A0A087YB91_POEFO Loading...

Tetratricopeptide repeat domain 8

AlphaFold DB (A0A3B3TYM8), UniProt , Accession A0A087YB91, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 505 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
1M42.1Very low77.4Confident234 Ų234106.6 Ų106.6100%1.15356%0.559SS**  098.40-70.7-172.8-109.500106.3V3M1-V3 PolarHBondContact O-N 3.44Å
2E46.9Very low78.8Confident182 Ų182103.4 Ų103.485%0.8554%0.542SS*.  trans-62.2119.7170.6-71.8178.9166.300107.1T4E2-T4 VanDerWaalsContact C-N 3.29Å; E2-T4 PolarHBondContact O-N 3.23Å
3V50.7Low80.1Confident141 Ų14197.8 Ų97.886%0.85552%0.517SS*.  trans-71.393.1176.4-179.60000106.4M1 M5M1-V3 PolarHBondContact O-N 3.44Å; V3-M5 PolarHBondContact O-N 3.03Å
4T73.8Confident81.3Confident123 Ų12394.5 Ų94.576%0.75550%0.495SS*.  trans-66.2115.9172.950.80000108E2E2-T4 VanDerWaalsContact C-N 3.29Å; E2-T4 PolarHBondContact O-N 3.23Å
5M82.6Confident82.2Confident114 Ų11489.9 Ų89.956%0.56247%0.469SS*.  trans-58.6139.1178-16667.8-174.400110.6V3 F9V3-M5 PolarHBondContact O-N 3.03Å; M5-F9 HydrophobicContact CE-CD1 3.07Å; M5-F9 HydrophobicContact CE-CE1 3.23Å; M5-F9 HydrophobicContact CE-CG 3.93Å; M5-F9 HydrophobicContact CE-CZ 4.2Å
6D90.1Very high83Confident92 Ų9296.6 Ų96.649%0.49249%0.486SS..  trans-56.4123.1178.4-178.3-9.6000110.7L8 F9 L10D6-L8 VanDerWaalsContact C-N 3.27Å; D6-L8 PolarHBondContact O-N 3.23Å; D6-L8 PolarHBondContact OD1-N 2.96Å; D6-F9 HydrophobicContact CB-CB 4.11Å; D6-F9 PolarHBondContact O-N 3.38Å; D6-L10 PolarHBondContact O-N 3.39Å
7P90.4Very high83.8Confident66 Ų6698.5 Ų98.543%0.42949%0.486SS..Hα-helixtrans-61.5-33.6-177.626.5-36.9000112.7L10 A11 I26 I30P7-L10 PolarHBondContact O-N 2.92Å; P7-A11 WeakPolarHBondContact O-CB 3.4Å; P7-A11 PolarHBondContact O-N 2.81Å; P7-I26 HydrophobicContact CB-CG2 4.18Å; P7-I26 WeakPolarHBondContact O-CG2 3.33Å; P7-I30 HydrophobicContact CB-CD1 3.98Å; P7-I30 HydrophobicContact CB-CG1 4.04Å; P7-I30 HydrophobicContact CG-CD1 4.38Å; P7-I30 HydrophobicContact CG-CG1 4.26Å
8L92.5Very high84.4Confident49 Ų49104.4 Ų104.426%0.25750%0.502SS..Hα-helixtrans-70-41.4179.7-177.564.6000111.3D6 L10 A11 L12 I30 A39 A40 L43D6-L8 VanDerWaalsContact C-N 3.27Å; D6-L8 PolarHBondContact O-N 3.23Å; D6-L8 PolarHBondContact OD1-N 2.96Å; L8-L10 VanDerWaalsContact C-N 3.33Å; L8-A11 PolarHBondContact O-N 3.19Å; L8-L12 PolarHBondContact O-N 3.21Å; L8-I30 HydrophobicContact CB-CD1 4.3Å; L8-I30 HydrophobicContact CD1-CD1 4.45Å; L8-A39 HydrophobicContact CD1-CB 4.5Å; L8-A39 HydrophobicContact CD2-CB 4.23Å; L8-A40 HydrophobicContact CD1-CB 4.35Å; L8-L43 HydrophobicContact CD1-CD1 4.19Å
9F93.8Very high84.9Confident117 Ų117103.9 Ų103.951%0.51350%0.498SS..Hα-helixtrans-63.4-41.8174.9-179.1-88.7000111.5M5 D6 L12 S13M5-F9 HydrophobicContact CE-CD1 3.07Å; M5-F9 HydrophobicContact CE-CE1 3.23Å; M5-F9 HydrophobicContact CE-CG 3.93Å; M5-F9 HydrophobicContact CE-CZ 4.2Å; D6-F9 HydrophobicContact CB-CB 4.11Å; D6-F9 PolarHBondContact O-N 3.38Å; F9-L12 PolarHBondContact O-N 3.23Å; F9-S13 WeakPolarHBondContact O-CB 3.41Å; F9-S13 PolarHBondContact O-N 3.03Å
10L93.9Very high85.4Confident55 Ų55100.4 Ų100.429%0.28848%0.48SS..Hα-helixtrans-60.3-45.5176.3-174.370.1000111.2D6 P7 L8 S13 Y14 I26D6-L10 PolarHBondContact O-N 3.39Å; P7-L10 PolarHBondContact O-N 2.92Å; L8-L10 VanDerWaalsContact C-N 3.33Å; L10-S13 WeakPolarHBondContact O-CB 3.46Å; L10-S13 PolarHBondContact O-N 3.21Å; L10-Y14 HydrophobicContact CD1-CD2 4.48Å; L10-Y14 HydrophobicContact CD1-CE2 3.78Å; L10-Y14 HydrophobicContact CD2-CE2 3.88Å; L10-Y14 HydrophobicContact CG-CD2 4.01Å; L10-Y14 HydrophobicContact CG-CE2 3.5Å; L10-Y14 VanDerWaalsContact CG-CE2 3.5Å; L10-Y14 VanDerWaalsContact O-CD2 3.31Å; L10-Y14 WeakPolarHBondContact O-CD2 3.31Å; L10-Y14 PolarHBondContact O-N 3.37Å; L10-I26 HydrophobicContact CD2-CD1 3.76Å; L10-I26 HydrophobicContact CG-CD1 4.09Å
11A94.4Very high85.7Confident0 Ų0102.5 Ų102.50%049%0.489CS..Hα-helixtrans-59.8-46.4175.900000112.1P7 L8 S13 Y14 F15 C23 I26 L43P7-A11 WeakPolarHBondContact O-CB 3.4Å; P7-A11 PolarHBondContact O-N 2.81Å; L8-A11 PolarHBondContact O-N 3.19Å; A11-S13 VanDerWaalsContact C-N 3.29Å; A11-S13 PolarHBondContact O-N 3.33Å; A11-Y14 PolarHBondContact O-N 2.84Å; A11-Y14 VanDerWaalsContact O-N 3.13Å; A11-F15 PolarHBondContact O-N 3.47Å; A11-C23 PolarHBondContact O-SG 2.93Å; A11-I26 HydrophobicContact CB-CB 4.26Å; A11-I26 HydrophobicContact CB-CG2 3.92Å; A11-L43 HydrophobicContact CB-CD1 4.27Å
12L94.9Very high88.1Confident68 Ų6895.4 Ų95.436%0.35645%0.453SS..Hα-helixtrans-61.4-39.3177.3-163.9157000111.7L8 F9 Y14 F15 R16 L43L8-L12 PolarHBondContact O-N 3.21Å; F9-L12 PolarHBondContact O-N 3.23Å; L12-Y14 VanDerWaalsContact C-N 3.35Å; L12-F15 PolarHBondContact O-N 3.5Å; L12-R16 PolarHBondContact O-N 3.2Å; L12-L43 HydrophobicContact CB-CD1 4.09Å
13S95.6Very high90.3Very high31 Ų3186.7 Ų86.722%0.21741%0.413CS..Hα-helixtrans-65.5-36.5176-170.30000112.6F9 L10 A11 R17F9-S13 WeakPolarHBondContact O-CB 3.41Å; F9-S13 PolarHBondContact O-N 3.03Å; L10-S13 WeakPolarHBondContact O-CB 3.46Å; L10-S13 PolarHBondContact O-N 3.21Å; A11-S13 VanDerWaalsContact C-N 3.29Å; A11-S13 PolarHBondContact O-N 3.33Å; S13-R17 WeakPolarHBondContact O-CB 3.32Å; S13-R17 WeakPolarHBondContact O-CG 3.37Å; S13-R17 PolarHBondContact O-N 3.09Å; S13-R17 PolarHBondContact O-NE 2.98Å; S13-R17 PolarHBondContact OG-NE 3.49Å; S13-R17 PolarHBondContact OG-NH2 3.1Å
14Y95.9Very high92.2Very high51 Ų5180.6 Ų80.620%0.238%0.376CS..Hα-helixtrans-70.6-41.5174-73.4-43.5000112.6L10 A11 L12 R16 R17 R18 K19 Q22 I26L10-Y14 HydrophobicContact CD1-CD2 4.48Å; L10-Y14 HydrophobicContact CD1-CE2 3.78Å; L10-Y14 HydrophobicContact CD2-CE2 3.88Å; L10-Y14 HydrophobicContact CG-CD2 4.01Å; L10-Y14 HydrophobicContact CG-CE2 3.5Å; L10-Y14 VanDerWaalsContact CG-CE2 3.5Å; L10-Y14 VanDerWaalsContact O-CD2 3.31Å; L10-Y14 WeakPolarHBondContact O-CD2 3.31Å; L10-Y14 PolarHBondContact O-N 3.37Å; A11-Y14 PolarHBondContact O-N 2.84Å; A11-Y14 VanDerWaalsContact O-N 3.13Å; L12-Y14 VanDerWaalsContact C-N 3.35Å; Y14-R16 PolarHBondContact O-N 3.3Å; Y14-R17 CarbonylContact O-C 3.6Å; Y14-R17 PolarHBondContact O-N 3.41Å; Y14-R17 VanDerWaalsContact O-N 3.1Å; Y14-R18 PolarHBondContact O-N 3Å; Y14-K19 HydrophobicContact CD1-CB 4.26Å; Y14-K19 HydrophobicContact CD1-CD 3.99Å; Y14-K19 HydrophobicContact CE1-CD 4.38Å; Y14-K19 HydrophobicContact CG-CB 4.5Å; Y14-K19 PolarHBondContact O-N 2.89Å; Y14-Q22 HydrophobicContact CD2-CB 4.17Å; Y14-Q22 HydrophobicContact CE2-CB 4.46Å; Y14-Q22 HydrophobicContact CG-CB 4.31Å; Y14-I26 HydrophobicContact CD2-CD1 3.56Å; Y14-I26 HydrophobicContact CE2-CD1 3.48Å; Y14-I26 VanDerWaalsContact CE2-CD1 3.48Å
15F95.7Very high93.1Very high25 Ų2578.9 Ų78.911%0.1136%0.363CS..Hα-helixtrans-56.2-49.3173.2-178.1-100.7000111.4A11 L12 R17 R18 F20 L43 R46 A47 E50A11-F15 PolarHBondContact O-N 3.47Å; L12-F15 PolarHBondContact O-N 3.5Å; F15-R17 PolarHBondContact O-N 3.49Å; F15-R18 PolarHBondContact O-N 3.47Å; F15-F20 HydrophobicContact CD2-CD1 4.03Å; F15-F20 HydrophobicContact CD2-CE1 4.04Å; F15-F20 HydrophobicContact CE2-CD1 4.31Å; F15-F20 HydrophobicContact CE2-CE1 4.07Å; F15-L43 HydrophobicContact CB-CD2 4.03Å; F15-L43 HydrophobicContact CD2-CD2 4.34Å; F15-L43 HydrophobicContact CG-CD2 4.25Å; F15-R46 HydrophobicContact CE2-CB 3.74Å; F15-R46 HydrophobicContact CZ-CB 3.83Å; F15-A47 HydrophobicContact CD2-CB 4.28Å; F15-E50 HydrophobicContact CE2-CG 4.46Å; F15-E50 VanDerWaalsContact CE2-OE2 3.22Å; F15-E50 WeakPolarHBondContact CE2-OE2 3.13Å; F15-E50 VanDerWaalsContact CZ-CD 3.41Å; F15-E50 WeakPolarHBondContact CZ-OE1 3.08Å; F15-E50 VanDerWaalsContact CZ-OE2 3.27Å; F15-E50 WeakPolarHBondContact CZ-OE2 3.47Å
16R95.3Very high93.6Very high197 Ų19774.7 Ų74.774%0.74334%0.342SS*.Hα-helixtrans-59.6-32.7176.7-170-178.1-62.4176.10.9113L12 Y14 R18L12-R16 PolarHBondContact O-N 3.2Å; Y14-R16 PolarHBondContact O-N 3.3Å; R16-R18 PolarHBondContact O-N 3.35Å
17R95.6Very high93.7Very high129 Ų12970.3 Ų70.349%0.48732%0.319SS..THydrogen-bonded Turntrans-84.69.5177.1-72.4-179.9-84.3172.5-5113.3S13 Y14 F15 K19S13-R17 WeakPolarHBondContact O-CB 3.32Å; S13-R17 WeakPolarHBondContact O-CG 3.37Å; S13-R17 PolarHBondContact O-N 3.09Å; S13-R17 PolarHBondContact O-NE 2.98Å; S13-R17 PolarHBondContact OG-NE 3.49Å; S13-R17 PolarHBondContact OG-NH2 3.1Å; Y14-R17 CarbonylContact O-C 3.6Å; Y14-R17 PolarHBondContact O-N 3.41Å; Y14-R17 VanDerWaalsContact O-N 3.1Å; F15-R17 PolarHBondContact O-N 3.49Å; R17-K19 HydrophobicContact CB-CG 4.4Å; R17-K19 PolarHBondContact O-N 3.43Å
18R95Very high93.7Very high205 Ų20567.9 Ų67.977%0.77430%0.303SS*.THydrogen-bonded Turntrans56.829.1-175.7-61.2-176.6170.4178.2-3.8114Y14 F15 R16 F20Y14-R18 PolarHBondContact O-N 3Å; F15-R18 PolarHBondContact O-N 3.47Å; R16-R18 PolarHBondContact O-N 3.35Å; R18-F20 HydrophobicContact CB-CE1 4.38Å; R18-F20 HydrophobicContact CB-CE2 4.27Å; R18-F20 HydrophobicContact CB-CZ 3.94Å; R18-F20 HydrophobicContact CG-CZ 3.97Å; R18-F20 PolarHBondContact O-N 2.93Å
19K94.8Very high93.7Very high96 Ų9671.6 Ų71.642%0.41732%0.317SS..  trans-94.572.2172.7-62.9-163.2-176.9-173.40109.7Y14 R17 C23Y14-K19 HydrophobicContact CD1-CB 4.26Å; Y14-K19 HydrophobicContact CD1-CD 3.99Å; Y14-K19 HydrophobicContact CE1-CD 4.38Å; Y14-K19 HydrophobicContact CG-CB 4.5Å; Y14-K19 PolarHBondContact O-N 2.89Å; R17-K19 HydrophobicContact CB-CG 4.4Å; R17-K19 PolarHBondContact O-N 3.43Å; K19-C23 VanDerWaalsContact O-CB 3.28Å; K19-C23 WeakPolarHBondContact O-CB 3.49Å; K19-C23 PolarHBondContact O-N 3.01Å
20F93.2Very high93.6Very high33 Ų3366.7 Ų66.715%0.14530%0.296CS..Hα-helixtrans-69.2-36.4-169.2-56.8-47.1000114.3F15 R18 C23 S24 A47 E50 M51F15-F20 HydrophobicContact CD2-CD1 4.03Å; F15-F20 HydrophobicContact CD2-CE1 4.04Å; F15-F20 HydrophobicContact CE2-CD1 4.31Å; F15-F20 HydrophobicContact CE2-CE1 4.07Å; R18-F20 HydrophobicContact CB-CE1 4.38Å; R18-F20 HydrophobicContact CB-CE2 4.27Å; R18-F20 HydrophobicContact CB-CZ 3.94Å; R18-F20 HydrophobicContact CG-CZ 3.97Å; R18-F20 PolarHBondContact O-N 2.93Å; F20-C23 WeakPolarHBondContact O-CB 3.01Å; F20-C23 PolarHBondContact O-N 3.22Å; F20-S24 PolarHBondContact O-N 3.49Å; F20-S24 PolarHBondContact O-OG 3.18Å; F20-A47 HydrophobicContact CB-CB 4.47Å; F20-E50 HydrophobicContact CD1-CB 4.32Å; F20-E50 HydrophobicContact CD2-CB 4.3Å; F20-E50 HydrophobicContact CE1-CB 3.87Å; F20-E50 WeakPolarHBondContact CE1-OE2 3.27Å; F20-E50 HydrophobicContact CE2-CB 3.81Å; F20-E50 HydrophobicContact CZ-CB 3.58Å; F20-E50 HydrophobicContact CZ-CG 4.44Å; F20-E50 WeakPolarHBondContact CZ-OE2 3.21Å; F20-M51 HydrophobicContact CB-CE 4.27Å; F20-M51 HydrophobicContact CB-CG 3.31Å; F20-M51 HydrophobicContact CB-SD 3.77Å; F20-M51 HydrophobicContact CD2-CG 3.85Å; F20-M51 HydrophobicContact CG-CG 3.96Å
21Q91.6Very high93.5Very high144 Ų14465.6 Ų65.667%0.67329%0.291SS*.Hα-helixtrans-64-51177.2-68.1-178.7-15.900112.2C23 S24 D25 M51Q21-C23 PolarHBondContact O-N 3.26Å; Q21-S24 PolarHBondContact O-N 3.21Å; Q21-S24 VanDerWaalsContact O-N 3.1Å; Q21-S24 PolarHBondContact O-OG 2.91Å; Q21-D25 PolarHBondContact O-N 3.09Å; Q21-M51 HydrophobicContact CG-SD 3.81Å
22Q92.6Very high93.2Very high85 Ų8571.4 Ų71.440%0.39732%0.317SS..Hα-helixtrans-60.4-35.8178.5-63.9-176.5-18.700111.7Y14 I26Y14-Q22 HydrophobicContact CD2-CB 4.17Å; Y14-Q22 HydrophobicContact CE2-CB 4.46Å; Y14-Q22 HydrophobicContact CG-CB 4.31Å; Q22-I26 WeakPolarHBondContact O-CD1 3.46Å; Q22-I26 WeakPolarHBondContact O-CG1 3.3Å; Q22-I26 PolarHBondContact O-N 2.99Å
23C93.3Very high93.1Very high0 Ų074.9 Ų74.90%034%0.336CS..Hα-helixtrans-64.8-48.3174.6-179.80000112.2A11 K19 F20 Q21 D25 I26 C27 L43 A47A11-C23 PolarHBondContact O-SG 2.93Å; K19-C23 VanDerWaalsContact O-CB 3.28Å; K19-C23 WeakPolarHBondContact O-CB 3.49Å; K19-C23 PolarHBondContact O-N 3.01Å; F20-C23 WeakPolarHBondContact O-CB 3.01Å; F20-C23 PolarHBondContact O-N 3.22Å; Q21-C23 PolarHBondContact O-N 3.26Å; C23-D25 VanDerWaalsContact C-N 3.29Å; C23-D25 PolarHBondContact O-N 3.19Å; C23-I26 PolarHBondContact O-N 3.44Å; C23-C27 PolarHBondContact O-N 3.41Å; C23-C27 PolarHBondContact O-SG 3.35Å; C23-L43 WeakPolarHBondContact SG-CD2 3.44Å; C23-A47 HydrophobicContact CB-CB 4.37Å
24S92.1Very high92.9Very high12 Ų1275.5 Ų75.58%0.08434%0.341CS..Hα-helixtrans-62.5-36.6178.5570000112.5F20 Q21 C27 S28F20-S24 PolarHBondContact O-N 3.49Å; F20-S24 PolarHBondContact O-OG 3.18Å; Q21-S24 PolarHBondContact O-N 3.21Å; Q21-S24 VanDerWaalsContact O-N 3.1Å; Q21-S24 PolarHBondContact O-OG 2.91Å; S24-C27 PolarHBondContact O-N 2.71Å; S24-S28 PolarHBondContact O-N 3.13Å; S24-S28 PolarHBondContact O-OG 3.44Å
