11996.5 Ų96.552%0.51749%0.488SS..Hα-helixtrans-58.2-45.5175-75.5175.2-178.9167.70112E235 E236 L242 A243E235-K239 HydrophobicContact CG-CD 4.44Å; E235-K239 WeakPolarHBondContact O-CG 3.49Å; E235-K239 PolarHBondContact O-N 2.86Å; E235-K239 WeakPolarHBondContact OE1-CE 3.4Å; E235-K239 IonicContact OE1-NZ 2.91Å; E235-K239 PolarHBondContact OE1-NZ 3.25Å; E236-K239 PolarHBondContact O-N 3.44Å; K239-L242 PolarHBondContact O-N 2.91Å; K239-A243 PolarHBondContact O-N 3.24Å
240K97.4Very high96.8Very high140 Ų14093.8 Ų93.861%0.60948%0.48SS*.Hα-helixtrans-61.8-45.9175.9-71.5171.3-175.2171.80112E236 T237 V238 L242 A243 V244E236-K240 WeakPolarHBondContact O-CG 3.29Å; E236-K240 PolarHBondContact O-N 3.42Å; T237-K240 PolarHBondContact O-N 3.25Å; V238-K240 PolarHBondContact O-N 3.26Å; K240-L242 VanDerWaalsContact C-N 3.32Å; K240-L242 PolarHBondContact O-N 3.4Å; K240-A243 PolarHBondContact O-N 3.36Å; K240-V244 WeakPolarHBondContact O-CG2 3.31Å; K240-V244 PolarHBondContact O-N 3.01Å; K240-V244 VanDerWaalsContact O-N 3.08Å
241K97.9Very high96.9Very high136 Ų13694.8 Ų94.859%0.59149%0.488SS*.Hα-helixtrans-62.9-39.2176.6-72.6177.8180-179.40112T237 V238 V244 L245T237-K241 HydrophobicContact CG2-CD 4.4Å; T237-K241 WeakPolarHBondContact O-CG 3.33Å; T237-K241 PolarHBondContact O-N 3.05Å; V238-K241 PolarHBondContact O-N 2.9Å; K241-V244 PolarHBondContact O-N 2.98Å; K241-L245 WeakPolarHBondContact O-CB 3.31Å; K241-L245 VanDerWaalsContact O-CG 3.32Å; K241-L245 WeakPolarHBondContact O-CG 3.36Å; K241-L245 PolarHBondContact O-N 3.36Å
242L97.4Very high97.1Very high105 Ų10598 Ų9855%0.5550%0.497SS..Hα-helixtrans-64.7-44176.7-171.268.4000110.8V238 K239 K240 V244 L245 T246V238-L242 WeakPolarHBondContact O-CB 3.38Å; V238-L242 PolarHBondContact O-N 3.07Å; K239-L242 PolarHBondContact O-N 2.91Å; K240-L242 VanDerWaalsContact C-N 3.32Å; K240-L242 PolarHBondContact O-N 3.4Å; L242-V244 PolarHBondContact O-N 2.91Å; L242-L245 PolarHBondContact O-N 2.91Å; L242-T246 WeakPolarHBondContact O-CG2 3.24Å; L242-T246 PolarHBondContact O-N 2.79Å; L242-T246 PolarHBondContact O-OG1 3.22Å; L242-T246 VanDerWaalsContact O-OG1 3.11Å
243A97.2Very high97.1Very high54 Ų5497 Ų9745%0.44650%0.495SS..Hα-helixtrans-58.6-46176.300000112.1K239 K240 T246 E247K239-A243 PolarHBondContact O-N 3.24Å; K240-A243 PolarHBondContact O-N 3.36Å; A243-T246 VanDerWaalsContact C-OG1 3.31Å; A243-T246 VanDerWaalsContact CA-OG1 3.3Å; A243-T246 WeakPolarHBondContact CA-OG1 3.38Å; A243-T246 PolarHBondContact O-N 2.83Å; A243-T246 PolarHBondContact O-OG1 3.44Å; A243-E247 PolarHBondContact O-N 3.43Å
244V97.5Very high97.1Very high75 Ų7594.7 Ų94.746%0.45549%0.494SS..Hα-helixtrans-64-42.8175.7174.20000111.3K240 K241 L242 T246 E247 I248K240-V244 WeakPolarHBondContact O-CG2 3.31Å; K240-V244 PolarHBondContact O-N 3.01Å; K240-V244 VanDerWaalsContact O-N 3.08Å; K241-V244 PolarHBondContact O-N 2.98Å; L242-V244 PolarHBondContact O-N 2.91Å; V244-T246 VanDerWaalsContact C-N 3.34Å; V244-T246 PolarHBondContact O-N 3.42Å; V244-E247 PolarHBondContact O-N 3.22Å; V244-I248 HydrophobicContact CG1-CD1 3.75Å; V244-I248 HydrophobicContact CG1-CG1 4.38Å; V244-I248 VanDerWaalsContact O-CG1 3.31Å; V244-I248 WeakPolarHBondContact O-CG1 3.47Å; V244-I248 PolarHBondContact O-N 3.41Å
245L97.4Very high97Very high111 Ų11191.3 Ų91.358%0.58149%0.49SS*.Hα-helixtrans-63.7-39.3176.6-77.3173.2000112.1K241 L242 I248 S249K241-L245 WeakPolarHBondContact O-CB 3.31Å; K241-L245 VanDerWaalsContact O-CG 3.32Å; K241-L245 WeakPolarHBondContact O-CG 3.36Å; K241-L245 PolarHBondContact O-N 3.36Å; L242-L245 PolarHBondContact O-N 2.91Å; L245-I248 PolarHBondContact O-N 3.46Å; L245-S249 VanDerWaalsContact O-CB 3.25Å; L245-S249 WeakPolarHBondContact O-CB 3.26Å; L245-S249 PolarHBondContact O-N 3.36Å
246T96.3Very high96.9Very high75 Ų7588.6 Ų88.646%0.4648%0.481SS..Hα-helixtrans-64.2-42.4175.649.20000111.2L242 A243 V244 S249 T250L242-T246 WeakPolarHBondContact O-CG2 3.24Å; L242-T246 PolarHBondContact O-N 2.79Å; L242-T246 PolarHBondContact O-OG1 3.22Å; L242-T246 VanDerWaalsContact O-OG1 3.11Å; A243-T246 VanDerWaalsContact C-OG1 3.31Å; A243-T246 VanDerWaalsContact CA-OG1 3.3Å; A243-T246 WeakPolarHBondContact CA-OG1 3.38Å; A243-T246 PolarHBondContact O-N 2.83Å; A243-T246 PolarHBondContact O-OG1 3.44Å; V244-T246 VanDerWaalsContact C-N 3.34Å; V244-T246 PolarHBondContact O-N 3.42Å; T246-S249 WeakPolarHBondContact O-CB 3.31Å; T246-S249 PolarHBondContact O-N 3.37Å; T246-T250 WeakPolarHBondContact O-CG2 3.25Å; T246-T250 PolarHBondContact O-N 2.97Å; T246-T250 PolarHBondContact O-OG1 2.82Å
247E97.8Very high96.9Very high116 Ų11688.7 Ų88.754%0.54249%0.485SS..Hα-helixtrans-63.9-44.7176.2-175.5-173.7170.200112.1A243 V244 S249 T250 N251A243-E247 PolarHBondContact O-N 3.43Å; V244-E247 PolarHBondContact O-N 3.22Å; E247-S249 VanDerWaalsContact C-N 3.28Å; E247-S249 PolarHBondContact O-N 3.35Å; E247-T250 PolarHBondContact O-N 3.39Å; E247-T250 PolarHBondContact O-OG1 2.91Å; E247-N251 WeakPolarHBondContact O-CB 3.18Å; E247-N251 PolarHBondContact O-N 3.33Å; E247-N251 PolarHBondContact O-ND2 2.84Å
248I97.9Very high96.9Very high97 Ų9791.8 Ų91.850%0.49750%0.503SS..Hα-helixtrans-63.7-39.1175.7-67.3168.3000110.4V244 L245 N251 L252V244-I248 HydrophobicContact CG1-CD1 3.75Å; V244-I248 HydrophobicContact CG1-CG1 4.38Å; V244-I248 VanDerWaalsContact O-CG1 3.31Å; V244-I248 WeakPolarHBondContact O-CG1 3.47Å; V244-I248 PolarHBondContact O-N 3.41Å; L245-I248 PolarHBondContact O-N 3.46Å; I248-N251 PolarHBondContact O-N 3.37Å; I248-L252 VanDerWaalsContact O-CB 3.32Å; I248-L252 WeakPolarHBondContact O-CB 3.22Å; I248-L252 PolarHBondContact O-N 2.9Å
249S97.1Very high96.9Very high67 Ų6792.4 Ų92.447%0.46950%0.503SS..Hα-helixtrans-64.9-45.1178.1-172.70000111.9L245 T246 E247 L252 V253L245-S249 VanDerWaalsContact O-CB 3.25Å; L245-S249 WeakPolarHBondContact O-CB 3.26Å; L245-S249 PolarHBondContact O-N 3.36Å; T246-S249 WeakPolarHBondContact O-CB 3.31Å; T246-S249 PolarHBondContact O-N 3.37Å; E247-S249 VanDerWaalsContact C-N 3.28Å; E247-S249 PolarHBondContact O-N 3.35Å; S249-L252 PolarHBondContact O-N 3.43Å; S249-V253 WeakPolarHBondContact O-CG2 3.45Å; S249-V253 PolarHBondContact O-N 3.38Å
250T97Very high96.6Very high77 Ų7794.7 Ų94.747%0.47251%0.508SS..Hα-helixtrans-64.7-42.3177.253.80000110.8T246 E247 L252 V253 N254T246-T250 WeakPolarHBondContact O-CG2 3.25Å; T246-T250 PolarHBondContact O-N 2.97Å; T246-T250 PolarHBondContact O-OG1 2.82Å; E247-T250 PolarHBondContact O-N 3.39Å; E247-T250 PolarHBondContact O-OG1 2.91Å; T250-L252 VanDerWaalsContact C-N 3.34Å; T250-L252 PolarHBondContact O-N 2.82Å; T250-V253 PolarHBondContact O-N 3.17Å; T250-N254 WeakPolarHBondContact O-CB 3.3Å; T250-N254 PolarHBondContact O-N 2.99Å; T250-N254 PolarHBondContact O-ND2 2.86Å
251N97.3Very high96.5Very high88 Ų8892.6 Ų92.647%0.47151%0.507SS..Hα-helixtrans-61.8-39.6174.6-72.3-25.1000112.5E247 I248 S255E247-N251 WeakPolarHBondContact O-CB 3.18Å; E247-N251 PolarHBondContact O-N 3.33Å; E247-N251 PolarHBondContact O-ND2 2.84Å; I248-N251 PolarHBondContact O-N 3.37Å; N251-S255 WeakPolarHBondContact O-CB 3.34Å; N251-S255 PolarHBondContact O-N 2.95Å; N251-S255 PolarHBondContact O-OG 2.88Å
252L97.4Very high96.5Very high115 Ų11589.1 Ų89.160%0.60250%0.5SS*.Hα-helixtrans-65.3-44176.4-18062.7000111.7I248 S249 T250 S255 S256I248-L252 VanDerWaalsContact O-CB 3.32Å; I248-L252 WeakPolarHBondContact O-CB 3.22Å; I248-L252 PolarHBondContact O-N 2.9Å; S249-L252 PolarHBondContact O-N 3.43Å; T250-L252 VanDerWaalsContact C-N 3.34Å; T250-L252 PolarHBondContact O-N 2.82Å; L252-S255 WeakPolarHBondContact CA-OG 3.47Å; L252-S255 PolarHBondContact O-N 3.24Å; L252-S255 PolarHBondContact O-OG 2.7Å; L252-S256 WeakPolarHBondContact O-CB 3.16Å; L252-S256 PolarHBondContact O-N 2.87Å
253V96.4Very high96.3Very high76 Ų7690.5 Ų90.546%0.46150%0.498SS..Hα-helixtrans-61.5-50.6176.5171.40000110.2S249 T250 S255 S256 D257S249-V253 WeakPolarHBondContact O-CG2 3.45Å; S249-V253 PolarHBondContact O-N 3.38Å; T250-V253 PolarHBondContact O-N 3.17Å; V253-S255 VanDerWaalsContact C-N 3.34Å; V253-S255 PolarHBondContact O-N 3.48Å; V253-S256 WeakPolarHBondContact O-CB 3.36Å; V253-S256 PolarHBondContact O-N 2.88Å; V253-S256 VanDerWaalsContact O-N 3.11Å; V253-D257 PolarHBondContact O-N 3.35Å
254N95.8Very high95.9Very high94 Ų9491.9 Ų91.950%0.50350%0.503SS..Hα-helixtrans-59.5-43.6179.4-67.6-14.8000112.2T250 D257 V258T250-N254 WeakPolarHBondContact O-CB 3.3Å; T250-N254 PolarHBondContact O-N 2.99Å; T250-N254 PolarHBondContact O-ND2 2.86Å; N254-D257 PolarHBondContact O-N 3.38Å; N254-V258 WeakPolarHBondContact O-CG2 3.47Å; N254-V258 PolarHBondContact O-N 3.43Å; N254-V258 VanDerWaalsContact O-N 3.08Å
255S96Very high95.7Very high56 Ų5691.1 Ų91.139%0.39250%0.501SS..Hα-helixtrans-67.2-35.917761.40000112.5N251 L252 V253 V258 L259N251-S255 WeakPolarHBondContact O-CB 3.34Å; N251-S255 PolarHBondContact O-N 2.95Å; N251-S255 PolarHBondContact O-OG 2.88Å; L252-S255 WeakPolarHBondContact CA-OG 3.47Å; L252-S255 PolarHBondContact O-N 3.24Å; L252-S255 PolarHBondContact O-OG 2.7Å; V253-S255 VanDerWaalsContact C-N 3.34Å; V253-S255 PolarHBondContact O-N 3.48Å; S255-V258 PolarHBondContact O-N 2.96Å; S255-L259 WeakPolarHBondContact O-CB 3.3Å; S255-L259 VanDerWaalsContact O-CG 3.28Å; S255-L259 WeakPolarHBondContact O-CG 3.25Å; S255-L259 PolarHBondContact O-N 3.42Å
256S94.8Very high95.6Very high42 Ų4289.5 Ų89.529%0.29449%0.491SS..Hα-helixtrans-61.9-43.3172.3-174.70000111.2L252 V253 V258 L259 W260L252-S256 WeakPolarHBondContact O-CB 3.16Å; L252-S256 PolarHBondContact O-N 2.87Å; V253-S256 WeakPolarHBondContact O-CB 3.36Å; V253-S256 PolarHBondContact O-N 2.88Å; V253-S256 VanDerWaalsContact O-N 3.11Å; S256-V258 PolarHBondContact O-N 3.47Å; S256-L259 WeakPolarHBondContact O-CB 3.42Å; S256-L259 PolarHBondContact O-N 2.87Å; S256-W260 PolarHBondContact O-N 2.78Å; S256-W260 VanDerWaalsContact OG-CD1 3.32Å; S256-W260 PolarHBondContact OG-NE1 3.43Å; S256-W260 VanDerWaalsContact OG-NE1 3.14Å
257D95.7Very high95.5Very high90 Ų9090.6 Ų90.648%0.48149%0.494SS..Hα-helixtrans-64.2-41.3179.1-72-17000112.1V253 N254 L259 W260 T261V253-D257 PolarHBondContact O-N 3.35Å; N254-D257 PolarHBondContact O-N 3.38Å; D257-L259 VanDerWaalsContact C-N 3.32Å; D257-L259 PolarHBondContact O-N 2.79Å; D257-W260 PolarHBondContact O-N 3.18Å; D257-T261 WeakPolarHBondContact O-CB 3Å; D257-T261 WeakPolarHBondContact O-CG2 3.21Å; D257-T261 PolarHBondContact O-N 2.86Å; D257-T261 PolarHBondContact O-OG1 3.24Å
258V96.3Very high95.3Very high99 Ų9989.9 Ų89.960%0.649%0.493SS*.Hα-helixtrans-62.5-40.5173175.80000111.2N254 S255 S256 T261 S262N254-V258 WeakPolarHBondContact O-CG2 3.47Å; N254-V258 PolarHBondContact O-N 3.43Å; N254-V258 VanDerWaalsContact O-N 3.08Å; S255-V258 PolarHBondContact O-N 2.96Å; S256-V258 PolarHBondContact O-N 3.47Å; V258-T261 VanDerWaalsContact CA-OG1 3.32Å; V258-T261 WeakPolarHBondContact CA-OG1 3.37Å; V258-T261 PolarHBondContact O-OG1 3.31Å; V258-S262 VanDerWaalsContact O-CB 3.32Å; V258-S262 WeakPolarHBondContact O-CB 3.31Å; V258-S262 PolarHBondContact O-N 2.89Å
259L96.8Very high95.2Very high109 Ų10990 Ų9057%0.57150%0.495SS*.Hα-helixtrans-64.6-44.1175.9-75.1168000111.7S255 S256 D257 S262 R263S255-L259 WeakPolarHBondContact O-CB 3.3Å; S255-L259 VanDerWaalsContact O-CG 3.28Å; S255-L259 WeakPolarHBondContact O-CG 3.25Å; S255-L259 PolarHBondContact O-N 3.42Å; S256-L259 WeakPolarHBondContact O-CB 3.42Å; S256-L259 PolarHBondContact O-N 2.87Å; D257-L259 VanDerWaalsContact C-N 3.32Å; D257-L259 PolarHBondContact O-N 2.79Å; L259-S262 PolarHBondContact O-N 3.39Å; L259-R263 WeakPolarHBondContact O-CB 3.32Å; L259-R263 VanDerWaalsContact O-CG 3.25Å; L259-R263 WeakPolarHBondContact O-CG 3.13Å; L259-R263 PolarHBondContact O-N 3.22Å
260W91.9Very high95Very high167 Ų16793.7 Ų93.763%0.63350%0.498SS*.Hα-helixtrans-64.2-44.3177.9-75.2116.7000112S256 D257 R263 C264S256-W260 PolarHBondContact O-N 2.78Å; S256-W260 VanDerWaalsContact OG-CD1 3.32Å; S256-W260 PolarHBondContact OG-NE1 3.43Å; S256-W260 VanDerWaalsContact OG-NE1 3.14Å; D257-W260 PolarHBondContact O-N 3.18Å; W260-R263 PolarHBondContact O-N 3Å; W260-C264 WeakPolarHBondContact O-CB 3.24Å; W260-C264 PolarHBondContact O-N 3Å; W260-C264 PolarHBondContact O-SG 2.82Å
261T95.3Very high94.7Very high95 Ų9593.1 Ų93.158%0.58350%0.497SS*.Hα-helixtrans-62.8-44.4177.349.30000111.8D257 V258 C264 S265D257-T261 WeakPolarHBondContact O-CB 3Å; D257-T261 WeakPolarHBondContact O-CG2 3.21Å; D257-T261 PolarHBondContact O-N 2.86Å; D257-T261 PolarHBondContact O-OG1 3.24Å; V258-T261 VanDerWaalsContact CA-OG1 3.32Å; V258-T261 WeakPolarHBondContact CA-OG1 3.37Å; V258-T261 PolarHBondContact O-OG1 3.31Å; T261-C264 PolarHBondContact O-N 3.38Å; T261-S265 PolarHBondContact O-N 3.25Å
262S96.3Very high94.6Very high63 Ų6394.5 Ų94.544%0.44150%0.499SS..Hα-helixtrans-59.7-47.1173.3179.60000112V258 L259 C264 S265 E266V258-S262 VanDerWaalsContact O-CB 3.32Å; V258-S262 WeakPolarHBondContact O-CB 3.31Å; V258-S262 PolarHBondContact O-N 2.89Å; L259-S262 PolarHBondContact O-N 3.39Å; S262-C264 PolarHBondContact O-N 3.5Å; S262-S265 PolarHBondContact O-N 2.97Å; S262-S265 VanDerWaalsContact O-N 3.13Å; S262-S265 PolarHBondContact O-OG 2.83Å; S262-E266 PolarHBondContact O-N 2.87Å
263R93.3Very high94.4Very high135 Ų13593.3 Ų93.351%0.50949%0.492SS..Hα-helixtrans-60.9-43.2177-73.9-62.2-170.8-179.54112.9L259 W260 S265 E266 D267L259-R263 WeakPolarHBondContact O-CB 3.32Å; L259-R263 VanDerWaalsContact O-CG 3.25Å; L259-R263 WeakPolarHBondContact O-CG 3.13Å; L259-R263 PolarHBondContact O-N 3.22Å; W260-R263 PolarHBondContact O-N 3Å; R263-S265 VanDerWaalsContact C-N 3.29Å; R263-S265 PolarHBondContact O-N 2.9Å; R263-E266 IonicContact CZ-OE2 3.55Å; R263-E266 IonicContact NH1-OE1 3.28Å; R263-E266 PolarHBondContact NH1-OE1 3.37Å; R263-E266 IonicContact NH1-OE2 2.66Å; R263-E266 PolarHBondContact NH1-OE2 3.33Å; R263-E266 PolarHBondContact O-N 3.44Å; R263-D267 PolarHBondContact O-N 3.35Å
264C89.5Confident94.2Very high82 Ų8295.8 Ų95.855%0.55450%0.497SS*.Hα-helixtrans-59.2-41.7174-71.90000111.6W260 T261 S262 D267 L268W260-C264 WeakPolarHBondContact O-CB 3.24Å; W260-C264 PolarHBondContact O-N 3Å; W260-C264 PolarHBondContact O-SG 2.82Å; T261-C264 PolarHBondContact O-N 3.38Å; S262-C264 PolarHBondContact O-N 3.5Å; C264-D267 PolarHBondContact O-N 2.94Å; C264-L268 WeakPolarHBondContact O-CB 3.5Å; C264-L268 PolarHBondContact O-N 3.06Å
265S92.7Very high94Very high59 Ų5994.9 Ų94.941%0.41350%0.495SS..Hα-helixtrans-67.4-38.8176.275.60000113.1T261 S262 R263 L268 L269T261-S265 PolarHBondContact O-N 3.25Å; S262-S265 PolarHBondContact O-N 2.97Å; S262-S265 VanDerWaalsContact O-N 3.13Å; S262-S265 PolarHBondContact O-OG 2.83Å; R263-S265 VanDerWaalsContact C-N 3.29Å; R263-S265 PolarHBondContact O-N 2.9Å; S265-L268 PolarHBondContact O-N 2.78Å; S265-L269 WeakPolarHBondContact O-CG 3.26Å; S265-L269 PolarHBondContact O-N 3.32Å
266E95.9Very high93.9Very high78 Ų7897.4 Ų97.436%0.36450%0.503SS..Hα-helixtrans-61.6-47175.2-173.5-168142.800110.2S262 R263 L268 L269 R270S262-E266 PolarHBondContact O-N 2.87Å; R263-E266 IonicContact CZ-OE2 3.55Å; R263-E266 IonicContact NH1-OE1 3.28Å; R263-E266 PolarHBondContact NH1-OE1 3.37Å; R263-E266 IonicContact NH1-OE2 2.66Å; R263-E266 PolarHBondContact NH1-OE2 3.33Å; R263-E266 PolarHBondContact O-N 3.44Å; E266-L268 VanDerWaalsContact C-N 3.33Å; E266-L268 PolarHBondContact O-N 3.18Å; E266-L269 PolarHBondContact O-N 3.17Å; E266-R270 VanDerWaalsContact O-CB 3.31Å; E266-R270 WeakPolarHBondContact O-CB 3.45Å; E266-R270 PolarHBondContact O-N 2.81Å
267D94.2Very high93.7Very high97 Ų97100.9 Ų100.952%0.51952%0.515SS..Hα-helixtrans-62.8-39.1177.6-79.2-26.3000112.2R263 C264 R270 S271R263-D267 PolarHBondContact O-N 3.35Å; C264-D267 PolarHBondContact O-N 2.94Å; D267-R270 PolarHBondContact O-N 3.4Å; D267-S271 WeakPolarHBondContact O-CB 3.45Å; D267-S271 PolarHBondContact O-N 2.92Å
268L94.4Very high93.3Very high101 Ų10199.1 Ų99.153%0.52951%0.513SS..Hα-helixtrans-61.6-47.7173.918066.2000111.5C264 S265 E266 R270 S271 K272C264-L268 WeakPolarHBondContact O-CB 3.5Å; C264-L268 PolarHBondContact O-N 3.06Å; S265-L268 PolarHBondContact O-N 2.78Å; E266-L268 VanDerWaalsContact C-N 3.33Å; E266-L268 PolarHBondContact O-N 3.18Å; L268-R270 VanDerWaalsContact C-N 3.33Å; L268-S271 WeakPolarHBondContact O-CB 3.47Å; L268-S271 PolarHBondContact O-N 3.06Å; L268-K272 WeakPolarHBondContact O-CG 3.25Å; L268-K272 PolarHBondContact O-N 2.98Å
269L94.5Very high92.9Very high101 Ų10199.6 Ų99.653%0.52951%0.509SS..Hα-helixtrans-63.7-40.5177.2-71.1173.5000111.2S265 E266 S271 K272 I273S265-L269 WeakPolarHBondContact O-CG 3.26Å; S265-L269 PolarHBondContact O-N 3.32Å; E266-L269 PolarHBondContact O-N 3.17Å; L269-S271 VanDerWaalsContact C-N 3.31Å; L269-S271 PolarHBondContact O-N 3.5Å; L269-K272 WeakPolarHBondContact O-CB 3.15Å; L269-K272 PolarHBondContact O-N 3.39Å; L269-I273 WeakPolarHBondContact O-CG1 3.3Å; L269-I273 PolarHBondContact O-N 2.94Å
270R94.4Very high92.5Very high143 Ų14399.8 Ų99.854%0.5451%0.51SS..Hα-helixtrans-63.3-37.7176.5-161174.9-162.4175.37.7112E266 D267 L268 K274E266-R270 VanDerWaalsContact O-CB 3.31Å; E266-R270 WeakPolarHBondContact O-CB 3.45Å; E266-R270 PolarHBondContact O-N 2.81Å; D267-R270 PolarHBondContact O-N 3.4Å; L268-R270 VanDerWaalsContact C-N 3.33Å; R270-K274 WeakPolarHBondContact O-CG 3.36Å; R270-K274 PolarHBondContact O-N 3.25Å
271S89.4Confident92.2Very high66 Ų6698 Ų9846%0.46251%0.508SS..Hα-helixtrans-63.7-46.7172.2-172.60000111.4D267 L268 L269 I273 K274 V275D267-S271 WeakPolarHBondContact O-CB 3.45Å; D267-S271 PolarHBondContact O-N 2.92Å; L268-S271 WeakPolarHBondContact O-CB 3.47Å; L268-S271 PolarHBondContact O-N 3.06Å; L269-S271 VanDerWaalsContact C-N 3.31Å; L269-S271 PolarHBondContact O-N 3.5Å; S271-I273 PolarHBondContact O-N 3.29Å; S271-K274 PolarHBondContact O-N 3.4Å; S271-V275 WeakPolarHBondContact O-CG2 3.4Å; S271-V275 PolarHBondContact O-N 3.45Å
272K95.7Very high91.4Very high116 Ų11696.9 Ų96.950%0.50450%0.501SS..Hα-helixtrans-59-43.9175.5-71.4177.3178.9-179.30112.3L268 L269 V275 L276L268-K272 WeakPolarHBondContact O-CG 3.25Å; L268-K272 PolarHBondContact O-N 2.98Å; L269-K272 WeakPolarHBondContact O-CB 3.15Å; L269-K272 PolarHBondContact O-N 3.39Å; K272-V275 PolarHBondContact O-N 2.88Å; K272-L276 WeakPolarHBondContact O-CG 3.47Å; K272-L276 PolarHBondContact O-N 3.45Å
273I93.9Very high90.6Very high90 Ų9099 Ų9946%0.46252%0.515SS..Hα-helixtrans-59.2-49.8175.9-69.8165.9000110.2L269 S271 V275 L276 E277L269-I273 WeakPolarHBondContact O-CG1 3.3Å; L269-I273 PolarHBondContact O-N 2.94Å; S271-I273 PolarHBondContact O-N 3.29Å; I273-V275 VanDerWaalsContact C-N 3.27Å; I273-V275 PolarHBondContact O-N 2.94Å; I273-L276 PolarHBondContact O-N 2.93Å; I273-L276 VanDerWaalsContact O-N 3.12Å; I273-E277 HydrophobicContact CG2-CG 4.12Å; I273-E277 WeakPolarHBondContact CG2-OE1 3.35Å; I273-E277 WeakPolarHBondContact O-CB 3.3Å; I273-E277 WeakPolarHBondContact O-CG 3.37Å; I273-E277 PolarHBondContact O-N 3.38Å
274K92.3Very high90Very high129 Ų12998.8 Ų98.856%0.56152%0.523SS*.Hα-helixtrans-58-37.9177.1-74.2175.4-180178.20112.9R270 S271 A278R270-K274 WeakPolarHBondContact O-CG 3.36Å; R270-K274 PolarHBondContact O-N 3.25Å; S271-K274 PolarHBondContact O-N 3.4Å; K274-A278 VanDerWaalsContact O-CB 3.29Å; K274-A278 WeakPolarHBondContact O-CB 3.15Å; K274-A278 PolarHBondContact O-N 3.12Å
275V91.4Very high89.3Confident74 Ų74100 Ų10045%0.44852%0.521SS..Hα-helixtrans-65.9-47175.7172.10000110.8S271 K272 I273 A278 Q279S271-V275 WeakPolarHBondContact O-CG2 3.4Å; S271-V275 PolarHBondContact O-N 3.45Å; K272-V275 PolarHBondContact O-N 2.88Å; I273-V275 VanDerWaalsContact C-N 3.27Å; I273-V275 PolarHBondContact O-N 2.94Å; V275-A278 PolarHBondContact O-N 3.29Å; V275-Q279 HydrophobicContact CG1-CG 4.48Å; V275-Q279 WeakPolarHBondContact O-CB 3.36Å; V275-Q279 VanDerWaalsContact O-CG 3.29Å; V275-Q279 WeakPolarHBondContact O-CG 3.37Å; V275-Q279 PolarHBondContact O-N 2.86Å
276L92.8Very high88Confident109 Ų109107.3 Ų107.357%0.57155%0.545SS*.Hα-helixtrans-64-41.1177.6-69.2173.1000112K272 I273 Q279 L280K272-L276 WeakPolarHBondContact O-CG 3.47Å; K272-L276 PolarHBondContact O-N 3.45Å; I273-L276 PolarHBondContact O-N 2.93Å; I273-L276 VanDerWaalsContact O-N 3.12Å; L276-Q279 PolarHBondContact O-N 2.92Å; L276-L280 WeakPolarHBondContact O-CB 3.46Å; L276-L280 PolarHBondContact O-N 3.43Å
277E91.5Very high86.2Confident115 Ų115106.6 Ų106.654%0.53754%0.541SS..Hα-helixtrans-60.4-45.6173.4-74.7173.8168.800111.1I273 L280 Q281I273-E277 HydrophobicContact CG2-CG 4.12Å; I273-E277 WeakPolarHBondContact CG2-OE1 3.35Å; I273-E277 WeakPolarHBondContact O-CB 3.3Å; I273-E277 WeakPolarHBondContact O-CG 3.37Å; I273-E277 PolarHBondContact O-N 3.38Å; E277-L280 PolarHBondContact O-N 3.36Å; E277-Q281 WeakPolarHBondContact O-CB 3.34Å; E277-Q281 PolarHBondContact O-N 2.75Å
278A86.8Confident84.9Confident54 Ų54106.6 Ų106.645%0.44655%0.546SS..Hα-helixtrans-63.8-40.9176.100000112.1K274 V275 Q281 V282K274-A278 VanDerWaalsContact O-CB 3.29Å; K274-A278 WeakPolarHBondContact O-CB 3.15Å; K274-A278 PolarHBondContact O-N 3.12Å; V275-A278 PolarHBondContact O-N 3.29Å; A278-Q281 WeakPolarHBondContact O-CB 3.37Å; A278-Q281 PolarHBondContact O-N 3.28Å; A278-V282 WeakPolarHBondContact O-CG2 3.4Å; A278-V282 PolarHBondContact O-N 2.87Å
279Q87.6Confident83.6Confident108 Ų108110.7 Ų110.751%0.50556%0.56SS.*Hα-helixtrans-61.3-44.5174.3-74.5174.3-5.900111.3V275 L276 V282 C283V275-Q279 HydrophobicContact CG1-CG 4.48Å; V275-Q279 WeakPolarHBondContact O-CB 3.36Å; V275-Q279 VanDerWaalsContact O-CG 3.29Å; V275-Q279 WeakPolarHBondContact O-CG 3.37Å; V275-Q279 PolarHBondContact O-N 2.86Å; L276-Q279 PolarHBondContact O-N 2.92Å; Q279-V282 PolarHBondContact O-N 2.94Å; Q279-C283 PolarHBondContact O-N 3.14Å; Q279-C283 PolarHBondContact O-SG 3.48Å
280L88.6Confident82.5Confident113 Ų113112 Ų11259%0.59257%0.568SS**Hα-helixtrans-61.9-43.8175.8-165.289000111.5L276 E277 V282 C283 L284L276-L280 WeakPolarHBondContact O-CB 3.46Å; L276-L280 PolarHBondContact O-N 3.43Å; E277-L280 PolarHBondContact O-N 3.36Å; L280-V282 VanDerWaalsContact C-N 3.28Å; L280-V282 PolarHBondContact O-N 3.4Å; L280-C283 PolarHBondContact O-N 3.23Å; L280-C283 VanDerWaalsContact O-N 3.15Å; L280-L284 HydrophobicContact CD2-CD1 4.16Å; L280-L284 HydrophobicContact CG-CD1 4.13Å; L280-L284 WeakPolarHBondContact O-CG 3.47Å; L280-L284 PolarHBondContact O-N 3.33Å
281Q85.8Confident81.6Confident129 Ų129106.7 Ų106.760%0.60356%0.557SS**Hα-helixtrans-58.2-41177.6-163.693.14.300111.6E277 A278 L284 Q285E277-Q281 WeakPolarHBondContact O-CB 3.34Å; E277-Q281 PolarHBondContact O-N 2.75Å; A278-Q281 WeakPolarHBondContact O-CB 3.37Å; A278-Q281 PolarHBondContact O-N 3.28Å; Q281-L284 PolarHBondContact O-N 2.97Å; Q281-Q285 PolarHBondContact O-N 2.87Å
282V77.8Confident81.2Confident72 Ų72106.2 Ų106.244%0.43655%0.551SS.*Hα-helixtrans-67.6-43.3175.7172.10000110.9A278 Q279 L280 L284 Q285 F287A278-V282 WeakPolarHBondContact O-CG2 3.4Å; A278-V282 PolarHBondContact O-N 2.87Å; Q279-V282 PolarHBondContact O-N 2.94Å; L280-V282 VanDerWaalsContact C-N 3.28Å; L280-V282 PolarHBondContact O-N 3.4Å; V282-L284 PolarHBondContact O-N 3.45Å; V282-Q285 PolarHBondContact O-N 2.87Å; V282-F287 HydrophobicContact CG1-CE2 4.09Å; V282-F287 HydrophobicContact CG1-CZ 4.48Å; V282-F287 WeakPolarHBondContact O-CE2 3.31Å
283C79.8Confident80.5Confident109 Ų109107.4 Ų107.474%0.73656%0.556SS**Hα-helixtrans-62.7-30.3177-69.50000113.3Q279 L280Q279-C283 PolarHBondContact O-N 3.14Å; Q279-C283 PolarHBondContact O-SG 3.48Å; L280-C283 PolarHBondContact O-N 3.23Å; L280-C283 VanDerWaalsContact O-N 3.15Å
284L80.7Confident80.1Confident129 Ų129110.9 Ų110.968%0.67557%0.568SS**Hα-helixtrans-82.2-21.3179.8-72.2168.8000113.7L280 Q281 V282 K286L280-L284 HydrophobicContact CD2-CD1 4.16Å; L280-L284 HydrophobicContact CG-CD1 4.13Å; L280-L284 WeakPolarHBondContact O-CG 3.47Å; L280-L284 PolarHBondContact O-N 3.33Å; Q281-L284 PolarHBondContact O-N 2.97Å; V282-L284 PolarHBondContact O-N 3.45Å; L284-K286 PolarHBondContact O-N 3.39Å
285Q74.9Confident79.7Confident108 Ų108107.7 Ų107.751%0.50556%0.556SS.*  trans-77.5118.3178.1-93.2-177.3-13.200111.5Q281 V282 F287Q281-Q285 PolarHBondContact O-N 2.87Å; V282-Q285 PolarHBondContact O-N 2.87Å; Q285-F287 HydrophobicContact CB-CD1 4.49Å; Q285-F287 HydrophobicContact CB-CD2 3.96Å; Q285-F287 HydrophobicContact CB-CE1 4.01Å; Q285-F287 HydrophobicContact CB-CE2 3.42Å; Q285-F287 VanDerWaalsContact CB-CE2 3.42Å; Q285-F287 HydrophobicContact CB-CG 4.46Å; Q285-F287 HydrophobicContact CB-CZ 3.45Å; Q285-F287 VanDerWaalsContact CB-CZ 3.45Å; Q285-F287 HydrophobicContact CG-CZ 4.26Å; Q285-F287 WeakPolarHBondContact O-CD2 3.43Å; Q285-F287 WeakPolarHBondContact O-CE2 3.49Å; Q285-F287 PolarHBondContact O-N 3.46Å; Q285-F287 VanDerWaalsContact O-N 3.12Å
286K65.5Low79.3Confident212 Ų212109.9 Ų109.992%0.92256%0.563SS**  trans-74.697.8167.1-70.5-169.6177.7-1770109.3L284L284-K286 PolarHBondContact O-N 3.39Å
287F58.8Low79Confident63 Ų63111.2 Ų111.228%0.27657%0.57SS.*  trans-88.4133.7-179.3-63.6-84.9000112.6V282 Q285 V292 L295V282-F287 HydrophobicContact CG1-CE2 4.09Å; V282-F287 HydrophobicContact CG1-CZ 4.48Å; V282-F287 WeakPolarHBondContact O-CE2 3.31Å; Q285-F287 HydrophobicContact CB-CD1 4.49Å; Q285-F287 HydrophobicContact CB-CD2 3.96Å; Q285-F287 HydrophobicContact CB-CE1 4.01Å; Q285-F287 HydrophobicContact CB-CE2 3.42Å; Q285-F287 VanDerWaalsContact CB-CE2 3.42Å; Q285-F287 HydrophobicContact CB-CG 4.46Å; Q285-F287 HydrophobicContact CB-CZ 3.45Å; Q285-F287 VanDerWaalsContact CB-CZ 3.45Å; Q285-F287 HydrophobicContact CG-CZ 4.26Å; Q285-F287 WeakPolarHBondContact O-CD2 3.43Å; Q285-F287 WeakPolarHBondContact O-CE2 3.49Å; Q285-F287 PolarHBondContact O-N 3.46Å; Q285-F287 VanDerWaalsContact O-N 3.12Å; F287-V292 HydrophobicContact CB-CB 4.45Å; F287-V292 HydrophobicContact CB-CG2 3.11Å; F287-V292 HydrophobicContact CD1-CG2 4.3Å; F287-V292 HydrophobicContact CD2-CG2 4.12Å; F287-V292 HydrophobicContact CG-CG2 3.64Å; F287-L295 HydrophobicContact CE1-CD2 3.7Å; F287-L295 HydrophobicContact CZ-CD2 3.9Å
288P66.3Low79Confident97 Ų97110.6 Ų110.663%0.6357%0.568SS**  trans-63.4140.7160.625.7-29.5000109.1D290 G291 V292P288-D290 PolarHBondContact O-N 3.13Å; P288-G291 PolarHBondContact O-N 3.01Å; P288-V292 PolarHBondContact O-N 3.31Å
289K66.6Low79Confident187 Ų187113.3 Ų113.381%0.81357%0.572SS**Hα-helixtrans-53.3-26.8-171.3-71.5-179.6177.21790114.3
290D71.7Confident79Confident130 Ų130112.9 Ų112.970%0.69557%0.57SS**Hα-helixtrans-85.6-25.3176.4-69.9-28.3000114.3P288 K294P288-D290 PolarHBondContact O-N 3.13Å; D290-K294 PolarHBondContact O-N 3.19Å
291G76.6Confident79.2Confident30 Ų30115.1 Ų115.131%0.30958%0.575SS.*Hα-helixtrans-70.3-37.2175.400000112.8P288 K294 L295P288-G291 PolarHBondContact O-N 3.01Å; G291-K294 PolarHBondContact O-N 2.96Å; G291-L295 PolarHBondContact O-N 2.98Å
292V79.3Confident79.4Confident56 Ų56113.1 Ų113.134%0.33957%0.566SS.*Hα-helixtrans-60.8-48.2177.2-1760000111.4F287 P288 K294 L295 M296F287-V292 HydrophobicContact CB-CB 4.45Å; F287-V292 HydrophobicContact CB-CG2 3.11Å; F287-V292 HydrophobicContact CD1-CG2 4.3Å; F287-V292 HydrophobicContact CD2-CG2 4.12Å; F287-V292 HydrophobicContact CG-CG2 3.64Å; P288-V292 PolarHBondContact O-N 3.31Å; V292-K294 VanDerWaalsContact C-N 3.31Å; V292-K294 PolarHBondContact O-N 2.88Å; V292-L295 PolarHBondContact O-N 2.67Å; V292-M296 WeakPolarHBondContact O-CB 3.45Å; V292-M296 PolarHBondContact O-N 3.33Å
293K82.5Confident80.1Confident141 Ų141115.4 Ų115.461%0.61357%0.566SS**Hα-helixtrans-61.4-41.4-178.1-69.7179.9-179.3174.30111.4M296 L297K293-M296 PolarHBondContact O-N 2.85Å; K293-L297 PolarHBondContact O-N 3.47Å
294K84.8Confident80.7Confident164 Ų164111.7 Ų111.771%0.71355%0.547SS*.Hα-helixtrans-66.3-41.9177.8-167.3176.3-177.4179.60112.1D290 G291 V292 Q298D290-K294 PolarHBondContact O-N 3.19Å; G291-K294 PolarHBondContact O-N 2.96Å; V292-K294 VanDerWaalsContact C-N 3.31Å; V292-K294 PolarHBondContact O-N 2.88Å; K294-Q298 WeakPolarHBondContact O-CB 2.89Å; K294-Q298 PolarHBondContact O-N 3.46Å; K294-Q298 VanDerWaalsContact O-N 3.08Å
295L83.8Confident81.3Confident61 Ų61108 Ų10832%0.31953%0.53SS..Hα-helixtrans-65.8-43.4176.3-175.965.2000111.6F287 G291 V292 L297 Q298 M299F287-L295 HydrophobicContact CE1-CD2 3.7Å; F287-L295 HydrophobicContact CZ-CD2 3.9Å; G291-L295 PolarHBondContact O-N 2.98Å; V292-L295 PolarHBondContact O-N 2.67Å; L295-L297 PolarHBondContact O-N 3.04Å; L295-Q298 WeakPolarHBondContact O-CB 3.44Å; L295-Q298 PolarHBondContact O-N 3.29Å; L295-Q298 VanDerWaalsContact O-N 3.16Å; L295-M299 WeakPolarHBondContact O-CG 3.33Å; L295-M299 PolarHBondContact O-N 3.03Å
296M82.8Confident82.2Confident121 Ų121110.4 Ų110.460%0.59654%0.535SS*.Hα-helixtrans-59.2-46.9176.3-174.3-169-68.700111.3V292 K293 Q298 M299 E300V292-M296 WeakPolarHBondContact O-CB 3.45Å; V292-M296 PolarHBondContact O-N 3.33Å; K293-M296 PolarHBondContact O-N 2.85Å; M296-Q298 VanDerWaalsContact C-N 3.28Å; M296-Q298 PolarHBondContact O-N 3.09Å; M296-M299 PolarHBondContact O-N 2.81Å; M296-E300 WeakPolarHBondContact O-CB 3.38Å; M296-E300 PolarHBondContact O-N 3.03Å
297L87.2Confident83.5Confident136 Ų136104.9 Ų104.971%0.71251%0.513SS*.Hα-helixtrans-60.5-38.7176.1-127.195.1000112.1K293 L295 K301K293-L297 PolarHBondContact O-N 3.47Å; L295-L297 PolarHBondContact O-N 3.04Å; L297-K301 WeakPolarHBondContact O-CB 3.37Å; L297-K301 PolarHBondContact O-N 2.79Å
298Q90.5Very high85.3Confident103 Ų103108.1 Ų108.148%0.48153%0.529SS..Hα-helixtrans-68-41.5177-178.6178.1-19.600111.9K294 L295 M296 K301 Q302K294-Q298 WeakPolarHBondContact O-CB 2.89Å; K294-Q298 PolarHBondContact O-N 3.46Å; K294-Q298 VanDerWaalsContact O-N 3.08Å; L295-Q298 WeakPolarHBondContact O-CB 3.44Å; L295-Q298 PolarHBondContact O-N 3.29Å; L295-Q298 VanDerWaalsContact O-N 3.16Å; M296-Q298 VanDerWaalsContact C-N 3.28Å; M296-Q298 PolarHBondContact O-N 3.09Å; Q298-K301 PolarHBondContact O-N 2.98Å; Q298-Q302 WeakPolarHBondContact O-CG 3.32Å; Q298-Q302 PolarHBondContact O-N 3.37Å
299M86.9Confident86.7Confident111 Ų111110.2 Ų110.255%0.54753%0.528SS..Hα-helixtrans-67.5-40.4176.9-70.4-162.880.300111.8L295 M296 K301 Q302 R303L295-M299 WeakPolarHBondContact O-CG 3.33Å; L295-M299 PolarHBondContact O-N 3.03Å; M296-M299 PolarHBondContact O-N 2.81Å; M299-K301 VanDerWaalsContact C-N 3.32Å; M299-K301 PolarHBondContact O-N 3.45Å; M299-Q302 PolarHBondContact O-N 3.43Å; M299-R303 WeakPolarHBondContact O-CB 3.41Å; M299-R303 PolarHBondContact O-N 3.36Å
300E88.2Confident88Confident98 Ų98103.7 Ų103.746%0.45851%0.509SS..Hα-helixtrans-59.2-45.2174-164.276.2-160.500110.5M296 R303 G304M296-E300 WeakPolarHBondContact O-CB 3.38Å; M296-E300 PolarHBondContact O-N 3.03Å; E300-R303 PolarHBondContact O-N 2.85Å; E300-R303 IonicContact OE1-CZ 3.89Å; E300-R303 IonicContact OE1-NH1 3.92Å; E300-R303 PolarHBondContact OE1-NH1 3.18Å; E300-R303 IonicContact OE1-NH2 3.02Å; E300-R303 PolarHBondContact OE1-NH2 3.24Å; E300-R303 IonicContact OE2-CZ 2.83Å; E300-R303 IonicContact OE2-NH1 3.86Å; E300-R303 PolarHBondContact OE2-NH1 2.79Å; E300-G304 PolarHBondContact O-N 3.41Å
301K92.8Very high89.2Confident160 Ų160102.7 Ų102.770%0.69650%0.503SS*.Hα-helixtrans-61.9-44.9175.4-175176.7-178.4176.80111.9L297 Q298 M299 T305L297-K301 WeakPolarHBondContact O-CB 3.37Å; L297-K301 PolarHBondContact O-N 2.79Å; Q298-K301 PolarHBondContact O-N 2.98Å; M299-K301 VanDerWaalsContact C-N 3.32Å; M299-K301 PolarHBondContact O-N 3.45Å; K301-T305 WeakPolarHBondContact O-CG2 3.27Å; K301-T305 PolarHBondContact O-N 2.9Å; K301-T305 VanDerWaalsContact O-N 3.14Å
302Q90.8Very high90.2Very high87 Ų87105.3 Ų105.341%0.40751%0.513SS..Hα-helixtrans-64.1-42.9176.7-75.1-177.7-9.200111.3Q298 M299 G304 T305 Y306Q298-Q302 WeakPolarHBondContact O-CG 3.32Å; Q298-Q302 PolarHBondContact O-N 3.37Å; M299-Q302 PolarHBondContact O-N 3.43Å; Q302-G304 PolarHBondContact O-N 2.96Å; Q302-T305 PolarHBondContact O-N 3.11Å; Q302-T305 VanDerWaalsContact O-N 3.15Å; Q302-T305 PolarHBondContact O-OG1 3.36Å; Q302-Y306 HydrophobicContact CB-CD2 4.47Å; Q302-Y306 HydrophobicContact CB-CE2 4.29Å; Q302-Y306 WeakPolarHBondContact O-CD2 3.48Å; Q302-Y306 PolarHBondContact O-N 2.93Å
303R91.6Very high90.9Very high120 Ų120105.4 Ų105.445%0.45352%0.52SS..Hα-helixtrans-55.7-51.3176.3-164.5-170.881.1-135.8-8.4110.8M299 E300 T305 Y306 E307M299-R303 WeakPolarHBondContact O-CB 3.41Å; M299-R303 PolarHBondContact O-N 3.36Å; E300-R303 PolarHBondContact O-N 2.85Å; E300-R303 IonicContact OE1-CZ 3.89Å; E300-R303 IonicContact OE1-NH1 3.92Å; E300-R303 PolarHBondContact OE1-NH1 3.18Å; E300-R303 IonicContact OE1-NH2 3.02Å; E300-R303 PolarHBondContact OE1-NH2 3.24Å; E300-R303 IonicContact OE2-CZ 2.83Å; E300-R303 IonicContact OE2-NH1 3.86Å; E300-R303 PolarHBondContact OE2-NH1 2.79Å; R303-T305 VanDerWaalsContact C-N 3.3Å; R303-T305 PolarHBondContact O-N 2.9Å; R303-Y306 PolarHBondContact O-N 3.5Å; R303-E307 VanDerWaalsContact CD-OE1 3.31Å; R303-E307 WeakPolarHBondContact CD-OE1 3.38Å; R303-E307 HydrophobicContact CG-CG 4.41Å; R303-E307 VanDerWaalsContact CG-OE1 3.32Å; R303-E307 WeakPolarHBondContact CG-OE1 3.45Å; R303-E307 IonicContact CZ-OE1 2.82Å; R303-E307 IonicContact NE-OE1 3.58Å; R303-E307 PolarHBondContact NE-OE1 3.08Å; R303-E307 IonicContact NE-OE2 2.61Å; R303-E307 WeakPolarHBondContact O-CG 3.45Å; R303-E307 PolarHBondContact O-N 3.46Å
304G92Very high91.6Very high31 Ų31104.3 Ų104.332%0.3252%0.52SS..Hα-helixtrans-56.7-41.9176.500000112.8E300 Q302 Y306 E307 E308E300-G304 PolarHBondContact O-N 3.41Å; Q302-G304 PolarHBondContact O-N 2.96Å; G304-Y306 PolarHBondContact O-N 2.77Å; G304-E307 PolarHBondContact O-N 3.13Å; G304-E308 WeakPolarHBondContact O-CB 3.46Å; G304-E308 PolarHBondContact O-N 2.98Å
305T93.6Very high92.2Very high53 Ų53102.6 Ų102.633%0.32551%0.514SS..Hα-helixtrans-68.4-31.4176.6620000114K301 Q302 R303 K309K301-T305 WeakPolarHBondContact O-CG2 3.27Å; K301-T305 PolarHBondContact O-N 2.9Å; K301-T305 VanDerWaalsContact O-N 3.14Å; Q302-T305 PolarHBondContact O-N 3.11Å; Q302-T305 VanDerWaalsContact O-N 3.15Å; Q302-T305 PolarHBondContact O-OG1 3.36Å; R303-T305 VanDerWaalsContact C-N 3.3Å; R303-T305 PolarHBondContact O-N 2.9Å; T305-K309 WeakPolarHBondContact O-CB 3.47Å; T305-K309 WeakPolarHBondContact O-CD 3.5Å; T305-K309 WeakPolarHBondContact O-CG 3.28Å; T305-K309 PolarHBondContact O-N 3.3Å
306Y94.1Very high92.8Very high158 Ų158105.9 Ų105.962%0.6253%0.526SS*.Hα-helixtrans-74.5-41.1174.7-76.1-66.3000111.2Q302 R303 G304 K309 A310Q302-Y306 HydrophobicContact CB-CD2 4.47Å; Q302-Y306 HydrophobicContact CB-CE2 4.29Å; Q302-Y306 WeakPolarHBondContact O-CD2 3.48Å; Q302-Y306 PolarHBondContact O-N 2.93Å; R303-Y306 PolarHBondContact O-N 3.5Å; G304-Y306 PolarHBondContact O-N 2.77Å; Y306-K309 PolarHBondContact O-N 2.88Å; Y306-A310 VanDerWaalsContact O-CB 3.25Å; Y306-A310 WeakPolarHBondContact O-CB 3.41Å; Y306-A310 PolarHBondContact O-N 2.94Å
307E93.3Very high93.5Very high95 Ų95102.6 Ų102.644%0.44452%0.518SS..Hα-helixtrans-59.6-47.7174.8-73.4170.1-178.400110.9R303 G304 K309 A310 L311R303-E307 VanDerWaalsContact CD-OE1 3.31Å; R303-E307 WeakPolarHBondContact CD-OE1 3.38Å; R303-E307 HydrophobicContact CG-CG 4.41Å; R303-E307 VanDerWaalsContact CG-OE1 3.32Å; R303-E307 WeakPolarHBondContact CG-OE1 3.45Å; R303-E307 IonicContact CZ-OE1 2.82Å; R303-E307 IonicContact NE-OE1 3.58Å; R303-E307 PolarHBondContact NE-OE1 3.08Å; R303-E307 IonicContact NE-OE2 2.61Å; R303-E307 WeakPolarHBondContact O-CG 3.45Å; R303-E307 PolarHBondContact O-N 3.46Å; G304-E307 PolarHBondContact O-N 3.13Å; E307-K309 PolarHBondContact O-N 3.47Å; E307-A310 PolarHBondContact O-N 2.95Å; E307-L311 WeakPolarHBondContact O-CB 3.46Å; E307-L311 WeakPolarHBondContact O-CG 3.48Å; E307-L311 PolarHBondContact O-N 2.98Å
308E95.2Very high93.9Very high132 Ų132100.4 Ų100.462%0.61751%0.51SS*.Hα-helixtrans-60.7-46.5176.8-173.2179-170.700111.6G304 A310 L311 V312G304-E308 WeakPolarHBondContact O-CB 3.46Å; G304-E308 PolarHBondContact O-N 2.98Å; E308-A310 VanDerWaalsContact C-N 3.34Å; E308-A310 PolarHBondContact O-N 3.31Å; E308-L311 PolarHBondContact O-N 2.9Å; E308-V312 WeakPolarHBondContact O-CG2 3.35Å; E308-V312 PolarHBondContact O-N 2.9Å
309K95.7Very high94.3Very high141 Ų141100.6 Ų100.661%0.61351%0.511SS*.Hα-helixtrans-63.3-38.6176.3-74.6173.4-176.1176.80112.6T305 Y306 E307 A313T305-K309 WeakPolarHBondContact O-CB 3.47Å; T305-K309 WeakPolarHBondContact O-CD 3.5Å; T305-K309 WeakPolarHBondContact O-CG 3.28Å; T305-K309 PolarHBondContact O-N 3.3Å; Y306-K309 PolarHBondContact O-N 2.88Å; E307-K309 PolarHBondContact O-N 3.47Å; K309-A313 VanDerWaalsContact O-CB 3.3Å; K309-A313 WeakPolarHBondContact O-CB 3.32Å; K309-A313 PolarHBondContact O-N 2.85Å
310A94.6Very high94.8Very high50 Ų50100.6 Ų100.641%0.41351%0.51SS..Hα-helixtrans-67.5-42.117800000111.1Y306 E307 E308 A313 L314Y306-A310 VanDerWaalsContact O-CB 3.25Å; Y306-A310 WeakPolarHBondContact O-CB 3.41Å; Y306-A310 PolarHBondContact O-N 2.94Å; E307-A310 PolarHBondContact O-N 2.95Å; E308-A310 VanDerWaalsContact C-N 3.34Å; E308-A310 PolarHBondContact O-N 3.31Å; A310-A313 PolarHBondContact O-N 3.31Å; A310-L314 WeakPolarHBondContact O-CB 3.45Å; A310-L314 WeakPolarHBondContact O-CG 3.48Å; A310-L314 PolarHBondContact O-N 2.99Å
311L96.4Very high95.2Very high108 Ų108102.7 Ų102.757%0.56552%0.518SS*.Hα-helixtrans-60.9-47.7174.8-76171.5000111.6E307 E308 A313 L314 Q315E307-L311 WeakPolarHBondContact O-CB 3.46Å; E307-L311 WeakPolarHBondContact O-CG 3.48Å; E307-L311 PolarHBondContact O-N 2.98Å; E308-L311 PolarHBondContact O-N 2.9Å; L311-A313 VanDerWaalsContact C-N 3.33Å; L311-A313 PolarHBondContact O-N 2.9Å; L311-L314 PolarHBondContact O-N 2.95Å; L311-Q315 WeakPolarHBondContact O-CB 3.46Å; L311-Q315 WeakPolarHBondContact O-CG 3.43Å; L311-Q315 PolarHBondContact O-N 3.48Å
312V97.5Very high95.4Very high85 Ų8597 Ų9752%0.51550%0.501SS..Hα-helixtrans-62.1-41.3177.2172.60000111.3E308 K316E308-V312 WeakPolarHBondContact O-CG2 3.35Å; E308-V312 PolarHBondContact O-N 2.9Å; V312-K316 WeakPolarHBondContact O-CB 3.36Å; V312-K316 PolarHBondContact O-N 3.43Å
313A95.3Very high95.7Very high59 Ų5996.3 Ų96.349%0.48850%0.5SS..Hα-helixtrans-65.3-41.4177.200000112.3K309 A310 L311 K316 A317K309-A313 VanDerWaalsContact O-CB 3.3Å; K309-A313 WeakPolarHBondContact O-CB 3.32Å; K309-A313 PolarHBondContact O-N 2.85Å; A310-A313 PolarHBondContact O-N 3.31Å; L311-A313 VanDerWaalsContact C-N 3.33Å; L311-A313 PolarHBondContact O-N 2.9Å; A313-K316 PolarHBondContact O-N 3.07Å; A313-A317 WeakPolarHBondContact O-CB 3.36Å; A313-A317 PolarHBondContact O-N 2.88Å
314L96.1Very high96Very high117 Ų11793.1 Ų93.161%0.61350%0.499SS*.Hα-helixtrans-66.4-45.5176.6-75.5171.7000111.6A310 L311 K316 A317 T318A310-L314 WeakPolarHBondContact O-CB 3.45Å; A310-L314 WeakPolarHBondContact O-CG 3.48Å; A310-L314 PolarHBondContact O-N 2.99Å; L311-L314 PolarHBondContact O-N 2.95Å; L314-K316 VanDerWaalsContact C-N 3.31Å; L314-K316 PolarHBondContact O-N 3.04Å; L314-A317 PolarHBondContact O-N 3.5Å; L314-T318 WeakPolarHBondContact O-CG2 3.39Å; L314-T318 PolarHBondContact O-N 2.85Å; L314-T318 PolarHBondContact O-OG1 3.36Å; L314-T318 VanDerWaalsContact O-OG1 3.13Å