25D92.4Very high92.5Very high88 Ų8877.9 Ų77.947%0.47136%0.362SS..Hα-helixtrans-71.5-32.8-179.5-62.3-15.3000112.9Q21 C23 S28 K29Q21-D25 PolarHBondContact O-N 3.09Å; C23-D25 VanDerWaalsContact C-N 3.29Å; C23-D25 PolarHBondContact O-N 3.19Å; D25-S28 PolarHBondContact O-OG 3.37Å; D25-K29 WeakPolarHBondContact O-CG 3.24Å; D25-K29 PolarHBondContact O-N 3.08Å
26I92.7Very high92Very high26 Ų2686.8 Ų86.813%0.13340%0.397CS..Hα-helixtrans-75.2-41.6173.9-68.6162.1000109.7P7 L10 A11 Y14 Q22 C23 S28 K29 I30P7-I26 HydrophobicContact CB-CG2 4.18Å; P7-I26 WeakPolarHBondContact O-CG2 3.33Å; L10-I26 HydrophobicContact CD2-CD1 3.76Å; L10-I26 HydrophobicContact CG-CD1 4.09Å; A11-I26 HydrophobicContact CB-CB 4.26Å; A11-I26 HydrophobicContact CB-CG2 3.92Å; Y14-I26 HydrophobicContact CD2-CD1 3.56Å; Y14-I26 HydrophobicContact CE2-CD1 3.48Å; Y14-I26 VanDerWaalsContact CE2-CD1 3.48Å; Q22-I26 WeakPolarHBondContact O-CD1 3.46Å; Q22-I26 WeakPolarHBondContact O-CG1 3.3Å; Q22-I26 PolarHBondContact O-N 2.99Å; C23-I26 PolarHBondContact O-N 3.44Å; I26-S28 VanDerWaalsContact C-N 3.31Å; I26-S28 PolarHBondContact O-N 3.28Å; I26-K29 PolarHBondContact O-N 3.38Å; I26-I30 HydrophobicContact CG2-CD1 3.93Å; I26-I30 HydrophobicContact CG2-CG1 4.41Å; I26-I30 WeakPolarHBondContact O-CG1 3.38Å; I26-I30 PolarHBondContact O-N 2.73Å
27C91.9Very high91.8Very high0 Ų079.6 Ų79.60%037%0.373CS..Hα-helixtrans-65.2-32.8176.5-66.80000112.7C23 S24 I30 L31 K44C23-C27 PolarHBondContact O-N 3.41Å; C23-C27 PolarHBondContact O-SG 3.35Å; S24-C27 PolarHBondContact O-N 2.71Å; C27-I30 PolarHBondContact O-N 3.45Å; C27-L31 WeakPolarHBondContact O-CB 3.41Å; C27-L31 WeakPolarHBondContact O-CG 3.18Å; C27-L31 PolarHBondContact O-N 3.36Å; C27-K44 HydrophobicContact CB-CB 3.76Å; C27-K44 HydrophobicContact CB-CD 4.27Å; C27-K44 HydrophobicContact CB-CG 4.34Å
28S91.6Very high91.5Very high14 Ų1478.3 Ų78.310%0.09837%0.373CS..Hα-helixtrans-63.1-43.2173.160.10000111.7S24 D25 I26 L31 Q32S24-S28 PolarHBondContact O-N 3.13Å; S24-S28 PolarHBondContact O-OG 3.44Å; D25-S28 PolarHBondContact O-OG 3.37Å; I26-S28 VanDerWaalsContact C-N 3.31Å; I26-S28 PolarHBondContact O-N 3.28Å; S28-L31 PolarHBondContact O-N 3.45Å; S28-Q32 WeakPolarHBondContact O-CG 3.38Å; S28-Q32 PolarHBondContact O-N 3.24Å
29K91.8Very high91.3Very high127 Ų12770.6 Ų70.655%0.55235%0.353SS*.Hα-helixtrans-60.7-47.6174.8-67.2170.6-1751780111.9D25 I26 L31 Q32 D33D25-K29 WeakPolarHBondContact O-CG 3.24Å; D25-K29 PolarHBondContact O-N 3.08Å; I26-K29 PolarHBondContact O-N 3.38Å; K29-L31 VanDerWaalsContact C-N 3.27Å; K29-L31 PolarHBondContact O-N 3.47Å; K29-Q32 WeakPolarHBondContact O-CB 3.45Å; K29-Q32 PolarHBondContact O-N 2.99Å; K29-Q32 VanDerWaalsContact O-N 3.14Å; K29-D33 PolarHBondContact O-N 3.03Å
30I91.9Very high91.1Very high15 Ų1566 Ų668%0.07733%0.333CS..Hα-helixtrans-58.8-40.6177.3-63.8166000111.1P7 L8 I26 C27 D33 S34 A40P7-I30 HydrophobicContact CB-CD1 3.98Å; P7-I30 HydrophobicContact CB-CG1 4.04Å; P7-I30 HydrophobicContact CG-CD1 4.38Å; P7-I30 HydrophobicContact CG-CG1 4.26Å; L8-I30 HydrophobicContact CB-CD1 4.3Å; L8-I30 HydrophobicContact CD1-CD1 4.45Å; I26-I30 HydrophobicContact CG2-CD1 3.93Å; I26-I30 HydrophobicContact CG2-CG1 4.41Å; I26-I30 WeakPolarHBondContact O-CG1 3.38Å; I26-I30 PolarHBondContact O-N 2.73Å; C27-I30 PolarHBondContact O-N 3.45Å; I30-D33 PolarHBondContact O-N 2.92Å; I30-S34 WeakPolarHBondContact O-CA 3.43Å; I30-S34 PolarHBondContact O-N 3.34Å; I30-S34 PolarHBondContact O-OG 3.4Å; I30-A40 HydrophobicContact CB-CB 4.1Å; I30-A40 HydrophobicContact CD1-CB 4.5Å; I30-A40 HydrophobicContact CG2-CB 3.65Å
31L90.8Very high91Very high32 Ų3266.2 Ų66.217%0.16833%0.333CS..Hα-helixtrans-72.9-28.7179.6-69.9170.8000113.2C27 S28 K29 S34 A40 W41 K44 F164C27-L31 WeakPolarHBondContact O-CB 3.41Å; C27-L31 WeakPolarHBondContact O-CG 3.18Å; C27-L31 PolarHBondContact O-N 3.36Å; S28-L31 PolarHBondContact O-N 3.45Å; K29-L31 VanDerWaalsContact C-N 3.27Å; K29-L31 PolarHBondContact O-N 3.47Å; L31-S34 CarbonylContact O-C 3.48Å; L31-A40 HydrophobicContact CD2-CB 4.19Å; L31-A40 HydrophobicContact CG-CB 4.27Å; L31-W41 HydrophobicContact CD2-CB 4.13Å; L31-K44 HydrophobicContact CD1-CD 3.98Å; L31-F164 HydrophobicContact CD1-CE2 3.85Å; L31-F164 HydrophobicContact CD1-CZ 4.02Å
32Q89.6Confident91.1Very high121 Ų12160.4 Ų60.457%0.56531%0.308SS*.Hα-helixtrans-68.7-42.9171.5-73.2171.56.300110.9S28 K29 E161S28-Q32 WeakPolarHBondContact O-CG 3.38Å; S28-Q32 PolarHBondContact O-N 3.24Å; K29-Q32 WeakPolarHBondContact O-CB 3.45Å; K29-Q32 PolarHBondContact O-N 2.99Å; K29-Q32 VanDerWaalsContact O-N 3.14Å; Q32-E161 PolarHBondContact NE2-OE1 3.04Å
33D91.3Very high91.1Very high141 Ų14156.6 Ų56.675%0.75429%0.291SS*.Hα-helixtrans-73.1-37.3178.5-64.4-24.5000112K29 I30K29-D33 PolarHBondContact O-N 3.03Å; I30-D33 PolarHBondContact O-N 2.92Å
34S91.5Very high91Very high45 Ų4557.6 Ų57.632%0.31530%0.295SS..  trans-134.994.5-17564.20000111.9I30 L31 Y36 D37I30-S34 WeakPolarHBondContact O-CA 3.43Å; I30-S34 PolarHBondContact O-N 3.34Å; I30-S34 PolarHBondContact O-OG 3.4Å; L31-S34 CarbonylContact O-C 3.48Å; S34-Y36 PolarHBondContact O-N 2.85Å; S34-Y36 VanDerWaalsContact O-N 3.15Å; S34-D37 PolarHBondContact O-N 3.08Å
35P87Confident91Very high100 Ų10057 Ų5765%0.64929%0.291SS*.THydrogen-bonded Turntrans-72.4-11.7-17226.7-34.6000114.5
36Y85.7Confident91Very high213 Ų21356.2 Ų56.284%0.83528%0.281SS*.THydrogen-bonded Turntrans-1023.4-176.6-64.9-68.5000114.4S34 Q38S34-Y36 PolarHBondContact O-N 2.85Å; S34-Y36 VanDerWaalsContact O-N 3.15Å; Y36-Q38 PolarHBondContact O-N 3.17Å; Y36-Q38 VanDerWaalsContact O-N 3.16Å
37D91.4Very high91Very high46 Ų4655 Ų5525%0.24628%0.275CS..  trans-77.2103.2-178.5-172.811.6000112.5S34 A39 A40 W41S34-D37 PolarHBondContact O-N 3.08Å; D37-A39 VanDerWaalsContact C-N 3.3Å; D37-A39 PolarHBondContact O-N 3.21Å; D37-A39 WeakPolarHBondContact OD1-CB 3.28Å; D37-A39 PolarHBondContact OD1-N 3.45Å; D37-A40 HydrophobicContact CB-CB 4.32Å; D37-A40 VanDerWaalsContact OD2-CB 3.26Å; D37-A40 WeakPolarHBondContact OD2-CB 3.47Å; D37-A40 PolarHBondContact OD2-N 2.98Å; D37-W41 WeakPolarHBondContact O-CB 3.5Å; D37-W41 PolarHBondContact O-N 3.04Å
38Q88.8Confident91Very high102 Ų10255.5 Ų55.548%0.47728%0.278SS..Hα-helixtrans-70.1-26.8177.1-72167.435.800112.4Y36 S42Y36-Q38 PolarHBondContact O-N 3.17Å; Y36-Q38 VanDerWaalsContact O-N 3.16Å; Q38-S42 WeakPolarHBondContact O-CB 3.23Å; Q38-S42 PolarHBondContact O-N 3.12Å; Q38-S42 PolarHBondContact O-OG 3.12Å
39A90.9Very high90.9Very high43 Ų4355 Ų5536%0.35527%0.274SS..Hα-helixtrans-70.3-53.7-178.500000110L8 D37 W41 S42 L43L8-A39 HydrophobicContact CD1-CB 4.5Å; L8-A39 HydrophobicContact CD2-CB 4.23Å; D37-A39 VanDerWaalsContact C-N 3.3Å; D37-A39 PolarHBondContact O-N 3.21Å; D37-A39 WeakPolarHBondContact OD1-CB 3.28Å; D37-A39 PolarHBondContact OD1-N 3.45Å; A39-W41 PolarHBondContact O-N 3.48Å; A39-S42 PolarHBondContact O-N 2.95Å; A39-S42 PolarHBondContact O-OG 3.4Å; A39-L43 WeakPolarHBondContact O-CB 3.5Å; A39-L43 PolarHBondContact O-N 3.17Å
40A91.6Very high90.9Very high0 Ų052.6 Ų52.60%027%0.265CS..Hα-helixtrans-57.2-37.8173.800000112.3L8 I30 L31 D37 L43 K44L8-A40 HydrophobicContact CD1-CB 4.35Å; I30-A40 HydrophobicContact CB-CB 4.1Å; I30-A40 HydrophobicContact CD1-CB 4.5Å; I30-A40 HydrophobicContact CG2-CB 3.65Å; L31-A40 HydrophobicContact CD2-CB 4.19Å; L31-A40 HydrophobicContact CG-CB 4.27Å; D37-A40 HydrophobicContact CB-CB 4.32Å; D37-A40 VanDerWaalsContact OD2-CB 3.26Å; D37-A40 WeakPolarHBondContact OD2-CB 3.47Å; D37-A40 PolarHBondContact OD2-N 2.98Å; A40-L43 PolarHBondContact O-N 3.3Å; A40-K44 WeakPolarHBondContact O-CB 3.43Å; A40-K44 PolarHBondContact O-N 3.42Å
41W91.4Very high90.7Very high36 Ų3655.5 Ų55.514%0.13628%0.279CS..Hα-helixtrans-62.3-51.1175.5-175.385.2000112.6L31 D37 A39 L43 K44 T45 F164 I165 Y175 L181 L185L31-W41 HydrophobicContact CD2-CB 4.13Å; D37-W41 WeakPolarHBondContact O-CB 3.5Å; D37-W41 PolarHBondContact O-N 3.04Å; A39-W41 PolarHBondContact O-N 3.48Å; W41-L43 PolarHBondContact O-N 2.83Å; W41-K44 PolarHBondContact O-N 3.09Å; W41-T45 HydrophobicContact CD2-CG2 4.34Å; W41-T45 HydrophobicContact CE3-CG2 4.42Å; W41-T45 HydrophobicContact CH2-CG2 4.39Å; W41-T45 HydrophobicContact CZ2-CG2 4.29Å; W41-T45 HydrophobicContact CZ3-CG2 4.44Å; W41-T45 PolarHBondContact O-N 3.14Å; W41-F164 AromaticContact CD1-CZ 3.38Å; W41-F164 HydrophobicContact CG-CZ 4.17Å; W41-F164 AromaticContact NE1-CE1 3.89Å; W41-F164 AromaticContact NE1-CZ 3.62Å; W41-I165 HydrophobicContact CH2-CD1 4.26Å; W41-I165 HydrophobicContact CZ2-CD1 3.32Å; W41-I165 HydrophobicContact CZ2-CG1 4.01Å; W41-Y175 HydrophobicContact CH2-CD1 4.41Å; W41-Y175 AromaticContact CH2-CE1 3.87Å; W41-Y175 HydrophobicContact CH2-CE1 3.87Å; W41-Y175 HydrophobicContact CZ3-CE1 4.21Å; W41-L181 HydrophobicContact CE3-CD2 4.15Å; W41-L181 HydrophobicContact CZ3-CD2 4.08Å; W41-L185 HydrophobicContact CH2-CB 4.45Å; W41-L185 HydrophobicContact CH2-CD1 3.97Å; W41-L185 HydrophobicContact CH2-CD2 4.41Å; W41-L185 HydrophobicContact CZ2-CD1 4.41Å
42S92.2Very high90.7Very high23 Ų2357.2 Ų57.216%0.16129%0.29CS..Hα-helixtrans-66-26.2178.271.30000113.6Q38 A39 T45 R46Q38-S42 WeakPolarHBondContact O-CB 3.23Å; Q38-S42 PolarHBondContact O-N 3.12Å; Q38-S42 PolarHBondContact O-OG 3.12Å; A39-S42 PolarHBondContact O-N 2.95Å; A39-S42 PolarHBondContact O-OG 3.4Å; S42-T45 WeakPolarHBondContact CA-OG1 3.28Å; S42-T45 PolarHBondContact O-OG1 3.37Å; S42-R46 WeakPolarHBondContact O-CG 3.31Å; S42-R46 PolarHBondContact O-N 3.06Å; S42-R46 PolarHBondContact O-NE 3.31Å
43L93.1Very high90.6Very high5 Ų556.6 Ų56.63%0.02628%0.284CS..Hα-helixtrans-77.2-42.4177-153.7171.5000109.7L8 A11 L12 F15 C23 A39 A40 W41 R46 A47L8-L43 HydrophobicContact CD1-CD1 4.19Å; A11-L43 HydrophobicContact CB-CD1 4.27Å; L12-L43 HydrophobicContact CB-CD1 4.09Å; F15-L43 HydrophobicContact CB-CD2 4.03Å; F15-L43 HydrophobicContact CD2-CD2 4.34Å; F15-L43 HydrophobicContact CG-CD2 4.25Å; C23-L43 WeakPolarHBondContact SG-CD2 3.44Å; A39-L43 WeakPolarHBondContact O-CB 3.5Å; A39-L43 PolarHBondContact O-N 3.17Å; A40-L43 PolarHBondContact O-N 3.3Å; W41-L43 PolarHBondContact O-N 2.83Å; L43-R46 PolarHBondContact O-N 3.49Å; L43-A47 WeakPolarHBondContact O-CB 3.24Å; L43-A47 PolarHBondContact O-N 3.12Å
44K92.4Very high90.5Very high21 Ų2154.7 Ų54.79%0.09127%0.272CS..Hα-helixtrans-62-44.1173.2-173.6165.6170.2179.80112.1C27 L31 A40 W41 R46 A47 L48 F164C27-K44 HydrophobicContact CB-CB 3.76Å; C27-K44 HydrophobicContact CB-CD 4.27Å; C27-K44 HydrophobicContact CB-CG 4.34Å; L31-K44 HydrophobicContact CD1-CD 3.98Å; A40-K44 WeakPolarHBondContact O-CB 3.43Å; A40-K44 PolarHBondContact O-N 3.42Å; W41-K44 PolarHBondContact O-N 3.09Å; K44-R46 VanDerWaalsContact C-N 3.35Å; K44-R46 PolarHBondContact O-N 2.99Å; K44-A47 PolarHBondContact O-N 2.89Å; K44-L48 HydrophobicContact CG-CD1 4.21Å; K44-L48 HydrophobicContact CG-CG 4.44Å; K44-L48 VanDerWaalsContact O-CG 3.31Å; K44-L48 WeakPolarHBondContact O-CG 3.33Å; K44-L48 PolarHBondContact O-N 3.48Å; K44-F164 HydrophobicContact CB-CE1 4.19Å; K44-F164 HydrophobicContact CB-CZ 3.95Å; K44-F164 HydrophobicContact CD-CD2 3.95Å; K44-F164 HydrophobicContact CD-CE1 4.24Å; K44-F164 HydrophobicContact CD-CE2 3.48Å; K44-F164 VanDerWaalsContact CD-CE2 3.48Å; K44-F164 HydrophobicContact CD-CZ 3.64Å; K44-F164 VanDerWaalsContact CE-CD2 3.45Å; K44-F164 HydrophobicContact CG-CD1 4.44Å; K44-F164 HydrophobicContact CG-CE1 3.97Å; K44-F164 HydrophobicContact CG-CE2 4.14Å; K44-F164 HydrophobicContact CG-CZ 3.81Å
45T90.7Very high90.4Very high0 Ų055.5 Ų55.50%027%0.273CS..Hα-helixtrans-57.5-48.417652.40000111.1W41 S42 A47 L48 T49 F164 I165 Y188W41-T45 HydrophobicContact CD2-CG2 4.34Å; W41-T45 HydrophobicContact CE3-CG2 4.42Å; W41-T45 HydrophobicContact CH2-CG2 4.39Å; W41-T45 HydrophobicContact CZ2-CG2 4.29Å; W41-T45 HydrophobicContact CZ3-CG2 4.44Å; W41-T45 PolarHBondContact O-N 3.14Å; S42-T45 WeakPolarHBondContact CA-OG1 3.28Å; S42-T45 PolarHBondContact O-OG1 3.37Å; T45-A47 PolarHBondContact O-N 3.13Å; T45-L48 PolarHBondContact O-N 2.84Å; T45-T49 WeakPolarHBondContact O-CG2 3.25Å; T45-T49 PolarHBondContact O-N 2.65Å; T45-T49 PolarHBondContact O-OG1 3.23Å; T45-F164 HydrophobicContact CG2-CD1 4.3Å; T45-F164 HydrophobicContact CG2-CE1 3.64Å; T45-I165 HydrophobicContact CG2-CD1 3.7Å; T45-Y188 HydrophobicContact CG2-CD2 4.42Å; T45-Y188 HydrophobicContact CG2-CG 4.46Å