315Q97.3Very high96.2Very high129 Ų12996.1 Ų96.160%0.60351%0.507SS*.Hα-helixtrans-58.6-44175.6-76.7177.5-18.100111.7L311 T318 Q319L311-Q315 WeakPolarHBondContact O-CB 3.46Å; L311-Q315 WeakPolarHBondContact O-CG 3.43Å; L311-Q315 PolarHBondContact O-N 3.48Å; Q315-T318 WeakPolarHBondContact CA-OG1 3.33Å; Q315-T318 PolarHBondContact O-N 2.99Å; Q315-T318 PolarHBondContact O-OG1 3.21Å; Q315-Q319 PolarHBondContact O-N 3.27Å
316K97.7Very high96.4Very high130 Ų13097.1 Ų97.157%0.56552%0.515SS*.Hα-helixtrans-61.9-46174.9-177.1175.8172.8177.10111.7V312 A313 L314 T318 Q319 E320V312-K316 WeakPolarHBondContact O-CB 3.36Å; V312-K316 PolarHBondContact O-N 3.43Å; A313-K316 PolarHBondContact O-N 3.07Å; L314-K316 VanDerWaalsContact C-N 3.31Å; L314-K316 PolarHBondContact O-N 3.04Å; K316-T318 VanDerWaalsContact C-N 3.32Å; K316-T318 PolarHBondContact O-N 3.48Å; K316-Q319 PolarHBondContact O-N 3.26Å; K316-E320 WeakPolarHBondContact CE-OE1 3.49Å; K316-E320 HydrophobicContact CG-CG 4.48Å; K316-E320 IonicContact NZ-OE1 3.21Å; K316-E320 WeakPolarHBondContact O-CG 3.34Å; K316-E320 PolarHBondContact O-N 3.43Å
317A97Very high96.6Very high52 Ų5295.6 Ų95.643%0.4351%0.514SS..Hα-helixtrans-63.6-37178.200000112.4A313 L314 K321A313-A317 WeakPolarHBondContact O-CB 3.36Å; A313-A317 PolarHBondContact O-N 2.88Å; L314-A317 PolarHBondContact O-N 3.5Å; A317-K321 WeakPolarHBondContact O-CB 3.37Å; A317-K321 PolarHBondContact O-N 2.83Å
318T95.8Very high96.7Very high89 Ų8993.6 Ų93.655%0.54651%0.514SS..Hα-helixtrans-68.8-37.4175.350.60000112.3L314 Q315 K316 K321 A322L314-T318 WeakPolarHBondContact O-CG2 3.39Å; L314-T318 PolarHBondContact O-N 2.85Å; L314-T318 PolarHBondContact O-OG1 3.36Å; L314-T318 VanDerWaalsContact O-OG1 3.13Å; Q315-T318 WeakPolarHBondContact CA-OG1 3.33Å; Q315-T318 PolarHBondContact O-N 2.99Å; Q315-T318 PolarHBondContact O-OG1 3.21Å; K316-T318 VanDerWaalsContact C-N 3.32Å; K316-T318 PolarHBondContact O-N 3.48Å; T318-K321 PolarHBondContact O-N 2.86Å; T318-A322 PolarHBondContact O-N 2.97Å
319Q98.1Very high96.9Very high107 Ų10793.2 Ų93.250%0.551%0.512SS..Hα-helixtrans-66-48.7174.9-174.861.438.300111Q315 K316 K321 A322 D323Q315-Q319 PolarHBondContact O-N 3.27Å; K316-Q319 PolarHBondContact O-N 3.26Å; Q319-K321 PolarHBondContact O-N 3.27Å; Q319-A322 WeakPolarHBondContact O-CB 3.34Å; Q319-A322 PolarHBondContact O-N 3.03Å; Q319-D323 PolarHBondContact NE2-OD1 2.98Å; Q319-D323 VanDerWaalsContact O-CG 3.27Å; Q319-D323 PolarHBondContact O-N 2.8Å
320E97.3Very high97Very high111 Ų11190.4 Ų90.452%0.51951%0.507SS..Hα-helixtrans-59.2-36.4176.9-72.5176.7179.300111.7K316 A324K316-E320 WeakPolarHBondContact CE-OE1 3.49Å; K316-E320 HydrophobicContact CG-CG 4.48Å; K316-E320 IonicContact NZ-OE1 3.21Å; K316-E320 WeakPolarHBondContact O-CG 3.34Å; K316-E320 PolarHBondContact O-N 3.43Å; E320-A324 VanDerWaalsContact O-CB 3.29Å; E320-A324 WeakPolarHBondContact O-CB 3.32Å; E320-A324 PolarHBondContact O-N 2.86Å
321K96.9Very high97.1Very high143 Ų14393.9 Ų93.962%0.62252%0.518SS*.Hα-helixtrans-64.8-44.8172.9-178.4-177.2174.8-177.80111.8A317 T318 Q319 A324 L325A317-K321 WeakPolarHBondContact O-CB 3.37Å; A317-K321 PolarHBondContact O-N 2.83Å; T318-K321 PolarHBondContact O-N 2.86Å; Q319-K321 PolarHBondContact O-N 3.27Å; K321-A324 PolarHBondContact O-N 2.89Å; K321-L325 HydrophobicContact CG-CD1 4.3Å; K321-L325 WeakPolarHBondContact O-CG 3.32Å; K321-L325 PolarHBondContact O-N 3.42Å
322A97.2Very high97.2Very high41 Ų4194 Ų9434%0.33952%0.515SS..Hα-helixtrans-62.6-46.1177.700000111.1T318 Q319 A324 L325 C326T318-A322 PolarHBondContact O-N 2.97Å; Q319-A322 WeakPolarHBondContact O-CB 3.34Å; Q319-A322 PolarHBondContact O-N 3.03Å; A322-A324 VanDerWaalsContact C-N 3.32Å; A322-A324 PolarHBondContact O-N 3.01Å; A322-L325 PolarHBondContact O-N 3.33Å; A322-L325 VanDerWaalsContact O-N 3.15Å; A322-C326 PolarHBondContact O-N 3.27Å; A322-C326 PolarHBondContact O-SG 2.93Å
323D97.4Very high97.3Very high72 Ų7296.3 Ų96.339%0.38552%0.521SS..Hα-helixtrans-60.6-41.8177.5-62.9-19.9000111.5Q319 C326 Q327Q319-D323 PolarHBondContact NE2-OD1 2.98Å; Q319-D323 VanDerWaalsContact O-CG 3.27Å; Q319-D323 PolarHBondContact O-N 2.8Å; D323-C326 PolarHBondContact O-N 3.47Å; D323-Q327 VanDerWaalsContact O-CG 3.31Å; D323-Q327 WeakPolarHBondContact O-CG 3.33Å; D323-Q327 PolarHBondContact O-N 3.46Å
324A96.5Very high97.4Very high53 Ų5396 Ų9644%0.43852%0.518SS..Hα-helixtrans-65.5-36.8176.400000112.8E320 K321 A322 Q327 A328E320-A324 VanDerWaalsContact O-CB 3.29Å; E320-A324 WeakPolarHBondContact O-CB 3.32Å; E320-A324 PolarHBondContact O-N 2.86Å; K321-A324 PolarHBondContact O-N 2.89Å; A322-A324 VanDerWaalsContact C-N 3.32Å; A322-A324 PolarHBondContact O-N 3.01Å; A324-Q327 PolarHBondContact O-N 2.97Å; A324-A328 WeakPolarHBondContact O-CB 3.42Å; A324-A328 PolarHBondContact O-N 2.9Å
325L98Very high97.5Very high94 Ų9494.4 Ų94.449%0.49251%0.51SS..Hα-helixtrans-67.7-46.2175.6-73.2172.6000111.5K321 A322 Q327 A328 E329K321-L325 HydrophobicContact CG-CD1 4.3Å; K321-L325 WeakPolarHBondContact O-CG 3.32Å; K321-L325 PolarHBondContact O-N 3.42Å; A322-L325 PolarHBondContact O-N 3.33Å; A322-L325 VanDerWaalsContact O-N 3.15Å; L325-Q327 VanDerWaalsContact C-N 3.28Å; L325-Q327 PolarHBondContact O-N 3.46Å; L325-A328 WeakPolarHBondContact O-CB 3.31Å; L325-A328 PolarHBondContact O-N 3.2Å; L325-A328 VanDerWaalsContact O-N 3.09Å; L325-E329 PolarHBondContact O-N 3.41Å
326C96.9Very high97.5Very high73 Ų7392 Ų9249%0.49350%0.503SS..Hα-helixtrans-58.4-42.1174.7-67.40000111.5A322 D323 A328 E329 T330A322-C326 PolarHBondContact O-N 3.27Å; A322-C326 PolarHBondContact O-SG 2.93Å; D323-C326 PolarHBondContact O-N 3.47Å; C326-A328 PolarHBondContact O-N 3.42Å; C326-E329 PolarHBondContact O-N 3.25Å; C326-T330 WeakPolarHBondContact O-CG2 3.43Å; C326-T330 PolarHBondContact O-N 3.37Å
327Q98.2Very high97.6Very high126 Ų12689.8 Ų89.859%0.58950%0.501SS*.Hα-helixtrans-61.8-43174.2-73.4174.71900112.1D323 A324 L325 E329 T330 L331D323-Q327 VanDerWaalsContact O-CG 3.31Å; D323-Q327 WeakPolarHBondContact O-CG 3.33Å; D323-Q327 PolarHBondContact O-N 3.46Å; A324-Q327 PolarHBondContact O-N 2.97Å; L325-Q327 VanDerWaalsContact C-N 3.28Å; L325-Q327 PolarHBondContact O-N 3.46Å; Q327-E329 VanDerWaalsContact C-N 3.33Å; Q327-E329 PolarHBondContact O-N 2.9Å; Q327-T330 PolarHBondContact O-N 3.2Å; Q327-T330 PolarHBondContact O-OG1 2.8Å; Q327-L331 WeakPolarHBondContact O-CG 3.48Å; Q327-L331 PolarHBondContact O-N 3.31Å
328A96.4Very high97.6Very high54 Ų5489.7 Ų89.745%0.44650%0.5SS..Hα-helixtrans-61.4-40.7177.500000112.3A324 L325 C326 L331 Q332A324-A328 WeakPolarHBondContact O-CB 3.42Å; A324-A328 PolarHBondContact O-N 2.9Å; L325-A328 WeakPolarHBondContact O-CB 3.31Å; L325-A328 PolarHBondContact O-N 3.2Å; L325-A328 VanDerWaalsContact O-N 3.09Å; C326-A328 PolarHBondContact O-N 3.42Å; A328-L331 PolarHBondContact O-N 3.03Å; A328-Q332 WeakPolarHBondContact O-CB 3.46Å; A328-Q332 PolarHBondContact O-N 3.31Å
329E97.6Very high97.7Very high124 Ų12490.4 Ų90.458%0.57950%0.497SS*.Hα-helixtrans-62.4-47.4175.4-71.2172.2175.600111.7L325 C326 Q327 L331 Q332 E333L325-E329 PolarHBondContact O-N 3.41Å; C326-E329 PolarHBondContact O-N 3.25Å; Q327-E329 VanDerWaalsContact C-N 3.33Å; Q327-E329 PolarHBondContact O-N 2.9Å; E329-L331 VanDerWaalsContact C-N 3.3Å; E329-L331 PolarHBondContact O-N 3.33Å; E329-Q332 WeakPolarHBondContact O-CB 3.38Å; E329-Q332 PolarHBondContact O-N 2.92Å; E329-Q332 VanDerWaalsContact O-N 3.09Å; E329-E333 PolarHBondContact O-N 2.98Å
330T98.2Very high97.7Very high82 Ų8288.1 Ų88.150%0.50350%0.497SS..Hα-helixtrans-61.5-37.2177610000112.9C326 Q327 E333 A334C326-T330 WeakPolarHBondContact O-CG2 3.43Å; C326-T330 PolarHBondContact O-N 3.37Å; Q327-T330 PolarHBondContact O-N 3.2Å; Q327-T330 PolarHBondContact O-OG1 2.8Å; T330-E333 PolarHBondContact O-N 3.47Å; T330-A334 WeakPolarHBondContact O-CB 3.45Å; T330-A334 PolarHBondContact O-N 3.27Å
331L98.2Very high97.8Very high122 Ų12288.1 Ų88.164%0.63950%0.497SS*.Hα-helixtrans-69.2-35.2175.6-71.7175.6000111.8Q327 A328 E329 A334 L335Q327-L331 WeakPolarHBondContact O-CG 3.48Å; Q327-L331 PolarHBondContact O-N 3.31Å; A328-L331 PolarHBondContact O-N 3.03Å; E329-L331 VanDerWaalsContact C-N 3.3Å; E329-L331 PolarHBondContact O-N 3.33Å; L331-A334 PolarHBondContact O-N 3.04Å; L331-L335 WeakPolarHBondContact O-CB 3.39Å; L331-L335 PolarHBondContact O-N 3.36Å
332Q98.3Very high97.8Very high111 Ų11184 Ų8452%0.51949%0.489SS..Hα-helixtrans-65.7-43.1175.5-175.761.927.900111.3A328 E329 L335 V336A328-Q332 WeakPolarHBondContact O-CB 3.46Å; A328-Q332 PolarHBondContact O-N 3.31Å; E329-Q332 WeakPolarHBondContact O-CB 3.38Å; E329-Q332 PolarHBondContact O-N 2.92Å; E329-Q332 VanDerWaalsContact O-N 3.09Å; Q332-L335 WeakPolarHBondContact O-CB 3.42Å; Q332-L335 PolarHBondContact O-N 3.07Å; Q332-V336 WeakPolarHBondContact O-CG2 3.37Å; Q332-V336 PolarHBondContact O-N 3.4Å
333E98.4Very high97.9Very high134 Ų13487.4 Ų87.463%0.62650%0.501SS*.Hα-helixtrans-61.7-46.4173.6-69.3176.6175.600111.2E329 T330 L335 V336 T337E329-E333 PolarHBondContact O-N 2.98Å; T330-E333 PolarHBondContact O-N 3.47Å; E333-L335 VanDerWaalsContact C-N 3.29Å; E333-L335 PolarHBondContact O-N 3.36Å; E333-V336 PolarHBondContact O-N 3.09Å; E333-T337 WeakPolarHBondContact O-CG2 3.47Å; E333-T337 PolarHBondContact O-N 3.43Å; E333-T337 PolarHBondContact O-OG1 3.09Å
334A97.6Very high98Very high52 Ų5289.8 Ų89.843%0.4351%0.505SS..Hα-helixtrans-59.2-39.7175.700000112.1T330 L331 T337 A338T330-A334 WeakPolarHBondContact O-CB 3.45Å; T330-A334 PolarHBondContact O-N 3.27Å; L331-A334 PolarHBondContact O-N 3.04Å; A334-T337 WeakPolarHBondContact CA-OG1 3.33Å; A334-T337 PolarHBondContact O-N 3.48Å; A334-T337 PolarHBondContact O-OG1 2.76Å; A334-A338 WeakPolarHBondContact O-CB 3.31Å; A334-A338 PolarHBondContact O-N 3.49Å
335L98Very high98Very high84 Ų8494.4 Ų94.444%0.4451%0.511SS..Hα-helixtrans-62.1-45.9175.3-178.769.4000111.7L331 Q332 E333 T337 A338 Q339L331-L335 WeakPolarHBondContact O-CB 3.39Å; L331-L335 PolarHBondContact O-N 3.36Å; Q332-L335 WeakPolarHBondContact O-CB 3.42Å; Q332-L335 PolarHBondContact O-N 3.07Å; E333-L335 VanDerWaalsContact C-N 3.29Å; E333-L335 PolarHBondContact O-N 3.36Å; L335-T337 VanDerWaalsContact C-N 3.35Å; L335-T337 PolarHBondContact O-N 2.96Å; L335-A338 PolarHBondContact O-N 3.33Å; L335-Q339 WeakPolarHBondContact O-CB 3.29Å; L335-Q339 VanDerWaalsContact O-CG 3.29Å; L335-Q339 WeakPolarHBondContact O-CG 3.35Å; L335-Q339 PolarHBondContact O-N 2.96Å
336V98.3Very high98.1Very high78 Ų7894.8 Ų94.847%0.47351%0.51SS..Hα-helixtrans-62.4-42.9178.3171.80000110.9Q332 E333 Q339 A340Q332-V336 WeakPolarHBondContact O-CG2 3.37Å; Q332-V336 PolarHBondContact O-N 3.4Å; E333-V336 PolarHBondContact O-N 3.09Å; V336-Q339 PolarHBondContact O-N 2.69Å; V336-A340 PolarHBondContact O-N 3.49Å
337T98.3Very high98.1Very high83 Ų8393.7 Ų93.751%0.50950%0.504SS..Hα-helixtrans-62.9-45.3176.261.30000112E333 A334 L335 Q339 A340 E341E333-T337 WeakPolarHBondContact O-CG2 3.47Å; E333-T337 PolarHBondContact O-N 3.43Å; E333-T337 PolarHBondContact O-OG1 3.09Å; A334-T337 WeakPolarHBondContact CA-OG1 3.33Å; A334-T337 PolarHBondContact O-N 3.48Å; A334-T337 PolarHBondContact O-OG1 2.76Å; L335-T337 VanDerWaalsContact C-N 3.35Å; L335-T337 PolarHBondContact O-N 2.96Å; T337-Q339 VanDerWaalsContact C-N 3.31Å; T337-Q339 PolarHBondContact O-N 3.15Å; T337-A340 PolarHBondContact O-N 3.39Å; T337-E341 WeakPolarHBondContact O-CG 3.25Å; T337-E341 PolarHBondContact O-N 2.96Å
338A97.9Very high98.2Very high50 Ų5090.9 Ų90.941%0.41349%0.492SS..Hα-helixtrans-62-37.5176.500000112.4A334 L335 E341 A342A334-A338 WeakPolarHBondContact O-CB 3.31Å; A334-A338 PolarHBondContact O-N 3.49Å; L335-A338 PolarHBondContact O-N 3.33Å; A338-E341 PolarHBondContact O-N 3.44Å; A338-A342 WeakPolarHBondContact O-CB 3.41Å; A338-A342 PolarHBondContact O-N 3.01Å
339Q98.5Very high98.2Very high105 Ų10595.1 Ų95.149%0.49150%0.498SS..Hα-helixtrans-65-44.2174.3-75175.2-7.700112L335 V336 T337 E341 A342 L343L335-Q339 WeakPolarHBondContact O-CB 3.29Å; L335-Q339 VanDerWaalsContact O-CG 3.29Å; L335-Q339 WeakPolarHBondContact O-CG 3.35Å; L335-Q339 PolarHBondContact O-N 2.96Å; V336-Q339 PolarHBondContact O-N 2.69Å; T337-Q339 VanDerWaalsContact C-N 3.31Å; T337-Q339 PolarHBondContact O-N 3.15Å; Q339-E341 VanDerWaalsContact C-N 3.33Å; Q339-E341 PolarHBondContact O-N 3.11Å; Q339-A342 PolarHBondContact O-N 2.93Å; Q339-L343 WeakPolarHBondContact O-CG 3.33Å; Q339-L343 PolarHBondContact O-N 2.87Å
340A98.3Very high98.3Very high59 Ų5994.9 Ų94.949%0.48850%0.495SS..Hα-helixtrans-61.9-41.8176.100000111.7V336 T337 L343 R344V336-A340 PolarHBondContact O-N 3.49Å; T337-A340 PolarHBondContact O-N 3.39Å; A340-L343 PolarHBondContact O-N 3.38Å; A340-R344 PolarHBondContact O-N 3.46Å
341E98.4Very high98.3Very high110 Ų11096.3 Ų96.351%0.51450%0.496SS..Hα-helixtrans-63.5-42.6174.8-73.2-177.9178.400112.4T337 A338 Q339 L343 R344 W345T337-E341 WeakPolarHBondContact O-CG 3.25Å; T337-E341 PolarHBondContact O-N 2.96Å; A338-E341 PolarHBondContact O-N 3.44Å; Q339-E341 VanDerWaalsContact C-N 3.33Å; Q339-E341 PolarHBondContact O-N 3.11Å; E341-L343 VanDerWaalsContact C-N 3.34Å; E341-L343 PolarHBondContact O-N 2.89Å; E341-R344 WeakPolarHBondContact O-CB 3.42Å; E341-R344 PolarHBondContact O-N 3.37Å; E341-W345 PolarHBondContact O-N 2.8Å
342A98.1Very high98.3Very high57 Ų5795.8 Ų95.847%0.47149%0.493SS..Hα-helixtrans-60.8-42.4177.400000112A338 Q339 W345 Q346A338-A342 WeakPolarHBondContact O-CB 3.41Å; A338-A342 PolarHBondContact O-N 3.01Å; Q339-A342 PolarHBondContact O-N 2.93Å; A342-W345 PolarHBondContact O-N 3.26Å; A342-Q346 WeakPolarHBondContact O-CB 3.48Å; A342-Q346 PolarHBondContact O-N 3.08Å
343L98.6Very high98.3Very high113 Ų11394.7 Ų94.759%0.59249%0.489SS*.Hα-helixtrans-63.7-40.9174.9-70.6173.3000111.8Q339 A340 E341 Q346 S347Q339-L343 WeakPolarHBondContact O-CG 3.33Å; Q339-L343 PolarHBondContact O-N 2.87Å; A340-L343 PolarHBondContact O-N 3.38Å; E341-L343 VanDerWaalsContact C-N 3.34Å; E341-L343 PolarHBondContact O-N 2.89Å; L343-Q346 WeakPolarHBondContact O-CB 3.39Å; L343-Q346 PolarHBondContact O-N 3.31Å; L343-S347 PolarHBondContact O-N 3.23Å
344R98.6Very high98.3Very high121 Ų12194.6 Ų94.646%0.45749%0.492SS..Hα-helixtrans-62.5-42.3175-170.9-177.370.8844.5112A340 E341 Q346 S347 L348A340-R344 PolarHBondContact O-N 3.46Å; E341-R344 WeakPolarHBondContact O-CB 3.42Å; E341-R344 PolarHBondContact O-N 3.37Å; R344-Q346 VanDerWaalsContact C-N 3.31Å; R344-Q346 PolarHBondContact O-N 3.44Å; R344-S347 PolarHBondContact O-N 3.32Å; R344-S347 PolarHBondContact O-OG 2.92Å; R344-L348 HydrophobicContact CG-CD1 4.41Å; R344-L348 WeakPolarHBondContact O-CG 3.34Å; R344-L348 PolarHBondContact O-N 3.45Å; R344-L348 VanDerWaalsContact O-N 3.12Å
345W98.1Very high98.4Very high150 Ų15095 Ų9557%0.56849%0.492SS*.Hα-helixtrans-66-36.1175.2-70.5122.8000112.1E341 A342 L348 Y349E341-W345 PolarHBondContact O-N 2.8Å; A342-W345 PolarHBondContact O-N 3.26Å; W345-L348 HydrophobicContact CE3-CD1 3.91Å; W345-L348 HydrophobicContact CZ3-CD1 4Å; W345-Y349 WeakPolarHBondContact O-CB 3.32Å; W345-Y349 PolarHBondContact O-N 2.99Å
346Q98.6Very high98.3Very high102 Ų10293.5 Ų93.548%0.47749%0.488SS..Hα-helixtrans-64.5-41.5176-169.5-174.333.300112.3A342 L343 R344 K350A342-Q346 WeakPolarHBondContact O-CB 3.48Å; A342-Q346 PolarHBondContact O-N 3.08Å; L343-Q346 WeakPolarHBondContact O-CB 3.39Å; L343-Q346 PolarHBondContact O-N 3.31Å; R344-Q346 VanDerWaalsContact C-N 3.31Å; R344-Q346 PolarHBondContact O-N 3.44Å; Q346-K350 WeakPolarHBondContact O-CG 3.43Å; Q346-K350 PolarHBondContact O-N 2.61Å; Q346-K350 VanDerWaalsContact O-N 3.16Å
347S98.6Very high98.3Very high51 Ų5190.6 Ų90.636%0.35747%0.474SS..Hα-helixtrans-65.8-47.4176.965.10000111.3L343 R344 Y349 K350 E351L343-S347 PolarHBondContact O-N 3.23Å; R344-S347 PolarHBondContact O-N 3.32Å; R344-S347 PolarHBondContact O-OG 2.92Å; S347-Y349 VanDerWaalsContact C-N 3.29Å; S347-Y349 PolarHBondContact O-N 3.13Å; S347-K350 WeakPolarHBondContact O-CB 3.31Å; S347-K350 PolarHBondContact O-N 3.39Å; S347-E351 PolarHBondContact O-N 2.99Å
348L98.6Very high98.3Very high66 Ų6692.4 Ų92.435%0.34648%0.477SS..Hα-helixtrans-59.9-38.8177.2-71.2173.6000112.4R344 W345 E351 L352R344-L348 HydrophobicContact CG-CD1 4.41Å; R344-L348 WeakPolarHBondContact O-CG 3.34Å; R344-L348 PolarHBondContact O-N 3.45Å; R344-L348 VanDerWaalsContact O-N 3.12Å; W345-L348 HydrophobicContact CE3-CD1 3.91Å; W345-L348 HydrophobicContact CZ3-CD1 4Å; L348-E351 PolarHBondContact O-N 2.98Å; L348-L352 WeakPolarHBondContact O-CB 3.31Å; L348-L352 PolarHBondContact O-N 3.4Å
349Y98.1Very high98.4Very high143 Ų14395.8 Ų95.856%0.56149%0.487SS*.Hα-helixtrans-61.8-43.7174.8174.9-101.1000111.8W345 S347 L352 M353W345-Y349 WeakPolarHBondContact O-CB 3.32Å; W345-Y349 PolarHBondContact O-N 2.99Å; S347-Y349 VanDerWaalsContact C-N 3.29Å; S347-Y349 PolarHBondContact O-N 3.13Å; Y349-L352 PolarHBondContact O-N 2.96Å; Y349-M353 HydrophobicContact CD1-CG 4.26Å; Y349-M353 HydrophobicContact CD2-CG 4.43Å; Y349-M353 HydrophobicContact CE1-CG 3.8Å; Y349-M353 HydrophobicContact CE2-CG 3.99Å; Y349-M353 HydrophobicContact CE2-SD 4.14Å; Y349-M353 WeakPolarHBondContact O-CB 3.41Å; Y349-M353 VanDerWaalsContact O-CG 3.28Å; Y349-M353 WeakPolarHBondContact O-CG 3.37Å; Y349-M353 PolarHBondContact O-N 2.88Å
350K98.6Very high98.4Very high119 Ų11997.6 Ų97.652%0.51749%0.49SS..Hα-helixtrans-62.9-43176.9-71.5172.3179.2175.10111.6Q346 S347 M353 L354Q346-K350 WeakPolarHBondContact O-CG 3.43Å; Q346-K350 PolarHBondContact O-N 2.61Å; Q346-K350 VanDerWaalsContact O-N 3.16Å; S347-K350 WeakPolarHBondContact O-CB 3.31Å; S347-K350 PolarHBondContact O-N 3.39Å; K350-M353 PolarHBondContact O-N 3.01Å; K350-L354 WeakPolarHBondContact O-CG 3.38Å; K350-L354 PolarHBondContact O-N 2.82Å
351E98.5Very high98.4Very high113 Ų113101.3 Ų101.353%0.52850%0.497SS..Hα-helixtrans-62-42.8175.7-71.4168.3-156.500112S347 L348 M353 L354 S355S347-E351 PolarHBondContact O-N 2.99Å; L348-E351 PolarHBondContact O-N 2.98Å; E351-M353 VanDerWaalsContact C-N 3.33Å; E351-M353 PolarHBondContact O-N 2.99Å; E351-L354 PolarHBondContact O-N 3.38Å; E351-S355 WeakPolarHBondContact O-CB 3.45Å; E351-S355 PolarHBondContact O-N 3.18Å; E351-S355 PolarHBondContact O-OG 3.34Å
352L98.5Very high98.4Very high111 Ų111100.2 Ų100.258%0.58150%0.495SS*.Hα-helixtrans-62.9-41175.6-175.966.1000111.6L348 Y349 S355 S356L348-L352 WeakPolarHBondContact O-CB 3.31Å; L348-L352 PolarHBondContact O-N 3.4Å; Y349-L352 PolarHBondContact O-N 2.96Å; L352-S355 WeakPolarHBondContact CA-OG 3.28Å; L352-S355 PolarHBondContact O-OG 3.38Å; L352-S356 WeakPolarHBondContact O-CB 3.33Å; L352-S356 PolarHBondContact O-N 3.45Å
353M98.2Very high98.4Very high87 Ų87103.3 Ų103.343%0.42950%0.499SS..Hα-helixtrans-64.2-41.1177.2-74.7-59.9-58.300112.1Y349 K350 E351 G357Y349-M353 HydrophobicContact CD1-CG 4.26Å; Y349-M353 HydrophobicContact CD2-CG 4.43Å; Y349-M353 HydrophobicContact CE1-CG 3.8Å; Y349-M353 HydrophobicContact CE2-CG 3.99Å; Y349-M353 HydrophobicContact CE2-SD 4.14Å; Y349-M353 WeakPolarHBondContact O-CB 3.41Å; Y349-M353 VanDerWaalsContact O-CG 3.28Å; Y349-M353 WeakPolarHBondContact O-CG 3.37Å; Y349-M353 PolarHBondContact O-N 2.88Å; K350-M353 PolarHBondContact O-N 3.01Å; E351-M353 VanDerWaalsContact C-N 3.33Å; E351-M353 PolarHBondContact O-N 2.99Å; M353-G357 PolarHBondContact O-N 3.19Å