46R92.9Very high90.5Very high70 Ų7051 Ų5126%0.26424%0.244SC..Hα-helixtrans-62.9-41.4178.3-73-173.8-61.3154.53.8113.4F15 S42 L43 K44 L48 T49 E50 T184F15-R46 HydrophobicContact CE2-CB 3.74Å; F15-R46 HydrophobicContact CZ-CB 3.83Å; S42-R46 WeakPolarHBondContact O-CG 3.31Å; S42-R46 PolarHBondContact O-N 3.06Å; S42-R46 PolarHBondContact O-NE 3.31Å; L43-R46 PolarHBondContact O-N 3.49Å; K44-R46 VanDerWaalsContact C-N 3.35Å; K44-R46 PolarHBondContact O-N 2.99Å; R46-L48 VanDerWaalsContact C-N 3.33Å; R46-L48 PolarHBondContact O-N 3.48Å; R46-T49 VanDerWaalsContact CA-OG1 3.29Å; R46-T49 WeakPolarHBondContact CA-OG1 3.36Å; R46-T49 PolarHBondContact O-N 3.04Å; R46-T49 PolarHBondContact O-OG1 3.39Å; R46-E50 WeakPolarHBondContact O-CB 3.28Å; R46-E50 WeakPolarHBondContact O-CG 3.27Å; R46-E50 PolarHBondContact O-N 2.93Å; R46-T184 HydrophobicContact CG-CG2 3.77Å
47A93.1Very high90.6Very high0 Ų041.9 Ų41.90%021%0.21CC..Hα-helixtrans-62.6-43.1176.600000111.1F15 F20 C23 L43 K44 T45 M51F15-A47 HydrophobicContact CD2-CB 4.28Å; F20-A47 HydrophobicContact CB-CB 4.47Å; C23-A47 HydrophobicContact CB-CB 4.37Å; L43-A47 WeakPolarHBondContact O-CB 3.24Å; L43-A47 PolarHBondContact O-N 3.12Å; K44-A47 PolarHBondContact O-N 2.89Å; T45-A47 PolarHBondContact O-N 3.13Å; A47-M51 WeakPolarHBondContact O-CE 3.37Å; A47-M51 WeakPolarHBondContact O-CG 3.26Å; A47-M51 PolarHBondContact O-N 3.22Å
48L90.9Very high90.2Very high11 Ų1142.9 Ų42.96%0.05822%0.215CC..Hα-helixtrans-63.4-42.5176.1-68.7175.9000111.9K44 T45 R46 M51 V52 F164 Y188K44-L48 HydrophobicContact CG-CD1 4.21Å; K44-L48 HydrophobicContact CG-CG 4.44Å; K44-L48 VanDerWaalsContact O-CG 3.31Å; K44-L48 WeakPolarHBondContact O-CG 3.33Å; K44-L48 PolarHBondContact O-N 3.48Å; T45-L48 PolarHBondContact O-N 2.84Å; R46-L48 VanDerWaalsContact C-N 3.33Å; R46-L48 PolarHBondContact O-N 3.48Å; L48-M51 HydrophobicContact CD2-CE 3.66Å; L48-M51 HydrophobicContact CG-CE 4.48Å; L48-V52 WeakPolarHBondContact O-CG2 3.32Å; L48-F164 HydrophobicContact CD1-CB 3.9Å; L48-F164 HydrophobicContact CD1-CD1 3.68Å; L48-F164 HydrophobicContact CD1-CE1 4.47Å; L48-F164 HydrophobicContact CD1-CG 3.94Å; L48-Y188 HydrophobicContact CB-CD2 4.48Å; L48-Y188 HydrophobicContact CB-CE2 4.16Å; L48-Y188 HydrophobicContact CD1-CE2 4.01Å
49T90.6Very high89.8Confident3 Ų338.8 Ų38.82%0.01820%0.197CC..Hα-helixtrans-66.2-47.2177.750.20000112.6T45 R46 M51 V52 Y53 Y188 H192T45-T49 WeakPolarHBondContact O-CG2 3.25Å; T45-T49 PolarHBondContact O-N 2.65Å; T45-T49 PolarHBondContact O-OG1 3.23Å; R46-T49 VanDerWaalsContact CA-OG1 3.29Å; R46-T49 WeakPolarHBondContact CA-OG1 3.36Å; R46-T49 PolarHBondContact O-N 3.04Å; R46-T49 PolarHBondContact O-OG1 3.39Å; T49-M51 PolarHBondContact O-N 3.22Å; T49-V52 CarbonylContact O-C 3.51Å; T49-V52 PolarHBondContact O-N 3.11Å; T49-Y53 WeakPolarHBondContact O-CA 3.46Å; T49-Y53 WeakPolarHBondContact O-CB 3.33Å; T49-Y53 PolarHBondContact O-N 3.03Å; T49-Y188 HydrophobicContact CG2-CD2 3.96Å; T49-Y188 HydrophobicContact CG2-CG 4.32Å; T49-H192 HydrophobicContact CG2-CB 4.19Å
50E91.1Very high89.2Confident78 Ų7837.6 Ų37.636%0.36419%0.185SC..Hα-helixtrans-67-21-175.9-71.8-174.9-177.300112.7F15 F20 R46 V52F15-E50 HydrophobicContact CE2-CG 4.46Å; F15-E50 VanDerWaalsContact CE2-OE2 3.22Å; F15-E50 WeakPolarHBondContact CE2-OE2 3.13Å; F15-E50 VanDerWaalsContact CZ-CD 3.41Å; F15-E50 WeakPolarHBondContact CZ-OE1 3.08Å; F15-E50 VanDerWaalsContact CZ-OE2 3.27Å; F15-E50 WeakPolarHBondContact CZ-OE2 3.47Å; F20-E50 HydrophobicContact CD1-CB 4.32Å; F20-E50 HydrophobicContact CD2-CB 4.3Å; F20-E50 HydrophobicContact CE1-CB 3.87Å; F20-E50 WeakPolarHBondContact CE1-OE2 3.27Å; F20-E50 HydrophobicContact CE2-CB 3.81Å; F20-E50 HydrophobicContact CZ-CB 3.58Å; F20-E50 HydrophobicContact CZ-CG 4.44Å; F20-E50 WeakPolarHBondContact CZ-OE2 3.21Å; R46-E50 WeakPolarHBondContact O-CB 3.28Å; R46-E50 WeakPolarHBondContact O-CG 3.27Å; R46-E50 PolarHBondContact O-N 2.93Å; E50-V52 VanDerWaalsContact C-N 3.32Å
51M88.7Confident88.6Confident76 Ų7638.9 Ų38.937%0.37419%0.191SC..Hα-helixtrans-66.2-31.6170.7-77.2-171.5-79.600113.6F20 Q21 A47 L48 T49F20-M51 HydrophobicContact CB-CE 4.27Å; F20-M51 HydrophobicContact CB-CG 3.31Å; F20-M51 HydrophobicContact CB-SD 3.77Å; F20-M51 HydrophobicContact CD2-CG 3.85Å; F20-M51 HydrophobicContact CG-CG 3.96Å; Q21-M51 HydrophobicContact CG-SD 3.81Å; A47-M51 WeakPolarHBondContact O-CE 3.37Å; A47-M51 WeakPolarHBondContact O-CG 3.26Å; A47-M51 PolarHBondContact O-N 3.22Å; L48-M51 HydrophobicContact CD2-CE 3.66Å; L48-M51 HydrophobicContact CG-CE 4.48Å; T49-M51 PolarHBondContact O-N 3.22Å
52V89.5Confident88.1Confident67 Ų6737.8 Ų37.841%0.40619%0.187SC..Hα-helixtrans-115.95.3-178.2-75.10000112.8L48 T49 E50 I54 H192L48-V52 WeakPolarHBondContact O-CG2 3.32Å; T49-V52 CarbonylContact O-C 3.51Å; T49-V52 PolarHBondContact O-N 3.11Å; E50-V52 VanDerWaalsContact C-N 3.32Å; V52-I54 PolarHBondContact O-N 3.48Å; V52-H192 HydrophobicContact CG2-CB 4.16Å
53Y89Confident87.7Confident108 Ų10836.7 Ų36.742%0.42418%0.18SC..  trans-65.5129.9-175.7-176.1-88.3000110.2T49 H191T49-Y53 WeakPolarHBondContact O-CA 3.46Å; T49-Y53 WeakPolarHBondContact O-CB 3.33Å; T49-Y53 PolarHBondContact O-N 3.03Å; Y53-H191 HydrophobicContact CD2-CB 4.42Å; Y53-H191 AromaticContact CD2-CD2 3.8Å; Y53-H191 AromaticContact CD2-CG 3.85Å; Y53-H191 AromaticContact CD2-ND1 4Å; Y53-H191 AromaticContact CD2-NE2 3.95Å; Y53-H191 AromaticContact CE2-CD2 3.66Å; Y53-H191 AromaticContact CE2-CE1 3.56Å; Y53-H191 AromaticContact CE2-ND1 3.99Å; Y53-H191 AromaticContact CE2-NE2 3.35Å; Y53-H191 WeakPolarHBondContact CE2-NE2 3.44Å
54I88.3Confident87.4Confident101 Ų10137.2 Ų37.252%0.51818%0.182SC..  trans-132.8135.2172.7-55.5170.6000105.7V52 E56 V59V52-I54 PolarHBondContact O-N 3.48Å; I54-E56 PolarHBondContact O-N 3.48Å; I54-V59 HydrophobicContact CB-CG2 4.21Å; I54-V59 HydrophobicContact CG2-CG2 3.32Å
55D89.9Confident87.1Confident62 Ų6237.6 Ų37.633%0.33219%0.19SC..  trans-65.7131.6178.1-167.4-6000110.4V57 V59 Y253D55-V57 PolarHBondContact O-N 3.19Å; D55-V57 PolarHBondContact OD1-N 3.08Å; D55-V59 VanDerWaalsContact O-CG2 3.27Å; D55-V59 WeakPolarHBondContact O-CG2 3.2Å; D55-V59 PolarHBondContact O-N 3.5Å; D55-Y253 PolarHBondContact OD1-OH 2.86Å
56E88.4Confident86.8Confident6 Ų639 Ų393%0.02820%0.196CC..THydrogen-bonded Turntrans-71.6-21.3-176.8-168.763.1-175.800112I54 D58 V59 K223 R227 Y253 K256I54-E56 PolarHBondContact O-N 3.48Å; E56-D58 PolarHBondContact O-N 3.14Å; E56-V59 PolarHBondContact O-N 2.89Å; E56-K223 HydrophobicContact CB-CD 4.34Å; E56-K223 HydrophobicContact CG-CD 4.33Å; E56-R227 IonicContact OE1-CZ 3.26Å; E56-R227 IonicContact OE1-NE 2.59Å; E56-R227 PolarHBondContact OE1-NE 2.92Å; E56-R227 IonicContact OE1-NH2 3.79Å; E56-R227 IonicContact OE2-CZ 2.82Å; E56-R227 IonicContact OE2-NE 3.81Å; E56-R227 PolarHBondContact OE2-NE 3.36Å; E56-R227 IonicContact OE2-NH2 3.23Å; E56-R227 PolarHBondContact OE2-NH2 3.45Å; E56-Y253 HydrophobicContact CB-CE1 4.06Å; E56-Y253 HydrophobicContact CG-CE1 4.35Å; E56-K256 PolarHBondContact O-NZ 3.35Å
57V87.8Confident86.4Confident22 Ų2236.1 Ų36.113%0.13319%0.186CC..THydrogen-bonded Turntrans-59.8-49.5178.3177.50000110.5D55 L252 Y253D55-V57 PolarHBondContact O-N 3.19Å; D55-V57 PolarHBondContact OD1-N 3.08Å; V57-L252 HydrophobicContact CG1-CB 3.93Å; V57-L252 HydrophobicContact CG1-CD1 4.2Å; V57-L252 HydrophobicContact CG2-CB 4.19Å; V57-L252 HydrophobicContact CG2-CD1 4.38Å; V57-Y253 HydrophobicContact CB-CE1 4.37Å; V57-Y253 HydrophobicContact CG2-CD1 4.12Å; V57-Y253 HydrophobicContact CG2-CE1 3.46Å; V57-Y253 VanDerWaalsContact CG2-CE1 3.46Å; V57-Y253 HydrophobicContact CG2-CE2 4.39Å
58D82.9Confident85.8Confident66 Ų6638.8 Ų38.835%0.35320%0.199SC..THydrogen-bonded Turntrans-81.3-18.3-176-67.6-33.2000113.5E56 D60 R290E56-D58 PolarHBondContact O-N 3.14Å; D58-D60 PolarHBondContact O-N 3Å; D58-R290 IonicContact OD1-NH1 2.93Å
59V81.1Confident85.4Confident17 Ų1744.6 Ų44.610%0.10323%0.229CC..  trans-82.186.3178.5-178.40000109.4I54 D55 E56 F148 K256I54-V59 HydrophobicContact CB-CG2 4.21Å; I54-V59 HydrophobicContact CG2-CG2 3.32Å; D55-V59 VanDerWaalsContact O-CG2 3.27Å; D55-V59 WeakPolarHBondContact O-CG2 3.2Å; D55-V59 PolarHBondContact O-N 3.5Å; E56-V59 PolarHBondContact O-N 2.89Å; V59-F148 HydrophobicContact CG1-CE2 4.45Å; V59-F148 HydrophobicContact CG1-CZ 3.77Å; V59-K256 PolarHBondContact O-NZ 2.7Å
60D78.8Confident84.8Confident17 Ų1747.9 Ų47.99%0.09125%0.247CC..  trans-127.170.7176.4-152.940.3000111.7D58 S116 Y226 K256 R260D58-D60 PolarHBondContact O-N 3Å; D60-S116 WeakPolarHBondContact O-CA 3.19Å; D60-Y226 PolarHBondContact OD1-OH 3.02Å; D60-K256 WeakPolarHBondContact OD1-CE 3.29Å; D60-K256 IonicContact OD1-NZ 2.77Å; D60-R260 VanDerWaalsContact CG-NE 3.34Å; D60-R260 IonicContact OD1-CZ 2.68Å; D60-R260 IonicContact OD1-NE 3.8Å; D60-R260 PolarHBondContact OD1-NE 3.25Å; D60-R260 IonicContact OD1-NH2 3.46Å; D60-R260 PolarHBondContact OD1-NH2 3.25Å; D60-R260 IonicContact OD2-CZ 3.57Å; D60-R260 VanDerWaalsContact OD2-CZ 3.26Å; D60-R260 IonicContact OD2-NE 3.25Å; D60-R260 PolarHBondContact OD2-NE 3.39Å; D60-R260 IonicContact OD2-NH2 3.47Å; D60-R260 PolarHBondContact OD2-NH2 3.49Å
61Q77.7Confident84.3Confident28 Ų2851.3 Ų51.313%0.13126%0.263CS..  trans-83137.1175.5-71.2168.132.500109.1S145 R260Q61-S145 VanDerWaalsContact O-CB 3.28Å; Q61-S145 WeakPolarHBondContact O-CB 3.4Å; Q61-S145 PolarHBondContact O-OG 3.18Å; Q61-R260 PolarHBondContact O-NH2 3.47Å; Q61-R260 VanDerWaalsContact O-NH2 3.16Å
62E80.7Confident83.9Confident13 Ų1349.3 Ų49.36%0.06126%0.256CS..  trans-108121.4168.9-69.3-166.1152.200108.1M67 R121 R260E62-M67 HydrophobicContact CB-CE 3.59Å; E62-M67 HydrophobicContact CB-CG 3.88Å; E62-R121 IonicContact OE1-CZ 2.73Å; E62-R121 IonicContact OE1-NH2 3.65Å; E62-R121 PolarHBondContact OE1-NH2 3.19Å; E62-R121 IonicContact OE2-CZ 2.83Å; E62-R121 IonicContact OE2-NE 3.93Å; E62-R121 IonicContact OE2-NH2 3.76Å; E62-R121 PolarHBondContact OE2-NH2 3.37Å; E62-R260 VanDerWaalsContact CG-NH1 3.29Å; E62-R260 WeakPolarHBondContact OE1-CD 3.45Å; E62-R260 IonicContact OE1-CZ 3.18Å; E62-R260 VanDerWaalsContact OE1-CZ 3.23Å; E62-R260 IonicContact OE1-NE 3.74Å; E62-R260 PolarHBondContact OE1-NE 2.83Å; E62-R260 IonicContact OE1-NH1 3.26Å; E62-R260 PolarHBondContact OE1-NH1 3.5Å; E62-R260 IonicContact OE1-NH2 3.38Å
63G85Confident83.6Confident0 Ų047 Ų470%024%0.243CC..  trans-77.5166.4167.800000111.3A65 E66 M67 T142G63-A65 PolarHBondContact O-N 3.25Å; G63-E66 PolarHBondContact N-OE2 2.86Å; G63-E66 PolarHBondContact O-N 2.91Å; G63-M67 WeakPolarHBondContact O-CG 3.41Å; G63-M67 PolarHBondContact O-N 3.45Å; G63-T142 CarbonylContact C-O 3.59Å; G63-T142 VanDerWaalsContact CA-O 3.29Å; G63-T142 WeakPolarHBondContact CA-O 3.48Å
64I85.8Confident83.4Confident15 Ų1548 Ų488%0.07725%0.254CS..Hα-helixtrans-59.7-37.2177.9-52.8172.1000111.2M67 M68 M125 A128 V141 T142 S143I64-M67 PolarHBondContact O-N 3.3Å; I64-M68 HydrophobicContact CG2-CG 4.36Å; I64-M68 WeakPolarHBondContact O-CB 3.48Å; I64-M68 WeakPolarHBondContact O-CG 3.5Å; I64-M68 PolarHBondContact O-N 3.4Å; I64-M125 HydrophobicContact CB-CE 4.05Å; I64-M125 HydrophobicContact CB-SD 4.43Å; I64-M125 HydrophobicContact CD1-CE 4.22Å; I64-M125 HydrophobicContact CG2-CE 3.45Å; I64-M125 VanDerWaalsContact CG2-CE 3.45Å; I64-M125 HydrophobicContact CG2-SD 3.35Å; I64-M125 WeakPolarHBondContact CG2-SD 3.38Å; I64-A128 HydrophobicContact CD1-CB 4.38Å; I64-A128 HydrophobicContact CG1-CB 4.47Å; I64-A128 HydrophobicContact CG2-CB 3.65Å; I64-V141 HydrophobicContact CD1-CG1 3.95Å; I64-V141 HydrophobicContact CG1-CG1 3.94Å; I64-V141 HydrophobicContact CG1-CG2 3.84Å; I64-T142 PolarHBondContact N-O 3.23Å; I64-S143 PolarHBondContact N-O 2.88Å
65A86.1Confident83.3Confident30 Ų3045.6 Ų45.625%0.24825%0.25CS..Hα-helixtrans-62.8-44.417700000112.2G63 M67 M68 L69 D70 S143G63-A65 PolarHBondContact O-N 3.25Å; A65-M67 VanDerWaalsContact C-N 3.33Å; A65-M67 PolarHBondContact O-N 2.89Å; A65-M68 PolarHBondContact O-N 3.36Å; A65-L69 HydrophobicContact CB-CD1 4.17Å; A65-L69 WeakPolarHBondContact O-CA 3.44Å; A65-L69 VanDerWaalsContact O-CB 3.27Å; A65-L69 WeakPolarHBondContact O-CB 3.21Å; A65-L69 PolarHBondContact O-N 2.82Å; A65-D70 PolarHBondContact O-N 3.27Å; A65-S143 WeakPolarHBondContact CB-O 3.17Å; A65-S143 PolarHBondContact N-O 3.44Å
66E85.3Confident83Confident28 Ų2850.7 Ų50.713%0.13127%0.272CS..Hα-helixtrans-69.3-33178.7-71.5152.1-13700112G63 M68 D70 S145 R260G63-E66 PolarHBondContact N-OE2 2.86Å; G63-E66 PolarHBondContact O-N 2.91Å; E66-M68 VanDerWaalsContact C-N 3.32Å; E66-M68 PolarHBondContact O-N 3.43Å; E66-D70 WeakPolarHBondContact CG-OD2 3.41Å; E66-S145 VanDerWaalsContact CD-CB 3.42Å; E66-S145 WeakPolarHBondContact OE1-CA 3.41Å; E66-S145 WeakPolarHBondContact OE1-CB 3.29Å; E66-S145 PolarHBondContact OE1-N 3.18Å; E66-S145 WeakPolarHBondContact OE2-CB 3.47Å; E66-R260 IonicContact OE2-NH1 2.92Å