354L98.5Very high98.3Very high133 Ų133103.2 Ų103.270%0.69650%0.495SS*.Hα-helixtrans-66.1-49.3176.4-70.1172.8000111.5K350 E351 S356 G357 Q358K350-L354 WeakPolarHBondContact O-CG 3.38Å; K350-L354 PolarHBondContact O-N 2.82Å; E351-L354 PolarHBondContact O-N 3.38Å; L354-S356 PolarHBondContact O-N 2.96Å; L354-G357 WeakPolarHBondContact O-CA 3.47Å; L354-G357 PolarHBondContact O-N 3.44Å; L354-G357 VanDerWaalsContact O-N 3.14Å; L354-Q358 PolarHBondContact O-N 3.1Å
355S98.2Very high98.3Very high60 Ų60102.3 Ų102.342%0.4250%0.499SS..Hα-helixtrans-64.2-38.2178.953.80000112.8E351 L352 Q358 L359E351-S355 WeakPolarHBondContact O-CB 3.45Å; E351-S355 PolarHBondContact O-N 3.18Å; E351-S355 PolarHBondContact O-OG 3.34Å; L352-S355 WeakPolarHBondContact CA-OG 3.28Å; L352-S355 PolarHBondContact O-OG 3.38Å; S355-Q358 PolarHBondContact O-N 2.98Å; S355-L359 WeakPolarHBondContact O-CB 3.38Å; S355-L359 PolarHBondContact O-N 3.45Å
356S97.7Very high98.3Very high52 Ų5297.9 Ų97.936%0.36449%0.491SS..Hα-helixtrans-65.6-38.3172.21800000112.1L352 L354 R360L352-S356 WeakPolarHBondContact O-CB 3.33Å; L352-S356 PolarHBondContact O-N 3.45Å; L354-S356 PolarHBondContact O-N 2.96Å; S356-R360 WeakPolarHBondContact O-CG 3.3Å; S356-R360 PolarHBondContact O-N 3.49Å; S356-R360 VanDerWaalsContact O-N 3.09Å
357G98.3Very high98.3Very high17 Ų1796 Ų9618%0.17548%0.484CS..Hα-helixtrans-57.8-53.2171.300000111.9M353 L354 L359 R360 E361M353-G357 PolarHBondContact O-N 3.19Å; L354-G357 WeakPolarHBondContact O-CA 3.47Å; L354-G357 PolarHBondContact O-N 3.44Å; L354-G357 VanDerWaalsContact O-N 3.14Å; G357-L359 VanDerWaalsContact C-N 3.33Å; G357-L359 PolarHBondContact O-N 3.17Å; G357-R360 WeakPolarHBondContact O-CB 3.31Å; G357-R360 PolarHBondContact O-N 3.35Å; G357-R360 VanDerWaalsContact O-N 3.11Å; G357-E361 PolarHBondContact O-N 2.87Å
358Q98.5Very high98.3Very high122 Ų12297.5 Ų97.557%0.5749%0.488SS*.Hα-helixtrans-60.8-40.3179.4-170.4177.45.800112.5L354 S355 R360 E361 N362L354-Q358 PolarHBondContact O-N 3.1Å; S355-Q358 PolarHBondContact O-N 2.98Å; Q358-R360 VanDerWaalsContact C-N 3.31Å; Q358-R360 PolarHBondContact O-N 3.29Å; Q358-E361 PolarHBondContact O-N 3.31Å; Q358-N362 PolarHBondContact O-N 2.94Å
359L98.2Very high98.3Very high121 Ų12199.1 Ų99.163%0.63449%0.494SS*.Hα-helixtrans-63.4-38176.1-175.662.9000112S355 G357 N362 H363S355-L359 WeakPolarHBondContact O-CB 3.38Å; S355-L359 PolarHBondContact O-N 3.45Å; G357-L359 VanDerWaalsContact C-N 3.33Å; G357-L359 PolarHBondContact O-N 3.17Å; L359-N362 PolarHBondContact O-N 3.23Å; L359-H363 WeakPolarHBondContact O-CB 3.44Å; L359-H363 PolarHBondContact O-N 2.96Å
360R98.4Very high98.3Very high143 Ų14397.4 Ų97.454%0.5449%0.494SS..Hα-helixtrans-64.9-44.7174.4-74.5-175.7-64.8-174.72.1111.5S356 G357 Q358 N362 H363 H364S356-R360 WeakPolarHBondContact O-CG 3.3Å; S356-R360 PolarHBondContact O-N 3.49Å; S356-R360 VanDerWaalsContact O-N 3.09Å; G357-R360 WeakPolarHBondContact O-CB 3.31Å; G357-R360 PolarHBondContact O-N 3.35Å; G357-R360 VanDerWaalsContact O-N 3.11Å; Q358-R360 VanDerWaalsContact C-N 3.31Å; Q358-R360 PolarHBondContact O-N 3.29Å; R360-N362 VanDerWaalsContact C-N 3.35Å; R360-N362 PolarHBondContact O-N 2.77Å; R360-H363 PolarHBondContact O-N 3.43Å; R360-H364 PolarHBondContact O-CD2 3.09Å; R360-H364 PolarHBondContact O-N 3.49Å
361E98.4Very high98.3Very high136 Ų13696.8 Ų96.864%0.63649%0.493SS*.Hα-helixtrans-59.4-45.4176.2-70.8175.4174.900111.5G357 Q358 H363 H364 L365G357-E361 PolarHBondContact O-N 2.87Å; Q358-E361 PolarHBondContact O-N 3.31Å; E361-H363 VanDerWaalsContact C-N 3.34Å; E361-H363 PolarHBondContact O-N 3Å; E361-H364 WeakPolarHBondContact O-CB 3.4Å; E361-H364 PolarHBondContact O-N 2.97Å; E361-L365 PolarHBondContact O-N 2.94Å
362N98.4Very high98.3Very high88 Ų8897.6 Ų97.647%0.47150%0.497SS..Hα-helixtrans-61-42.3175-71.7-15.1000112.3Q358 L359 R360 H364 L365 S366Q358-N362 PolarHBondContact O-N 2.94Å; L359-N362 PolarHBondContact O-N 3.23Å; R360-N362 VanDerWaalsContact C-N 3.35Å; R360-N362 PolarHBondContact O-N 2.77Å; N362-H364 VanDerWaalsContact C-N 3.35Å; N362-L365 PolarHBondContact O-N 3.4Å; N362-S366 WeakPolarHBondContact O-CB 3.44Å; N362-S366 PolarHBondContact O-N 3.37Å
363H97.9Very high98.3Very high122 Ų12297 Ų9757%0.56549%0.493SS*.Hα-helixtrans-63.4-41.3176178.8-81.9000111.6L359 R360 E361 S366 N367L359-H363 WeakPolarHBondContact O-CB 3.44Å; L359-H363 PolarHBondContact O-N 2.96Å; R360-H363 PolarHBondContact O-N 3.43Å; E361-H363 VanDerWaalsContact C-N 3.34Å; E361-H363 PolarHBondContact O-N 3Å; H363-S366 PolarHBondContact O-N 2.91Å; H363-N367 WeakPolarHBondContact O-CB 3.36Å; H363-N367 PolarHBondContact O-N 3.5Å
364H98.3Very high98.2Very high110 Ų11098.1 Ų98.151%0.50950%0.498SS..Hα-helixtrans-60.4-49.2174.1-76.3-62.9000111.3R360 E361 N362 S366 N367 D368R360-H364 PolarHBondContact O-CD2 3.09Å; R360-H364 PolarHBondContact O-N 3.49Å; E361-H364 WeakPolarHBondContact O-CB 3.4Å; E361-H364 PolarHBondContact O-N 2.97Å; N362-H364 VanDerWaalsContact C-N 3.35Å; H364-S366 VanDerWaalsContact C-N 3.33Å; H364-S366 PolarHBondContact O-N 3.26Å; H364-N367 WeakPolarHBondContact O-CB 3.36Å; H364-N367 PolarHBondContact O-N 3.3Å; H364-N367 VanDerWaalsContact O-N 3.15Å; H364-D368 VanDerWaalsContact O-CG 3.29Å; H364-D368 PolarHBondContact O-N 3.25Å
365L98.5Very high98.2Very high103 Ų10395.7 Ų95.754%0.53949%0.488SS..Hα-helixtrans-58.8-44.3177.9-174.769.9000112.1E361 N362 N367 D368 Q369E361-L365 PolarHBondContact O-N 2.94Å; N362-L365 PolarHBondContact O-N 3.4Å; L365-N367 VanDerWaalsContact C-N 3.34Å; L365-N367 PolarHBondContact O-N 2.64Å; L365-D368 PolarHBondContact O-N 2.89Å; L365-Q369 WeakPolarHBondContact O-CG 3.3Å; L365-Q369 PolarHBondContact O-N 3.33Å
366S97.8Very high98.2Very high57 Ų5799 Ų9940%0.39950%0.497SS..Hα-helixtrans-64.4-39177.4-179.40000112.1N362 H363 H364 Q369 L370N362-S366 WeakPolarHBondContact O-CB 3.44Å; N362-S366 PolarHBondContact O-N 3.37Å; H363-S366 PolarHBondContact O-N 2.91Å; H364-S366 VanDerWaalsContact C-N 3.33Å; H364-S366 PolarHBondContact O-N 3.26Å; S366-Q369 PolarHBondContact O-N 3.5Å; S366-L370 WeakPolarHBondContact O-CG 3.35Å; S366-L370 PolarHBondContact O-N 2.9Å
367N98.4Very high98.3Very high63 Ų6399.3 Ų99.334%0.33750%0.497SS..Hα-helixtrans-65.7-41175.7-168.714.7000111.6H363 H364 L365 Q369 L370 Q371H363-N367 WeakPolarHBondContact O-CB 3.36Å; H363-N367 PolarHBondContact O-N 3.5Å; H364-N367 WeakPolarHBondContact O-CB 3.36Å; H364-N367 PolarHBondContact O-N 3.3Å; H364-N367 VanDerWaalsContact O-N 3.15Å; L365-N367 VanDerWaalsContact C-N 3.34Å; L365-N367 PolarHBondContact O-N 2.64Å; N367-Q369 VanDerWaalsContact C-N 3.33Å; N367-Q369 PolarHBondContact O-N 3.36Å; N367-L370 PolarHBondContact O-N 3.4Å; N367-Q371 WeakPolarHBondContact O-CG 3.44Å; N367-Q371 PolarHBondContact O-N 2.85Å; N367-Q371 PolarHBondContact OD1-NE2 2.91Å
368D98.4Very high98.3Very high81 Ų81102.7 Ų102.743%0.43351%0.508SS..Hα-helixtrans-62.2-42176.3-66.3-13.9000111H364 L365 Q371 Q372H364-D368 VanDerWaalsContact O-CG 3.29Å; H364-D368 PolarHBondContact O-N 3.25Å; L365-D368 PolarHBondContact O-N 2.89Å; D368-Q371 PolarHBondContact O-N 3.44Å; D368-Q372 WeakPolarHBondContact O-CG 3.34Å; D368-Q372 PolarHBondContact O-N 2.92Å
369Q98.4Very high98.3Very high101 Ų101101.8 Ų101.847%0.47251%0.506SS..Hα-helixtrans-61.7-43.7173-71.5173.8-19.200112.2L365 S366 N367 Q371 Q372 L373L365-Q369 WeakPolarHBondContact O-CG 3.3Å; L365-Q369 PolarHBondContact O-N 3.33Å; S366-Q369 PolarHBondContact O-N 3.5Å; N367-Q369 VanDerWaalsContact C-N 3.33Å; N367-Q369 PolarHBondContact O-N 3.36Å; Q369-Q371 VanDerWaalsContact C-N 3.31Å; Q369-Q371 PolarHBondContact O-N 3.09Å; Q369-Q372 PolarHBondContact O-N 3.45Å; Q369-L373 WeakPolarHBondContact O-CG 3.4Å; Q369-L373 PolarHBondContact O-N 3.26Å
370L98.2Very high98.2Very high106 Ų10698.9 Ų98.956%0.55550%0.496SS*.Hα-helixtrans-63-38.8176.5-75171.7000111.9S366 N367 L373 H374S366-L370 WeakPolarHBondContact O-CG 3.35Å; S366-L370 PolarHBondContact O-N 2.9Å; N367-L370 PolarHBondContact O-N 3.4Å; L370-L373 PolarHBondContact O-N 3.48Å; L370-H374 VanDerWaalsContact O-CB 3.32Å; L370-H374 WeakPolarHBondContact O-CB 3.45Å; L370-H374 PolarHBondContact O-N 3.34Å
371Q98.1Very high98.2Very high107 Ų10798.8 Ų98.850%0.550%0.496SS..Hα-helixtrans-65.6-40.4175.5-72.8175.517.400111.8N367 D368 Q369 H374 T375N367-Q371 WeakPolarHBondContact O-CG 3.44Å; N367-Q371 PolarHBondContact O-N 2.85Å; N367-Q371 PolarHBondContact OD1-NE2 2.91Å; D368-Q371 PolarHBondContact O-N 3.44Å; Q369-Q371 VanDerWaalsContact C-N 3.31Å; Q369-Q371 PolarHBondContact O-N 3.09Å; Q371-H374 WeakPolarHBondContact O-CB 3.45Å; Q371-H374 PolarHBondContact O-N 3.03Å; Q371-T375 WeakPolarHBondContact O-CG2 3.25Å; Q371-T375 PolarHBondContact O-N 3.49Å; Q371-T375 PolarHBondContact O-OG1 2.89Å
372Q98.3Very high98.2Very high130 Ų13095.2 Ų95.261%0.60749%0.489SS*.Hα-helixtrans-61.5-47.7174.2-72.4174.4-9.600111.8D368 Q369 H374 T375 E376D368-Q372 WeakPolarHBondContact O-CG 3.34Å; D368-Q372 PolarHBondContact O-N 2.92Å; Q369-Q372 PolarHBondContact O-N 3.45Å; Q372-H374 VanDerWaalsContact C-N 3.26Å; Q372-H374 PolarHBondContact O-N 3.35Å; Q372-T375 PolarHBondContact O-N 3.22Å; Q372-T375 PolarHBondContact O-OG1 3.37Å; Q372-E376 PolarHBondContact O-N 2.88Å
373L98.3Very high98.1Very high98 Ų9898.9 Ų98.951%0.51350%0.497SS..Hα-helixtrans-62.8-36.7175.6-69.8173.7000111.6Q369 L370 E376 V377Q369-L373 WeakPolarHBondContact O-CG 3.4Å; Q369-L373 PolarHBondContact O-N 3.26Å; L370-L373 PolarHBondContact O-N 3.48Å; L373-E376 PolarHBondContact O-N 3.06Å; L373-V377 WeakPolarHBondContact O-CB 3.4Å; L373-V377 VanDerWaalsContact O-CG2 3.26Å; L373-V377 WeakPolarHBondContact O-CG2 3.45Å; L373-V377 PolarHBondContact O-N 3.24Å
374H98Very high98.1Very high111 Ų11197.4 Ų97.451%0.51449%0.49SS..Hα-helixtrans-61.9-46.5176.5-171.180000111.6L370 Q371 Q372 V377 Q378L370-H374 VanDerWaalsContact O-CB 3.32Å; L370-H374 WeakPolarHBondContact O-CB 3.45Å; L370-H374 PolarHBondContact O-N 3.34Å; Q371-H374 WeakPolarHBondContact O-CB 3.45Å; Q371-H374 PolarHBondContact O-N 3.03Å; Q372-H374 VanDerWaalsContact C-N 3.26Å; Q372-H374 PolarHBondContact O-N 3.35Å; H374-V377 PolarHBondContact O-N 3.46Å; H374-Q378 PolarHBondContact NE2-NE2 3.42Å; H374-Q378 VanDerWaalsContact O-CG 3.29Å; H374-Q378 WeakPolarHBondContact O-CG 3.27Å; H374-Q378 PolarHBondContact O-N 2.86Å
375T98.3Very high98.1Very high82 Ų8295.1 Ų95.150%0.50349%0.49SS..Hα-helixtrans-65.7-38.9178.4580000111.8Q371 Q372 Q378 L379Q371-T375 WeakPolarHBondContact O-CG2 3.25Å; Q371-T375 PolarHBondContact O-N 3.49Å; Q371-T375 PolarHBondContact O-OG1 2.89Å; Q372-T375 PolarHBondContact O-N 3.22Å; Q372-T375 PolarHBondContact O-OG1 3.37Å; T375-Q378 PolarHBondContact O-N 2.69Å; T375-L379 WeakPolarHBondContact O-CG 3.4Å; T375-L379 PolarHBondContact O-N 2.86Å
376E98.4Very high98.1Very high128 Ų12896.2 Ų96.260%0.59849%0.493SS*.Hα-helixtrans-62.3-43.5175.4-171.3174.7-173.800112.2Q372 L373 Q378 L379 S380Q372-E376 PolarHBondContact O-N 2.88Å; L373-E376 PolarHBondContact O-N 3.06Å; E376-Q378 VanDerWaalsContact C-N 3.32Å; E376-Q378 PolarHBondContact O-N 2.95Å; E376-L379 PolarHBondContact O-N 3.44Å; E376-S380 PolarHBondContact O-N 3.16Å
377V98.3Very high98.1Very high60 Ų6098.4 Ų98.436%0.36450%0.499SS..Hα-helixtrans-64.4-36.1175.2169.80000111.8L373 H374 S380 R381L373-V377 WeakPolarHBondContact O-CB 3.4Å; L373-V377 VanDerWaalsContact O-CG2 3.26Å; L373-V377 WeakPolarHBondContact O-CG2 3.45Å; L373-V377 PolarHBondContact O-N 3.24Å; H374-V377 PolarHBondContact O-N 3.46Å; V377-S380 WeakPolarHBondContact CA-OG 3.45Å; V377-S380 PolarHBondContact O-OG 2.94Å; V377-R381 WeakPolarHBondContact O-CB 3.47Å; V377-R381 VanDerWaalsContact O-CG 3.26Å; V377-R381 WeakPolarHBondContact O-CG 3.08Å; V377-R381 PolarHBondContact O-N 3.4Å
378Q98.2Very high98Very high88 Ų88103 Ų10341%0.41151%0.512SS..Hα-helixtrans-66.8-41.4174.9-68-66.5-8.500111.7H374 T375 E376 R381 A382H374-Q378 PolarHBondContact NE2-NE2 3.42Å; H374-Q378 VanDerWaalsContact O-CG 3.29Å; H374-Q378 WeakPolarHBondContact O-CG 3.27Å; H374-Q378 PolarHBondContact O-N 2.86Å; T375-Q378 PolarHBondContact O-N 2.69Å; E376-Q378 VanDerWaalsContact C-N 3.32Å; E376-Q378 PolarHBondContact O-N 2.95Å; Q378-R381 PolarHBondContact O-N 3.34Å; Q378-A382 PolarHBondContact O-N 3.21Å
379L98.3Very high98Very high102 Ų102100.8 Ų100.853%0.53451%0.508SS..Hα-helixtrans-64.2-41.7175.9-70.7173.1000111.9T375 E376 A382 R383T375-L379 WeakPolarHBondContact O-CG 3.4Å; T375-L379 PolarHBondContact O-N 2.86Å; E376-L379 PolarHBondContact O-N 3.44Å; L379-A382 PolarHBondContact O-N 3.38Å; L379-R383 WeakPolarHBondContact O-CG 3.25Å; L379-R383 PolarHBondContact O-N 3.17Å; L379-R383 VanDerWaalsContact O-N 3.09Å
380S96.9Very high98Very high60 Ų60100.6 Ų100.642%0.4251%0.507SS..Hα-helixtrans-65.1-40.9176.969.50000111.9E376 V377 A382 R383 E384E376-S380 PolarHBondContact O-N 3.16Å; V377-S380 WeakPolarHBondContact CA-OG 3.45Å; V377-S380 PolarHBondContact O-OG 2.94Å; S380-A382 PolarHBondContact O-N 2.93Å; S380-R383 PolarHBondContact O-N 3.03Å; S380-E384 WeakPolarHBondContact O-CB 3.19Å; S380-E384 PolarHBondContact O-N 2.94Å
381R98.1Very high98Very high142 Ų14299.2 Ų99.254%0.53650%0.503SS..Hα-helixtrans-62-40.9173.8-75.9174.5179.6175.30.8113V377 Q378 E384 A385V377-R381 WeakPolarHBondContact O-CB 3.47Å; V377-R381 VanDerWaalsContact O-CG 3.26Å; V377-R381 WeakPolarHBondContact O-CG 3.08Å; V377-R381 PolarHBondContact O-N 3.4Å; Q378-R381 PolarHBondContact O-N 3.34Å; R381-E384 PolarHBondContact O-N 3.46Å; R381-A385 WeakPolarHBondContact O-CB 3.37Å; R381-A385 PolarHBondContact O-N 3.46Å
382A97.9Very high98Very high60 Ų6097.7 Ų97.750%0.49650%0.501SS..Hα-helixtrans-62.8-45.917700000111.4Q378 L379 S380 E384 A385 E386Q378-A382 PolarHBondContact O-N 3.21Å; L379-A382 PolarHBondContact O-N 3.38Å; S380-A382 PolarHBondContact O-N 2.93Å; A382-E384 VanDerWaalsContact C-N 3.34Å; A382-E384 PolarHBondContact O-N 3.49Å; A382-A385 PolarHBondContact O-N 3.32Å; A382-E386 PolarHBondContact O-N 2.95Å
383R98.2Very high97.9Very high165 Ų16593.7 Ų93.762%0.62349%0.487SS*.Hα-helixtrans-62.2-41174.8-68.5172.3-175.41712.6112.1L379 S380 A385 E386 L387L379-R383 WeakPolarHBondContact O-CG 3.25Å; L379-R383 PolarHBondContact O-N 3.17Å; L379-R383 VanDerWaalsContact O-N 3.09Å; S380-R383 PolarHBondContact O-N 3.03Å; R383-A385 VanDerWaalsContact C-N 3.32Å; R383-A385 PolarHBondContact O-N 2.91Å; R383-E386 PolarHBondContact O-N 3.4Å; R383-L387 WeakPolarHBondContact O-CG 3.38Å; R383-L387 PolarHBondContact O-N 3.08Å
384E97.4Very high97.9Very high92 Ų9293.9 Ų93.943%0.4349%0.488SS..Hα-helixtrans-63-40.1176.6-166.8-170.1157.900111.5S380 R381 A382 R388S380-E384 WeakPolarHBondContact O-CB 3.19Å; S380-E384 PolarHBondContact O-N 2.94Å; R381-E384 PolarHBondContact O-N 3.46Å; A382-E384 VanDerWaalsContact C-N 3.34Å; A382-E384 PolarHBondContact O-N 3.49Å; E384-R388 WeakPolarHBondContact O-CB 3.46Å; E384-R388 WeakPolarHBondContact O-CG 3.34Å; E384-R388 PolarHBondContact O-N 3.27Å; E384-R388 IonicContact OE1-CZ 2.79Å; E384-R388 IonicContact OE1-NE 2.78Å; E384-R388 PolarHBondContact OE1-NE 2.9Å; E384-R388 IonicContact OE1-NH2 3.2Å; E384-R388 PolarHBondContact OE1-NH2 3.35Å
385A97.5Very high97.9Very high62 Ų6295.5 Ų95.551%0.51249%0.49SS..Hα-helixtrans-65.3-40.717600000112.4R381 A382 R383 R388 G389R381-A385 WeakPolarHBondContact O-CB 3.37Å; R381-A385 PolarHBondContact O-N 3.46Å; A382-A385 PolarHBondContact O-N 3.32Å; R383-A385 VanDerWaalsContact C-N 3.32Å; R383-A385 PolarHBondContact O-N 2.91Å; A385-R388 PolarHBondContact O-N 2.97Å; A385-G389 PolarHBondContact O-N 2.81Å
386E98Very high97.9Very high126 Ų12696.9 Ų96.959%0.58949%0.491SS*.Hα-helixtrans-60.1-52.4174.7-175.8174.6-159.700111.3A382 R383 R388 G389 E390A382-E386 PolarHBondContact O-N 2.95Å; R383-E386 PolarHBondContact O-N 3.4Å; E386-R388 VanDerWaalsContact C-N 3.31Å; E386-R388 PolarHBondContact O-N 3.28Å; E386-G389 WeakPolarHBondContact O-CA 3.45Å; E386-G389 PolarHBondContact O-N 2.92Å; E386-E390 PolarHBondContact O-N 3.48Å
387L97.7Very high97.8Very high103 Ų10395.8 Ų95.854%0.53949%0.485SS..Hα-helixtrans-60.1-39.4176.6-69.9173.4000112.3R383 G389 E390 V391R383-L387 WeakPolarHBondContact O-CG 3.38Å; R383-L387 PolarHBondContact O-N 3.08Å; L387-G389 VanDerWaalsContact C-N 3.29Å; L387-G389 PolarHBondContact O-N 3.29Å; L387-E390 PolarHBondContact O-N 3.08Å; L387-V391 VanDerWaalsContact O-CG2 3.29Å; L387-V391 WeakPolarHBondContact O-CG2 3.42Å; L387-V391 PolarHBondContact O-N 3Å
388R98.1Very high97.8Very high159 Ų15999 Ų9960%0.649%0.494SS*.Hα-helixtrans-62-38.8174-76.6172.7-178-78.21.2111.3E384 A385 E386 V391 T392E384-R388 WeakPolarHBondContact O-CB 3.46Å; E384-R388 WeakPolarHBondContact O-CG 3.34Å; E384-R388 PolarHBondContact O-N 3.27Å; E384-R388 IonicContact OE1-CZ 2.79Å; E384-R388 IonicContact OE1-NE 2.78Å; E384-R388 PolarHBondContact OE1-NE 2.9Å; E384-R388 IonicContact OE1-NH2 3.2Å; E384-R388 PolarHBondContact OE1-NH2 3.35Å; A385-R388 PolarHBondContact O-N 2.97Å; E386-R388 VanDerWaalsContact C-N 3.31Å; E386-R388 PolarHBondContact O-N 3.28Å; R388-V391 PolarHBondContact O-N 2.92Å; R388-T392 WeakPolarHBondContact O-CG2 3.45Å; R388-T392 PolarHBondContact O-N 3.4Å; R388-T392 PolarHBondContact O-OG1 3.4Å
389G97.9Very high97.7Very high34 Ų34100.2 Ų100.235%0.35150%0.5SS..Hα-helixtrans-60.6-49.6173.600000112.4A385 E386 L387 V391 T392 S393A385-G389 PolarHBondContact O-N 2.81Å; E386-G389 WeakPolarHBondContact O-CA 3.45Å; E386-G389 PolarHBondContact O-N 2.92Å; L387-G389 VanDerWaalsContact C-N 3.29Å; L387-G389 PolarHBondContact O-N 3.29Å; G389-V391 VanDerWaalsContact C-N 3.33Å; G389-V391 PolarHBondContact O-N 2.98Å; G389-T392 WeakPolarHBondContact CA-OG1 3.41Å; G389-T392 PolarHBondContact O-N 2.82Å; G389-T392 VanDerWaalsContact O-N 3.07Å; G389-T392 PolarHBondContact O-OG1 2.92Å; G389-S393 PolarHBondContact O-N 3.46Å
390E97.9Very high97.7Very high98 Ų98101.3 Ų101.346%0.45850%0.503SS..Hα-helixtrans-59.5-41.8175.9-66.7179.2173.200112.3E386 L387 T392 S393 L394E386-E390 PolarHBondContact O-N 3.48Å; L387-E390 PolarHBondContact O-N 3.08Å; E390-T392 VanDerWaalsContact C-N 3.26Å; E390-T392 PolarHBondContact O-N 3.5Å; E390-S393 PolarHBondContact O-N 2.89Å; E390-S393 PolarHBondContact O-OG 3.48Å; E390-L394 WeakPolarHBondContact O-CB 3.41Å; E390-L394 VanDerWaalsContact O-CG 3.31Å; E390-L394 WeakPolarHBondContact O-CG 3.47Å; E390-L394 PolarHBondContact O-N 2.9Å
391V97.8Very high97.7Very high77 Ų77103.7 Ų103.747%0.46751%0.51SS..Hα-helixtrans-62.9-36.1176.1169.50000111.1L387 R388 G389 R395L387-V391 VanDerWaalsContact O-CG2 3.29Å; L387-V391 WeakPolarHBondContact O-CG2 3.42Å; L387-V391 PolarHBondContact O-N 3Å; R388-V391 PolarHBondContact O-N 2.92Å; G389-V391 VanDerWaalsContact C-N 3.33Å; G389-V391 PolarHBondContact O-N 2.98Å; V391-R395 VanDerWaalsContact O-CB 3.29Å; V391-R395 WeakPolarHBondContact O-CB 3.43Å; V391-R395 PolarHBondContact O-N 3.38Å; V391-R395 VanDerWaalsContact O-N 3.08Å
392T97.9Very high97.7Very high74 Ų74101.6 Ų101.645%0.45451%0.506SS..Hα-helixtrans-69.6-40.9175.253.80000112.9R388 G389 E390 R395 Q396R388-T392 WeakPolarHBondContact O-CG2 3.45Å; R388-T392 PolarHBondContact O-N 3.4Å; R388-T392 PolarHBondContact O-OG1 3.4Å; G389-T392 WeakPolarHBondContact CA-OG1 3.41Å; G389-T392 PolarHBondContact O-N 2.82Å; G389-T392 VanDerWaalsContact O-N 3.07Å; G389-T392 PolarHBondContact O-OG1 2.92Å; E390-T392 VanDerWaalsContact C-N 3.26Å; E390-T392 PolarHBondContact O-N 3.5Å; T392-R395 PolarHBondContact O-N 3.21Å; T392-Q396 WeakPolarHBondContact O-CG 3.4Å; T392-Q396 PolarHBondContact O-N 3.49Å
393S97.6Very high97.7Very high46 Ų46106.3 Ų106.332%0.32251%0.513SS..Hα-helixtrans-66.9-45.5177.464.10000111.6G389 E390 R395 Q396 E397G389-S393 PolarHBondContact O-N 3.46Å; E390-S393 PolarHBondContact O-N 2.89Å; E390-S393 PolarHBondContact O-OG 3.48Å; S393-R395 PolarHBondContact O-N 3.11Å; S393-Q396 WeakPolarHBondContact O-CA 3.29Å; S393-Q396 WeakPolarHBondContact O-CB 3.48Å; S393-Q396 PolarHBondContact O-N 3.23Å; S393-E397 PolarHBondContact O-N 3.33Å
394L97.7Very high97.6Very high102 Ų102102.1 Ų102.153%0.53450%0.503SS..Hα-helixtrans-60.3-35.5175-71.7173.4000112.2E390 K398E390-L394 WeakPolarHBondContact O-CB 3.41Å; E390-L394 VanDerWaalsContact O-CG 3.31Å; E390-L394 WeakPolarHBondContact O-CG 3.47Å; E390-L394 PolarHBondContact O-N 2.9Å; L394-K398 VanDerWaalsContact O-CB 3.31Å; L394-K398 WeakPolarHBondContact O-CB 3.33Å; L394-K398 PolarHBondContact O-N 2.87Å
395R97.6Very high97.6Very high145 Ų145102.1 Ų102.155%0.54750%0.504SS..Hα-helixtrans-66.6-38.1174.3-177.7178-80118.8-5.6111.6V391 T392 S393 Q399V391-R395 VanDerWaalsContact O-CB 3.29Å; V391-R395 WeakPolarHBondContact O-CB 3.43Å; V391-R395 PolarHBondContact O-N 3.38Å; V391-R395 VanDerWaalsContact O-N 3.08Å; T392-R395 PolarHBondContact O-N 3.21Å; S393-R395 PolarHBondContact O-N 3.11Å; R395-Q399 WeakPolarHBondContact O-CG 3.45Å; R395-Q399 PolarHBondContact O-N 2.94Å; R395-Q399 VanDerWaalsContact O-N 3.13Å
396Q97.8Very high97.6Very high112 Ų112102.1 Ų102.152%0.52350%0.5SS..Hα-helixtrans-67-49.5175.5-71.6170.3-15.700111.2T392 S393 K398 Q399 E400T392-Q396 WeakPolarHBondContact O-CG 3.4Å; T392-Q396 PolarHBondContact O-N 3.49Å; S393-Q396 WeakPolarHBondContact O-CA 3.29Å; S393-Q396 WeakPolarHBondContact O-CB 3.48Å; S393-Q396 PolarHBondContact O-N 3.23Å; Q396-K398 VanDerWaalsContact C-N 3.27Å; Q396-K398 PolarHBondContact O-N 2.92Å; Q396-Q399 WeakPolarHBondContact O-CA 3.4Å; Q396-Q399 WeakPolarHBondContact O-CB 3.49Å; Q396-Q399 PolarHBondContact O-N 3.44Å; Q396-E400 PolarHBondContact O-N 3.34Å
397E97.4Very high97.6Very high104 Ų10499.6 Ų99.649%0.48649%0.49SS..Hα-helixtrans-56.3-42.3175.7-71175.7-171.300111.5S393 Q399 E400 L401S393-E397 PolarHBondContact O-N 3.33Å; E397-Q399 VanDerWaalsContact C-N 3.33Å; E397-Q399 PolarHBondContact O-N 3.02Å; E397-E400 PolarHBondContact O-N 3.42Å; E397-L401 WeakPolarHBondContact O-CB 3.47Å; E397-L401 VanDerWaalsContact O-CG 3.3Å; E397-L401 WeakPolarHBondContact O-CG 3.38Å; E397-L401 PolarHBondContact O-N 3.48Å
398K97.2Very high97.5Very high127 Ų12799.5 Ų99.555%0.55249%0.49SS*.Hα-helixtrans-58.7-44173.8179.2-178174.3179.70111.8L394 Q396 Q402L394-K398 VanDerWaalsContact O-CB 3.31Å; L394-K398 WeakPolarHBondContact O-CB 3.33Å; L394-K398 PolarHBondContact O-N 2.87Å; Q396-K398 VanDerWaalsContact C-N 3.27Å; Q396-K398 PolarHBondContact O-N 2.92Å; K398-Q402 WeakPolarHBondContact O-CB 3.31Å; K398-Q402 VanDerWaalsContact O-CG 3.23Å; K398-Q402 WeakPolarHBondContact O-CG 3.3Å; K398-Q402 PolarHBondContact O-N 3.2Å
399Q97.5Very high97.4Very high115 Ų11597.2 Ų97.254%0.53749%0.486SS..Hα-helixtrans-65.8-40.8178.7-74.5173.9-17.400111.7R395 Q396 E397 Q402 Y403R395-Q399 WeakPolarHBondContact O-CG 3.45Å; R395-Q399 PolarHBondContact O-N 2.94Å; R395-Q399 VanDerWaalsContact O-N 3.13Å; Q396-Q399 WeakPolarHBondContact O-CA 3.4Å; Q396-Q399 WeakPolarHBondContact O-CB 3.49Å; Q396-Q399 PolarHBondContact O-N 3.44Å; E397-Q399 VanDerWaalsContact C-N 3.33Å; E397-Q399 PolarHBondContact O-N 3.02Å; Q399-Q402 WeakPolarHBondContact O-CB 3.49Å; Q399-Q402 PolarHBondContact O-N 2.96Å; Q399-Y403 PolarHBondContact O-N 3.45Å
400E97.8Very high97.3Very high124 Ų124101.9 Ų101.958%0.57950%0.498SS*.Hα-helixtrans-63.4-45.2175.6-70.3176.4-175.700111.8Q396 E397 Q402 Y403 N404Q396-E400 PolarHBondContact O-N 3.34Å; E397-E400 PolarHBondContact O-N 3.42Å; E400-Q402 VanDerWaalsContact C-N 3.32Å; E400-Q402 PolarHBondContact O-N 3.06Å; E400-Y403 WeakPolarHBondContact O-CB 3.4Å; E400-Y403 PolarHBondContact O-N 2.68Å; E400-N404 VanDerWaalsContact O-CG 3.29Å; E400-N404 PolarHBondContact O-N 3.22Å; E400-N404 PolarHBondContact O-ND2 3.29Å
401L97.2Very high97.2Very high110 Ų110101.3 Ų101.358%0.57650%0.498SS*.Hα-helixtrans-61.8-40.7174.7-71.4174.2000111.7E397 N404 I405E397-L401 WeakPolarHBondContact O-CB 3.47Å; E397-L401 VanDerWaalsContact O-CG 3.3Å; E397-L401 WeakPolarHBondContact O-CG 3.38Å; E397-L401 PolarHBondContact O-N 3.48Å; L401-N404 PolarHBondContact O-N 2.9Å; L401-I405 VanDerWaalsContact O-CG1 3.29Å; L401-I405 WeakPolarHBondContact O-CG1 3.31Å; L401-I405 PolarHBondContact O-N 3.15Å
402Q97.3Very high97Very high98 Ų98101.2 Ų101.246%0.45850%0.496SS..Hα-helixtrans-61.2-44.1174.4-77.8178-28.300111.9K398 Q399 E400 I405 C406K398-Q402 WeakPolarHBondContact O-CB 3.31Å; K398-Q402 VanDerWaalsContact O-CG 3.23Å; K398-Q402 WeakPolarHBondContact O-CG 3.3Å; K398-Q402 PolarHBondContact O-N 3.2Å; Q399-Q402 WeakPolarHBondContact O-CB 3.49Å; Q399-Q402 PolarHBondContact O-N 2.96Å; E400-Q402 VanDerWaalsContact C-N 3.32Å; E400-Q402 PolarHBondContact O-N 3.06Å; Q402-I405 PolarHBondContact O-N 2.89Å; Q402-C406 PolarHBondContact O-N 3.1Å; Q402-C406 VanDerWaalsContact O-N 3.12Å; Q402-C406 PolarHBondContact O-SG 2.92Å
403Y97.6Very high96.9Very high160 Ų160101.9 Ų101.963%0.62749%0.494SS*.Hα-helixtrans-60.2-45175175.9-95.8000111.9Q399 E400 I405 C406 L407Q399-Y403 PolarHBondContact O-N 3.45Å; E400-Y403 WeakPolarHBondContact O-CB 3.4Å; E400-Y403 PolarHBondContact O-N 2.68Å; Y403-I405 VanDerWaalsContact C-N 3.34Å; Y403-I405 PolarHBondContact O-N 2.92Å; Y403-C406 PolarHBondContact O-N 2.9Å; Y403-L407 PolarHBondContact O-N 3.16Å; Y403-L407 VanDerWaalsContact O-N 3.08Å
404N97.8Very high96.7Very high77 Ų77102.4 Ų102.441%0.41250%0.501SS..Hα-helixtrans-63.3-37.9177.5-69-28.5000112.5E400 L401 L407 L408E400-N404 VanDerWaalsContact O-CG 3.29Å; E400-N404 PolarHBondContact O-N 3.22Å; E400-N404 PolarHBondContact O-ND2 3.29Å; L401-N404 PolarHBondContact O-N 2.9Å; N404-L407 PolarHBondContact O-N 3.34Å; N404-L408 WeakPolarHBondContact O-CB 3.42Å; N404-L408 WeakPolarHBondContact O-CG 3.33Å; N404-L408 PolarHBondContact O-N 2.9Å
405I97.4Very high96.5Very high91 Ų91102 Ų10247%0.46750%0.498SS..Hα-helixtrans-60.7-48.2174.5-71.2165000110L401 Q402 Y403 L407 L408 E409L401-I405 VanDerWaalsContact O-CG1 3.29Å; L401-I405 WeakPolarHBondContact O-CG1 3.31Å; L401-I405 PolarHBondContact O-N 3.15Å; Q402-I405 PolarHBondContact O-N 2.89Å; Y403-I405 VanDerWaalsContact C-N 3.34Å; Y403-I405 PolarHBondContact O-N 2.92Å; I405-L407 VanDerWaalsContact C-N 3.34Å; I405-L407 PolarHBondContact O-N 3.46Å; I405-L408 PolarHBondContact O-N 3.34Å; I405-E409 HydrophobicContact CG2-CG 4.22Å; I405-E409 WeakPolarHBondContact CG2-OE1 3.47Å; I405-E409 WeakPolarHBondContact O-CB 3.44Å; I405-E409 VanDerWaalsContact O-CG 3.3Å; I405-E409 WeakPolarHBondContact O-CG 3.48Å; I405-E409 PolarHBondContact O-N 3.38Å
406C97.4Very high96.3Very high63 Ų63101.1 Ų101.143%0.42650%0.495SS..Hα-helixtrans-59.1-44.1178.8-67.20000112.2Q402 Y403 L408 E409 E410Q402-C406 PolarHBondContact O-N 3.1Å; Q402-C406 VanDerWaalsContact O-N 3.12Å; Q402-C406 PolarHBondContact O-SG 2.92Å; Y403-C406 PolarHBondContact O-N 2.9Å; C406-L408 PolarHBondContact O-N 3.39Å; C406-E409 WeakPolarHBondContact O-CB 3.48Å; C406-E409 PolarHBondContact O-N 2.94Å; C406-E410 WeakPolarHBondContact O-CG 3.47Å; C406-E410 PolarHBondContact O-N 3.45Å
407L97.2Very high95.9Very high72 Ų7299.7 Ų99.738%0.37749%0.491SS..Hα-helixtrans-62-44.7177.3-175.467.3000111.9Y403 N404 I405 E409 E410 D411Y403-L407 PolarHBondContact O-N 3.16Å; Y403-L407 VanDerWaalsContact O-N 3.08Å; N404-L407 PolarHBondContact O-N 3.34Å; I405-L407 VanDerWaalsContact C-N 3.34Å; I405-L407 PolarHBondContact O-N 3.46Å; L407-E409 VanDerWaalsContact C-N 3.31Å; L407-E409 PolarHBondContact O-N 2.98Å; L407-E410 WeakPolarHBondContact O-CB 3.37Å; L407-E410 PolarHBondContact O-N 3.12Å; L407-D411 PolarHBondContact O-N 3Å
408L96.1Very high95.6Very high101 Ų101100.1 Ų100.153%0.52949%0.493SS..Hα-helixtrans-65.6-34.7176.5-72.2172.9000112.2N404 I405 C406 N412N404-L408 WeakPolarHBondContact O-CB 3.42Å; N404-L408 WeakPolarHBondContact O-CG 3.33Å; N404-L408 PolarHBondContact O-N 2.9Å; I405-L408 PolarHBondContact O-N 3.34Å; C406-L408 PolarHBondContact O-N 3.39Å; L408-N412 VanDerWaalsContact O-CB 3.27Å; L408-N412 WeakPolarHBondContact O-CB 3.44Å; L408-N412 PolarHBondContact O-N 3.28Å; L408-N412 PolarHBondContact O-ND2 3.32Å
409E96.1Very high95.1Very high112 Ų11298.7 Ų98.752%0.52349%0.491SS..Hα-helixtrans-63.9-42.3174.2-76172.4168.300111.3I405 C406 L407 Q413I405-E409 HydrophobicContact CG2-CG 4.22Å; I405-E409 WeakPolarHBondContact CG2-OE1 3.47Å; I405-E409 WeakPolarHBondContact O-CB 3.44Å; I405-E409 VanDerWaalsContact O-CG 3.3Å; I405-E409 WeakPolarHBondContact O-CG 3.48Å; I405-E409 PolarHBondContact O-N 3.38Å; C406-E409 WeakPolarHBondContact O-CB 3.48Å; C406-E409 PolarHBondContact O-N 2.94Å; L407-E409 VanDerWaalsContact C-N 3.31Å; L407-E409 PolarHBondContact O-N 2.98Å; E409-Q413 WeakPolarHBondContact O-CB 3.39Å; E409-Q413 PolarHBondContact O-N 3.06Å
410E95.8Very high94.5Very high131 Ų13197.5 Ų97.561%0.61249%0.485SS*.Hα-helixtrans-62-50173.9-71.5173.3-175.800111.7C406 L407 N412 Q413 A414C406-E410 WeakPolarHBondContact O-CG 3.47Å; C406-E410 PolarHBondContact O-N 3.45Å; L407-E410 WeakPolarHBondContact O-CB 3.37Å; L407-E410 PolarHBondContact O-N 3.12Å; E410-N412 PolarHBondContact O-N 2.89Å; E410-Q413 WeakPolarHBondContact O-CB 3.34Å; E410-Q413 PolarHBondContact O-N 3.42Å; E410-Q413 VanDerWaalsContact O-N 3.09Å; E410-A414 PolarHBondContact O-N 3.16Å
411D95.4Very high93.8Very high86 Ų8697 Ų9746%0.4649%0.487SS..Hα-helixtrans-59.7-44.7177.2-76.3-18.6000111.6L407 Q413 A414 L415L407-D411 PolarHBondContact O-N 3Å; D411-Q413 VanDerWaalsContact C-N 3.26Å; D411-Q413 PolarHBondContact O-N 2.93Å; D411-A414 PolarHBondContact O-N 3.19Å; D411-L415 WeakPolarHBondContact O-CG 3.4Å; D411-L415 PolarHBondContact O-N 3.47Å
412N94.2Very high93Very high76 Ų7697.8 Ų97.841%0.40649%0.49SS..Hα-helixtrans-63-34.8175.9-86.4-71.2000112.1L408 E410 R416L408-N412 VanDerWaalsContact O-CB 3.27Å; L408-N412 WeakPolarHBondContact O-CB 3.44Å; L408-N412 PolarHBondContact O-N 3.28Å; L408-N412 PolarHBondContact O-ND2 3.32Å; E410-N412 PolarHBondContact O-N 2.89Å; N412-R416 WeakPolarHBondContact O-CG 3.15Å; N412-R416 PolarHBondContact O-N 3.2Å
413Q94.7Very high92Very high88 Ų88100.6 Ų100.641%0.41150%0.497SS..Hα-helixtrans-69.3-44.6176.3-169.259.227.200111.1E409 E410 D411 L415 R416 D417E409-Q413 WeakPolarHBondContact O-CB 3.39Å; E409-Q413 PolarHBondContact O-N 3.06Å; E410-Q413 WeakPolarHBondContact O-CB 3.34Å; E410-Q413 PolarHBondContact O-N 3.42Å; E410-Q413 VanDerWaalsContact O-N 3.09Å; D411-Q413 VanDerWaalsContact C-N 3.26Å; D411-Q413 PolarHBondContact O-N 2.93Å; Q413-L415 VanDerWaalsContact C-N 3.31Å; Q413-L415 PolarHBondContact O-N 2.86Å; Q413-R416 WeakPolarHBondContact O-CB 3.43Å; Q413-R416 PolarHBondContact O-N 3.42Å; Q413-R416 VanDerWaalsContact O-N 3.12Å; Q413-D417 PolarHBondContact NE2-OD1 3Å; Q413-D417 VanDerWaalsContact O-CG 3.27Å; Q413-D417 PolarHBondContact O-N 2.95Å
414A93.8Very high90.5Very high57 Ų5798 Ų9847%0.47149%0.494SS..Hα-helixtrans-58.4-42.7174.700000112.1E410 D411 D417 E418E410-A414 PolarHBondContact O-N 3.16Å; D411-A414 PolarHBondContact O-N 3.19Å; A414-D417 PolarHBondContact O-N 3.3Å; A414-E418 WeakPolarHBondContact O-CB 3.35Å; A414-E418 PolarHBondContact O-N 2.71Å
415L93.1Very high88.7Confident93 Ų9397.9 Ų97.949%0.48751%0.51SS..Hα-helixtrans-64-39.7174.6-72.6172.4000112.5D411 Q413 D417 E418 I419D411-L415 WeakPolarHBondContact O-CG 3.4Å; D411-L415 PolarHBondContact O-N 3.47Å; Q413-L415 VanDerWaalsContact C-N 3.31Å; Q413-L415 PolarHBondContact O-N 2.86Å; L415-D417 VanDerWaalsContact C-N 3.33Å; L415-E418 PolarHBondContact O-N 3.47Å; L415-I419 VanDerWaalsContact O-CG1 3.28Å; L415-I419 WeakPolarHBondContact O-CG1 3.45Å; L415-I419 PolarHBondContact O-N 3.34Å
416R92.9Very high86.7Confident126 Ų12696.2 Ų96.248%0.47552%0.516SS..Hα-helixtrans-61.8-43.5174.2-81.6-175.1-80.8-87.82.9111.2N412 Q413 E418 I419 Q420N412-R416 WeakPolarHBondContact O-CG 3.15Å; N412-R416 PolarHBondContact O-N 3.2Å; Q413-R416 WeakPolarHBondContact O-CB 3.43Å; Q413-R416 PolarHBondContact O-N 3.42Å; Q413-R416 VanDerWaalsContact O-N 3.12Å; R416-E418 VanDerWaalsContact C-N 3.35Å; R416-I419 PolarHBondContact O-N 2.86Å; R416-Q420 WeakPolarHBondContact O-CB 3.41Å; R416-Q420 PolarHBondContact O-N 3.33Å
417D91.3Very high84.1Confident82 Ų8298.3 Ų98.344%0.43952%0.523SS..Hα-helixtrans-66-38.1177.9-63.5-17.6000111.1Q413 A414 L415 Q420 N421Q413-D417 PolarHBondContact NE2-OD1 3Å; Q413-D417 VanDerWaalsContact O-CG 3.27Å; Q413-D417 PolarHBondContact O-N 2.95Å; A414-D417 PolarHBondContact O-N 3.3Å; L415-D417 VanDerWaalsContact C-N 3.33Å; D417-Q420 PolarHBondContact O-N 2.88Å; D417-N421 WeakPolarHBondContact O-CB 3.38Å; D417-N421 PolarHBondContact O-N 3.11Å; D417-N421 PolarHBondContact O-ND2 2.92Å; D417-N421 VanDerWaalsContact O-ND2 3.12Å
418E89.7Confident81.6Confident113 Ų113104.7 Ų104.753%0.52855%0.551SS.*Hα-helixtrans-64.6-45.8173.6-171.3175.9-168.400112.2A414 L415 R416 Q420 N421 L422A414-E418 WeakPolarHBondContact O-CB 3.35Å; A414-E418 PolarHBondContact O-N 2.71Å; L415-E418 PolarHBondContact O-N 3.47Å; R416-E418 VanDerWaalsContact C-N 3.35Å; E418-Q420 VanDerWaalsContact C-N 3.29Å; E418-Q420 PolarHBondContact O-N 3.03Å; E418-N421 PolarHBondContact O-N 3.09Å; E418-L422 HydrophobicContact CG-CD1 4.37Å; E418-L422 WeakPolarHBondContact O-CB 3.28Å; E418-L422 VanDerWaalsContact O-CG 3.31Å; E418-L422 WeakPolarHBondContact O-CG 3.5Å; E418-L422 PolarHBondContact O-N 3.39Å
419I86.6Confident79.1Confident98 Ų98103 Ų10350%0.50356%0.558SS.*Hα-helixtrans-60.1-41.4174.2-69.5166.6000110.8L415 R416 L422 R423L415-I419 VanDerWaalsContact O-CG1 3.28Å; L415-I419 WeakPolarHBondContact O-CG1 3.45Å; L415-I419 PolarHBondContact O-N 3.34Å; R416-I419 PolarHBondContact O-N 2.86Å; I419-L422 PolarHBondContact O-N 2.9Å; I419-R423 WeakPolarHBondContact O-CB 3.47Å; I419-R423 PolarHBondContact O-N 3.42Å
420Q85.1Confident76.3Confident89 Ų89106.1 Ų106.142%0.41657%0.572SS.*Hα-helixtrans-65.3-44.4177.6-174.459.830.600111.2R416 D417 E418 L422 R423 D424R416-Q420 WeakPolarHBondContact O-CB 3.41Å; R416-Q420 PolarHBondContact O-N 3.33Å; D417-Q420 PolarHBondContact O-N 2.88Å; E418-Q420 VanDerWaalsContact C-N 3.29Å; E418-Q420 PolarHBondContact O-N 3.03Å; Q420-L422 VanDerWaalsContact C-N 3.35Å; Q420-L422 PolarHBondContact O-N 3.44Å; Q420-R423 CarbonylContact O-C 3.59Å; Q420-R423 WeakPolarHBondContact O-CB 3.44Å; Q420-R423 PolarHBondContact O-N 2.9Å; Q420-R423 VanDerWaalsContact O-N 3.16Å; Q420-D424 VanDerWaalsContact NE2-CG 3.31Å; Q420-D424 PolarHBondContact NE2-OD1 3.46Å; Q420-D424 PolarHBondContact NE2-OD2 2.92Å; Q420-D424 WeakPolarHBondContact O-CB 3.37Å; Q420-D424 VanDerWaalsContact O-CG 3.3Å; Q420-D424 PolarHBondContact O-N 2.95Å
421N82.8Confident73.5Confident115 Ų115105 Ų10562%0.61558%0.579SS**Hα-helixtrans-61.9-39.9174.8-72.3-33.4000112.6D417 E418 R423 D424 G425D417-N421 WeakPolarHBondContact O-CB 3.38Å; D417-N421 PolarHBondContact O-N 3.11Å; D417-N421 PolarHBondContact O-ND2 2.92Å; D417-N421 VanDerWaalsContact O-ND2 3.12Å; E418-N421 PolarHBondContact O-N 3.09Å; N421-R423 VanDerWaalsContact C-N 3.33Å; N421-D424 PolarHBondContact O-N 2.92Å; N421-G425 PolarHBondContact O-N 3.49Å
422L81.2Confident70.6Confident125 Ų125110.1 Ų110.165%0.65460%0.597SS**Hα-helixtrans-66.9-34.2175.1-71.2173000112.1E418 I419 Q420 G426E418-L422 HydrophobicContact CG-CD1 4.37Å; E418-L422 WeakPolarHBondContact O-CB 3.28Å; E418-L422 VanDerWaalsContact O-CG 3.31Å; E418-L422 WeakPolarHBondContact O-CG 3.5Å; E418-L422 PolarHBondContact O-N 3.39Å; I419-L422 PolarHBondContact O-N 2.9Å; Q420-L422 VanDerWaalsContact C-N 3.35Å; Q420-L422 PolarHBondContact O-N 3.44Å; L422-G426 PolarHBondContact O-N 3.46Å
423R76Confident67.9Low157 Ų157115 Ų11559%0.59262%0.615SS**Hα-helixtrans-71.5-41.8173.9-177-178.9-64.4-87.2-2.1111.9I419 Q420 N421 G425 G426 D427I419-R423 WeakPolarHBondContact O-CB 3.47Å; I419-R423 PolarHBondContact O-N 3.42Å; Q420-R423 CarbonylContact O-C 3.59Å; Q420-R423 WeakPolarHBondContact O-CB 3.44Å; Q420-R423 PolarHBondContact O-N 2.9Å; Q420-R423 VanDerWaalsContact O-N 3.16Å; N421-R423 VanDerWaalsContact C-N 3.33Å; R423-G425 VanDerWaalsContact C-N 3.31Å; R423-G425 PolarHBondContact O-N 3.33Å; R423-G426 CarbonylContact O-C 3.58Å; R423-G426 WeakPolarHBondContact O-CA 3.31Å; R423-G426 PolarHBondContact O-N 3.21Å; R423-D427 PolarHBondContact O-N 3.14Å
424D66.6Low65.2Low107 Ų107117 Ų11757%0.57263%0.634SS**Hα-helixtrans-73.2-25178.5-68.8-21.5000112Q420 N421 G426Q420-D424 VanDerWaalsContact NE2-CG 3.31Å; Q420-D424 PolarHBondContact NE2-OD1 3.46Å; Q420-D424 PolarHBondContact NE2-OD2 2.92Å; Q420-D424 WeakPolarHBondContact O-CB 3.37Å; Q420-D424 VanDerWaalsContact O-CG 3.3Å; Q420-D424 PolarHBondContact O-N 2.95Å; N421-D424 PolarHBondContact O-N 2.92Å; D424-G426 VanDerWaalsContact C-N 3.27Å
425G59.9Low62.8Low73 Ų73118.4 Ų118.475%0.75364%0.638SS**THydrogen-bonded Turntrans-79.1-6.616600000114.3N421 R423N421-G425 PolarHBondContact O-N 3.49Å; R423-G425 VanDerWaalsContact C-N 3.31Å; R423-G425 PolarHBondContact O-N 3.33Å
426G54.8Low59.8Low56 Ų56121.3 Ų121.358%0.57765%0.649SS**SBendtrans-13756.5-175.300000112.2L422 R423 D424L422-G426 PolarHBondContact O-N 3.46Å; R423-G426 CarbonylContact O-C 3.58Å; R423-G426 WeakPolarHBondContact O-CA 3.31Å; R423-G426 PolarHBondContact O-N 3.21Å; D424-G426 VanDerWaalsContact C-N 3.27Å
427D44.1Very low57Low108 Ų108123.5 Ų123.558%0.57866%0.657SS**  trans-137.588.6162.6-156.618.9000110.8R423 G429 Q430R423-D427 PolarHBondContact O-N 3.14Å; D427-G429 WeakPolarHBondContact OD1-CA 3.48Å; D427-G429 PolarHBondContact OD1-N 2.86Å; D427-Q430 PolarHBondContact OD1-N 3.01Å
428E43.1Very low54.2Low206 Ų206127.7 Ų127.796%0.96368%0.679SS**SBend-98.8101.9125.2-80-148168.500108.1
429G43.9Very low51.4Low66 Ų66129.9 Ų129.968%0.6869%0.689SS**SBendtrans99.796.9160.700000115D427D427-G429 WeakPolarHBondContact OD1-CA 3.48Å; D427-G429 PolarHBondContact OD1-N 2.86Å
430Q38Very low48.8Very low176 Ų176131 Ų13182%0.82271%0.706SS**  159.2117.382.6-170.7159.252.800110D427D427-Q430 PolarHBondContact OD1-N 3.01Å
431S37.3Very low46.2Very low109 Ų109130.3 Ų130.376%0.76272%0.722SS**  trans-66.2136.717373.70000111.4
432F34.8Very low44.1Very low192 Ų192132.6 Ų132.684%0.84273%0.734SS**  trans-139.1114.9152.6-143.9-95.5000111.1V434F432-V434 HydrophobicContact CD1-CG2 4.29Å
433F37.4Very low42Very low178 Ų178133 Ų13378%0.78174%0.742SS**  trans-80.4135.4175-143.4-110.9000108.4P435F433-P435 HydrophobicContact CD1-CB 4.49Å; F433-P435 HydrophobicContact CD1-CG 3.56Å; F433-P435 HydrophobicContact CE1-CB 4.39Å; F433-P435 HydrophobicContact CE1-CG 3.77Å
434V37Very low39.8Very low131 Ų131133.6 Ų133.679%0.79475%0.751SS**  trans-128.4106.9163.7178.70000109F432F432-V434 HydrophobicContact CD1-CG2 4.29Å
435P43Very low38.6Very low86 Ų86134.6 Ų134.656%0.55876%0.764SS**  trans-123.4116.7161.936.5-23.4000111.3F433F433-P435 HydrophobicContact CD1-CB 4.49Å; F433-P435 HydrophobicContact CD1-CG 3.56Å; F433-P435 HydrophobicContact CE1-CB 4.39Å; F433-P435 HydrophobicContact CE1-CG 3.77Å
436E30.4Very low37.5Very low155 Ų155140.8 Ų140.872%0.72477%0.77SS**  trans179.3147159.3-131.4152.6-175.700109