67M83.4Confident82.8Confident10 Ų1056.7 Ų56.75%0.04931%0.308CS..Hα-helixtrans-66.2-35.6176.4-70.5-177.9177.400112.6E62 G63 I64 A65 P122 T137E62-M67 HydrophobicContact CB-CE 3.59Å; E62-M67 HydrophobicContact CB-CG 3.88Å; G63-M67 WeakPolarHBondContact O-CG 3.41Å; G63-M67 PolarHBondContact O-N 3.45Å; I64-M67 PolarHBondContact O-N 3.3Å; A65-M67 VanDerWaalsContact C-N 3.33Å; A65-M67 PolarHBondContact O-N 2.89Å; M67-P122 HydrophobicContact SD-CG 4.3Å; M67-T137 HydrophobicContact CE-CG2 3.8Å
68M82.1Confident82.7Confident56 Ų5656.3 Ų56.328%0.27631%0.308SS..Hα-helixtrans-112.5-39.3-166.5-62.3-51.8-57.200115.2I64 A65 E66 P122 G123I64-M68 HydrophobicContact CG2-CG 4.36Å; I64-M68 WeakPolarHBondContact O-CB 3.48Å; I64-M68 WeakPolarHBondContact O-CG 3.5Å; I64-M68 PolarHBondContact O-N 3.4Å; A65-M68 PolarHBondContact O-N 3.36Å; E66-M68 VanDerWaalsContact C-N 3.32Å; E66-M68 PolarHBondContact O-N 3.43Å; M68-P122 HydrophobicContact SD-CG 4.32Å; M68-G123 VanDerWaalsContact CE-O 3.26Å; M68-G123 WeakPolarHBondContact CE-O 3.37Å
69L81Confident82.9Confident133 Ų13362.7 Ų62.770%0.69633%0.327SS*.THydrogen-bonded Turntrans-96.2-28.4-172.7-55.5177.7000111.9A65 E71A65-L69 HydrophobicContact CB-CD1 4.17Å; A65-L69 WeakPolarHBondContact O-CA 3.44Å; A65-L69 VanDerWaalsContact O-CB 3.27Å; A65-L69 WeakPolarHBondContact O-CB 3.21Å; A65-L69 PolarHBondContact O-N 2.82Å; L69-E71 PolarHBondContact O-N 2.97Å
70D78.1Confident83Confident73 Ų7365.6 Ų65.639%0.3935%0.346SS..  trans-86.692178.4-70.4-18000110.9A65 E66 S72A65-D70 PolarHBondContact O-N 3.27Å; E66-D70 WeakPolarHBondContact CG-OD2 3.41Å; D70-S72 PolarHBondContact O-N 3.42Å
71E79.9Confident83.1Confident150 Ų15065.8 Ų65.870%0.70135%0.352SS*.  trans-82.984.5170-70-167.7172.200111.1L69L69-E71 PolarHBondContact O-N 2.97Å
72S81.3Confident83.5Confident34 Ų3466.8 Ų66.824%0.23836%0.361CS..  trans-89.3-14174.8560000114D70 R260D70-S72 PolarHBondContact O-N 3.42Å; S72-R260 PolarHBondContact OG-O 2.67Å
73S83.7Confident83.8Confident19 Ų1966.3 Ų66.313%0.13336%0.359CS..  trans-79.4130.2-177.755.40000111.5R85S73-R85 PolarHBondContact OG-NH1 3.18Å
74I84.9Confident83.7Confident127 Ų12767.6 Ų67.665%0.65137%0.365SS*.SBendtrans-71-42.9178.4-62.4169000111.4
75A85.1Confident83.4Confident52 Ų5271.6 Ų71.643%0.4338%0.379SS..  trans-94.1124.4-176.800000110.3A78A75-A78 HydrophobicContact CB-CB 4.27Å
76Q83.2Confident82.8Confident168 Ų16874 Ų7479%0.78539%0.387SS*.SBendtrans-77.5-38.2174.7-68.9-178.6-16.400112.2
77V86.1Confident81.6Confident132 Ų13274.3 Ų74.380%0.839%0.392SS*.SBendtrans-125.780.4177.4-169.70000108.2
78A85.4Confident80.5Confident15 Ų1574.6 Ų74.612%0.12440%0.398CS..PPolyproline II helixtrans-67.9155.917600000111A75A75-A78 HydrophobicContact CB-CB 4.27Å
79R86.6Confident79.2Confident199 Ų19976.9 Ų76.975%0.75142%0.415SS*.PPolyproline II helixtrans-61.2137.3171.8-178.6178.2174.9173.8-1.2109.1G81 T82R79-G81 PolarHBondContact O-N 3.02Å; R79-T82 HydrophobicContact CB-CG2 4.05Å; R79-T82 HydrophobicContact CG-CG2 4.4Å; R79-T82 PolarHBondContact N-OG1 3.39Å; R79-T82 PolarHBondContact O-N 3.14Å; R79-T82 PolarHBondContact O-OG1 3.49Å
80P83Confident77.7Confident78 Ų7874.3 Ų74.351%0.50641%0.408SS..THydrogen-bonded Turntrans-53.6129.9176-27.234.7000111.5
81G80.1Confident76.3Confident21 Ų2179.9 Ų79.922%0.21643%0.432CS..THydrogen-bonded Turntrans86.6-0.9-177.700000115.4R79 L86R79-G81 PolarHBondContact O-N 3.02Å; G81-L86 PolarHBondContact N-O 3.01Å
82T85.9Confident74.9Confident50 Ų5073.5 Ų73.531%0.30741%0.406SS..SBendtrans-106.62.3173.171.90000113.6R79 P264 I265R79-T82 HydrophobicContact CB-CG2 4.05Å; R79-T82 HydrophobicContact CG-CG2 4.4Å; R79-T82 PolarHBondContact N-OG1 3.39Å; R79-T82 PolarHBondContact O-N 3.14Å; R79-T82 PolarHBondContact O-OG1 3.49Å; T82-P264 WeakPolarHBondContact O-CD 3.37Å; T82-P264 WeakPolarHBondContact O-CG 3.11Å; T82-I265 HydrophobicContact CG2-CD1 3.84Å
83S86.9Confident73.8Confident3 Ų375.3 Ų75.32%0.02143%0.43CS..SBendtrans-136150.8-179.9160.20000109.3R85 L86 D262S83-R85 VanDerWaalsContact C-N 3.35Å; S83-R85 PolarHBondContact OG-N 3.13Å; S83-R85 VanDerWaalsContact OG-N 3.08Å; S83-L86 CarbonylContact O-C 3.47Å; S83-D262 WeakPolarHBondContact CB-OD2 3.42Å; S83-D262 VanDerWaalsContact OG-CG 3.24Å; S83-D262 PolarHBondContact OG-OD1 3.42Å; S83-D262 PolarHBondContact OG-OD2 3.33Å
84L82.9Confident73.1Confident27 Ų2775.9 Ų75.914%0.14144%0.439CS..SBendtrans-77.4-25175.2-60.6174.5000111.7R107 Q259 D262 P264 E294 M295L84-R107 PolarHBondContact O-NH2 3.36Å; L84-Q259 HydrophobicContact CD1-CB 4.37Å; L84-Q259 HydrophobicContact CD1-CG 4.4Å; L84-D262 WeakPolarHBondContact CB-OD1 3.27Å; L84-D262 PolarHBondContact N-OD1 3.07Å; L84-P264 HydrophobicContact CD2-CB 3.83Å; L84-P264 HydrophobicContact CD2-CG 4.27Å; L84-P264 HydrophobicContact CG-CB 4.08Å; L84-P264 HydrophobicContact CG-CG 4.21Å; L84-E294 HydrophobicContact CD2-CB 3.77Å; L84-M295 HydrophobicContact CD2-CG 4.08Å
85R80.8Confident73Confident99 Ų9971.1 Ų71.137%0.37442%0.417SS..SBendtrans-74.6-38.5178.3-61.1-179.6178.6-168.90.7112.2S73 S83 P87S73-R85 PolarHBondContact OG-NH1 3.18Å; S83-R85 VanDerWaalsContact C-N 3.35Å; S83-R85 PolarHBondContact OG-N 3.13Å; S83-R85 VanDerWaalsContact OG-N 3.08Å; R85-P87 VanDerWaalsContact C-CD 3.4Å; R85-P87 WeakPolarHBondContact O-CD 3.28Å
86L72.6Confident73Confident79 Ų7971.2 Ų71.241%0.41441%0.412SS..SBendtrans-112.475.7175.1-75.9156.7000108.4G81 S83G81-L86 PolarHBondContact N-O 3.01Å; S83-L86 CarbonylContact O-C 3.47Å
87P61.4Low73.2Confident36 Ų3664.5 Ų64.523%0.23438%0.382CS..PPolyproline II helixtrans-55.4146.8172.626.3-33.1000108.5R85 T89 N296R85-P87 VanDerWaalsContact C-CD 3.4Å; R85-P87 WeakPolarHBondContact O-CD 3.28Å; P87-T89 PolarHBondContact O-N 3.09Å; P87-N296 HydrophobicContact CB-CB 4.04Å
88G58.9Low73.4Confident16 Ų1660.8 Ų60.817%0.16537%0.366CS..PPolyproline II helixtrans-52.4138.9179.900000109.9S90G88-S90 PolarHBondContact O-N 3.11Å
89T54.7Low73.6Confident103 Ų10363.4 Ų63.463%0.63238%0.38SS*.PPolyproline II helixtrans-51.4145.2165.546.50000108.1P87 Q91P87-T89 PolarHBondContact O-N 3.09Å; T89-Q91 PolarHBondContact O-N 3.04Å
90S50.8Low73.8Confident79 Ų7954.3 Ų54.355%0.55235%0.346SS*.SBendtrans-46.250.5-177.143.90000116.4G88 E487G88-S90 PolarHBondContact O-N 3.11Å; S90-E487 PolarHBondContact OG-OE1 3.42Å
91Q47.2Very low74.2Confident191 Ų19152.4 Ų52.489%0.89333%0.333SS*.  trans-78.6-11164.9-68-166.9-13.600111T89T89-Q91 PolarHBondContact O-N 3.04Å
92G50.8Low74.6Confident15 Ų1552.8 Ų52.816%0.15533%0.33CS..SBendtrans-104.250.2-171.700000115.3G94G92-G94 PolarHBondContact O-N 3.34Å
93G59.2Low74.6Confident72 Ų7252.6 Ų52.674%0.74233%0.329SS*.  trans47.121.5154.600000119.3
94G69.4Low74.3Confident32 Ų3254.3 Ų54.333%0.3334%0.336SS..PPolyproline II helixtrans-78.3154.9-179.800000111.6G92 T96G92-G94 PolarHBondContact O-N 3.34Å; G94-T96 PolarHBondContact O-N 2.85Å
95P81.5Confident73.8Confident27 Ų2756.9 Ų56.918%0.17536%0.357CS..PPolyproline II helixtrans-60.7134.9173.426.3-32.7000109.5V99 R100P95-V99 HydrophobicContact CB-CB 4.47Å; P95-R100 HydrophobicContact CB-CB 4.01Å; P95-R100 HydrophobicContact CG-CB 3.89Å; P95-R100 HydrophobicContact CG-CG 4.43Å
96T86.5Confident73.4Confident54 Ų5454.2 Ų54.233%0.33136%0.36SS..PPolyproline II helixtrans-69.7161.7179.555.50000110.8G94 A98 V99 R100G94-T96 PolarHBondContact O-N 2.85Å; T96-A98 PolarHBondContact O-N 3.35Å; T96-V99 PolarHBondContact O-N 3.41Å; T96-R100 PolarHBondContact O-N 2.99Å
97P86.9Confident73.9Confident26 Ų2652.3 Ų52.317%0.16935%0.347CS..THydrogen-bonded Turntrans-53.6-22.1173-28.737000114.2V99 M102 Y455 F485P97-V99 PolarHBondContact O-N 3.1Å; P97-M102 HydrophobicContact CB-CG 3.77Å; P97-M102 HydrophobicContact CB-SD 4.28Å; P97-M102 HydrophobicContact CG-CE 4.23Å; P97-M102 HydrophobicContact CG-CG 4.08Å; P97-M102 HydrophobicContact CG-SD 4.07Å; P97-Y455 HydrophobicContact CB-CD1 4.26Å; P97-Y455 HydrophobicContact CB-CE1 4.21Å; P97-F485 HydrophobicContact CB-CD1 4.45Å; P97-F485 HydrophobicContact CB-CD2 4.33Å; P97-F485 HydrophobicContact CB-CG 4.24Å; P97-F485 HydrophobicContact CG-CD2 3.77Å; P97-F485 HydrophobicContact CG-CE2 4.12Å; P97-F485 HydrophobicContact CG-CG 4.15Å
98A88.8Confident75.1Confident55 Ų5551.9 Ų51.946%0.45535%0.345SS..THydrogen-bonded Turntrans-68.2-21.8175.800000114.2T96 Y455 F485T96-A98 PolarHBondContact O-N 3.35Å; A98-Y455 WeakPolarHBondContact CA-OH 3.44Å; A98-F485 HydrophobicContact CB-CE1 4.35Å
99V90.8Very high76.6Confident70 Ų7053.8 Ų53.842%0.42435%0.35SS..THydrogen-bonded Turntrans-111.6-44.2-179-177.20000111.2P95 T96 P97 Y328P95-V99 HydrophobicContact CB-CB 4.47Å; T96-V99 PolarHBondContact O-N 3.41Å; P97-V99 PolarHBondContact O-N 3.1Å; V99-Y328 HydrophobicContact CG1-CD1 4.43Å; V99-Y328 VanDerWaalsContact CG1-O 3.23Å; V99-Y328 WeakPolarHBondContact CG1-O 3.25Å; V99-Y328 WeakPolarHBondContact O-CD1 3.49Å
100R91.3Very high78.3Confident8 Ų851.2 Ų51.23%0.0334%0.335CS..SBendtrans-105.4125-177.4-173167.9-177.5167.27.5110.6P95 T96 P108 I109 N325 Y328P95-R100 HydrophobicContact CB-CB 4.01Å; P95-R100 HydrophobicContact CG-CB 3.89Å; P95-R100 HydrophobicContact CG-CG 4.43Å; T96-R100 PolarHBondContact O-N 2.99Å; R100-P108 HydrophobicContact CB-CB 4.48Å; R100-P108 HydrophobicContact CG-CB 3.76Å; R100-I109 HydrophobicContact CG-CG1 4.29Å; R100-I109 PolarHBondContact NE-O 2.86Å; R100-I109 PolarHBondContact NH2-O 3.22Å; R100-N325 PolarHBondContact NH1-OD1 3.18Å; R100-Y328 HydrophobicContact CB-CD1 3.98Å; R100-Y328 HydrophobicContact CB-CD2 4.33Å; R100-Y328 HydrophobicContact CB-CE1 4.42Å; R100-Y328 HydrophobicContact CB-CG 3.95Å; R100-Y328 HydrophobicContact CG-CD1 4.11Å; R100-Y328 HydrophobicContact CG-CD2 3.7Å; R100-Y328 HydrophobicContact CG-CE1 4.27Å; R100-Y328 HydrophobicContact CG-CE2 3.89Å; R100-Y328 HydrophobicContact CG-CG 3.84Å
101P91Very high80Confident37 Ų3748.5 Ų48.524%0.2432%0.319CS..  trans-57.3148.4175-24.533.8000112.3P108 I109 Y328P101-P108 WeakPolarHBondContact O-CA 3.12Å; P101-I109 HydrophobicContact CB-CD1 4.22Å; P101-I109 HydrophobicContact CB-CG1 4.38Å; P101-I109 HydrophobicContact CB-CG2 4.15Å; P101-I109 HydrophobicContact CG-CD1 4.22Å; P101-I109 PolarHBondContact O-N 2.97Å; P101-Y328 VanDerWaalsContact CD-CE1 3.49Å
102M88.1Confident82.2Confident29 Ų2942.7 Ų42.714%0.14329%0.291CS..EExtended strand (participates in β ladder)trans-115.9137.2-174.8-58.1-65.4-73.600110.1P97 P108 H453P97-M102 HydrophobicContact CB-CG 3.77Å; P97-M102 HydrophobicContact CB-SD 4.28Å; P97-M102 HydrophobicContact CG-CE 4.23Å; P97-M102 HydrophobicContact CG-CG 4.08Å; P97-M102 HydrophobicContact CG-SD 4.07Å; M102-P108 WeakPolarHBondContact SD-CA 3.48Å; M102-P108 HydrophobicContact SD-CB 3.68Å; M102-H453 PolarHBondContact O-NE2 3.35Å
103T85.1Confident84.1Confident46 Ų4646.6 Ų46.628%0.28231%0.312SS..EExtended strand (participates in β ladder)trans-86.8-29.6173.850.60000112.5R107 I109 S119 H453T103-R107 PolarHBondContact N-O 2.94Å; T103-R107 PolarHBondContact OG1-O 3.12Å; T103-I109 HydrophobicContact CG2-CB 4.46Å; T103-I109 HydrophobicContact CG2-CG2 3.67Å; T103-S119 WeakPolarHBondContact OG1-CB 3.11Å; T103-H453 PolarHBondContact O-CE1 3.38Å; T103-H453 PolarHBondContact O-NE2 3.32Å
104Q81.7Confident85.5Confident39 Ų3944 Ų4418%0.18228%0.279CS..EExtended strand (participates in β ladder)trans-150.8169.4177.8-68.3-60.9-27.600108.2G106 R107 S119 A135Q104-G106 PolarHBondContact O-N 2.96Å; Q104-G106 VanDerWaalsContact O-N 3.12Å; Q104-R107 PolarHBondContact O-N 3Å; Q104-S119 WeakPolarHBondContact CB-O 3.35Å; Q104-A135 PolarHBondContact NE2-O 3.46Å
105S71.6Confident86.4Confident81 Ų8144.7 Ų44.757%0.56628%0.279SS*.THydrogen-bonded Turntrans-57.2120.5174.650.90000110.8R107S105-R107 VanDerWaalsContact C-N 3.34Å; S105-R107 PolarHBondContact O-N 2.95Å
106G72.9Confident86.6Confident43 Ų4344.3 Ų44.344%0.44328%0.277SS..THydrogen-bonded Turntrans79.9-2.2177.400000116.7Q104Q104-G106 PolarHBondContact O-N 2.96Å; Q104-G106 VanDerWaalsContact O-N 3.12Å
107R83.4Confident86.5Confident39 Ų3942.7 Ų42.715%0.14727%0.266CS..EExtended strand (participates in β ladder)trans-116.6108.7174.8-65.4-65.6-169.7177.10.8112.2L84 T103 Q104 S105 S119 E293 E294L84-R107 PolarHBondContact O-NH2 3.36Å; T103-R107 PolarHBondContact N-O 2.94Å; T103-R107 PolarHBondContact OG1-O 3.12Å; Q104-R107 PolarHBondContact O-N 3Å; S105-R107 VanDerWaalsContact C-N 3.34Å; S105-R107 PolarHBondContact O-N 2.95Å; R107-S119 WeakPolarHBondContact CB-O 3.41Å; R107-S119 VanDerWaalsContact CG-O 3.22Å; R107-S119 WeakPolarHBondContact CG-O 3.42Å; R107-E293 PolarHBondContact NH1-O 3.31Å; R107-E294 VanDerWaalsContact NH1-C 3.29Å; R107-E294 PolarHBondContact NH1-O 3.49Å; R107-E294 PolarHBondContact NH2-O 3Å
108P87.2Confident86.4Confident28 Ų2843.6 Ų43.618%0.18227%0.268CS..EExtended strand (participates in β ladder)trans-72.5159175.129.5-33.3000111.8R100 P101 M102 T110R100-P108 HydrophobicContact CB-CB 4.48Å; R100-P108 HydrophobicContact CG-CB 3.76Å; P101-P108 WeakPolarHBondContact O-CA 3.12Å; M102-P108 WeakPolarHBondContact SD-CA 3.48Å; M102-P108 HydrophobicContact SD-CB 3.68Å; P108-T110 PolarHBondContact O-N 3.1Å
109I89.3Confident85.9Confident55 Ų5542.2 Ų42.228%0.28226%0.256SS..PPolyproline II helixtrans-57.4138.9173.163.2166.7000110.6R100 P101 T103 Y328R100-I109 HydrophobicContact CG-CG1 4.29Å; R100-I109 PolarHBondContact NE-O 2.86Å; R100-I109 PolarHBondContact NH2-O 3.22Å; P101-I109 HydrophobicContact CB-CD1 4.22Å; P101-I109 HydrophobicContact CB-CG1 4.38Å; P101-I109 HydrophobicContact CB-CG2 4.15Å; P101-I109 HydrophobicContact CG-CD1 4.22Å; P101-I109 PolarHBondContact O-N 2.97Å; T103-I109 HydrophobicContact CG2-CB 4.46Å; T103-I109 HydrophobicContact CG2-CG2 3.67Å; I109-Y328 HydrophobicContact CD1-CE2 4.22Å; I109-Y328 WeakPolarHBondContact CD1-OH 3.35Å; I109-Y328 HydrophobicContact CG1-CE2 4.38Å
110T90.2Very high85.2Confident50 Ų5040 Ų4031%0.30725%0.246SC..PPolyproline II helixtrans-93.2156.5177.8-179.20000111.9P108 F112 V113 T117P108-T110 PolarHBondContact O-N 3.1Å; T110-F112 VanDerWaalsContact C-N 3.32Å; T110-F112 WeakPolarHBondContact CG2-O 3.1Å; T110-F112 PolarHBondContact OG1-N 3.39Å; T110-V113 HydrophobicContact CG2-CG2 4.49Å; T110-T117 HydrophobicContact CG2-CG2 4.44Å
111G87.9Confident84.7Confident22 Ų2243.9 Ų43.923%0.22726%0.261CS..SBendtrans-75.1-18.7176.100000114A320G111-A320 WeakPolarHBondContact O-CB 3.36Å
112F93.1Very high84.3Confident68 Ų6843 Ų4330%0.29826%0.255SS..SBendtrans-140118.9-179.1-173.3-99.4000111.7T110 R114 V316 E317T110-F112 VanDerWaalsContact C-N 3.32Å; T110-F112 WeakPolarHBondContact CG2-O 3.1Å; T110-F112 PolarHBondContact OG1-N 3.39Å; F112-R114 HydrophobicContact CD1-CB 4.44Å; F112-R114 HydrophobicContact CE1-CB 4.23Å; F112-V316 HydrophobicContact CD2-CG1 4.43Å; F112-V316 HydrophobicContact CE2-CG1 4.23Å; F112-E317 HydrophobicContact CB-CB 4.27Å; F112-E317 HydrophobicContact CB-CG 3.92Å; F112-E317 HydrophobicContact CD1-CB 3.88Å; F112-E317 HydrophobicContact CD1-CG 3.72Å; F112-E317 HydrophobicContact CD2-CB 4.23Å; F112-E317 HydrophobicContact CE1-CB 4.25Å; F112-E317 HydrophobicContact CE1-CG 4.43Å; F112-E317 HydrophobicContact CG-CB 3.87Å; F112-E317 HydrophobicContact CG-CG 3.88Å
113V90.9Very high83.9Confident98 Ų9844.1 Ų44.159%0.59427%0.274SS*.  trans-90.1119.6177.6-178.50000109.6T110 A138T110-V113 HydrophobicContact CG2-CG2 4.49Å; V113-A138 HydrophobicContact CG1-CB 3.46Å; V113-A138 VanDerWaalsContact CG1-CB 3.46Å
114R88.8Confident83.9Confident16 Ų1645.5 Ų45.56%0.0628%0.283CS..  trans-110.5153174.952.2179.6-172.5-88.22.3110.1F112 S116 T117 A138 E294F112-R114 HydrophobicContact CD1-CB 4.44Å; F112-R114 HydrophobicContact CE1-CB 4.23Å; R114-S116 WeakPolarHBondContact CD-OG 3.49Å; R114-S116 WeakPolarHBondContact CG-OG 3.09Å; R114-S116 PolarHBondContact NE-OG 3.18Å; R114-S116 PolarHBondContact O-N 3.5Å; R114-T117 HydrophobicContact CB-CG2 4.39Å; R114-T117 HydrophobicContact CG-CG2 3.31Å; R114-T117 PolarHBondContact O-N 2.88Å; R114-T117 PolarHBondContact O-OG1 3.08Å; R114-A138 WeakPolarHBondContact O-CB 3.36Å; R114-E294 IonicContact CZ-OE1 2.67Å; R114-E294 IonicContact NH2-OE1 3.76Å; R114-E294 PolarHBondContact NH2-OE1 3.36Å
115P87.3Confident84.1Confident48 Ų4847.8 Ų47.831%0.31229%0.294SS..THydrogen-bonded Turntrans-57.5-21.4177.3-24.934.8000114.4
116S85.5Confident84.8Confident19 Ų1949.5 Ų49.513%0.13329%0.294CS..THydrogen-bonded Turntrans-91.9-1.7177.657.50000115.2D60 R114 Q118D60-S116 WeakPolarHBondContact O-CA 3.19Å; R114-S116 WeakPolarHBondContact CD-OG 3.49Å; R114-S116 WeakPolarHBondContact CG-OG 3.09Å; R114-S116 PolarHBondContact NE-OG 3.18Å; R114-S116 PolarHBondContact O-N 3.5Å; S116-Q118 PolarHBondContact O-N 3.15Å
117T85.6Confident85.4Confident19 Ų1951.9 Ų51.912%0.11729%0.293CS..  trans-64.7125-179.747.40000110.8T110 R114T110-T117 HydrophobicContact CG2-CG2 4.44Å; R114-T117 HydrophobicContact CB-CG2 4.39Å; R114-T117 HydrophobicContact CG-CG2 3.31Å; R114-T117 PolarHBondContact O-N 2.88Å; R114-T117 PolarHBondContact O-OG1 3.08Å
118Q84.1Confident85.4Confident45 Ų4550.4 Ų50.421%0.2129%0.289CS..BIsolated β-bridgetrans-110.2108.6167.6-60.1-60.7-22.200108.3S116 G120 S136S116-Q118 PolarHBondContact O-N 3.15Å; Q118-G120 VanDerWaalsContact C-N 3.28Å; Q118-S136 WeakPolarHBondContact CA-O 3.35Å; Q118-S136 PolarHBondContact OE1-O 3.43Å
119S77.6Confident85.4Confident27 Ų2754.4 Ų54.419%0.18931%0.308CS..  trans-88.14.7-179.554.90000113.2T103 Q104 R107 A135 S136T103-S119 WeakPolarHBondContact OG1-CB 3.11Å; Q104-S119 WeakPolarHBondContact CB-O 3.35Å; R107-S119 WeakPolarHBondContact CB-O 3.41Å; R107-S119 VanDerWaalsContact CG-O 3.22Å; R107-S119 WeakPolarHBondContact CG-O 3.42Å; S119-A135 PolarHBondContact OG-O 3.4Å; S119-S136 PolarHBondContact N-O 2.95Å; S119-S136 VanDerWaalsContact N-O 3.1Å; S119-S136 WeakPolarHBondContact OG-CA 3.46Å; S119-S136 PolarHBondContact OG-O 2.88Å
120G76.1Confident85.2Confident22 Ų2259.1 Ų59.123%0.22733%0.326CS..  trans155.4158179.300000110.9Q118 S136Q118-G120 VanDerWaalsContact C-N 3.28Å; G120-S136 WeakPolarHBondContact O-CB 3.38Å
121R80.9Confident85Confident91 Ų9158.7 Ų58.734%0.34332%0.324SS..  trans-108.8134.3173.4-71.7-171.6174.7-148.2-2.4109.9E62E62-R121 IonicContact OE1-CZ 2.73Å; E62-R121 IonicContact OE1-NH2 3.65Å; E62-R121 PolarHBondContact OE1-NH2 3.19Å; E62-R121 IonicContact OE2-CZ 2.83Å; E62-R121 IonicContact OE2-NE 3.93Å; E62-R121 IonicContact OE2-NH2 3.76Å; E62-R121 PolarHBondContact OE2-NH2 3.37Å
122P82.8Confident84.9Confident17 Ų1761.5 Ų61.511%0.1134%0.338CS..  trans-64.4143.617328.2-32.9000109.9M67 M68 A128M67-P122 HydrophobicContact SD-CG 4.3Å; M68-P122 HydrophobicContact SD-CG 4.32Å; P122-A128 HydrophobicContact CB-CB 3.68Å; P122-A128 HydrophobicContact CG-CB 3.56Å
123G80.6Confident84.6Confident53 Ų5366.3 Ų66.355%0.54635%0.354SS..SBendtrans-79.4-27.5-179.500000113.4M68M68-G123 VanDerWaalsContact CE-O 3.26Å; M68-G123 WeakPolarHBondContact CE-O 3.37Å
124T85.5Confident84.4Confident76 Ų7665 Ų6547%0.46635%0.347SS..SBendtrans-137.3158178.661.50000111.4E126 Q127 A128T124-E126 VanDerWaalsContact C-N 3.25Å; T124-E126 PolarHBondContact O-N 3.33Å; T124-Q127 PolarHBondContact O-N 2.76Å; T124-Q127 VanDerWaalsContact OG1-CB 3.31Å; T124-Q127 WeakPolarHBondContact OG1-CB 3.16Å; T124-Q127 PolarHBondContact OG1-N 2.92Å; T124-A128 PolarHBondContact O-N 3.03Å
125M84.6Confident84.2Confident86 Ų8665.3 Ų65.342%0.42435%0.352SS..Hα-helixtrans-58.8-38.7174.2-170.475.6-158.800111.8I64 A128 I129I64-M125 HydrophobicContact CB-CE 4.05Å; I64-M125 HydrophobicContact CB-SD 4.43Å; I64-M125 HydrophobicContact CD1-CE 4.22Å; I64-M125 HydrophobicContact CG2-CE 3.45Å; I64-M125 VanDerWaalsContact CG2-CE 3.45Å; I64-M125 HydrophobicContact CG2-SD 3.35Å; I64-M125 WeakPolarHBondContact CG2-SD 3.38Å; M125-A128 WeakPolarHBondContact O-CB 3.27Å; M125-A128 PolarHBondContact O-N 3.15Å; M125-I129 HydrophobicContact CE-CD1 3.83Å; M125-I129 HydrophobicContact CE-CG1 4.08Å; M125-I129 HydrophobicContact CG-CD1 4.03Å; M125-I129 WeakPolarHBondContact O-CG1 3.39Å; M125-I129 PolarHBondContact O-N 3.34Å
126E86.6Confident83.9Confident118 Ų11863.8 Ų63.855%0.55134%0.343SS*.Hα-helixtrans-64.4-44.1178.3-174.3179.7172.400111.3T124 A128 I129 K130T124-E126 VanDerWaalsContact C-N 3.25Å; T124-E126 PolarHBondContact O-N 3.33Å; E126-A128 VanDerWaalsContact C-N 3.33Å; E126-A128 PolarHBondContact O-N 3.35Å; E126-I129 PolarHBondContact O-N 3.05Å; E126-K130 HydrophobicContact CG-CD 3.91Å; E126-K130 HydrophobicContact CG-CG 4.4Å; E126-K130 WeakPolarHBondContact O-CB 3.35Å; E126-K130 WeakPolarHBondContact O-CG 3.36Å; E126-K130 PolarHBondContact O-N 3.18Å; E126-K130 WeakPolarHBondContact OE1-CE 3.24Å; E126-K130 IonicContact OE1-NZ 3.18Å; E126-K130 PolarHBondContact OE1-NZ 3.16Å
127Q84.8Confident84Confident92 Ų9263.6 Ų63.643%0.4334%0.341SS..Hα-helixtrans-62.1-41174.4-172.8-178.19.400111.4T124 I129 K130 T131T124-Q127 PolarHBondContact O-N 2.76Å; T124-Q127 VanDerWaalsContact OG1-CB 3.31Å; T124-Q127 WeakPolarHBondContact OG1-CB 3.16Å; T124-Q127 PolarHBondContact OG1-N 2.92Å; Q127-I129 VanDerWaalsContact C-N 3.29Å; Q127-I129 PolarHBondContact O-N 3Å; Q127-K130 PolarHBondContact O-N 3.39Å; Q127-T131 HydrophobicContact CG-CG2 4.22Å; Q127-T131 WeakPolarHBondContact O-CB 3.1Å; Q127-T131 VanDerWaalsContact O-CG2 3.22Å; Q127-T131 WeakPolarHBondContact O-CG2 3.32Å; Q127-T131 PolarHBondContact O-N 3.42Å; Q127-T131 PolarHBondContact O-OG1 3.35Å
128A84.8Confident84Confident8 Ų864.7 Ų64.77%0.06635%0.352CS..Hα-helixtrans-62.2-34.9177.100000113I64 P122 T124 M125 E126 T131I64-A128 HydrophobicContact CD1-CB 4.38Å; I64-A128 HydrophobicContact CG1-CB 4.47Å; I64-A128 HydrophobicContact CG2-CB 3.65Å; P122-A128 HydrophobicContact CB-CB 3.68Å; P122-A128 HydrophobicContact CG-CB 3.56Å; T124-A128 PolarHBondContact O-N 3.03Å; M125-A128 WeakPolarHBondContact O-CB 3.27Å; M125-A128 PolarHBondContact O-N 3.15Å; E126-A128 VanDerWaalsContact C-N 3.33Å; E126-A128 PolarHBondContact O-N 3.35Å; A128-T131 PolarHBondContact O-OG1 3.02Å
129I86.9Confident84Confident113 Ų11368 Ų6858%0.57936%0.362SS*.Hα-helixtrans-80.9-36179.5-66.7168000111.7M125 E126 Q127M125-I129 HydrophobicContact CE-CD1 3.83Å; M125-I129 HydrophobicContact CE-CG1 4.08Å; M125-I129 HydrophobicContact CG-CD1 4.03Å; M125-I129 WeakPolarHBondContact O-CG1 3.39Å; M125-I129 PolarHBondContact O-N 3.34Å; E126-I129 PolarHBondContact O-N 3.05Å; Q127-I129 VanDerWaalsContact C-N 3.29Å; Q127-I129 PolarHBondContact O-N 3Å
130K84.9Confident84.4Confident153 Ų15369.1 Ų69.167%0.66537%0.369SS*.Hα-helixtrans-80.8-17.5-177.8-72.8-176174-179.10113.9E126 Q127E126-K130 HydrophobicContact CG-CD 3.91Å; E126-K130 HydrophobicContact CG-CG 4.4Å; E126-K130 WeakPolarHBondContact O-CB 3.35Å; E126-K130 WeakPolarHBondContact O-CG 3.36Å; E126-K130 PolarHBondContact O-N 3.18Å; E126-K130 WeakPolarHBondContact OE1-CE 3.24Å; E126-K130 IonicContact OE1-NZ 3.18Å; E126-K130 PolarHBondContact OE1-NZ 3.16Å; Q127-K130 PolarHBondContact O-N 3.39Å
131T85.2Confident84.9Confident42 Ų4268.9 Ų68.926%0.25836%0.363SS..SBendtrans-83156.417745.40000111.5Q127 A128 R133Q127-T131 HydrophobicContact CG-CG2 4.22Å; Q127-T131 WeakPolarHBondContact O-CB 3.1Å; Q127-T131 VanDerWaalsContact O-CG2 3.22Å; Q127-T131 WeakPolarHBondContact O-CG2 3.32Å; Q127-T131 PolarHBondContact O-N 3.42Å; Q127-T131 PolarHBondContact O-OG1 3.35Å; A128-T131 PolarHBondContact O-OG1 3.02Å; T131-R133 PolarHBondContact O-N 2.85Å
132P86.5Confident85.1Confident80 Ų8066.2 Ų66.252%0.51936%0.357SS..  trans-53.9138.1173.9-24.333.3000111.2T134 A135P132-T134 PolarHBondContact O-N 3.49Å; P132-A135 HydrophobicContact CB-CB 4.26Å; P132-A135 WeakPolarHBondContact O-CB 3.2Å; P132-A135 PolarHBondContact O-N 3.22Å
133R85.9Confident85.1Confident170 Ų17070 Ų7064%0.64238%0.384SS*.THydrogen-bonded Turntrans-65.1-15.4-170.8-65.7-145.1-58.5-147.3-2.3114.9T131 P140 V141T131-R133 PolarHBondContact O-N 2.85Å; R133-P140 HydrophobicContact CB-CB 4.06Å; R133-P140 WeakPolarHBondContact O-CA 3.34Å; R133-V141 HydrophobicContact CB-CG1 4.5Å; R133-V141 PolarHBondContact O-N 3.34Å
134T86.5Confident85Confident70 Ų7069.9 Ų69.943%0.42938%0.375SS..THydrogen-bonded Turntrans-106.2817946.50000112.4P132 S136 T137 P140P132-T134 PolarHBondContact O-N 3.49Å; T134-S136 PolarHBondContact O-N 2.7Å; T134-T137 CarbonylContact C-O 3.59Å; T134-T137 WeakPolarHBondContact CA-O 3.27Å; T134-P140 HydrophobicContact CG2-CB 4.25Å
135A84.5Confident84.2Confident22 Ų2267.1 Ų67.118%0.18236%0.359CS..SBendtrans-70.1-33.2-173.400000114Q104 S119 P132Q104-A135 PolarHBondContact NE2-O 3.46Å; S119-A135 PolarHBondContact OG-O 3.4Å; P132-A135 HydrophobicContact CB-CB 4.26Å; P132-A135 WeakPolarHBondContact O-CB 3.2Å; P132-A135 PolarHBondContact O-N 3.22Å
136S82.9Confident82.7Confident17 Ų1764.1 Ų64.112%0.11935%0.35CS..SBendtrans-101.7-21.2179.5560000113.9Q118 S119 G120 T134Q118-S136 WeakPolarHBondContact CA-O 3.35Å; Q118-S136 PolarHBondContact OE1-O 3.43Å; S119-S136 PolarHBondContact N-O 2.95Å; S119-S136 VanDerWaalsContact N-O 3.1Å; S119-S136 WeakPolarHBondContact OG-CA 3.46Å; S119-S136 PolarHBondContact OG-O 2.88Å; G120-S136 WeakPolarHBondContact O-CB 3.38Å; T134-S136 PolarHBondContact O-N 2.7Å
137T86.6Confident81Confident14 Ų1463 Ų639%0.08634%0.341CS..BIsolated β-bridgetrans-134.3146-168.144.60000110.6M67 T134 R139M67-T137 HydrophobicContact CE-CG2 3.8Å; T134-T137 CarbonylContact C-O 3.59Å; T134-T137 WeakPolarHBondContact CA-O 3.27Å; T137-R139 PolarHBondContact O-N 3.49Å; T137-R139 PolarHBondContact OG1-O 3.07Å