437R33.3Very low37.3Very low171 Ų171142.9 Ų142.965%0.64577%0.773SS**  cis171.4146.2-12.2171.7-163.7-69.9-123.45104.5
438L33.2Very low37.5Very low171 Ų171140.3 Ų140.390%0.89576%0.761SS**  trans-171.7113.1131.7-99.6162.8000110.7
439E31.6Very low37.9Very low159 Ų159136.7 Ų136.774%0.74375%0.753SS**  trans-66.1141.7165.1-62.3167.7133.300110.9
440S30.8Very low38.2Very low122 Ų122144.2 Ų144.285%0.85376%0.761SS**  trans-166120135.563.40000105.3
441G31.4Very low39Very low74 Ų74144 Ų14476%0.76375%0.753SS**  117.195.175.700000107V443G441-V443 PolarHBondContact O-N 3.03Å
442D37.7Very low39.8Very low162 Ų162142.8 Ų142.887%0.86674%0.737SS**  trans-50.2119.7171.3-170.114.8000111.7
443V38Very low41.1Very low135 Ų135136.7 Ų136.782%0.81872%0.719SS**  trans-149.7115.8157.7-176.80000110.5G441G441-V443 PolarHBondContact O-N 3.03Å
444E30.6Very low42.6Very low168 Ų168133.9 Ų133.979%0.78571%0.708SS**  trans-46.7143.7165.6-167.7179.3-177.300114.4
445P41.3Very low44.3Very low128 Ų128131 Ų13183%0.83169%0.691SS**  trans-83.8123.2-172.133-33.3000112.5
446K35.9Very low45.8Very low204 Ų204132.6 Ų132.689%0.88769%0.69SS**  trans-107.1136.8170.4-160.6163.1-173.2171.60110.7
447P49.6Very low48.1Very low99 Ų99131.7 Ų131.764%0.64369%0.686SS**  trans-88.1156.9-150.434.5-35.7000115.2
448T49Very low50.3Low54 Ų54129 Ų12933%0.33168%0.681SS.*  trans-10.1113151.449.20000117R451T448-R451 HydrophobicContact CG2-CB 3.93Å
449V51.1Low52.6Low130 Ų130125.5 Ų125.579%0.78866%0.663SS**SBendtrans-112.9-10.6158.7174.70000111.4
450R51.7Low55.1Low225 Ų225126.5 Ų126.585%0.84966%0.66SS**THydrogen-bonded Turntrans-100.1-17-178.3-148.8179.2-168.3169.43.4114.5S453R450-S453 PolarHBondContact O-OG 2.89Å
451R54.8Low57.9Low172 Ų172126 Ų12665%0.64965%0.647SS**THydrogen-bonded Turntrans-85.4-33.2176.9-142.6176.5-78.3138.2-5.2110.3T448 Q454 V455T448-R451 HydrophobicContact CG2-CB 3.93Å; R451-Q454 PolarHBondContact O-N 3.38Å; R451-V455 VanDerWaalsContact O-CG2 3.24Å; R451-V455 WeakPolarHBondContact O-CG2 3.36Å; R451-V455 PolarHBondContact O-N 3.26Å; R451-V455 VanDerWaalsContact O-N 3.09Å
452D53.6Low60.6Low82 Ų82126 Ų12644%0.43963%0.633SS.*Hα-helixtrans-68.5-36.9-179-61.55.3000112.1Q454 V455 E456D452-Q454 PolarHBondContact O-N 2.92Å; D452-V455 PolarHBondContact O-N 2.84Å; D452-E456 WeakPolarHBondContact O-CB 3.42Å; D452-E456 VanDerWaalsContact O-CG 3.29Å; D452-E456 WeakPolarHBondContact O-CG 3.47Å; D452-E456 PolarHBondContact O-N 2.94Å
453S62.4Low63Low64 Ų64124 Ų12445%0.44862%0.618SS.*Hα-helixtrans-67.1-34.2177.360.20000113.8R450 E457R450-S453 PolarHBondContact O-OG 2.89Å; S453-E457 PolarHBondContact O-N 3.49Å
454Q67.3Low65.6Low120 Ų120123.5 Ų123.556%0.56161%0.607SS**Hα-helixtrans-76.1-38.8177.1-173.2175.92.100111.1R451 D452 E457 E458R451-Q454 PolarHBondContact O-N 3.38Å; D452-Q454 PolarHBondContact O-N 2.92Å; Q454-E457 PolarHBondContact O-N 3.37Å; Q454-E458 PolarHBondContact O-N 2.86Å
455V73.8Confident68.4Low71 Ų71122.7 Ų122.743%0.4360%0.6SS.*Hα-helixtrans-66.9-36.6174.9172.50000111.1R451 D452 L459R451-V455 VanDerWaalsContact O-CG2 3.24Å; R451-V455 WeakPolarHBondContact O-CG2 3.36Å; R451-V455 PolarHBondContact O-N 3.26Å; R451-V455 VanDerWaalsContact O-N 3.09Å; D452-V455 PolarHBondContact O-N 2.84Å; V455-L459 HydrophobicContact CG1-CD1 3.86Å; V455-L459 VanDerWaalsContact O-CB 3.28Å; V455-L459 WeakPolarHBondContact O-CB 3.44Å; V455-L459 WeakPolarHBondContact O-CD1 3.43Å; V455-L459 WeakPolarHBondContact O-CG 3.46Å; V455-L459 PolarHBondContact O-N 2.93Å
456E73.6Confident70.6Confident118 Ų118122.3 Ų122.355%0.55159%0.591SS**Hα-helixtrans-64.6-37.6173.8-81.6178.8-179.600112.9D452 L459 R460D452-E456 WeakPolarHBondContact O-CB 3.42Å; D452-E456 VanDerWaalsContact O-CG 3.29Å; D452-E456 WeakPolarHBondContact O-CG 3.47Å; D452-E456 PolarHBondContact O-N 2.94Å; E456-L459 PolarHBondContact O-N 3.2Å; E456-R460 WeakPolarHBondContact O-CG 3.43Å; E456-R460 PolarHBondContact O-N 2.92Å
457E79.8Confident73.1Confident137 Ų137117.2 Ų117.264%0.6457%0.57SS**Hα-helixtrans-73.1-39.7178.6-157166.2-153.200111.7S453 Q454 R460 L461S453-E457 PolarHBondContact O-N 3.49Å; Q454-E457 PolarHBondContact O-N 3.37Å; E457-R460 PolarHBondContact O-N 3.38Å; E457-L461 PolarHBondContact O-N 3.37Å
458E80.2Confident75.1Confident114 Ų114117.1 Ų117.153%0.53356%0.564SS.*Hα-helixtrans-64.8-37.7170.5-75-178.5-179.300112.4Q454 L461 T462Q454-E458 PolarHBondContact O-N 2.86Å; E458-L461 PolarHBondContact O-N 3.15Å; E458-T462 WeakPolarHBondContact O-CB 3.39Å; E458-T462 VanDerWaalsContact O-CG2 3.28Å; E458-T462 WeakPolarHBondContact O-CG2 3.34Å; E458-T462 PolarHBondContact O-N 3.43Å; E458-T462 PolarHBondContact O-OG1 2.93Å
459L81Confident77.1Confident98 Ų98119.5 Ų119.551%0.51357%0.569SS.*Hα-helixtrans-63.7-39.8173.3-87.6159.5000111.9V455 E456 T462 Q463V455-L459 HydrophobicContact CG1-CD1 3.86Å; V455-L459 VanDerWaalsContact O-CB 3.28Å; V455-L459 WeakPolarHBondContact O-CB 3.44Å; V455-L459 WeakPolarHBondContact O-CD1 3.43Å; V455-L459 WeakPolarHBondContact O-CG 3.46Å; V455-L459 PolarHBondContact O-N 2.93Å; E456-L459 PolarHBondContact O-N 3.2Å; L459-T462 VanDerWaalsContact CA-OG1 3.31Å; L459-T462 WeakPolarHBondContact CA-OG1 3.5Å; L459-T462 PolarHBondContact O-OG1 3.39Å; L459-Q463 VanDerWaalsContact O-CB 3.23Å; L459-Q463 WeakPolarHBondContact O-CB 3.32Å; L459-Q463 PolarHBondContact O-N 3.45Å
460R83.4Confident79Confident179 Ų179119 Ų11968%0.67556%0.558SS**Hα-helixtrans-66.3-46.5176-76.5179.8178.7-178.22.8112.3E456 E457 T462 Q463 E464E456-R460 WeakPolarHBondContact O-CG 3.43Å; E456-R460 PolarHBondContact O-N 2.92Å; E457-R460 PolarHBondContact O-N 3.38Å; R460-T462 VanDerWaalsContact C-N 3.34Å; R460-T462 PolarHBondContact O-N 3.23Å; R460-Q463 PolarHBondContact O-N 3.48Å; R460-E464 WeakPolarHBondContact O-CG 3.31Å; R460-E464 PolarHBondContact O-N 2.98Å
461L90.3Very high81Confident112 Ų112114.8 Ų114.859%0.58655%0.546SS*.Hα-helixtrans-61.3-41.5176.6-98.7155.8000112.4E457 E458 K465E457-L461 PolarHBondContact O-N 3.37Å; E458-L461 PolarHBondContact O-N 3.15Å; L461-K465 WeakPolarHBondContact O-CB 3.35Å; L461-K465 PolarHBondContact O-N 3.27Å
462T86.8Confident82.9Confident75 Ų75110.1 Ų110.146%0.4653%0.532SS..Hα-helixtrans-67.6-38175.550.50000111.5E458 L459 R460 K465 L466E458-T462 WeakPolarHBondContact O-CB 3.39Å; E458-T462 VanDerWaalsContact O-CG2 3.28Å; E458-T462 WeakPolarHBondContact O-CG2 3.34Å; E458-T462 PolarHBondContact O-N 3.43Å; E458-T462 PolarHBondContact O-OG1 2.93Å; L459-T462 VanDerWaalsContact CA-OG1 3.31Å; L459-T462 WeakPolarHBondContact CA-OG1 3.5Å; L459-T462 PolarHBondContact O-OG1 3.39Å; R460-T462 VanDerWaalsContact C-N 3.34Å; R460-T462 PolarHBondContact O-N 3.23Å; T462-K465 PolarHBondContact O-N 3.47Å; T462-L466 WeakPolarHBondContact O-CB 3.29Å; T462-L466 VanDerWaalsContact O-CG 3.26Å; T462-L466 WeakPolarHBondContact O-CG 3.45Å; T462-L466 PolarHBondContact O-N 3.3Å
463Q88.9Confident84.4Confident118 Ų118110 Ų11055%0.55154%0.536SS*.Hα-helixtrans-66.4-41.3176.2-172.8150.9-12.400112.8L459 R460 L466 Q467L459-Q463 VanDerWaalsContact O-CB 3.23Å; L459-Q463 WeakPolarHBondContact O-CB 3.32Å; L459-Q463 PolarHBondContact O-N 3.45Å; R460-Q463 PolarHBondContact O-N 3.48Å; Q463-L466 PolarHBondContact O-N 3.29Å; Q463-Q467 WeakPolarHBondContact O-CG 3.41Å; Q463-Q467 PolarHBondContact O-N 3.28Å
464E91.9Very high85.8Confident126 Ų126112.4 Ų112.459%0.58954%0.541SS*.Hα-helixtrans-63.1-41173.4-72.8178.2-179.600111.9R460 L466 Q467 L468R460-E464 WeakPolarHBondContact O-CG 3.31Å; R460-E464 PolarHBondContact O-N 2.98Å; E464-L466 VanDerWaalsContact C-N 3.35Å; E464-Q467 PolarHBondContact O-N 2.85Å; E464-L468 PolarHBondContact O-N 3.33Å
465K91.2Very high87Confident150 Ų150112.5 Ų112.565%0.65254%0.541SS*.Hα-helixtrans-65.4-38.2175.9-170.5176.5-177.8179.20112.1L461 T462 L468 K469L461-K465 WeakPolarHBondContact O-CB 3.35Å; L461-K465 PolarHBondContact O-N 3.27Å; T462-K465 PolarHBondContact O-N 3.47Å; K465-L468 PolarHBondContact O-N 2.91Å; K465-K469 WeakPolarHBondContact O-CB 3.48Å; K465-K469 VanDerWaalsContact O-CG 3.29Å; K465-K469 WeakPolarHBondContact O-CG 3.5Å; K465-K469 PolarHBondContact O-N 3.02Å
466L86.8Confident87.9Confident120 Ų120113.7 Ų113.763%0.62855%0.545SS*.Hα-helixtrans-66.2-42.4174.5-73.6174000111.4T462 Q463 E464 L468 K469 E470T462-L466 WeakPolarHBondContact O-CB 3.29Å; T462-L466 VanDerWaalsContact O-CG 3.26Å; T462-L466 WeakPolarHBondContact O-CG 3.45Å; T462-L466 PolarHBondContact O-N 3.3Å; Q463-L466 PolarHBondContact O-N 3.29Å; E464-L466 VanDerWaalsContact C-N 3.35Å; L466-L468 VanDerWaalsContact C-N 3.32Å; L466-L468 PolarHBondContact O-N 2.87Å; L466-K469 CarbonylContact O-C 3.47Å; L466-K469 PolarHBondContact O-N 3.46Å; L466-E470 WeakPolarHBondContact O-CB 3.38Å; L466-E470 PolarHBondContact O-N 2.85Å
467Q88.1Confident88.8Confident97 Ų97113.5 Ų113.545%0.45354%0.544SS..Hα-helixtrans-63.6-36.1175.4-74.9-178.1-4.900112.8Q463 E464 E470 K471Q463-Q467 WeakPolarHBondContact O-CG 3.41Å; Q463-Q467 PolarHBondContact O-N 3.28Å; E464-Q467 PolarHBondContact O-N 2.85Å; Q467-E470 PolarHBondContact O-N 3.31Å; Q467-K471 WeakPolarHBondContact O-CG 3.32Å; Q467-K471 PolarHBondContact O-N 3Å; Q467-K471 VanDerWaalsContact O-N 3.09Å
468L92.4Very high89.4Confident98 Ų98111.3 Ų111.351%0.51354%0.54SS..Hα-helixtrans-68.8-40.9175.3-165.8147.5000111E464 K465 L466 E470 K471 E472E464-L468 PolarHBondContact O-N 3.33Å; K465-L468 PolarHBondContact O-N 2.91Å; L466-L468 VanDerWaalsContact C-N 3.32Å; L466-L468 PolarHBondContact O-N 2.87Å; L468-E470 VanDerWaalsContact C-N 3.33Å; L468-K471 PolarHBondContact O-N 3.22Å; L468-E472 HydrophobicContact CD2-CG 4.22Å; L468-E472 WeakPolarHBondContact CD2-OE1 3.46Å; L468-E472 WeakPolarHBondContact O-CG 3.33Å; L468-E472 PolarHBondContact O-N 3.46Å
469K89.6Confident90Very high103 Ų103111 Ų11145%0.44854%0.538SS..Hα-helixtrans-64.8-36.3173.6-72.8-75.4162.8-157.10112.6K465 L466 E472 C473K465-K469 WeakPolarHBondContact O-CB 3.48Å; K465-K469 VanDerWaalsContact O-CG 3.29Å; K465-K469 WeakPolarHBondContact O-CG 3.5Å; K465-K469 PolarHBondContact O-N 3.02Å; L466-K469 CarbonylContact O-C 3.47Å; L466-K469 PolarHBondContact O-N 3.46Å; K469-E472 WeakPolarHBondContact CD-OE2 3.49Å; K469-E472 WeakPolarHBondContact CE-OE2 3.41Å; K469-E472 IonicContact NZ-OE1 3.77Å; K469-E472 IonicContact NZ-OE2 3.82Å; K469-E472 PolarHBondContact NZ-OE2 3.46Å; K469-E472 PolarHBondContact O-N 2.92Å; K469-C473 WeakPolarHBondContact O-CB 3.04Å; K469-C473 PolarHBondContact O-N 3.43Å; K469-C473 PolarHBondContact O-SG 2.84Å; K469-C473 VanDerWaalsContact O-SG 3.32Å
470E92.2Very high90.6Very high119 Ų119112.3 Ų112.356%0.55655%0.545SS*.Hα-helixtrans-62-44.4174.3-172.2171.2-158.200110.9L466 Q467 L468 C473 E474L466-E470 WeakPolarHBondContact O-CB 3.38Å; L466-E470 PolarHBondContact O-N 2.85Å; Q467-E470 PolarHBondContact O-N 3.31Å; L468-E470 VanDerWaalsContact C-N 3.33Å; E470-C473 WeakPolarHBondContact O-CB 3.44Å; E470-C473 PolarHBondContact O-N 3.36Å; E470-E474 WeakPolarHBondContact O-CG 3.35Å; E470-E474 PolarHBondContact O-N 2.66Å
471K93.1Very high91Very high138 Ų138108.6 Ų108.660%0.654%0.535SS*.Hα-helixtrans-64-42.1174-70.8175-178.4177.10113.4Q467 L468 C473 E474 E475Q467-K471 WeakPolarHBondContact O-CG 3.32Å; Q467-K471 PolarHBondContact O-N 3Å; Q467-K471 VanDerWaalsContact O-N 3.09Å; L468-K471 PolarHBondContact O-N 3.22Å; K471-C473 VanDerWaalsContact C-N 3.28Å; K471-C473 PolarHBondContact O-N 3.03Å; K471-E474 PolarHBondContact O-N 2.91Å; K471-E475 WeakPolarHBondContact O-CB 3.41Å; K471-E475 PolarHBondContact O-N 2.94Å
472E93.8Very high91.1Very high74 Ų74105.6 Ų105.635%0.34653%0.527SS..Hα-helixtrans-61.3-39.5173.8-73.3176.5-176.800111L468 K469 E475 L476L468-E472 HydrophobicContact CD2-CG 4.22Å; L468-E472 WeakPolarHBondContact CD2-OE1 3.46Å; L468-E472 WeakPolarHBondContact O-CG 3.33Å; L468-E472 PolarHBondContact O-N 3.46Å; K469-E472 WeakPolarHBondContact CD-OE2 3.49Å; K469-E472 WeakPolarHBondContact CE-OE2 3.41Å; K469-E472 IonicContact NZ-OE1 3.77Å; K469-E472 IonicContact NZ-OE2 3.82Å; K469-E472 PolarHBondContact NZ-OE2 3.46Å; K469-E472 PolarHBondContact O-N 2.92Å; E472-E475 PolarHBondContact O-N 2.92Å; E472-L476 WeakPolarHBondContact O-CB 3.26Å; E472-L476 VanDerWaalsContact O-CG 3.25Å; E472-L476 WeakPolarHBondContact O-CG 3.26Å; E472-L476 PolarHBondContact O-N 3.4Å
473C85.9Confident91.2Very high78 Ų78107 Ų10753%0.52753%0.529SS..Hα-helixtrans-66-41175.2-75.70000112.3K469 E470 K471 Q477K469-C473 WeakPolarHBondContact O-CB 3.04Å; K469-C473 PolarHBondContact O-N 3.43Å; K469-C473 PolarHBondContact O-SG 2.84Å; K469-C473 VanDerWaalsContact O-SG 3.32Å; E470-C473 WeakPolarHBondContact O-CB 3.44Å; E470-C473 PolarHBondContact O-N 3.36Å; K471-C473 VanDerWaalsContact C-N 3.28Å; K471-C473 PolarHBondContact O-N 3.03Å; C473-Q477 VanDerWaalsContact O-CB 3.24Å; C473-Q477 WeakPolarHBondContact O-CB 3.44Å; C473-Q477 PolarHBondContact O-N 3.45Å
474E92.2Very high91.4Very high116 Ų116106.2 Ų106.254%0.54253%0.526SS..Hα-helixtrans-62.5-44.3174-72.9179167.700111.5E470 K471 Q477 T478E470-E474 WeakPolarHBondContact O-CG 3.35Å; E470-E474 PolarHBondContact O-N 2.66Å; K471-E474 PolarHBondContact O-N 2.91Å; E474-Q477 WeakPolarHBondContact O-CB 3.46Å; E474-Q477 PolarHBondContact O-N 2.63Å; E474-T478 WeakPolarHBondContact O-CG2 3.44Å; E474-T478 PolarHBondContact O-N 3.39Å
475E92.6Very high91.5Very high121 Ų121106.9 Ų106.957%0.56553%0.529SS*.Hα-helixtrans-61.9-50.1177-174.1170.4-161.600111.1K471 E472 Q477 T478 E479K471-E475 WeakPolarHBondContact O-CB 3.41Å; K471-E475 PolarHBondContact O-N 2.94Å; E472-E475 PolarHBondContact O-N 2.92Å; E475-Q477 PolarHBondContact O-N 3.38Å; E475-T478 PolarHBondContact O-N 2.95Å; E475-T478 PolarHBondContact O-OG1 3.25Å; E475-E479 PolarHBondContact O-N 2.94Å
476L92.8Very high91.5Very high97 Ų97105.8 Ų105.851%0.50853%0.526SS..Hα-helixtrans-59.3-35.7175.2-74.1170.7000112.4E472 E479 L480E472-L476 WeakPolarHBondContact O-CB 3.26Å; E472-L476 VanDerWaalsContact O-CG 3.25Å; E472-L476 WeakPolarHBondContact O-CG 3.26Å; E472-L476 PolarHBondContact O-N 3.4Å; L476-E479 PolarHBondContact O-N 2.97Å; L476-L480 WeakPolarHBondContact O-CB 3.46Å; L476-L480 WeakPolarHBondContact O-CG 3.47Å; L476-L480 PolarHBondContact O-N 3.27Å
477Q92.4Very high91.6Very high113 Ų113103.6 Ų103.653%0.52852%0.52SS..Hα-helixtrans-67.3-38.1175.9-171.3173.2-800111.3C473 E474 E475 H481C473-Q477 VanDerWaalsContact O-CB 3.24Å; C473-Q477 WeakPolarHBondContact O-CB 3.44Å; C473-Q477 PolarHBondContact O-N 3.45Å; E474-Q477 WeakPolarHBondContact O-CB 3.46Å; E474-Q477 PolarHBondContact O-N 2.63Å; E475-Q477 PolarHBondContact O-N 3.38Å; Q477-H481 PolarHBondContact O-CD2 2.97Å; Q477-H481 PolarHBondContact O-N 3.49Å
478T91.3Very high91.9Very high92 Ų92104 Ų10456%0.56452%0.522SS*.Hα-helixtrans-68.6-38.6173.863.60000112.8E474 E475 H481 A482E474-T478 WeakPolarHBondContact O-CG2 3.44Å; E474-T478 PolarHBondContact O-N 3.39Å; E475-T478 PolarHBondContact O-N 2.95Å; E475-T478 PolarHBondContact O-OG1 3.25Å; T478-H481 PolarHBondContact O-N 3.37Å; T478-A482 WeakPolarHBondContact O-CB 3.37Å; T478-A482 PolarHBondContact O-N 3.47Å
479E94.3Very high91.9Very high107 Ų107102.5 Ų102.550%0.552%0.519SS..Hα-helixtrans-64.7-41174.5-70.9-171.1163.100111.8E475 L476 A482 M483E475-E479 PolarHBondContact O-N 2.94Å; L476-E479 PolarHBondContact O-N 2.97Å; E479-A482 PolarHBondContact O-N 3.36Å; E479-M483 WeakPolarHBondContact O-CB 3.43Å; E479-M483 WeakPolarHBondContact O-CG 3.39Å; E479-M483 PolarHBondContact O-N 3.4Å
480L92.3Very high91.6Very high126 Ų126100.2 Ų100.266%0.6652%0.516SS*.Hα-helixtrans-60.7-45.1174-86.7170.5000111.8L476 M483 E484L476-L480 WeakPolarHBondContact O-CB 3.46Å; L476-L480 WeakPolarHBondContact O-CG 3.47Å; L476-L480 PolarHBondContact O-N 3.27Å; L480-M483 PolarHBondContact O-N 3.48Å; L480-E484 WeakPolarHBondContact O-CB 3.24Å; L480-E484 PolarHBondContact O-N 3.02Å
481H91.8Very high91.6Very high101 Ų101100.7 Ų100.747%0.46852%0.518SS..Hα-helixtrans-65.8-37.3176.3-77.5-51.1000112.8Q477 T478 E484 Q485Q477-H481 PolarHBondContact O-CD2 2.97Å; Q477-H481 PolarHBondContact O-N 3.49Å; T478-H481 PolarHBondContact O-N 3.37Å; H481-E484 IonicContact ND1-OE2 2.69Å; H481-E484 PolarHBondContact O-N 3.02Å; H481-Q485 WeakPolarHBondContact O-CG 3.47Å; H481-Q485 PolarHBondContact O-N 2.98Å
482A93Very high91.5Very high49 Ų4996.7 Ų96.741%0.40551%0.511SS..Hα-helixtrans-63.3-44.5173.300000111T478 E479 E484 Q485 E486T478-A482 WeakPolarHBondContact O-CB 3.37Å; T478-A482 PolarHBondContact O-N 3.47Å; E479-A482 PolarHBondContact O-N 3.36Å; A482-E484 VanDerWaalsContact C-N 3.34Å; A482-E484 PolarHBondContact O-N 3.26Å; A482-Q485 PolarHBondContact O-N 3.45Å; A482-E486 PolarHBondContact O-N 3.23Å
483M88.5Confident91.5Very high103 Ų103101.8 Ų101.851%0.50753%0.527SS..Hα-helixtrans-65.3-37.2177-78.1-88.256.200113.1E479 L480 E486 C487E479-M483 WeakPolarHBondContact O-CB 3.43Å; E479-M483 WeakPolarHBondContact O-CG 3.39Å; E479-M483 PolarHBondContact O-N 3.4Å; L480-M483 PolarHBondContact O-N 3.48Å; M483-E486 HydrophobicContact CE-CB 3.83Å; M483-E486 HydrophobicContact CE-CG 4.24Å; M483-E486 WeakPolarHBondContact CE-OE2 3.36Å; M483-E486 PolarHBondContact O-N 3Å; M483-C487 WeakPolarHBondContact O-CB 3.46Å; M483-C487 PolarHBondContact O-N 2.91Å
484E92.6Very high91.6Very high102 Ų102103.9 Ų103.948%0.47753%0.533SS..Hα-helixtrans-61.6-43.8173-174178.1-170.600111.3L480 H481 A482 C487 Q488L480-E484 WeakPolarHBondContact O-CB 3.24Å; L480-E484 PolarHBondContact O-N 3.02Å; H481-E484 IonicContact ND1-OE2 2.69Å; H481-E484 PolarHBondContact O-N 3.02Å; A482-E484 VanDerWaalsContact C-N 3.34Å; A482-E484 PolarHBondContact O-N 3.26Å; E484-C487 WeakPolarHBondContact O-CB 3.35Å; E484-C487 PolarHBondContact O-N 3.38Å; E484-Q488 WeakPolarHBondContact O-CG 3.39Å; E484-Q488 PolarHBondContact O-N 2.98Å
485Q94.4Very high91.5Very high141 Ų141101.3 Ų101.366%0.65953%0.527SS*.Hα-helixtrans-63.2-41.1175.5-77.3-173.5-9.700112.6H481 A482 C487 Q488 S489H481-Q485 WeakPolarHBondContact O-CG 3.47Å; H481-Q485 PolarHBondContact O-N 2.98Å; A482-Q485 PolarHBondContact O-N 3.45Å; Q485-C487 VanDerWaalsContact C-N 3.33Å; Q485-Q488 PolarHBondContact O-N 3.17Å; Q485-S489 VanDerWaalsContact O-CB 3.31Å; Q485-S489 WeakPolarHBondContact O-CB 3.29Å; Q485-S489 PolarHBondContact O-N 2.89Å
486E92Very high91.5Very high126 Ų126101 Ų10159%0.58953%0.526SS*.Hα-helixtrans-63.9-39.7174.8-71.9-169.6-177.300111.8A482 M483 S489 S490A482-E486 PolarHBondContact O-N 3.23Å; M483-E486 HydrophobicContact CE-CB 3.83Å; M483-E486 HydrophobicContact CE-CG 4.24Å; M483-E486 WeakPolarHBondContact CE-OE2 3.36Å; M483-E486 PolarHBondContact O-N 3Å; E486-S489 PolarHBondContact O-N 3.27Å; E486-S490 WeakPolarHBondContact O-CB 3.41Å; E486-S490 PolarHBondContact O-N 3.24Å
487C89Confident91.2Very high74 Ų7499.7 Ų99.750%0.552%0.524SS..Hα-helixtrans-62.2-48.4175.1-168.20000111M483 E484 Q485 S489 S490 Q491M483-C487 WeakPolarHBondContact O-CB 3.46Å; M483-C487 PolarHBondContact O-N 2.91Å; E484-C487 WeakPolarHBondContact O-CB 3.35Å; E484-C487 PolarHBondContact O-N 3.38Å; Q485-C487 VanDerWaalsContact C-N 3.33Å; C487-S489 VanDerWaalsContact C-N 3.34Å; C487-S489 PolarHBondContact O-N 3.02Å; C487-S490 PolarHBondContact O-N 3.28Å; C487-S490 PolarHBondContact O-OG 3.38Å; C487-Q491 WeakPolarHBondContact O-CB 3.41Å; C487-Q491 PolarHBondContact O-N 2.88Å
488Q93.8Very high91.1Very high107 Ų107102.3 Ų102.350%0.553%0.529SS..Hα-helixtrans-61.2-40.6176.5-70.4177.510.900112.1E484 Q485 Q491 A492E484-Q488 WeakPolarHBondContact O-CG 3.39Å; E484-Q488 PolarHBondContact O-N 2.98Å; Q485-Q488 PolarHBondContact O-N 3.17Å; Q488-Q491 PolarHBondContact O-N 2.91Å; Q488-A492 WeakPolarHBondContact O-CB 3.39Å; Q488-A492 PolarHBondContact O-N 3.34Å
489S91.8Very high91.1Very high65 Ų65101.4 Ų101.446%0.45552%0.521SS..Hα-helixtrans-62.9-43.9174.3178.40000111.9Q485 E486 C487 Q491 A492 R493Q485-S489 VanDerWaalsContact O-CB 3.31Å; Q485-S489 WeakPolarHBondContact O-CB 3.29Å; Q485-S489 PolarHBondContact O-N 2.89Å; E486-S489 PolarHBondContact O-N 3.27Å; C487-S489 VanDerWaalsContact C-N 3.34Å; C487-S489 PolarHBondContact O-N 3.02Å; S489-Q491 VanDerWaalsContact C-N 3.34Å; S489-Q491 PolarHBondContact O-N 3.44Å; S489-A492 PolarHBondContact O-N 3.06Å; S489-R493 WeakPolarHBondContact O-CG 3.19Å; S489-R493 PolarHBondContact O-N 2.93Å
490S84.1Confident91Very high55 Ų55101 Ų10139%0.38552%0.519SS..Hα-helixtrans-63.6-40.2175.880.70000111.7E486 C487 R493 L494E486-S490 WeakPolarHBondContact O-CB 3.41Å; E486-S490 PolarHBondContact O-N 3.24Å; C487-S490 PolarHBondContact O-N 3.28Å; C487-S490 PolarHBondContact O-OG 3.38Å; S490-R493 PolarHBondContact O-N 2.91Å; S490-L494 WeakPolarHBondContact O-CB 3.48Å; S490-L494 VanDerWaalsContact O-CG 3.31Å; S490-L494 WeakPolarHBondContact O-CG 3.41Å; S490-L494 PolarHBondContact O-N 3.03Å
491Q91.7Very high90.3Very high129 Ų129100.7 Ų100.760%0.60352%0.517SS*.Hα-helixtrans-65-41.2176-175176.3-2.300111.4C487 Q488 S489 L494 S495C487-Q491 WeakPolarHBondContact O-CB 3.41Å; C487-Q491 PolarHBondContact O-N 2.88Å; Q488-Q491 PolarHBondContact O-N 2.91Å; S489-Q491 VanDerWaalsContact C-N 3.34Å; S489-Q491 PolarHBondContact O-N 3.44Å; Q491-L494 PolarHBondContact O-N 2.97Å; Q491-S495 PolarHBondContact O-N 3.08Å
492A90.8Very high89.8Confident54 Ų54102.1 Ų102.145%0.44652%0.518SS..Hα-helixtrans-61.3-47.217400000111.3Q488 S489 L494 S495 Q496Q488-A492 WeakPolarHBondContact O-CB 3.39Å; Q488-A492 PolarHBondContact O-N 3.34Å; S489-A492 PolarHBondContact O-N 3.06Å; A492-L494 VanDerWaalsContact C-N 3.32Å; A492-L494 PolarHBondContact O-N 3.3Å; A492-S495 PolarHBondContact O-N 3.29Å; A492-S495 VanDerWaalsContact O-N 3.15Å; A492-S495 PolarHBondContact O-OG 3.06Å; A492-Q496 PolarHBondContact O-N 2.89Å
493R94.8Very high89.2Confident182 Ų182106.3 Ų106.369%0.68753%0.53SS*.Hα-helixtrans-61.3-38.7176.1-70.1175.867.6-171.60.9112.6S489 S490 Q496 C497S489-R493 WeakPolarHBondContact O-CG 3.19Å; S489-R493 PolarHBondContact O-N 2.93Å; S490-R493 PolarHBondContact O-N 2.91Å; R493-Q496 PolarHBondContact O-N 3.28Å; R493-C497 WeakPolarHBondContact O-CB 3.39Å; R493-C497 PolarHBondContact O-N 3.27Å
494L88.7Confident88.5Confident122 Ų122106.7 Ų106.764%0.63953%0.533SS*.Hα-helixtrans-66.6-39.5175-74.8172.3000111.9S490 Q491 A492 C497 R498S490-L494 WeakPolarHBondContact O-CB 3.48Å; S490-L494 VanDerWaalsContact O-CG 3.31Å; S490-L494 WeakPolarHBondContact O-CG 3.41Å; S490-L494 PolarHBondContact O-N 3.03Å; Q491-L494 PolarHBondContact O-N 2.97Å; A492-L494 VanDerWaalsContact C-N 3.32Å; A492-L494 PolarHBondContact O-N 3.3Å; L494-C497 PolarHBondContact O-N 3.13Å; L494-R498 VanDerWaalsContact O-CB 3.31Å; L494-R498 WeakPolarHBondContact O-CB 3.37Å; L494-R498 PolarHBondContact O-N 2.97Å
495S88.8Confident87.4Confident61 Ų61104.3 Ų104.343%0.42753%0.528SS..Hα-helixtrans-64.9-41.8175.274.60000111.9Q491 A492 R498 D499Q491-S495 PolarHBondContact O-N 3.08Å; A492-S495 PolarHBondContact O-N 3.29Å; A492-S495 VanDerWaalsContact O-N 3.15Å; A492-S495 PolarHBondContact O-OG 3.06Å; S495-R498 WeakPolarHBondContact O-CB 3.36Å; S495-R498 PolarHBondContact O-N 2.91Å; S495-D499 PolarHBondContact O-N 3.01Å
496Q92.4Very high85.8Confident115 Ų115103.4 Ų103.454%0.53752%0.523SS..Hα-helixtrans-61.1-49174-175.8-176.3-1200111.6A492 R493 R498 D499 E500A492-Q496 PolarHBondContact O-N 2.89Å; R493-Q496 PolarHBondContact O-N 3.28Å; Q496-R498 VanDerWaalsContact C-N 3.26Å; Q496-R498 PolarHBondContact O-N 3.33Å; Q496-D499 PolarHBondContact O-N 3.35Å; Q496-D499 VanDerWaalsContact O-N 3.11Å; Q496-E500 PolarHBondContact NE2-OE1 2.95Å; Q496-E500 VanDerWaalsContact NE2-OE1 3.16Å; Q496-E500 WeakPolarHBondContact O-CG 3.44Å; Q496-E500 PolarHBondContact O-N 3.4Å
497C86.4Confident84.1Confident69 Ų69107.2 Ų107.247%0.46653%0.532SS..Hα-helixtrans-59.7-38.5176.5-175.40000111.5R493 L494 E500 L501R493-C497 WeakPolarHBondContact O-CB 3.39Å; R493-C497 PolarHBondContact O-N 3.27Å; L494-C497 PolarHBondContact O-N 3.13Å; C497-E500 PolarHBondContact O-N 3.44Å; C497-L501 WeakPolarHBondContact O-CB 3.42Å; C497-L501 PolarHBondContact O-N 3.36Å
498R91.3Very high82.3Confident168 Ų168114.6 Ų114.663%0.63455%0.55SS*.Hα-helixtrans-63.8-40.4175.4-169.1-179.3-133.1160.24.5112.1L494 S495 Q496 L501 R502L494-R498 VanDerWaalsContact O-CB 3.31Å; L494-R498 WeakPolarHBondContact O-CB 3.37Å; L494-R498 PolarHBondContact O-N 2.97Å; S495-R498 WeakPolarHBondContact O-CB 3.36Å; S495-R498 PolarHBondContact O-N 2.91Å; Q496-R498 VanDerWaalsContact C-N 3.26Å; Q496-R498 PolarHBondContact O-N 3.33Å; R498-L501 WeakPolarHBondContact O-CB 3.25Å; R498-L501 PolarHBondContact O-N 2.97Å; R498-R502 WeakPolarHBondContact O-CG 3.4Å; R498-R502 PolarHBondContact O-N 3.34Å
499D90.4Very high80.1Confident74 Ų74119.1 Ų119.140%0.39656%0.562SS.*Hα-helixtrans-73.5-36178.9-72.1-23.4000112.3S495 Q496 L501 R502 Q503S495-D499 PolarHBondContact O-N 3.01Å; Q496-D499 PolarHBondContact O-N 3.35Å; Q496-D499 VanDerWaalsContact O-N 3.11Å; D499-L501 VanDerWaalsContact C-N 3.33Å; D499-L501 PolarHBondContact O-N 3.07Å; D499-R502 WeakPolarHBondContact O-CB 3.35Å; D499-R502 PolarHBondContact O-N 3.06Å; D499-R502 IonicContact OD1-CZ 2.87Å; D499-R502 IonicContact OD1-NH1 3.9Å; D499-R502 PolarHBondContact OD1-NH1 3.09Å; D499-Q503 WeakPolarHBondContact O-CG 3.44Å; D499-Q503 PolarHBondContact O-N 3.32Å
500E91.7Very high77.8Confident98 Ų98125.9 Ų125.946%0.45858%0.578SS.*Hα-helixtrans-60.9-43168.8-72.3175.5-167.800111.2Q496 C497 R502 Q503 L504Q496-E500 PolarHBondContact NE2-OE1 2.95Å; Q496-E500 VanDerWaalsContact NE2-OE1 3.16Å; Q496-E500 WeakPolarHBondContact O-CG 3.44Å; Q496-E500 PolarHBondContact O-N 3.4Å; C497-E500 PolarHBondContact O-N 3.44Å; E500-R502 VanDerWaalsContact C-N 3.32Å; E500-R502 PolarHBondContact O-N 2.92Å; E500-Q503 PolarHBondContact O-N 2.89Å; E500-L504 WeakPolarHBondContact O-CG 3.47Å; E500-L504 PolarHBondContact O-N 3.28Å
501L78.6Confident75.9Confident119 Ų119128.7 Ų128.762%0.62360%0.595SS**Hα-helixtrans-62.2-40.1174.9-139.284.5000111.6C497 R498 D499 L504 S505C497-L501 WeakPolarHBondContact O-CB 3.42Å; C497-L501 PolarHBondContact O-N 3.36Å; R498-L501 WeakPolarHBondContact O-CB 3.25Å; R498-L501 PolarHBondContact O-N 2.97Å; D499-L501 VanDerWaalsContact C-N 3.33Å; D499-L501 PolarHBondContact O-N 3.07Å; L501-L504 PolarHBondContact O-N 3.45Å; L501-S505 WeakPolarHBondContact O-CB 3.47Å; L501-S505 PolarHBondContact O-N 2.98Å
502R80.3Confident73.8Confident131 Ų131130.4 Ų130.449%0.49460%0.604SS.*Hα-helixtrans-63.4-44.3174.6-75.1170.2178.5167.7-7.1111R498 D499 E500 L504 S505 H506R498-R502 WeakPolarHBondContact O-CG 3.4Å; R498-R502 PolarHBondContact O-N 3.34Å; D499-R502 WeakPolarHBondContact O-CB 3.35Å; D499-R502 PolarHBondContact O-N 3.06Å; D499-R502 IonicContact OD1-CZ 2.87Å; D499-R502 IonicContact OD1-NH1 3.9Å; D499-R502 PolarHBondContact OD1-NH1 3.09Å; E500-R502 VanDerWaalsContact C-N 3.32Å; E500-R502 PolarHBondContact O-N 2.92Å; R502-L504 PolarHBondContact O-N 3Å; R502-S505 WeakPolarHBondContact CA-OG 3.23Å; R502-S505 PolarHBondContact O-N 3.34Å; R502-S505 VanDerWaalsContact O-N 3.16Å; R502-S505 PolarHBondContact O-OG 2.87Å; R502-H506 PolarHBondContact O-CD2 2.89Å; R502-H506 PolarHBondContact O-N 3.36Å
503Q82.3Confident71.7Confident138 Ų138135.5 Ų135.565%0.64562%0.624SS**Hα-helixtrans-61.2-42.7176.6-73-177.44.400112.3D499 E500 H506 R507D499-Q503 WeakPolarHBondContact O-CG 3.44Å; D499-Q503 PolarHBondContact O-N 3.32Å; E500-Q503 PolarHBondContact O-N 2.89Å; Q503-H506 PolarHBondContact O-N 3.45Å; Q503-R507 PolarHBondContact O-N 3.24Å
504L73.2Confident69.7Low110 Ų110131.6 Ų131.658%0.57662%0.623SS**Hα-helixtrans-64.7-39.3173.9-68.6176.6000111.8E500 L501 R502 H506 R507 R508E500-L504 WeakPolarHBondContact O-CG 3.47Å; E500-L504 PolarHBondContact O-N 3.28Å; L501-L504 PolarHBondContact O-N 3.45Å; R502-L504 PolarHBondContact O-N 3Å; L504-H506 VanDerWaalsContact C-N 3.35Å; L504-H506 PolarHBondContact O-N 2.89Å; L504-R507 PolarHBondContact O-N 3.49Å; L504-R508 PolarHBondContact O-N 2.98Å
505S69.4Low67.9Low52 Ų52129.4 Ų129.436%0.36462%0.618SS.*Hα-helixtrans-65.7-36.3176.282.30000112.6L501 R502 R508 R509L501-S505 WeakPolarHBondContact O-CB 3.47Å; L501-S505 PolarHBondContact O-N 2.98Å; R502-S505 WeakPolarHBondContact CA-OG 3.23Å; R502-S505 PolarHBondContact O-N 3.34Å; R502-S505 VanDerWaalsContact O-N 3.16Å; R502-S505 PolarHBondContact O-OG 2.87Å; S505-R508 CarbonylContact O-C 3.04Å; S505-R508 PolarHBondContact O-N 3.44Å; S505-R509 PolarHBondContact O-N 3.31Å
506H61.1Low66.6Low123 Ų123129.5 Ų129.557%0.56962%0.618SS**Hα-helixtrans-71.3-35.7174.9-76.9-61.5000111.9R502 Q503 L504 R508 R509R502-H506 PolarHBondContact O-CD2 2.89Å; R502-H506 PolarHBondContact O-N 3.36Å; Q503-H506 PolarHBondContact O-N 3.45Å; L504-H506 VanDerWaalsContact C-N 3.35Å; L504-H506 PolarHBondContact O-N 2.89Å; H506-R508 VanDerWaalsContact C-N 3.28Å; H506-R508 PolarHBondContact O-N 2.69Å; H506-R509 PolarHBondContact O-N 2.92Å; H506-R509 VanDerWaalsContact O-N 3.17Å
507R55.7Low65.2Low205 Ų205133 Ų13377%0.77463%0.627SS**Hα-helixtrans-62.4-35.2168.2-78.5-175.4177.9-173.30.9112.1Q503 L504 R509Q503-R507 PolarHBondContact O-N 3.24Å; L504-R507 PolarHBondContact O-N 3.49Å; R507-R509 VanDerWaalsContact C-N 3.3Å; R507-R509 PolarHBondContact O-N 3.12Å
508R51.7Low64.5Low230 Ų230138.6 Ų138.687%0.86864%0.638SS**Hα-helixtrans-75.2-14.9175.4-151.4176.7-166.2-172.24.6113.8L504 S505 H506L504-R508 PolarHBondContact O-N 2.98Å; S505-R508 CarbonylContact O-C 3.04Å; S505-R508 PolarHBondContact O-N 3.44Å; H506-R508 VanDerWaalsContact C-N 3.28Å; H506-R508 PolarHBondContact O-N 2.69Å
509R46.3Very low64Low201 Ų201138.9 Ų138.976%0.75864%0.639SS**THydrogen-bonded Turntrans-97.126.9175.9-78.7-169.4-175.6-172.64.1113.9S505 H506 R507S505-R509 PolarHBondContact O-N 3.31Å; H506-R509 PolarHBondContact O-N 2.92Å; H506-R509 VanDerWaalsContact O-N 3.17Å; R507-R509 VanDerWaalsContact C-N 3.3Å; R507-R509 PolarHBondContact O-N 3.12Å
510R43.6Very low63.5Low208 Ų208139 Ų13979%0.78564%0.639SS**SBendtrans-71.7124.9149.8-75.8-175.8177.3-177.3-0.6106.6M512R510-M512 PolarHBondContact O-N 3.42Å
511P45.9Very low62.9Low114 Ų114137.6 Ų137.674%0.7464%0.639SS**  trans-64103-17925.9-31.3000108L513P511-L513 PolarHBondContact O-N 2.95Å
512M45.8Very low63.3Low164 Ų164135.7 Ų135.781%0.80863%0.629SS**  trans-58.3124157.1-80.4-177.9159.700106.1R510 C514 S515R510-M512 PolarHBondContact O-N 3.42Å; M512-C514 PolarHBondContact O-N 3.45Å; M512-S515 PolarHBondContact O-N 2.95Å
513L48.1Very low63.7Low162 Ų162136.2 Ų136.285%0.84864%0.635SS**THydrogen-bonded Turntrans-58.32.8178.8-7984000114.1P511P511-L513 PolarHBondContact O-N 2.95Å
514C52.3Low64Low99 Ų99135.9 Ų135.967%0.66963%0.632SS**THydrogen-bonded Turntrans-87.6-1.6-180-85.20000116.1M512 S516M512-C514 PolarHBondContact O-N 3.45Å; C514-S516 VanDerWaalsContact C-N 3.33Å
515S51.7Low64.8Low76 Ų76136 Ų13653%0.53163%0.633SS.*Hα-helixtrans-75.3-22.8176.975.30000113.5M512 R519M512-S515 PolarHBondContact O-N 2.95Å; S515-R519 WeakPolarHBondContact O-CG 3.48Å
516S60.3Low66Low63 Ų63138.8 Ų138.844%0.44164%0.643SS.*Hα-helixtrans-73.8-41-177.9-173.70000112.1C514 W518 R519 I520C514-S516 VanDerWaalsContact C-N 3.33Å; S516-W518 PolarHBondContact O-N 2.92Å; S516-R519 PolarHBondContact O-N 3.33Å; S516-I520 WeakPolarHBondContact O-CD1 3.31Å; S516-I520 VanDerWaalsContact O-CG1 3.24Å; S516-I520 WeakPolarHBondContact O-CG1 3.45Å; S516-I520 PolarHBondContact O-N 2.93Å
517W62.9Low67.5Low190 Ų190138.2 Ų138.272%0.7264%0.644SS**Hα-helixtrans-65.9-37-176.2-74.878.8000113.1I520 C521W517-I520 PolarHBondContact O-N 3.28Å; W517-C521 WeakPolarHBondContact O-CB 3.42Å; W517-C521 PolarHBondContact O-N 3.08Å
518W72.8Confident69.2Low186 Ų186134.2 Ų134.271%0.70564%0.637SS**Hα-helixtrans-71.2-36.5177.5-162.658000112S516 I520 C521 L522S516-W518 PolarHBondContact O-N 2.92Å; W518-I520 VanDerWaalsContact C-N 3.35Å; W518-C521 PolarHBondContact O-N 3.3Å; W518-L522 HydrophobicContact CD2-CD1 3.98Å; W518-L522 HydrophobicContact CE3-CD1 3.91Å; W518-L522 HydrophobicContact CH2-CD1 4.15Å; W518-L522 HydrophobicContact CZ2-CD1 4.21Å; W518-L522 HydrophobicContact CZ3-CD1 4Å; W518-L522 WeakPolarHBondContact O-CB 3.3Å; W518-L522 VanDerWaalsContact O-CG 3.31Å; W518-L522 WeakPolarHBondContact O-CG 3.44Å; W518-L522 PolarHBondContact O-N 2.96Å
519R79Confident71.2Confident173 Ų173126 Ų12665%0.65362%0.618SS**Hα-helixtrans-64.7-39.4172.6-69.4-179.4-178.4-172.80.2112S515 S516 L522 F523S515-R519 WeakPolarHBondContact O-CG 3.48Å; S516-R519 PolarHBondContact O-N 3.33Å; R519-L522 PolarHBondContact O-N 3.44Å; R519-F523 PolarHBondContact O-N 3.24Å
520I81Confident73.3Confident76 Ų76120.9 Ų120.939%0.3961%0.609SS.*Hα-helixtrans-65.8-45.9175.4-67.9164000110.3S516 W517 W518 L522 F523 F524S516-I520 WeakPolarHBondContact O-CD1 3.31Å; S516-I520 VanDerWaalsContact O-CG1 3.24Å; S516-I520 WeakPolarHBondContact O-CG1 3.45Å; S516-I520 PolarHBondContact O-N 2.93Å; W517-I520 PolarHBondContact O-N 3.28Å; W518-I520 VanDerWaalsContact C-N 3.35Å; I520-L522 VanDerWaalsContact C-N 3.35Å; I520-L522 PolarHBondContact O-N 3.45Å; I520-F523 PolarHBondContact O-N 3.32Å; I520-F524 HydrophobicContact CG2-CD2 3.58Å; I520-F524 HydrophobicContact CG2-CE2 3.51Å; I520-F524 VanDerWaalsContact O-CD2 3.25Å; I520-F524 WeakPolarHBondContact O-CD2 3.39Å; I520-F524 PolarHBondContact O-N 2.88Å
521C78.9Confident75.6Confident69 Ų69113.3 Ų113.347%0.46659%0.591SS.*Hα-helixtrans-59.4-42.6175-83.80000112.8W517 W518 F524 L525W517-C521 WeakPolarHBondContact O-CB 3.42Å; W517-C521 PolarHBondContact O-N 3.08Å; W518-C521 PolarHBondContact O-N 3.3Å; C521-F524 PolarHBondContact O-N 2.91Å; C521-L525 WeakPolarHBondContact O-CB 3.29Å; C521-L525 WeakPolarHBondContact O-CG 3.48Å; C521-L525 PolarHBondContact O-N 2.91Å
522L86.5Confident77.7Confident79 Ų79109.4 Ų109.441%0.41457%0.571SS.*Hα-helixtrans-64.3-40.6176.4-73.3170.6000111.7W518 R519 I520 L525 L526W518-L522 HydrophobicContact CD2-CD1 3.98Å; W518-L522 HydrophobicContact CE3-CD1 3.91Å; W518-L522 HydrophobicContact CH2-CD1 4.15Å; W518-L522 HydrophobicContact CZ2-CD1 4.21Å; W518-L522 HydrophobicContact CZ3-CD1 4Å; W518-L522 WeakPolarHBondContact O-CB 3.3Å; W518-L522 VanDerWaalsContact O-CG 3.31Å; W518-L522 WeakPolarHBondContact O-CG 3.44Å; W518-L522 PolarHBondContact O-N 2.96Å; R519-L522 PolarHBondContact O-N 3.44Å; I520-L522 VanDerWaalsContact C-N 3.35Å; I520-L522 PolarHBondContact O-N 3.45Å; L522-L525 PolarHBondContact O-N 2.8Å; L522-L526 WeakPolarHBondContact O-CB 3.42Å; L522-L526 PolarHBondContact O-N 3.46Å
523F89.9Confident79.6Confident142 Ų142105.2 Ų105.262%0.62356%0.555SS**Hα-helixtrans-62.2-43.5173.8-108.6-84.7000112.3R519 I520 L526 L527R519-F523 PolarHBondContact O-N 3.24Å; I520-F523 PolarHBondContact O-N 3.32Å; F523-L526 PolarHBondContact O-N 3.42Å; F523-L527 WeakPolarHBondContact O-CB 3.47Å; F523-L527 PolarHBondContact O-N 3.31Å
524F88.6Confident81.3Confident132 Ų132100.2 Ų100.258%0.57954%0.536SS*.Hα-helixtrans-66-38.8176.8-86.6-71.2000112.7I520 C521 L527 L528I520-F524 HydrophobicContact CG2-CD2 3.58Å; I520-F524 HydrophobicContact CG2-CE2 3.51Å; I520-F524 VanDerWaalsContact O-CD2 3.25Å; I520-F524 WeakPolarHBondContact O-CD2 3.39Å; I520-F524 PolarHBondContact O-N 2.88Å; C521-F524 PolarHBondContact O-N 2.91Å; F524-L527 PolarHBondContact O-N 3.22Å; F524-L528 WeakPolarHBondContact O-CB 3.31Å; F524-L528 WeakPolarHBondContact O-CG 3.39Å; F524-L528 PolarHBondContact O-N 2.98Å
525L90Very high82.8Confident112 Ų112100.2 Ų100.259%0.58653%0.528SS*.Hα-helixtrans-63.9-41.4174.6-76168.2000111.6C521 L522 L528 A529C521-L525 WeakPolarHBondContact O-CB 3.29Å; C521-L525 WeakPolarHBondContact O-CG 3.48Å; C521-L525 PolarHBondContact O-N 2.91Å; L522-L525 PolarHBondContact O-N 2.8Å; L525-L528 PolarHBondContact O-N 2.69Å; L525-A529 WeakPolarHBondContact O-CB 3.29Å; L525-A529 PolarHBondContact O-N 3.12Å
526L93.3Very high84.3Confident110 Ų110101 Ų10158%0.57653%0.525SS*.Hα-helixtrans-63.1-44.2175-168.275.3000111.1L522 F523 L528 A529 V530L522-L526 WeakPolarHBondContact O-CB 3.42Å; L522-L526 PolarHBondContact O-N 3.46Å; F523-L526 PolarHBondContact O-N 3.42Å; L526-L528 PolarHBondContact O-N 3.23Å; L526-A529 PolarHBondContact O-N 3.46Å; L526-V530 WeakPolarHBondContact O-CG2 3.49Å; L526-V530 PolarHBondContact O-N 3.09Å
527L92.6Very high85.2Confident112 Ų112102.2 Ų102.259%0.58652%0.521SS*.Hα-helixtrans-61.9-41.5177.3-116.1143.7000112.2F523 F524 V530 A531F523-L527 WeakPolarHBondContact O-CB 3.47Å; F523-L527 PolarHBondContact O-N 3.31Å; F524-L527 PolarHBondContact O-N 3.22Å; L527-V530 PolarHBondContact O-N 3.38Å; L527-A531 VanDerWaalsContact O-CB 3.28Å; L527-A531 WeakPolarHBondContact O-CB 3.43Å; L527-A531 PolarHBondContact O-N 3.01Å
528L92.4Very high86Confident121 Ų12196.8 Ų96.863%0.63451%0.512SS*.Hα-helixtrans-66.5-38.2175.5-77.1166.7000112.2F524 L525 L526 G532F524-L528 WeakPolarHBondContact O-CB 3.31Å; F524-L528 WeakPolarHBondContact O-CG 3.39Å; F524-L528 PolarHBondContact O-N 2.98Å; L525-L528 PolarHBondContact O-N 2.69Å; L526-L528 PolarHBondContact O-N 3.23Å; L528-G532 PolarHBondContact O-N 3.31Å
529A92.5Very high86.2Confident56 Ų5697.9 Ų97.946%0.46352%0.516SS..Hα-helixtrans-64.7-47175.300000111.3L525 L526 G532 V533L525-A529 WeakPolarHBondContact O-CB 3.29Å; L525-A529 PolarHBondContact O-N 3.12Å; L526-A529 PolarHBondContact O-N 3.46Å; A529-G532 PolarHBondContact O-N 2.89Å; A529-V533 WeakPolarHBondContact O-CG2 3.48Å; A529-V533 PolarHBondContact O-N 3.43Å
530V91.4Very high86.1Confident95 Ų9594.5 Ų94.558%0.57651%0.507SS*.Hα-helixtrans-62.8-44177.3173.70000111.1L526 L527 G532 V533 A534L526-V530 WeakPolarHBondContact O-CG2 3.49Å; L526-V530 PolarHBondContact O-N 3.09Å; L527-V530 PolarHBondContact O-N 3.38Å; V530-G532 VanDerWaalsContact C-N 3.33Å; V530-G532 PolarHBondContact O-N 3.09Å; V530-V533 PolarHBondContact O-N 3.28Å; V530-A534 WeakPolarHBondContact O-CB 3.45Å; V530-A534 PolarHBondContact O-N 3.45Å
531A91.8Very high85.8Confident48 Ų4895.2 Ų95.240%0.39752%0.517SS..Hα-helixtrans-63.2-39.4175.400000111.9L527 A534 M535L527-A531 VanDerWaalsContact O-CB 3.28Å; L527-A531 WeakPolarHBondContact O-CB 3.43Å; L527-A531 PolarHBondContact O-N 3.01Å; A531-A534 PolarHBondContact O-N 3.25Å; A531-M535 WeakPolarHBondContact O-CB 3.43Å; A531-M535 WeakPolarHBondContact O-CG 3.37Å; A531-M535 PolarHBondContact O-N 2.96Å
532G89.4Confident85.7Confident32 Ų3294.9 Ų94.933%0.3351%0.514SS..Hα-helixtrans-62.2-44175.200000112.6L528 A529 V530 M535 L536L528-G532 PolarHBondContact O-N 3.31Å; A529-G532 PolarHBondContact O-N 2.89Å; V530-G532 VanDerWaalsContact C-N 3.33Å; V530-G532 PolarHBondContact O-N 3.09Å; G532-M535 PolarHBondContact O-N 2.92Å; G532-L536 WeakPolarHBondContact O-CD1 3.3Å; G532-L536 PolarHBondContact O-N 2.77Å
533V85.6Confident85.2Confident77 Ų7793.8 Ų93.847%0.46751%0.506SS..Hα-helixtrans-64.4-44175174.40000110.9A529 V530 M535 L536 W537A529-V533 WeakPolarHBondContact O-CG2 3.48Å; A529-V533 PolarHBondContact O-N 3.43Å; V530-V533 PolarHBondContact O-N 3.28Å; V533-M535 VanDerWaalsContact C-N 3.35Å; V533-M535 PolarHBondContact O-N 2.95Å; V533-L536 PolarHBondContact O-N 2.93Å; V533-W537 WeakPolarHBondContact O-CB 3.47Å; V533-W537 PolarHBondContact O-N 2.85Å