138A85.6Confident79.4Confident42 Ų4261.2 Ų61.235%0.34733%0.332SS..SBendtrans-62.6-11.2179.700000114.6V113 R114V113-A138 HydrophobicContact CG1-CB 3.46Å; V113-A138 VanDerWaalsContact CG1-CB 3.46Å; R114-A138 WeakPolarHBondContact O-CB 3.36Å
139R85Confident77.4Confident114 Ų11466.8 Ų66.843%0.4336%0.359SS..SBendtrans-136.4154.5-178.5-70.2-178.1175.6-172.5-1.8108.2T137 V141T137-R139 PolarHBondContact O-N 3.49Å; T137-R139 PolarHBondContact OG1-O 3.07Å; R139-V141 PolarHBondContact O-N 3Å; R139-V141 VanDerWaalsContact O-N 3.08Å
140P86.2Confident75.3Confident51 Ų5169.2 Ų69.233%0.33136%0.361SS..  trans-59.6121.7-177.320.7-30.4000110.6R133 T134 R147R133-P140 HydrophobicContact CB-CB 4.06Å; R133-P140 WeakPolarHBondContact O-CA 3.34Å; T134-P140 HydrophobicContact CG2-CB 4.25Å; P140-R147 PolarHBondContact O-NH2 3.4Å
141V85.2Confident73.2Confident17 Ų1769 Ų6910%0.10337%0.366CS..  trans-61.3143.5-175.180.60000110.9I64 R133 R139I64-V141 HydrophobicContact CD1-CG1 3.95Å; I64-V141 HydrophobicContact CG1-CG1 3.94Å; I64-V141 HydrophobicContact CG1-CG2 3.84Å; R133-V141 HydrophobicContact CB-CG1 4.5Å; R133-V141 PolarHBondContact O-N 3.34Å; R139-V141 PolarHBondContact O-N 3Å; R139-V141 VanDerWaalsContact O-N 3.08Å
142T84.7Confident70.9Confident36 Ų3669.2 Ų69.222%0.22138%0.377CS..  trans-115.4164.8177.5480000110.6G63 I64 S144 R147G63-T142 CarbonylContact C-O 3.59Å; G63-T142 VanDerWaalsContact CA-O 3.29Å; G63-T142 WeakPolarHBondContact CA-O 3.48Å; I64-T142 PolarHBondContact N-O 3.23Å; T142-S144 VanDerWaalsContact C-N 3.32Å; T142-S144 WeakPolarHBondContact CB-O 3.41Å; T142-S144 PolarHBondContact O-N 2.99Å; T142-S144 PolarHBondContact OG1-O 3.3Å; T142-R147 HydrophobicContact CG2-CG 4.34Å
143S83.8Confident68.5Low95 Ų9569.1 Ų69.166%0.66438%0.375SS*.SBendtrans-59.9-41.5178.348.60000112.4I64 A65I64-S143 PolarHBondContact N-O 2.88Å; A65-S143 WeakPolarHBondContact CB-O 3.17Å; A65-S143 PolarHBondContact N-O 3.44Å
144S79.3Confident66.2Low52 Ų5263.8 Ų63.836%0.36437%0.367SS..SBendtrans-129.4155169.6164.20000108.9T142 G146T142-S144 VanDerWaalsContact C-N 3.32Å; T142-S144 WeakPolarHBondContact CB-O 3.41Å; T142-S144 PolarHBondContact O-N 2.99Å; T142-S144 PolarHBondContact OG1-O 3.3Å; S144-G146 PolarHBondContact O-N 2.61Å; S144-G146 PolarHBondContact OG-N 3.49Å
145S67.6Low64Low18 Ų1863.6 Ų63.613%0.12637%0.369CS..SBendtrans-60.4-8.7175-172.30000113.2Q61 E66 R147Q61-S145 VanDerWaalsContact O-CB 3.28Å; Q61-S145 WeakPolarHBondContact O-CB 3.4Å; Q61-S145 PolarHBondContact O-OG 3.18Å; E66-S145 VanDerWaalsContact CD-CB 3.42Å; E66-S145 WeakPolarHBondContact OE1-CA 3.41Å; E66-S145 WeakPolarHBondContact OE1-CB 3.29Å; E66-S145 PolarHBondContact OE1-N 3.18Å; E66-S145 WeakPolarHBondContact OE2-CB 3.47Å; S145-R147 PolarHBondContact O-N 2.87Å
146G53.8Low61.8Low23 Ų2370 Ų7024%0.23740%0.397CS..  trans-64.550173.600000116.9S144 F148 I149S144-G146 PolarHBondContact O-N 2.61Å; S144-G146 PolarHBondContact OG-N 3.49Å; G146-F148 PolarHBondContact O-N 2.83Å; G146-F148 VanDerWaalsContact O-N 3.16Å; G146-I149 PolarHBondContact O-N 2.97Å
147R50.4Low59.8Low95 Ų9575.8 Ų75.836%0.35843%0.426SS..G310 helixtrans-54.1-22152.5-87.6-171.4-173.7-165.26.3111.7P140 T142 S145 I149 R150P140-R147 PolarHBondContact O-NH2 3.4Å; T142-R147 HydrophobicContact CG2-CG 4.34Å; S145-R147 PolarHBondContact O-N 2.87Å; R147-I149 PolarHBondContact O-N 3.42Å; R147-R150 PolarHBondContact O-N 3.36Å
148F50.8Low57.6Low54 Ų5479.9 Ų79.924%0.23745%0.451CS..G310 helixtrans-63.3-19.1172.2-60.5-59.5000114.9V59 G146 N194V59-F148 HydrophobicContact CG1-CE2 4.45Å; V59-F148 HydrophobicContact CG1-CZ 3.77Å; G146-F148 PolarHBondContact O-N 2.83Å; G146-F148 VanDerWaalsContact O-N 3.16Å; F148-N194 HydrophobicContact CB-CB 3.9Å; F148-N194 HydrophobicContact CD1-CB 4.02Å; F148-N194 VanDerWaalsContact CD1-OD1 3.3Å; F148-N194 WeakPolarHBondContact CD1-OD1 3.42Å; F148-N194 HydrophobicContact CG-CB 4.41Å; F148-N194 WeakPolarHBondContact O-CB 3.41Å
149I42.8Very low56.1Low125 Ų12582.1 Ų82.164%0.64146%0.457SS*.G310 helixtrans-99.76.3-177.9-54.9168.1000111.7G146 R147 L151G146-I149 PolarHBondContact O-N 2.97Å; R147-I149 PolarHBondContact O-N 3.42Å; I149-L151 PolarHBondContact O-N 2.88Å
150R44.1Very low54.5Low163 Ų16383.3 Ų83.362%0.61548%0.48SS*.  trans-74.675.8167.9-81.2-169.4179172.80.4110.6R147 G152 T153R147-R150 PolarHBondContact O-N 3.36Å; R150-G152 PolarHBondContact O-N 2.96Å; R150-T153 WeakPolarHBondContact CB-OG1 3.39Å; R150-T153 PolarHBondContact O-N 3.43Å; R150-T153 VanDerWaalsContact O-N 3.14Å; R150-T153 PolarHBondContact O-OG1 3.13Å
151L39.7Very low53.1Low148 Ų14886.6 Ų86.678%0.77549%0.49SS*.Hα-helixtrans-40.6-31.9155.4-82.4144.1000111.7I149 S155I149-L151 PolarHBondContact O-N 2.88Å; L151-S155 WeakPolarHBondContact O-CB 3.37Å; L151-S155 PolarHBondContact O-N 3.2Å; L151-S155 PolarHBondContact O-OG 3.27Å
152G37.3Very low52.3Low47 Ų4787.1 Ų87.149%0.48550%0.499SS..Hα-helixtrans-76.4-19.5-17700000117.5R150 S155 M156R150-G152 PolarHBondContact O-N 2.96Å; G152-S155 VanDerWaalsContact C-OG 3.24Å; G152-S155 VanDerWaalsContact CA-OG 3.3Å; G152-S155 WeakPolarHBondContact CA-OG 3.46Å; G152-S155 PolarHBondContact O-OG 3.22Å; G152-M156 WeakPolarHBondContact O-CG 3.27Å
153T36.8Very low51.9Low78 Ų7890.5 Ų90.548%0.47952%0.522SS..Hα-helixtrans-95.9-31.1175.335.80000112.7R150 S155 M156R150-T153 WeakPolarHBondContact CB-OG1 3.39Å; R150-T153 PolarHBondContact O-N 3.43Å; R150-T153 VanDerWaalsContact O-N 3.14Å; R150-T153 PolarHBondContact O-OG1 3.13Å; T153-S155 PolarHBondContact O-N 2.87Å; T153-M156 PolarHBondContact O-N 3.19Å; T153-M156 VanDerWaalsContact O-N 3.12Å
154A37.7Very low51.8Low58 Ų5888.3 Ų88.348%0.47950%0.5SS..Hα-helixtrans-63.4-32.916800000111.2M156 L157A154-M156 VanDerWaalsContact C-N 3.26Å; A154-M156 PolarHBondContact O-N 3.43Å; A154-L157 PolarHBondContact O-N 3.16Å
155S39Very low52Low66 Ų6686.6 Ų86.646%0.46249%0.487SS..THydrogen-bonded Turntrans-72.8-9.2173.164.10000115.2L151 G152 T153 T158L151-S155 WeakPolarHBondContact O-CB 3.37Å; L151-S155 PolarHBondContact O-N 3.2Å; L151-S155 PolarHBondContact O-OG 3.27Å; G152-S155 VanDerWaalsContact C-OG 3.24Å; G152-S155 VanDerWaalsContact CA-OG 3.3Å; G152-S155 WeakPolarHBondContact CA-OG 3.46Å; G152-S155 PolarHBondContact O-OG 3.22Å; T153-S155 PolarHBondContact O-N 2.87Å; S155-T158 WeakPolarHBondContact O-CG2 3.33Å; S155-T158 PolarHBondContact O-OG1 3.19Å
156M38.6Very low52.9Low157 Ų15789.1 Ų89.177%0.77350%0.499SS*.THydrogen-bonded Turntrans-90.9-20174-72-103.4-70.600112.2G152 T153 A154 T158G152-M156 WeakPolarHBondContact O-CG 3.27Å; T153-M156 PolarHBondContact O-N 3.19Å; T153-M156 VanDerWaalsContact O-N 3.12Å; A154-M156 VanDerWaalsContact C-N 3.26Å; A154-M156 PolarHBondContact O-N 3.43Å; M156-T158 PolarHBondContact O-N 3.35Å
157L41.3Very low54.2Low139 Ų13989.3 Ų89.373%0.72849%0.494SS*.SBendtrans-9045.5163.1-75.6170.9000109.5A154 N159A154-L157 PolarHBondContact O-N 3.16Å; L157-N159 VanDerWaalsContact C-N 3.32Å; L157-N159 PolarHBondContact O-N 3.12Å
158T40Very low55.8Low99 Ų9989.6 Ų89.661%0.60751%0.511SS*.  trans-65.5100.7167.634.80000107.5S155 M156S155-T158 WeakPolarHBondContact O-CG2 3.33Å; S155-T158 PolarHBondContact O-OG1 3.19Å; M156-T158 PolarHBondContact O-N 3.35Å
159N53.1Low57.4Low89 Ų8996.6 Ų96.648%0.47654%0.536SS..  trans-47.5140155.8-71.9-31.6000107.3L157 E161 G162L157-N159 VanDerWaalsContact C-N 3.32Å; L157-N159 PolarHBondContact O-N 3.12Å; N159-E161 PolarHBondContact O-N 3.32Å; N159-G162 PolarHBondContact O-N 3.08Å
160P53.3Low59.5Low140 Ų14092 Ų9291%0.90951%0.512SS*.THydrogen-bonded Turntrans-54.3-18.5178.817.9-30.3000113.3
161E55.4Low61.7Low120 Ų12089.8 Ų89.856%0.56151%0.512SS*.THydrogen-bonded Turntrans-90.20.4177.5-58.5-170159.300115.4Q32 N159Q32-E161 PolarHBondContact NE2-OE1 3.04Å; N159-E161 PolarHBondContact O-N 3.32Å
162G68.1Low64.1Low27 Ų2783.5 Ų83.528%0.27848%0.479SS..  trans81.9-173.9-177.600000114.7N159N159-G162 PolarHBondContact O-N 3.08Å
163P77.4Confident66.6Low108 Ų10884.3 Ų84.370%0.70148%0.478SS*.  trans-65.6135.8179.527.4-33.8000110.9
164F81.7Confident69.2Low49 Ų4987.4 Ų87.422%0.21549%0.485CS..SBendtrans-63.8-46.4-173.4177.4-132000112.8L31 W41 K44 T45 L48 Y188L31-F164 HydrophobicContact CD1-CE2 3.85Å; L31-F164 HydrophobicContact CD1-CZ 4.02Å; W41-F164 AromaticContact CD1-CZ 3.38Å; W41-F164 HydrophobicContact CG-CZ 4.17Å; W41-F164 AromaticContact NE1-CE1 3.89Å; W41-F164 AromaticContact NE1-CZ 3.62Å; K44-F164 HydrophobicContact CB-CE1 4.19Å; K44-F164 HydrophobicContact CB-CZ 3.95Å; K44-F164 HydrophobicContact CD-CD2 3.95Å; K44-F164 HydrophobicContact CD-CE1 4.24Å; K44-F164 HydrophobicContact CD-CE2 3.48Å; K44-F164 VanDerWaalsContact CD-CE2 3.48Å; K44-F164 HydrophobicContact CD-CZ 3.64Å; K44-F164 VanDerWaalsContact CE-CD2 3.45Å; K44-F164 HydrophobicContact CG-CD1 4.44Å; K44-F164 HydrophobicContact CG-CE1 3.97Å; K44-F164 HydrophobicContact CG-CE2 4.14Å; K44-F164 HydrophobicContact CG-CZ 3.81Å; T45-F164 HydrophobicContact CG2-CD1 4.3Å; T45-F164 HydrophobicContact CG2-CE1 3.64Å; L48-F164 HydrophobicContact CD1-CB 3.9Å; L48-F164 HydrophobicContact CD1-CD1 3.68Å; L48-F164 HydrophobicContact CD1-CE1 4.47Å; L48-F164 HydrophobicContact CD1-CG 3.94Å; F164-Y188 HydrophobicContact CD1-CE2 4.44Å
165I83.8Confident71.6Confident15 Ų1587.5 Ų87.58%0.07747%0.473CS..  trans-130.7130.7179.3-61.8155.3000108.7W41 T45 I170 L185 Y188W41-I165 HydrophobicContact CH2-CD1 4.26Å; W41-I165 HydrophobicContact CZ2-CD1 3.32Å; W41-I165 HydrophobicContact CZ2-CG1 4.01Å; T45-I165 HydrophobicContact CG2-CD1 3.7Å; I165-I170 HydrophobicContact CG2-CD1 4.2Å; I165-I170 HydrophobicContact CG2-CG2 3.92Å; I165-L185 HydrophobicContact CD1-CD1 4.48Å; I165-Y188 HydrophobicContact CB-CE1 4.33Å; I165-Y188 HydrophobicContact CD1-CD1 4.29Å; I165-Y188 HydrophobicContact CD1-CE1 4.14Å
166N85.2Confident74.1Confident72 Ų7284.6 Ų84.639%0.38545%0.453SS..  trans-90.2111.2170.1-173.1-15.3000109.7S168 R169N166-S168 VanDerWaalsContact CG-OG 3.29Å; N166-S168 PolarHBondContact ND2-OG 3.4Å; N166-S168 PolarHBondContact O-N 3.49Å; N166-S168 PolarHBondContact OD1-N 3.1Å; N166-S168 VanDerWaalsContact OD1-N 3.13Å; N166-S168 PolarHBondContact OD1-OG 3.27Å; N166-R169 HydrophobicContact CB-CG 4.22Å; N166-R169 PolarHBondContact O-N 3.17Å; N166-R169 VanDerWaalsContact O-N 3.08Å
167L81.9Confident76.6Confident26 Ų2683.3 Ų83.314%0.13645%0.445CS..G310 helixtrans-57.9-32.9-177.9-58-176.4000113R169 I170 I189 E193 D195L167-R169 PolarHBondContact O-N 3.38Å; L167-I170 HydrophobicContact CD2-CD1 4.07Å; L167-I170 WeakPolarHBondContact O-CG1 3.43Å; L167-I170 PolarHBondContact O-N 3.25Å; L167-I189 HydrophobicContact CD1-CG2 4.16Å; L167-I189 HydrophobicContact CD2-CD1 4.12Å; L167-I189 HydrophobicContact CD2-CG1 3.69Å; L167-E193 HydrophobicContact CD1-CB 4.13Å; L167-E193 HydrophobicContact CD1-CG 4.17Å; L167-D195 HydrophobicContact CD1-CB 3.99Å
168S84.3Confident79Confident101 Ų10180.8 Ų80.871%0.70643%0.428SS*.G310 helixtrans-67.9-21.1179.665.10000114N166N166-S168 VanDerWaalsContact CG-OG 3.29Å; N166-S168 PolarHBondContact ND2-OG 3.4Å; N166-S168 PolarHBondContact O-N 3.49Å; N166-S168 PolarHBondContact OD1-N 3.1Å; N166-S168 VanDerWaalsContact OD1-N 3.13Å; N166-S168 PolarHBondContact OD1-OG 3.27Å
169R84.2Confident81.3Confident202 Ų20279.8 Ų79.876%0.76242%0.423SS*.G310 helixtrans-95.2-15.4-175.9-64.2-171.8-176.6176.61.1113.6N166 L167N166-R169 HydrophobicContact CB-CG 4.22Å; N166-R169 PolarHBondContact O-N 3.17Å; N166-R169 VanDerWaalsContact O-N 3.08Å; L167-R169 PolarHBondContact O-N 3.38Å
170I87.5Confident83Confident27 Ų2779.8 Ų79.814%0.13843%0.43CS..SBendtrans-92130.6-175.454.2165.6000111I165 L167 L172 Y175 L185I165-I170 HydrophobicContact CG2-CD1 4.2Å; I165-I170 HydrophobicContact CG2-CG2 3.92Å; L167-I170 HydrophobicContact CD2-CD1 4.07Å; L167-I170 WeakPolarHBondContact O-CG1 3.43Å; L167-I170 PolarHBondContact O-N 3.25Å; I170-L172 HydrophobicContact CD1-CD2 3.81Å; I170-L172 HydrophobicContact CG1-CD2 4.15Å; I170-L172 PolarHBondContact O-N 2.87Å; I170-Y175 HydrophobicContact CB-CE2 4Å; I170-Y175 HydrophobicContact CG2-CE2 4.17Å; I170-L185 HydrophobicContact CD1-CD1 4.22Å; I170-L185 HydrophobicContact CD1-CD2 4.12Å
171N89.1Confident84.8Confident117 Ų11773.7 Ų73.763%0.62639%0.39SS*.  trans-83102.1173.6-66.9-13.3000109.2S173 K174 Y175N171-S173 PolarHBondContact O-N 3.2Å; N171-K174 PolarHBondContact O-N 3.02Å; N171-K174 VanDerWaalsContact O-N 3.09Å; N171-Y175 WeakPolarHBondContact O-CD2 3.31Å