534A84.6Confident84.6Confident56 Ų5692.5 Ų92.546%0.46350%0.497SS..Hα-helixtrans-63.8-38.5176.800000112.6V530 A531 W537 S538V530-A534 WeakPolarHBondContact O-CB 3.45Å; V530-A534 PolarHBondContact O-N 3.45Å; A531-A534 PolarHBondContact O-N 3.25Å; A534-W537 WeakPolarHBondContact O-CB 3.49Å; A534-W537 PolarHBondContact O-N 3.23Å; A534-S538 WeakPolarHBondContact O-CB 3.38Å; A534-S538 PolarHBondContact O-N 3.4Å; A534-S538 PolarHBondContact O-OG 2.89Å
535M84.1Confident84.2Confident100 Ų10092.4 Ų92.449%0.49350%0.498SS..Hα-helixtrans-65.3-46.5174.2-74.1-64.3-64.300111.1A531 G532 V533 W537 S538 W539A531-M535 WeakPolarHBondContact O-CB 3.43Å; A531-M535 WeakPolarHBondContact O-CG 3.37Å; A531-M535 PolarHBondContact O-N 2.96Å; G532-M535 PolarHBondContact O-N 2.92Å; V533-M535 VanDerWaalsContact C-N 3.35Å; V533-M535 PolarHBondContact O-N 2.95Å; M535-W537 VanDerWaalsContact C-N 3.27Å; M535-W537 PolarHBondContact O-N 3.01Å; M535-S538 PolarHBondContact O-N 2.93Å; M535-S538 PolarHBondContact O-OG 2.93Å; M535-W539 HydrophobicContact CE-CD2 4.46Å; M535-W539 WeakPolarHBondContact O-CB 3.27Å; M535-W539 PolarHBondContact O-N 3.33Å
536L82.9Confident83.7Confident91 Ų9193.5 Ų93.548%0.47650%0.5SS..Hα-helixtrans-58-41173.1-102.983.6000111.8G532 V533 S538 H540 F543G532-L536 WeakPolarHBondContact O-CD1 3.3Å; G532-L536 PolarHBondContact O-N 2.77Å; V533-L536 PolarHBondContact O-N 2.93Å; L536-S538 VanDerWaalsContact C-N 3.33Å; L536-S538 PolarHBondContact O-N 3.32Å; L536-H540 WeakPolarHBondContact O-CB 3.44Å; L536-H540 PolarHBondContact O-N 2.89Å; L536-F543 HydrophobicContact CB-CD1 4.09Å; L536-F543 HydrophobicContact CB-CE1 4.12Å; L536-F543 HydrophobicContact CD2-CD2 4.37Å; L536-F543 HydrophobicContact CD2-CE1 4.46Å; L536-F543 HydrophobicContact CD2-CE2 4.31Å; L536-F543 HydrophobicContact CD2-CG 4.46Å; L536-F543 HydrophobicContact CD2-CZ 4.36Å
537W79.3Confident83Confident89 Ų8989.6 Ų89.634%0.33748%0.481SS..Hα-helixtrans-62.1-39.3177.3-156.8-75.8000112.7V533 A534 M535 F543 R544 V547V533-W537 WeakPolarHBondContact O-CB 3.47Å; V533-W537 PolarHBondContact O-N 2.85Å; A534-W537 WeakPolarHBondContact O-CB 3.49Å; A534-W537 PolarHBondContact O-N 3.23Å; M535-W537 VanDerWaalsContact C-N 3.27Å; M535-W537 PolarHBondContact O-N 3.01Å; W537-F543 HydrophobicContact CE3-CE1 4.19Å; W537-R544 HydrophobicContact CZ2-CG 4.37Å; W537-V547 HydrophobicContact CH2-CB 3.6Å; W537-V547 HydrophobicContact CH2-CG1 3.42Å; W537-V547 VanDerWaalsContact CH2-CG1 3.42Å; W537-V547 HydrophobicContact CH2-CG2 4.41Å; W537-V547 HydrophobicContact CZ3-CB 3.57Å; W537-V547 HydrophobicContact CZ3-CG1 3.4Å; W537-V547 VanDerWaalsContact CZ3-CG1 3.4Å; W537-V547 HydrophobicContact CZ3-CG2 3.89Å
538S78.6Confident82.5Confident77 Ų7788.4 Ų88.454%0.53847%0.473SS..Hα-helixtrans-82.2-27.1-177.768.70000114.2A534 M535 L536A534-S538 WeakPolarHBondContact O-CB 3.38Å; A534-S538 PolarHBondContact O-N 3.4Å; A534-S538 PolarHBondContact O-OG 2.89Å; M535-S538 PolarHBondContact O-N 2.93Å; M535-S538 PolarHBondContact O-OG 2.93Å; L536-S538 VanDerWaalsContact C-N 3.33Å; L536-S538 PolarHBondContact O-N 3.32Å
539W78.3Confident82.2Confident209 Ų20987.7 Ų87.779%0.79247%0.473SS*.Hα-helixtrans-108.6-15.4-172.6-84.525.4000114.4M535M535-W539 HydrophobicContact CE-CD2 4.46Å; M535-W539 WeakPolarHBondContact O-CB 3.27Å; M535-W539 PolarHBondContact O-N 3.33Å
540H77Confident81.8Confident102 Ų10289.8 Ų89.847%0.47248%0.476SS..  trans-123.291.3-177-158.7-86.6000111.8L536 P542 F543L536-H540 WeakPolarHBondContact O-CB 3.44Å; L536-H540 PolarHBondContact O-N 2.89Å; H540-P542 VanDerWaalsContact C-CD 3.42Å; H540-P542 WeakPolarHBondContact ND1-CD 3.29Å; H540-F543 HydrophobicContact CB-CB 4.14Å; H540-F543 PolarHBondContact ND1-N 3.46Å; H540-F543 WeakPolarHBondContact O-CB 3.33Å; H540-F543 PolarHBondContact O-N 3.06Å
541P73.4Confident81.4Confident90 Ų9088.5 Ų88.558%0.58447%0.47SS*.Hα-helixtrans-53.4-40.2-178.2-21.629.8000115.3F543 R544 E545P541-F543 PolarHBondContact O-N 2.97Å; P541-R544 WeakPolarHBondContact O-CB 3.26Å; P541-R544 PolarHBondContact O-N 3.46Å; P541-E545 PolarHBondContact O-N 3.37Å
542P77.8Confident81.1Confident63 Ų6388.5 Ų88.541%0.40947%0.47SS..Hα-helixtrans-64.5-25.2177.5-17.425.5000114.2H540 Q546H540-P542 VanDerWaalsContact C-CD 3.42Å; H540-P542 WeakPolarHBondContact ND1-CD 3.29Å; P542-Q546 WeakPolarHBondContact O-CG 3.48Å; P542-Q546 PolarHBondContact O-N 3.36Å
543F76.5Confident81.1Confident55 Ų5590.8 Ų90.824%0.24148%0.475CS..Hα-helixtrans-74.5-36.8178.7-179.2-102.6000110.5L536 W537 H540 P541 Q546 V547L536-F543 HydrophobicContact CB-CD1 4.09Å; L536-F543 HydrophobicContact CB-CE1 4.12Å; L536-F543 HydrophobicContact CD2-CD2 4.37Å; L536-F543 HydrophobicContact CD2-CE1 4.46Å; L536-F543 HydrophobicContact CD2-CE2 4.31Å; L536-F543 HydrophobicContact CD2-CG 4.46Å; L536-F543 HydrophobicContact CD2-CZ 4.36Å; W537-F543 HydrophobicContact CE3-CE1 4.19Å; H540-F543 HydrophobicContact CB-CB 4.14Å; H540-F543 PolarHBondContact ND1-N 3.46Å; H540-F543 WeakPolarHBondContact O-CB 3.33Å; H540-F543 PolarHBondContact O-N 3.06Å; P541-F543 PolarHBondContact O-N 2.97Å; F543-Q546 PolarHBondContact O-N 3.33Å; F543-V547 HydrophobicContact CD1-CG2 4.23Å; F543-V547 HydrophobicContact CD2-CG2 4.49Å; F543-V547 HydrophobicContact CE1-CG2 3.84Å; F543-V547 HydrophobicContact CE2-CG2 4.12Å; F543-V547 HydrophobicContact CZ-CG2 3.78Å; F543-V547 WeakPolarHBondContact O-CG2 3.46Å; F543-V547 PolarHBondContact O-N 3.3Å
544R75.6Confident81.1Confident116 Ų11691 Ų9144%0.43847%0.473SS..Hα-helixtrans-59.1-47.1175-172.4178.9-163.6-73.9-10.2111.6W537 P541 V547 E548W537-R544 HydrophobicContact CZ2-CG 4.37Å; P541-R544 WeakPolarHBondContact O-CB 3.26Å; P541-R544 PolarHBondContact O-N 3.46Å; R544-V547 PolarHBondContact O-N 2.89Å; R544-E548 IonicContact CZ-OE1 3.22Å; R544-E548 IonicContact NH1-OE1 2.66Å; R544-E548 PolarHBondContact NH1-OE1 2.88Å; R544-E548 IonicContact NH1-OE2 3.65Å; R544-E548 IonicContact NH2-OE1 3.52Å; R544-E548 WeakPolarHBondContact O-CB 3.38Å; R544-E548 WeakPolarHBondContact O-CG 3.41Å; R544-E548 PolarHBondContact O-N 3.29Å
545E81.4Confident81.3Confident130 Ų13094 Ų9461%0.60748%0.477SS*.Hα-helixtrans-64.8-40.4178.2-67.8177.7-177.300112P541 V547 E548 V549P541-E545 PolarHBondContact O-N 3.37Å; E545-V547 PolarHBondContact O-N 2.92Å; E545-E548 PolarHBondContact O-N 2.91Å; E545-V549 WeakPolarHBondContact O-CG2 3.28Å; E545-V549 PolarHBondContact O-N 3.39Å
546Q79.1Confident81.5Confident134 Ų13492.3 Ų92.363%0.62647%0.472SS*.Hα-helixtrans-64.8-38.2176.6-75.7176.9-1.800112.9P542 F543 L550P542-Q546 WeakPolarHBondContact O-CG 3.48Å; P542-Q546 PolarHBondContact O-N 3.36Å; F543-Q546 PolarHBondContact O-N 3.33Å; Q546-L550 PolarHBondContact O-N 3.39Å; Q546-L550 VanDerWaalsContact O-N 3.1Å
547V79.7Confident81.6Confident28 Ų2895.1 Ų95.117%0.1748%0.477CS..Hα-helixtrans-76.6-34177.5-173.60000111.6W537 F543 R544 E545 V549 L550 C551W537-V547 HydrophobicContact CH2-CB 3.6Å; W537-V547 HydrophobicContact CH2-CG1 3.42Å; W537-V547 VanDerWaalsContact CH2-CG1 3.42Å; W537-V547 HydrophobicContact CH2-CG2 4.41Å; W537-V547 HydrophobicContact CZ3-CB 3.57Å; W537-V547 HydrophobicContact CZ3-CG1 3.4Å; W537-V547 VanDerWaalsContact CZ3-CG1 3.4Å; W537-V547 HydrophobicContact CZ3-CG2 3.89Å; F543-V547 HydrophobicContact CD1-CG2 4.23Å; F543-V547 HydrophobicContact CD2-CG2 4.49Å; F543-V547 HydrophobicContact CE1-CG2 3.84Å; F543-V547 HydrophobicContact CE2-CG2 4.12Å; F543-V547 HydrophobicContact CZ-CG2 3.78Å; F543-V547 WeakPolarHBondContact O-CG2 3.46Å; F543-V547 PolarHBondContact O-N 3.3Å; R544-V547 PolarHBondContact O-N 2.89Å; E545-V547 PolarHBondContact O-N 2.92Å; V547-V549 VanDerWaalsContact C-N 3.32Å; V547-V549 PolarHBondContact O-N 3.12Å; V547-L550 PolarHBondContact O-N 3.39Å; V547-C551 WeakPolarHBondContact O-CB 3.42Å; V547-C551 PolarHBondContact O-N 2.9Å; V547-C551 PolarHBondContact O-SG 3.37Å
548E82Confident81.8Confident88 Ų8895.2 Ų95.241%0.41148%0.483SS..Hα-helixtrans-61.8-40.5172.8-78177174.900111.6R544 E545 C551 A552R544-E548 IonicContact CZ-OE1 3.22Å; R544-E548 IonicContact NH1-OE1 2.66Å; R544-E548 PolarHBondContact NH1-OE1 2.88Å; R544-E548 IonicContact NH1-OE2 3.65Å; R544-E548 IonicContact NH2-OE1 3.52Å; R544-E548 WeakPolarHBondContact O-CB 3.38Å; R544-E548 WeakPolarHBondContact O-CG 3.41Å; R544-E548 PolarHBondContact O-N 3.29Å; E545-E548 PolarHBondContact O-N 2.91Å; E548-C551 PolarHBondContact O-N 2.91Å; E548-A552 WeakPolarHBondContact O-CB 3.41Å; E548-A552 PolarHBondContact O-N 3Å
549V86.1Confident82.2Confident105 Ų10596.6 Ų96.664%0.63648%0.481SS*.Hα-helixtrans-64.4-42.1173.3172.30000111.7E545 V547 A552 D553E545-V549 WeakPolarHBondContact O-CG2 3.28Å; E545-V549 PolarHBondContact O-N 3.39Å; V547-V549 VanDerWaalsContact C-N 3.32Å; V547-V549 PolarHBondContact O-N 3.12Å; V549-A552 PolarHBondContact O-N 3.32Å; V549-D553 PolarHBondContact O-N 3.03Å
550L83.5Confident82.5Confident100 Ų10091.9 Ų91.952%0.52447%0.471SS..Hα-helixtrans-66.8-41.4177.7-167.282.8000111.9Q546 V547 D553 I554Q546-L550 PolarHBondContact O-N 3.39Å; Q546-L550 VanDerWaalsContact O-N 3.1Å; V547-L550 PolarHBondContact O-N 3.39Å; L550-D553 PolarHBondContact O-N 2.94Å; L550-I554 HydrophobicContact CD2-CD1 4.26Å; L550-I554 HydrophobicContact CG-CD1 4.03Å; L550-I554 WeakPolarHBondContact O-CB 3.39Å; L550-I554 VanDerWaalsContact O-CG1 3.24Å; L550-I554 WeakPolarHBondContact O-CG1 3.4Å; L550-I554 PolarHBondContact O-N 3.2Å
551C82.4Confident82.7Confident68 Ų6894.2 Ų94.246%0.45948%0.477SS..Hα-helixtrans-64-41.8176.4-80.30000111.1V547 E548 I554 E555V547-C551 WeakPolarHBondContact O-CB 3.42Å; V547-C551 PolarHBondContact O-N 2.9Å; V547-C551 PolarHBondContact O-SG 3.37Å; E548-C551 PolarHBondContact O-N 2.91Å; C551-I554 PolarHBondContact O-N 2.83Å; C551-E555 VanDerWaalsContact O-CB 3.31Å; C551-E555 WeakPolarHBondContact O-CB 3.42Å; C551-E555 PolarHBondContact O-N 2.93Å
552A86.7Confident83Confident49 Ų4995.5 Ų95.541%0.40548%0.478SS..Hα-helixtrans-63.1-41.1174.500000112.1E548 V549 E555 T556E548-A552 WeakPolarHBondContact O-CB 3.41Å; E548-A552 PolarHBondContact O-N 3Å; V549-A552 PolarHBondContact O-N 3.32Å; A552-E555 PolarHBondContact O-N 3.46Å; A552-T556 WeakPolarHBondContact O-CG2 3.49Å; A552-T556 PolarHBondContact O-N 3.03Å; A552-T556 PolarHBondContact O-OG1 3.01Å
553D89.3Confident83.1Confident80 Ų8099 Ų9943%0.42849%0.491SS..Hα-helixtrans-67.8-33.9176.6-172.461.2000112.9V549 L550 T556 R557V549-D553 PolarHBondContact O-N 3.03Å; L550-D553 PolarHBondContact O-N 2.94Å; D553-T556 WeakPolarHBondContact CA-OG1 3.28Å; D553-T556 PolarHBondContact O-OG1 2.97Å; D553-R557 WeakPolarHBondContact O-CB 3.19Å; D553-R557 VanDerWaalsContact O-CG 3.3Å; D553-R557 WeakPolarHBondContact O-CG 3.45Å; D553-R557 PolarHBondContact O-N 2.92Å; D553-R557 VanDerWaalsContact O-N 3.13Å; D553-R557 IonicContact OD2-NE 2.8Å
554I84.8Confident83.1Confident82 Ų82101.9 Ų101.942%0.42151%0.505SS..Hα-helixtrans-71.5-41.1174.2-68.8165.9000110.3L550 C551 R557 I558L550-I554 HydrophobicContact CD2-CD1 4.26Å; L550-I554 HydrophobicContact CG-CD1 4.03Å; L550-I554 WeakPolarHBondContact O-CB 3.39Å; L550-I554 VanDerWaalsContact O-CG1 3.24Å; L550-I554 WeakPolarHBondContact O-CG1 3.4Å; L550-I554 PolarHBondContact O-N 3.2Å; C551-I554 PolarHBondContact O-N 2.83Å; I554-R557 PolarHBondContact O-N 3.27Å; I554-I558 HydrophobicContact CG2-CD1 3.64Å; I554-I558 HydrophobicContact CG2-CG1 4.31Å; I554-I558 WeakPolarHBondContact O-CB 3.36Å; I554-I558 VanDerWaalsContact O-CG1 3.22Å; I554-I558 WeakPolarHBondContact O-CG1 3.23Å; I554-I558 PolarHBondContact O-N 3Å
555E88.8Confident82.7Confident119 Ų119102.3 Ų102.356%0.55651%0.513SS*.Hα-helixtrans-63.5-47.1178.1-171.4167.1-158.200111C551 A552 R557 I558 E559C551-E555 VanDerWaalsContact O-CB 3.31Å; C551-E555 WeakPolarHBondContact O-CB 3.42Å; C551-E555 PolarHBondContact O-N 2.93Å; A552-E555 PolarHBondContact O-N 3.46Å; E555-R557 VanDerWaalsContact C-N 3.33Å; E555-R557 PolarHBondContact O-N 2.88Å; E555-I558 PolarHBondContact O-N 3.5Å; E555-I558 VanDerWaalsContact O-N 3.17Å; E555-E559 WeakPolarHBondContact O-CB 3.28Å; E555-E559 WeakPolarHBondContact O-CG 3.31Å; E555-E559 PolarHBondContact O-N 2.9Å
556T87.8Confident81.9Confident63 Ų6399.8 Ų99.839%0.38751%0.514SS..Hα-helixtrans-61.6-40.4175.4550000112A552 D553 E559 D560A552-T556 WeakPolarHBondContact O-CG2 3.49Å; A552-T556 PolarHBondContact O-N 3.03Å; A552-T556 PolarHBondContact O-OG1 3.01Å; D553-T556 WeakPolarHBondContact CA-OG1 3.28Å; D553-T556 PolarHBondContact O-OG1 2.97Å; T556-E559 PolarHBondContact O-N 3.5Å; T556-D560 WeakPolarHBondContact O-CB 3.31Å; T556-D560 VanDerWaalsContact O-CG 3.22Å; T556-D560 PolarHBondContact O-N 3.16Å
557R85.2Confident81.1Confident150 Ų15095.3 Ų95.357%0.56650%0.498SS*.Hα-helixtrans-64.8-40.9174.5-80.3177.9172.5-132.1-3.9112.8D553 I554 E555 E559 D560 Y561D553-R557 WeakPolarHBondContact O-CB 3.19Å; D553-R557 VanDerWaalsContact O-CG 3.3Å; D553-R557 WeakPolarHBondContact O-CG 3.45Å; D553-R557 PolarHBondContact O-N 2.92Å; D553-R557 VanDerWaalsContact O-N 3.13Å; D553-R557 IonicContact OD2-NE 2.8Å; I554-R557 PolarHBondContact O-N 3.27Å; E555-R557 VanDerWaalsContact C-N 3.33Å; E555-R557 PolarHBondContact O-N 2.88Å; R557-E559 VanDerWaalsContact C-N 3.34Å; R557-D560 PolarHBondContact O-N 2.92Å; R557-Y561 WeakPolarHBondContact O-CB 3.42Å; R557-Y561 WeakPolarHBondContact O-CD2 3.43Å; R557-Y561 PolarHBondContact O-N 3.42Å
558I84.5Confident80.1Confident91 Ų9199.7 Ų99.747%0.46753%0.527SS..Hα-helixtrans-66.3-40.9177.3-70.8167.9000109.9I554 E555 Y561 L562I554-I558 HydrophobicContact CG2-CD1 3.64Å; I554-I558 HydrophobicContact CG2-CG1 4.31Å; I554-I558 WeakPolarHBondContact O-CB 3.36Å; I554-I558 VanDerWaalsContact O-CG1 3.22Å; I554-I558 WeakPolarHBondContact O-CG1 3.23Å; I554-I558 PolarHBondContact O-N 3Å; E555-I558 PolarHBondContact O-N 3.5Å; E555-I558 VanDerWaalsContact O-N 3.17Å; I558-Y561 PolarHBondContact O-N 3.42Å; I558-L562 HydrophobicContact CG2-CD1 3.84Å; I558-L562 HydrophobicContact CG2-CG 4.33Å; I558-L562 WeakPolarHBondContact O-CB 3.42Å; I558-L562 VanDerWaalsContact O-CG 3.26Å; I558-L562 WeakPolarHBondContact O-CG 3.46Å; I558-L562 PolarHBondContact O-N 2.83Å
559E86.5Confident79.1Confident107 Ų107103.8 Ų103.850%0.555%0.546SS..Hα-helixtrans-62-45.3173.7-73.9-178.6165.400111.3E555 T556 R557 Y561 L562 M563E555-E559 WeakPolarHBondContact O-CB 3.28Å; E555-E559 WeakPolarHBondContact O-CG 3.31Å; E555-E559 PolarHBondContact O-N 2.9Å; T556-E559 PolarHBondContact O-N 3.5Å; R557-E559 VanDerWaalsContact C-N 3.34Å; E559-Y561 PolarHBondContact O-N 2.79Å; E559-L562 PolarHBondContact O-N 3.38Å; E559-M563 VanDerWaalsContact O-CB 3.31Å; E559-M563 WeakPolarHBondContact O-CB 3.34Å; E559-M563 WeakPolarHBondContact O-CG 3.29Å; E559-M563 PolarHBondContact O-N 3.49Å
560D84.7Confident77.6Confident109 Ų109103.5 Ų103.558%0.58354%0.541SS*.Hα-helixtrans-60.2-44175.3-74.3-20.9000111.5T556 R557 M563 E564T556-D560 WeakPolarHBondContact O-CB 3.31Å; T556-D560 VanDerWaalsContact O-CG 3.22Å; T556-D560 PolarHBondContact O-N 3.16Å; R557-D560 PolarHBondContact O-N 2.92Å; D560-M563 PolarHBondContact O-N 3.41Å; D560-E564 VanDerWaalsContact O-CB 3.3Å; D560-E564 WeakPolarHBondContact O-CB 3.46Å; D560-E564 PolarHBondContact O-N 3.44Å
561Y81.1Confident76Confident152 Ų152104.4 Ų104.460%0.59656%0.556SS**Hα-helixtrans-64.3-41.1175.2-89.6-64.3000112.6R557 I558 E559 E564 M565R557-Y561 WeakPolarHBondContact O-CB 3.42Å; R557-Y561 WeakPolarHBondContact O-CD2 3.43Å; R557-Y561 PolarHBondContact O-N 3.42Å; I558-Y561 PolarHBondContact O-N 3.42Å; E559-Y561 PolarHBondContact O-N 2.79Å; Y561-E564 PolarHBondContact O-N 3.09Å; Y561-M565 WeakPolarHBondContact O-CB 3.34Å; Y561-M565 WeakPolarHBondContact O-CG 3.38Å; Y561-M565 PolarHBondContact O-N 3.05Å
562L80Confident74.7Confident117 Ų117104.5 Ų104.561%0.61357%0.568SS**Hα-helixtrans-68.6-36.4177.1-75.1171.5000111.5I558 E559 M565 A566I558-L562 HydrophobicContact CG2-CD1 3.84Å; I558-L562 HydrophobicContact CG2-CG 4.33Å; I558-L562 WeakPolarHBondContact O-CB 3.42Å; I558-L562 VanDerWaalsContact O-CG 3.26Å; I558-L562 WeakPolarHBondContact O-CG 3.46Å; I558-L562 PolarHBondContact O-N 2.83Å; E559-L562 PolarHBondContact O-N 3.38Å; L562-M565 PolarHBondContact O-N 3.44Å; L562-A566 VanDerWaalsContact O-CB 3.31Å; L562-A566 WeakPolarHBondContact O-CB 3.24Å; L562-A566 PolarHBondContact O-N 3.39Å
563M78.4Confident73.1Confident136 Ų136107.7 Ų107.767%0.6759%0.587SS**Hα-helixtrans-70-36.8174.8-72.3-61.9-66.600112E559 D560 M565 A566 S567E559-M563 VanDerWaalsContact O-CB 3.31Å; E559-M563 WeakPolarHBondContact O-CB 3.34Å; E559-M563 WeakPolarHBondContact O-CG 3.29Å; E559-M563 PolarHBondContact O-N 3.49Å; D560-M563 PolarHBondContact O-N 3.41Å; M563-M565 VanDerWaalsContact C-N 3.35Å; M563-A566 PolarHBondContact O-N 3.36Å; M563-S567 PolarHBondContact O-N 3.27Å
564E77.6Confident71Confident115 Ų115113 Ų11354%0.53761%0.606SS.*Hα-helixtrans-67.6-35.2172.7-168.3174-164.100111.8D560 Y561 S567D560-E564 VanDerWaalsContact O-CB 3.3Å; D560-E564 WeakPolarHBondContact O-CB 3.46Å; D560-E564 PolarHBondContact O-N 3.44Å; Y561-E564 PolarHBondContact O-N 3.09Å; E564-S567 WeakPolarHBondContact O-CB 3.35Å; E564-S567 PolarHBondContact O-N 2.99Å
565M67.8Low69Low126 Ų126120.4 Ų120.462%0.62163%0.629SS**Hα-helixtrans-73.6-26172.7-71.3-72.5-69.400113.2Y561 L562 M563Y561-M565 WeakPolarHBondContact O-CB 3.34Å; Y561-M565 WeakPolarHBondContact O-CG 3.38Å; Y561-M565 PolarHBondContact O-N 3.05Å; L562-M565 PolarHBondContact O-N 3.44Å; M563-M565 VanDerWaalsContact C-N 3.35Å
566A64Low67.4Low76 Ų76120.5 Ų120.563%0.62864%0.639SS**Hα-helixtrans-87.6-7.4175.700000113.6L562 M563L562-A566 VanDerWaalsContact O-CB 3.31Å; L562-A566 WeakPolarHBondContact O-CB 3.24Å; L562-A566 PolarHBondContact O-N 3.39Å; M563-A566 PolarHBondContact O-N 3.36Å
567S61.9Low65.3Low41 Ų41129 Ų12929%0.28768%0.68SS.*SBendtrans-65.2134.9173.7169.30000111.3M563 E564 Q569 N570M563-S567 PolarHBondContact O-N 3.27Å; E564-S567 WeakPolarHBondContact O-CB 3.35Å; E564-S567 PolarHBondContact O-N 2.99Å; S567-Q569 PolarHBondContact O-N 2.82Å; S567-N570 PolarHBondContact O-N 3.35Å
568P60Low64.3Low120 Ų120128 Ų12878%0.77969%0.686SS**G310 helixtrans-67.52.1-176.826.9-33.1000114.6
569Q59Low63.2Low173 Ų173129.9 Ų129.981%0.80870%0.698SS**G310 helixtrans-83-12.2175.4-82.7174.6-20.500114.5S567S567-Q569 PolarHBondContact O-N 2.82Å
570N55Low61.9Low100 Ų100131.2 Ų131.254%0.53571%0.709SS.*G310 helixtrans-116.838.3-179.4-76.1-30.3000113.5S567 G572S567-N570 PolarHBondContact O-N 3.35Å; N570-G572 PolarHBondContact O-N 3.44Å
571S51.4Low60.6Low118 Ų118132.5 Ų132.583%0.82572%0.716SS**THydrogen-bonded Turntrans-72.315.2178.165.20000115.1
572G54.5Low59.3Low70 Ų70131.3 Ų131.372%0.72272%0.723SS**THydrogen-bonded Turntrans-98.2-13.2-168.500000116.9N570N570-G572 PolarHBondContact O-N 3.44Å
573C53.4Low57.9Low117 Ų117132.3 Ų132.379%0.79173%0.731SS**  trans-129.358.1-167.4-70.10000113.4
574F44.2Very low56.4Low190 Ų190132 Ų13283%0.83374%0.735SS**  trans-128.4103157.3-87.7-85.2000109.7
575R43.1Very low54.8Low239 Ų239133.3 Ų133.390%0.90275%0.75SS**  trans-85.7119.9152.5-103.7-171.8-176.4-157.11.5106.7
576P54.3Low53.7Low120 Ų120133.9 Ų133.978%0.77976%0.761SS**  trans-69.9139.9167.328.2-26000108.4
577I43.6Very low52.8Low243 Ų243139.2 Ų139.2100%1.24677%0.773SS**  trans-64.30171-66.5171.2000109.3

Retrieved 577 of 577 residues in 714.3 ms (Link to these results)