172L89.8Confident86.5Confident16 Ų1668 Ų688%0.08436%0.363CS..Hα-helixtrans-57.3-34.7-177.3-56.6177000112.1I170 K174 Y175 S176 I189 D201 L202 Q205I170-L172 HydrophobicContact CD1-CD2 3.81Å; I170-L172 HydrophobicContact CG1-CD2 4.15Å; I170-L172 PolarHBondContact O-N 2.87Å; L172-K174 PolarHBondContact O-N 3.25Å; L172-Y175 PolarHBondContact O-N 3.12Å; L172-S176 PolarHBondContact O-N 3.45Å; L172-S176 PolarHBondContact O-OG 3.28Å; L172-I189 HydrophobicContact CD2-CD1 4.32Å; L172-D201 HydrophobicContact CD1-CB 4.16Å; L172-L202 HydrophobicContact CB-CB 4.41Å; L172-L202 HydrophobicContact CB-CD1 4.5Å; L172-L202 HydrophobicContact CD1-CB 4.29Å; L172-L202 HydrophobicContact CD2-CB 4.31Å; L172-L202 HydrophobicContact CD2-CD1 3.82Å; L172-Q205 VanDerWaalsContact C-OE1 3.23Å
173S89.8Confident87.7Confident65 Ų6571.5 Ų71.546%0.45537%0.368SS..Hα-helixtrans-62.8-24.1179.161.70000114.5N171 S176N171-S173 PolarHBondContact O-N 3.2Å; S173-S176 WeakPolarHBondContact CA-OG 3.48Å; S173-S176 PolarHBondContact O-OG 2.85Å
174K91.4Very high88.4Confident142 Ų14267 Ų6762%0.61734%0.339SS*.Hα-helixtrans-82.4-36174.7-174.6177.7178.3179.50111.3N171 L172N171-K174 PolarHBondContact O-N 3.02Å; N171-K174 VanDerWaalsContact O-N 3.09Å; L172-K174 PolarHBondContact O-N 3.25Å
175Y89.5Confident89Confident60 Ų6064.7 Ų64.724%0.23533%0.329CS..Hα-helixtrans-75.3-33.8179-72.9-79.3000111.5W41 I170 N171 L172 Q177 K178 L181 S182 L185W41-Y175 HydrophobicContact CH2-CD1 4.41Å; W41-Y175 AromaticContact CH2-CE1 3.87Å; W41-Y175 HydrophobicContact CH2-CE1 3.87Å; W41-Y175 HydrophobicContact CZ3-CE1 4.21Å; I170-Y175 HydrophobicContact CB-CE2 4Å; I170-Y175 HydrophobicContact CG2-CE2 4.17Å; N171-Y175 WeakPolarHBondContact O-CD2 3.31Å; L172-Y175 PolarHBondContact O-N 3.12Å; Y175-Q177 VanDerWaalsContact C-N 3.26Å; Y175-Q177 PolarHBondContact O-N 2.62Å; Y175-K178 PolarHBondContact O-N 3.13Å; Y175-L181 HydrophobicContact CD1-CB 4.32Å; Y175-L181 HydrophobicContact CD1-CD1 4.45Å; Y175-S182 WeakPolarHBondContact O-CB 3.43Å; Y175-L185 HydrophobicContact CD1-CD2 4.01Å; Y175-L185 HydrophobicContact CD2-CD2 4.02Å; Y175-L185 HydrophobicContact CG-CD2 3.67Å
176S90.1Very high89.5Confident5 Ų564 Ų644%0.03533%0.325CS..Hα-helixtrans-60-32.6177.864.60000113.2L172 S173 K178 H209L172-S176 PolarHBondContact O-N 3.45Å; L172-S176 PolarHBondContact O-OG 3.28Å; S173-S176 WeakPolarHBondContact CA-OG 3.48Å; S173-S176 PolarHBondContact O-OG 2.85Å; S176-K178 PolarHBondContact O-N 2.85Å; S176-H209 PolarHBondContact OG-CD2 3.18Å; S176-H209 PolarHBondContact OG-NE2 3.01Å
177Q91.5Very high89.8Confident130 Ų13063.3 Ų63.361%0.60732%0.319SS*.THydrogen-bonded Turntrans-64.2-25.5175.6-66.41777.200113.4Y175 P179Y175-Q177 VanDerWaalsContact C-N 3.26Å; Y175-Q177 PolarHBondContact O-N 2.62Å; Q177-P179 WeakPolarHBondContact O-CD 3.43Å
178K92.1Very high90.3Very high87 Ų8762.1 Ų62.138%0.37831%0.313SS..  trans-107.1100.3-177-70.5-176.9174.7-173.20110.1Y175 S176 S180 L181 S182Y175-K178 PolarHBondContact O-N 3.13Å; S176-K178 PolarHBondContact O-N 2.85Å; K178-S180 VanDerWaalsContact C-N 3.3Å; K178-S180 PolarHBondContact O-N 2.93Å; K178-L181 HydrophobicContact CB-CB 4.37Å; K178-L181 HydrophobicContact CB-CD1 4.39Å; K178-L181 HydrophobicContact CD-CD1 3.81Å; K178-L181 PolarHBondContact O-N 3.11Å; K178-L181 VanDerWaalsContact O-N 3.16Å; K178-S182 PolarHBondContact O-N 3.19Å; K178-S182 PolarHBondContact O-OG 2.89Å; K178-S182 VanDerWaalsContact O-OG 3.14Å
179P88.4Confident90.7Very high78 Ų7857.3 Ų57.351%0.50628%0.279SS..Hα-helixtrans-62-33.5-171.123.6-33.9000113.8Q177 S182 R183Q177-P179 WeakPolarHBondContact O-CD 3.43Å; P179-S182 VanDerWaalsContact CA-OG 3.26Å; P179-S182 WeakPolarHBondContact CA-OG 3.44Å; P179-S182 PolarHBondContact O-OG 3.39Å; P179-R183 WeakPolarHBondContact O-CG 3.4Å; P179-R183 PolarHBondContact O-N 3.39Å
180S87.8Confident91Very high89 Ų8947.7 Ų47.762%0.62224%0.243SC*.Hα-helixtrans-66.1-39.9179.253.10000112.5K178K178-S180 VanDerWaalsContact C-N 3.3Å; K178-S180 PolarHBondContact O-N 2.93Å
181L90.9Very high91.1Very high11 Ų1146.9 Ų46.96%0.05824%0.239CC..Hα-helixtrans-80.7-41.1179-65.3176.8000111.3W41 Y175 K178 R183 T184 L185W41-L181 HydrophobicContact CE3-CD2 4.15Å; W41-L181 HydrophobicContact CZ3-CD2 4.08Å; Y175-L181 HydrophobicContact CD1-CB 4.32Å; Y175-L181 HydrophobicContact CD1-CD1 4.45Å; K178-L181 HydrophobicContact CB-CB 4.37Å; K178-L181 HydrophobicContact CB-CD1 4.39Å; K178-L181 HydrophobicContact CD-CD1 3.81Å; K178-L181 PolarHBondContact O-N 3.11Å; K178-L181 VanDerWaalsContact O-N 3.16Å; L181-R183 VanDerWaalsContact C-N 3.33Å; L181-R183 PolarHBondContact O-N 2.82Å; L181-T184 PolarHBondContact O-N 3Å; L181-T184 PolarHBondContact O-OG1 2.94Å; L181-L185 VanDerWaalsContact O-CB 3.24Å; L181-L185 WeakPolarHBondContact O-CB 3.48Å; L181-L185 PolarHBondContact O-N 3.44Å
182S92.9Very high91Very high0 Ų043.9 Ų43.90%022%0.221CC..Hα-helixtrans-61.1-38.9-178.655.30000112.6Y175 K178 P179 L185 F186 W217Y175-S182 WeakPolarHBondContact O-CB 3.43Å; K178-S182 PolarHBondContact O-N 3.19Å; K178-S182 PolarHBondContact O-OG 2.89Å; K178-S182 VanDerWaalsContact O-OG 3.14Å; P179-S182 VanDerWaalsContact CA-OG 3.26Å; P179-S182 WeakPolarHBondContact CA-OG 3.44Å; P179-S182 PolarHBondContact O-OG 3.39Å; S182-L185 PolarHBondContact O-N 3.42Å; S182-F186 VanDerWaalsContact O-CB 3.25Å; S182-F186 WeakPolarHBondContact O-CB 3.38Å; S182-F186 PolarHBondContact O-N 2.94Å; S182-W217 WeakPolarHBondContact OG-CZ2 3.34Å
183R93.5Very high90.8Very high101 Ų10145.9 Ų45.938%0.38123%0.23SC..Hα-helixtrans-61.7-51.3175.5-69-176.1-177.8177.42.4112P179 L181 L185 F186 E187 D214 W216 W217P179-R183 WeakPolarHBondContact O-CG 3.4Å; P179-R183 PolarHBondContact O-N 3.39Å; L181-R183 VanDerWaalsContact C-N 3.33Å; L181-R183 PolarHBondContact O-N 2.82Å; R183-L185 VanDerWaalsContact C-N 3.31Å; R183-L185 PolarHBondContact O-N 3.24Å; R183-F186 WeakPolarHBondContact O-CB 3.47Å; R183-F186 PolarHBondContact O-N 3.45Å; R183-E187 WeakPolarHBondContact O-CG 3.24Å; R183-E187 PolarHBondContact O-N 3.26Å; R183-D214 IonicContact NH2-OD2 3.6Å; R183-W216 HydrophobicContact CB-CH2 3.88Å; R183-W216 HydrophobicContact CB-CZ2 4.42Å; R183-W216 HydrophobicContact CB-CZ3 4.2Å; R183-W216 HydrophobicContact CG-CE3 4.08Å; R183-W216 HydrophobicContact CG-CH2 3.81Å; R183-W216 HydrophobicContact CG-CZ2 4.43Å; R183-W216 HydrophobicContact CG-CZ3 3.62Å; R183-W217 HydrophobicContact CG-CZ2 3.86Å
184T92.1Very high90.7Very high15 Ų1544.6 Ų44.69%0.09222%0.218CC..Hα-helixtrans-64.8-35.2179.561.10000112.9R46 L181 Y188R46-T184 HydrophobicContact CG-CG2 3.77Å; L181-T184 PolarHBondContact O-N 3Å; L181-T184 PolarHBondContact O-OG1 2.94Å; T184-Y188 WeakPolarHBondContact O-CB 3.39Å; T184-Y188 PolarHBondContact O-N 3.35Å; T184-Y188 VanDerWaalsContact O-N 3.09Å
185L92.8Very high90.5Very high0 Ų040.2 Ų40.20%020%0.201CC..Hα-helixtrans-72.8-39.3177.5-178.760.2000111W41 I165 I170 Y175 L181 S182 R183 Y188 I189 L202W41-L185 HydrophobicContact CH2-CB 4.45Å; W41-L185 HydrophobicContact CH2-CD1 3.97Å; W41-L185 HydrophobicContact CH2-CD2 4.41Å; W41-L185 HydrophobicContact CZ2-CD1 4.41Å; I165-L185 HydrophobicContact CD1-CD1 4.48Å; I170-L185 HydrophobicContact CD1-CD1 4.22Å; I170-L185 HydrophobicContact CD1-CD2 4.12Å; Y175-L185 HydrophobicContact CD1-CD2 4.01Å; Y175-L185 HydrophobicContact CD2-CD2 4.02Å; Y175-L185 HydrophobicContact CG-CD2 3.67Å; L181-L185 VanDerWaalsContact O-CB 3.24Å; L181-L185 WeakPolarHBondContact O-CB 3.48Å; L181-L185 PolarHBondContact O-N 3.44Å; S182-L185 PolarHBondContact O-N 3.42Å; R183-L185 VanDerWaalsContact C-N 3.31Å; R183-L185 PolarHBondContact O-N 3.24Å; L185-Y188 WeakPolarHBondContact O-CB 3.28Å; L185-Y188 PolarHBondContact O-N 3.07Å; L185-I189 HydrophobicContact CD1-CD1 4.04Å; L185-I189 HydrophobicContact CD1-CG1 4.18Å; L185-I189 HydrophobicContact CG-CD1 3.86Å; L185-I189 HydrophobicContact CG-CG1 4.41Å; L185-I189 VanDerWaalsContact O-CG1 3.23Å; L185-I189 WeakPolarHBondContact O-CG1 3.13Å; L185-I189 PolarHBondContact O-N 3.01Å; L185-L202 HydrophobicContact CB-CD1 4.44Å; L185-L202 HydrophobicContact CD2-CD1 3.6Å; L185-L202 HydrophobicContact CG-CD1 3.93Å
186F94.9Very high90.5Very high0 Ų038.3 Ų38.30%020%0.196CC..Hα-helixtrans-58.3-50.9173.3177.9-91.4000110.9S182 R183 Y188 I189 F190 A199 L202 A203 W216 W217 Q220S182-F186 VanDerWaalsContact O-CB 3.25Å; S182-F186 WeakPolarHBondContact O-CB 3.38Å; S182-F186 PolarHBondContact O-N 2.94Å; R183-F186 WeakPolarHBondContact O-CB 3.47Å; R183-F186 PolarHBondContact O-N 3.45Å; F186-Y188 PolarHBondContact O-N 3.48Å; F186-I189 PolarHBondContact O-N 2.93Å; F186-F190 HydrophobicContact CD1-CB 4.43Å; F186-F190 HydrophobicContact CE1-CB 3.93Å; F186-F190 HydrophobicContact CE1-CD2 4.45Å; F186-F190 HydrophobicContact CE1-CG 4.1Å; F186-F190 HydrophobicContact CZ-CB 4.02Å; F186-F190 AromaticContact CZ-CD2 3.91Å; F186-F190 HydrophobicContact CZ-CD2 3.91Å; F186-F190 HydrophobicContact CZ-CG 4.02Å; F186-F190 VanDerWaalsContact O-CB 3.24Å; F186-F190 WeakPolarHBondContact O-CB 3.4Å; F186-F190 PolarHBondContact O-N 3.42Å; F186-A199 HydrophobicContact CD2-CB 4.18Å; F186-A199 WeakPolarHBondContact CD2-O 3.25Å; F186-A199 HydrophobicContact CE2-CB 3.75Å; F186-A199 WeakPolarHBondContact CE2-O 3.48Å; F186-A199 HydrophobicContact CZ-CB 4.41Å; F186-L202 HydrophobicContact CB-CD2 3.64Å; F186-L202 HydrophobicContact CD2-CD2 4.03Å; F186-L202 HydrophobicContact CG-CD2 4.32Å; F186-A203 HydrophobicContact CD2-CB 4.01Å; F186-A203 HydrophobicContact CE2-CB 3.8Å; F186-W216 HydrophobicContact CB-CH2 4.37Å; F186-W216 AromaticContact CD1-CH2 3.92Å; F186-W216 HydrophobicContact CD1-CH2 3.92Å; F186-W216 HydrophobicContact CG-CH2 4.39Å; F186-W217 HydrophobicContact CB-CH2 4Å; F186-W217 HydrophobicContact CB-CZ3 4Å; F186-W217 HydrophobicContact CD2-CZ3 4.01Å; F186-W217 HydrophobicContact CG-CH2 4.47Å; F186-W217 AromaticContact CG-CZ3 3.98Å; F186-W217 HydrophobicContact CG-CZ3 3.98Å; F186-Q220 HydrophobicContact CD1-CB 4.23Å; F186-Q220 HydrophobicContact CD1-CG 3.86Å; F186-Q220 HydrophobicContact CE1-CB 3.58Å; F186-Q220 HydrophobicContact CE1-CG 3.48Å; F186-Q220 VanDerWaalsContact CE1-CG 3.48Å; F186-Q220 VanDerWaalsContact CE1-OE1 3.29Å; F186-Q220 HydrophobicContact CE2-CB 4.12Å; F186-Q220 HydrophobicContact CZ-CB 3.52Å; F186-Q220 HydrophobicContact CZ-CG 4.01Å
187E92.4Very high90.5Very high57 Ų5745.5 Ų45.527%0.26623%0.227SC..Hα-helixtrans-58-38.3178-71.7169.1177.900111.4R183 H191 W216R183-E187 WeakPolarHBondContact O-CG 3.24Å; R183-E187 PolarHBondContact O-N 3.26Å; E187-H191 WeakPolarHBondContact O-CB 3.2Å; E187-H191 PolarHBondContact O-N 3.44Å; E187-W216 HydrophobicContact CG-CZ2 4.32Å
188Y91.6Very high90.5Very high1 Ų141.9 Ų41.90%0.00421%0.211CC..Iπ-helixtrans-62.6-52173.7-177.6-92.1000113.3T45 L48 T49 F164 I165 T184 L185 F186 F190 H192 E193T45-Y188 HydrophobicContact CG2-CD2 4.42Å; T45-Y188 HydrophobicContact CG2-CG 4.46Å; L48-Y188 HydrophobicContact CB-CD2 4.48Å; L48-Y188 HydrophobicContact CB-CE2 4.16Å; L48-Y188 HydrophobicContact CD1-CE2 4.01Å; T49-Y188 HydrophobicContact CG2-CD2 3.96Å; T49-Y188 HydrophobicContact CG2-CG 4.32Å; F164-Y188 HydrophobicContact CD1-CE2 4.44Å; I165-Y188 HydrophobicContact CB-CE1 4.33Å; I165-Y188 HydrophobicContact CD1-CD1 4.29Å; I165-Y188 HydrophobicContact CD1-CE1 4.14Å; T184-Y188 WeakPolarHBondContact O-CB 3.39Å; T184-Y188 PolarHBondContact O-N 3.35Å; T184-Y188 VanDerWaalsContact O-N 3.09Å; L185-Y188 WeakPolarHBondContact O-CB 3.28Å; L185-Y188 PolarHBondContact O-N 3.07Å; F186-Y188 PolarHBondContact O-N 3.48Å; Y188-F190 VanDerWaalsContact C-N 3.3Å; Y188-F190 PolarHBondContact O-N 2.75Å; Y188-H192 HydrophobicContact CD2-CB 3.97Å; Y188-H192 HydrophobicContact CE2-CB 4.05Å; Y188-H192 AromaticContact CE2-CE1 3.98Å; Y188-H192 AromaticContact CE2-CG 3.7Å; Y188-H192 AromaticContact CE2-ND1 3.5Å; Y188-H192 WeakPolarHBondContact CE2-ND1 3.47Å; Y188-H192 HydrophobicContact CG-CB 4.49Å; Y188-H192 AromaticContact CZ-ND1 3.52Å; Y188-H192 WeakPolarHBondContact O-CA 3.4Å; Y188-H192 VanDerWaalsContact O-CB 3.27Å; Y188-H192 WeakPolarHBondContact O-CB 3.38Å; Y188-H192 PolarHBondContact O-N 3.01Å; Y188-H192 PolarHBondContact OH-ND1 2.91Å; Y188-E193 HydrophobicContact CD1-CG 4.1Å; Y188-E193 HydrophobicContact CE1-CG 3.52Å; Y188-E193 WeakPolarHBondContact CE1-OE1 3.39Å; Y188-E193 PolarHBondContact O-N 3.08Å; Y188-E193 VanDerWaalsContact O-N 3.1Å; Y188-E193 PolarHBondContact OH-OE1 3.45Å
189I91.8Very high90.6Very high0 Ų037.7 Ų37.70%019%0.193CC..Iπ-helixtrans-64.8-39.9-178.9-61.4168.5000110.4L167 L172 L185 F186 N194 D195 N198 A199 L202L167-I189 HydrophobicContact CD1-CG2 4.16Å; L167-I189 HydrophobicContact CD2-CD1 4.12Å; L167-I189 HydrophobicContact CD2-CG1 3.69Å; L172-I189 HydrophobicContact CD2-CD1 4.32Å; L185-I189 HydrophobicContact CD1-CD1 4.04Å; L185-I189 HydrophobicContact CD1-CG1 4.18Å; L185-I189 HydrophobicContact CG-CD1 3.86Å; L185-I189 HydrophobicContact CG-CG1 4.41Å; L185-I189 VanDerWaalsContact O-CG1 3.23Å; L185-I189 WeakPolarHBondContact O-CG1 3.13Å; L185-I189 PolarHBondContact O-N 3.01Å; F186-I189 PolarHBondContact O-N 2.93Å; I189-N194 WeakPolarHBondContact O-CA 3.07Å; I189-N194 PolarHBondContact O-N 2.94Å; I189-D195 HydrophobicContact CG2-CB 4.14Å; I189-D195 WeakPolarHBondContact CG2-O 3.23Å; I189-D195 PolarHBondContact O-N 3.47Å; I189-D195 VanDerWaalsContact O-N 3.11Å; I189-N198 HydrophobicContact CG2-CB 4.12Å; I189-A199 HydrophobicContact CB-CB 4.39Å; I189-A199 HydrophobicContact CG2-CB 3.89Å; I189-L202 HydrophobicContact CD1-CD1 4.25Å
190F91.2Very high90.9Very high0 Ų035.7 Ų35.70%018%0.178CC..Iπ-helixtrans-79-42.2-173.3-171.9-94.1000114F186 Y188 N194 A199 K223 R227F186-F190 HydrophobicContact CD1-CB 4.43Å; F186-F190 HydrophobicContact CE1-CB 3.93Å; F186-F190 HydrophobicContact CE1-CD2 4.45Å; F186-F190 HydrophobicContact CE1-CG 4.1Å; F186-F190 HydrophobicContact CZ-CB 4.02Å; F186-F190 AromaticContact CZ-CD2 3.91Å; F186-F190 HydrophobicContact CZ-CD2 3.91Å; F186-F190 HydrophobicContact CZ-CG 4.02Å; F186-F190 VanDerWaalsContact O-CB 3.24Å; F186-F190 WeakPolarHBondContact O-CB 3.4Å; F186-F190 PolarHBondContact O-N 3.42Å; Y188-F190 VanDerWaalsContact C-N 3.3Å; Y188-F190 PolarHBondContact O-N 2.75Å; F190-N194 WeakPolarHBondContact O-CA 3.39Å; F190-N194 PolarHBondContact O-OD1 3.43Å; F190-N194 VanDerWaalsContact O-OD1 3.06Å; F190-A199 HydrophobicContact CB-CB 4.24Å; F190-A199 HydrophobicContact CD2-CB 4.15Å; F190-K223 HydrophobicContact CE1-CD 4.49Å; F190-K223 HydrophobicContact CE2-CB 4.29Å; F190-K223 HydrophobicContact CZ-CB 3.84Å; F190-R227 HydrophobicContact CZ-CG 4.29Å; F190-R227 PolarHBondContact O-NH1 3.15Å
191H89Confident91.2Very high11 Ų1134.8 Ų34.85%0.05117%0.166CC..Iπ-helixtrans-98.3-37.6-176.3-66.6-74000113.8Y53 E187 N194Y53-H191 HydrophobicContact CD2-CB 4.42Å; Y53-H191 AromaticContact CD2-CD2 3.8Å; Y53-H191 AromaticContact CD2-CG 3.85Å; Y53-H191 AromaticContact CD2-ND1 4Å; Y53-H191 AromaticContact CD2-NE2 3.95Å; Y53-H191 AromaticContact CE2-CD2 3.66Å; Y53-H191 AromaticContact CE2-CE1 3.56Å; Y53-H191 AromaticContact CE2-ND1 3.99Å; Y53-H191 AromaticContact CE2-NE2 3.35Å; Y53-H191 WeakPolarHBondContact CE2-NE2 3.44Å; E187-H191 WeakPolarHBondContact O-CB 3.2Å; E187-H191 PolarHBondContact O-N 3.44Å; H191-N194 PolarHBondContact O-ND2 3.27Å; H191-N194 PolarHBondContact O-OD1 3.27Å
192H87.8Confident91.3Very high54 Ų5434.3 Ų34.325%0.2516%0.163CC..Iπ-helixtrans-86.3-58.7-178.5-179.6-85.1000111.7T49 V52 Y188 N194T49-H192 HydrophobicContact CG2-CB 4.19Å; V52-H192 HydrophobicContact CG2-CB 4.16Å; Y188-H192 HydrophobicContact CD2-CB 3.97Å; Y188-H192 HydrophobicContact CE2-CB 4.05Å; Y188-H192 AromaticContact CE2-CE1 3.98Å; Y188-H192 AromaticContact CE2-CG 3.7Å; Y188-H192 AromaticContact CE2-ND1 3.5Å; Y188-H192 WeakPolarHBondContact CE2-ND1 3.47Å; Y188-H192 HydrophobicContact CG-CB 4.49Å; Y188-H192 AromaticContact CZ-ND1 3.52Å; Y188-H192 WeakPolarHBondContact O-CA 3.4Å; Y188-H192 VanDerWaalsContact O-CB 3.27Å; Y188-H192 WeakPolarHBondContact O-CB 3.38Å; Y188-H192 PolarHBondContact O-N 3.01Å; Y188-H192 PolarHBondContact OH-ND1 2.91Å; H192-N194 VanDerWaalsContact C-N 3.34Å; H192-N194 PolarHBondContact O-ND2 3.46Å
193E85.9Confident91.4Very high58 Ų5834.3 Ų34.327%0.27116%0.163SC..Iπ-helixtrans-76.7-24.4-180-60.8-60.5146.300112.5L167 Y188 D195L167-E193 HydrophobicContact CD1-CB 4.13Å; L167-E193 HydrophobicContact CD1-CG 4.17Å; Y188-E193 HydrophobicContact CD1-CG 4.1Å; Y188-E193 HydrophobicContact CE1-CG 3.52Å; Y188-E193 WeakPolarHBondContact CE1-OE1 3.39Å; Y188-E193 PolarHBondContact O-N 3.08Å; Y188-E193 VanDerWaalsContact O-N 3.1Å; Y188-E193 PolarHBondContact OH-OE1 3.45Å; E193-D195 PolarHBondContact O-N 3.18Å
194N86.5Confident91.5Very high37 Ų3730.7 Ų30.720%0.19816%0.155CC..  trans57.326.8-176.4-64.9-67000114.5F148 I189 F190 H191 H192 V196F148-N194 HydrophobicContact CB-CB 3.9Å; F148-N194 HydrophobicContact CD1-CB 4.02Å; F148-N194 VanDerWaalsContact CD1-OD1 3.3Å; F148-N194 WeakPolarHBondContact CD1-OD1 3.42Å; F148-N194 HydrophobicContact CG-CB 4.41Å; F148-N194 WeakPolarHBondContact O-CB 3.41Å; I189-N194 WeakPolarHBondContact O-CA 3.07Å; I189-N194 PolarHBondContact O-N 2.94Å; F190-N194 WeakPolarHBondContact O-CA 3.39Å; F190-N194 PolarHBondContact O-OD1 3.43Å; F190-N194 VanDerWaalsContact O-OD1 3.06Å; H191-N194 PolarHBondContact O-ND2 3.27Å; H191-N194 PolarHBondContact O-OD1 3.27Å; H192-N194 VanDerWaalsContact C-N 3.34Å; H192-N194 PolarHBondContact O-ND2 3.46Å; N194-V196 PolarHBondContact O-N 2.91Å
195D88.8Confident91.6Very high51 Ų5131.9 Ų31.927%0.27316%0.16SC..  trans-8991.5176-172.8-6.7000111L167 I189 E193 K197 N198 A199L167-D195 HydrophobicContact CD1-CB 3.99Å; I189-D195 HydrophobicContact CG2-CB 4.14Å; I189-D195 WeakPolarHBondContact CG2-O 3.23Å; I189-D195 PolarHBondContact O-N 3.47Å; I189-D195 VanDerWaalsContact O-N 3.11Å; E193-D195 PolarHBondContact O-N 3.18Å; D195-K197 VanDerWaalsContact C-N 3.26Å; D195-K197 PolarHBondContact O-N 3.44Å; D195-K197 PolarHBondContact OD1-N 3.18Å; D195-N198 PolarHBondContact OD1-N 3.47Å; D195-N198 PolarHBondContact OD2-ND2 3.22Å; D195-A199 WeakPolarHBondContact O-CB 3.21Å; D195-A199 PolarHBondContact O-N 2.84Å; D195-A199 VanDerWaalsContact O-N 3.11Å
196V88.7Confident91.7Very high20 Ų2032 Ų3212%0.12116%0.161CC..Hα-helixtrans-64.6-29.1-175.2-175.30000112.5N194 L200 C224 R227 L228N194-V196 PolarHBondContact O-N 2.91Å; V196-L200 VanDerWaalsContact O-CB 3.3Å; V196-L200 WeakPolarHBondContact O-CB 3.3Å; V196-L200 PolarHBondContact O-N 3.29Å; V196-C224 HydrophobicContact CG1-CB 4.04Å; V196-C224 WeakPolarHBondContact CG1-O 3.29Å; V196-R227 HydrophobicContact CG1-CB 4.07Å; V196-R227 HydrophobicContact CG2-CB 4.03Å; V196-L228 HydrophobicContact CG1-CD1 4.48Å; V196-L228 HydrophobicContact CG1-CD2 4.25Å; V196-L228 HydrophobicContact CG1-CG 3.96Å
197K90.8Very high91.6Very high156 Ų15632.2 Ų32.268%0.67816%0.162SC*.Hα-helixtrans-72.6-49.4-175.8-65.8179.9-178.4177.40111.4D195 A199 L200 D201D195-K197 VanDerWaalsContact C-N 3.26Å; D195-K197 PolarHBondContact O-N 3.44Å; D195-K197 PolarHBondContact OD1-N 3.18Å; K197-A199 VanDerWaalsContact C-N 3.31Å; K197-L200 WeakPolarHBondContact O-CB 3.19Å; K197-L200 PolarHBondContact O-N 3.46Å; K197-D201 PolarHBondContact O-N 2.84Å
198N91.4Very high91.7Very high53 Ų5335.5 Ų35.528%0.28318%0.178SC..Hα-helixtrans-67.6-34.6176.6-75.4-28000111.5I189 D195 L200 D201 L202I189-N198 HydrophobicContact CG2-CB 4.12Å; D195-N198 PolarHBondContact OD1-N 3.47Å; D195-N198 PolarHBondContact OD2-ND2 3.22Å; N198-L200 VanDerWaalsContact C-N 3.34Å; N198-D201 PolarHBondContact O-N 3.34Å; N198-L202 WeakPolarHBondContact O-CB 3.36Å; N198-L202 PolarHBondContact O-N 3.5Å; N198-L202 VanDerWaalsContact O-N 3.07Å
199A93Very high91.7Very high0 Ų040.3 Ų40.30%020%0.2CC..Hα-helixtrans-61.4-4317200000111.6F186 I189 F190 D195 K197 L202 A203F186-A199 HydrophobicContact CD2-CB 4.18Å; F186-A199 WeakPolarHBondContact CD2-O 3.25Å; F186-A199 HydrophobicContact CE2-CB 3.75Å; F186-A199 WeakPolarHBondContact CE2-O 3.48Å; F186-A199 HydrophobicContact CZ-CB 4.41Å; I189-A199 HydrophobicContact CB-CB 4.39Å; I189-A199 HydrophobicContact CG2-CB 3.89Å; F190-A199 HydrophobicContact CB-CB 4.24Å; F190-A199 HydrophobicContact CD2-CB 4.15Å; D195-A199 WeakPolarHBondContact O-CB 3.21Å; D195-A199 PolarHBondContact O-N 2.84Å; D195-A199 VanDerWaalsContact O-N 3.11Å; K197-A199 VanDerWaalsContact C-N 3.31Å; A199-L202 PolarHBondContact O-N 3.5Å; A199-A203 VanDerWaalsContact O-CB 3.3Å; A199-A203 WeakPolarHBondContact O-CB 3.45Å; A199-A203 PolarHBondContact O-N 3.24Å
200L94.7Very high91.7Very high36 Ų3641.5 Ų41.519%0.18821%0.21CC..Hα-helixtrans-63-47177.9-171.7161.1000111.6V196 K197 N198 L202 A203 A204 L221 C224 Y225 L228V196-L200 VanDerWaalsContact O-CB 3.3Å; V196-L200 WeakPolarHBondContact O-CB 3.3Å; V196-L200 PolarHBondContact O-N 3.29Å; K197-L200 WeakPolarHBondContact O-CB 3.19Å; K197-L200 PolarHBondContact O-N 3.46Å; N198-L200 VanDerWaalsContact C-N 3.34Å; L200-L202 PolarHBondContact O-N 2.98Å; L200-A203 PolarHBondContact O-N 3.46Å; L200-A204 WeakPolarHBondContact O-CB 3.42Å; L200-A204 PolarHBondContact O-N 3.3Å; L200-L221 HydrophobicContact CG-CD2 4.41Å; L200-C224 HydrophobicContact CB-CB 4.01Å; L200-C224 HydrophobicContact CD1-CB 4.2Å; L200-C224 HydrophobicContact CG-CB 4.22Å; L200-Y225 HydrophobicContact CD1-CD1 4.04Å; L200-Y225 HydrophobicContact CD1-CE1 3.8Å; L200-L228 HydrophobicContact CD1-CD1 3.46Å; L200-L228 VanDerWaalsContact CD1-CD1 3.46Å
201D94.4Very high91.7Very high70 Ų7047.5 Ų47.537%0.37424%0.238SC..Hα-helixtrans-61-45.7178.7-174.428.5000111.6L172 K197 N198 A203 A204 Q205L172-D201 HydrophobicContact CD1-CB 4.16Å; K197-D201 PolarHBondContact O-N 2.84Å; N198-D201 PolarHBondContact O-N 3.34Å; D201-A203 VanDerWaalsContact C-N 3.34Å; D201-A203 PolarHBondContact O-N 2.74Å; D201-A204 PolarHBondContact O-N 3.41Å; D201-Q205 VanDerWaalsContact O-CG 3.32Å; D201-Q205 WeakPolarHBondContact O-CG 3.45Å; D201-Q205 PolarHBondContact O-N 3.43Å; D201-Q205 PolarHBondContact OD1-NE2 2.73Å; D201-Q205 PolarHBondContact OD2-NE2 2.97Å; D201-Q205 VanDerWaalsContact OD2-NE2 3.16Å
202L94.2Very high91.8Very high0 Ų052.5 Ų52.50%026%0.26CS..Hα-helixtrans-61.8-42175.7-179.2141.5000112L172 L185 F186 I189 N198 A199 L200 A206 W217L172-L202 HydrophobicContact CB-CB 4.41Å; L172-L202 HydrophobicContact CB-CD1 4.5Å; L172-L202 HydrophobicContact CD1-CB 4.29Å; L172-L202 HydrophobicContact CD2-CB 4.31Å; L172-L202 HydrophobicContact CD2-CD1 3.82Å; L185-L202 HydrophobicContact CB-CD1 4.44Å; L185-L202 HydrophobicContact CD2-CD1 3.6Å; L185-L202 HydrophobicContact CG-CD1 3.93Å; F186-L202 HydrophobicContact CB-CD2 3.64Å; F186-L202 HydrophobicContact CD2-CD2 4.03Å; F186-L202 HydrophobicContact CG-CD2 4.32Å; I189-L202 HydrophobicContact CD1-CD1 4.25Å; N198-L202 WeakPolarHBondContact O-CB 3.36Å; N198-L202 PolarHBondContact O-N 3.5Å; N198-L202 VanDerWaalsContact O-N 3.07Å; A199-L202 PolarHBondContact O-N 3.5Å; L200-L202 PolarHBondContact O-N 2.98Å; L202-A206 VanDerWaalsContact O-CB 3.26Å; L202-A206 WeakPolarHBondContact O-CB 3.06Å; L202-A206 PolarHBondContact O-N 3Å; L202-W217 HydrophobicContact CD2-CH2 3.8Å; L202-W217 HydrophobicContact CD2-CZ3 3.99Å
203A94.9Very high91.9Very high0 Ų056.4 Ų56.40%028%0.276CS..Hα-helixtrans-65.3-43.4177.500000111.6F186 A199 L200 D201 A206 T207 W217 L221F186-A203 HydrophobicContact CD2-CB 4.01Å; F186-A203 HydrophobicContact CE2-CB 3.8Å; A199-A203 VanDerWaalsContact O-CB 3.3Å; A199-A203 WeakPolarHBondContact O-CB 3.45Å; A199-A203 PolarHBondContact O-N 3.24Å; L200-A203 PolarHBondContact O-N 3.46Å; D201-A203 VanDerWaalsContact C-N 3.34Å; D201-A203 PolarHBondContact O-N 2.74Å; A203-A206 PolarHBondContact O-N 2.94Å; A203-T207 WeakPolarHBondContact O-CG2 3.49Å; A203-T207 PolarHBondContact O-N 2.92Å; A203-W217 HydrophobicContact CB-CE3 3.98Å; A203-W217 HydrophobicContact CB-CZ3 4Å; A203-L221 HydrophobicContact CB-CD2 3.66Å; A203-L221 HydrophobicContact CB-CG 3.99Å
204A94.8Very high92.2Very high26 Ų2656.4 Ų56.422%0.21528%0.278CS..Hα-helixtrans-59-51.8177.500000110.9L200 D201 A206 T207 E208 L221L200-A204 WeakPolarHBondContact O-CB 3.42Å; L200-A204 PolarHBondContact O-N 3.3Å; D201-A204 PolarHBondContact O-N 3.41Å; A204-A206 VanDerWaalsContact C-N 3.32Å; A204-A206 PolarHBondContact O-N 3.18Å; A204-T207 PolarHBondContact O-N 2.88Å; A204-T207 VanDerWaalsContact O-N 3.1Å; A204-T207 PolarHBondContact O-OG1 2.98Å; A204-E208 PolarHBondContact O-N 3.2Å; A204-E208 VanDerWaalsContact O-N 3.1Å; A204-L221 HydrophobicContact CB-CD2 4.39Å
205Q94.5Very high92.6Very high39 Ų3957.6 Ų57.618%0.18228%0.28CS..Hα-helixtrans-60.4-40.8177.5-65.617117.700112L172 D201 T207 E208 H209L172-Q205 VanDerWaalsContact C-OE1 3.23Å; D201-Q205 VanDerWaalsContact O-CG 3.32Å; D201-Q205 WeakPolarHBondContact O-CG 3.45Å; D201-Q205 PolarHBondContact O-N 3.43Å; D201-Q205 PolarHBondContact OD1-NE2 2.73Å; D201-Q205 PolarHBondContact OD2-NE2 2.97Å; D201-Q205 VanDerWaalsContact OD2-NE2 3.16Å; Q205-T207 VanDerWaalsContact C-N 3.33Å; Q205-T207 PolarHBondContact O-N 3.43Å; Q205-E208 PolarHBondContact O-N 2.87Å; Q205-H209 PolarHBondContact O-CD2 3.38Å; Q205-H209 PolarHBondContact O-N 3.06Å; Q205-H209 VanDerWaalsContact O-N 3.17Å
206A93.8Very high92.9Very high3 Ų357 Ų573%0.02527%0.274CS..Hα-helixtrans-65.8-34.9176.900000112.5L202 A203 A204 H209 A210 W217L202-A206 VanDerWaalsContact O-CB 3.26Å; L202-A206 WeakPolarHBondContact O-CB 3.06Å; L202-A206 PolarHBondContact O-N 3Å; A203-A206 PolarHBondContact O-N 2.94Å; A204-A206 VanDerWaalsContact C-N 3.32Å; A204-A206 PolarHBondContact O-N 3.18Å; A206-H209 PolarHBondContact O-N 2.98Å; A206-A210 WeakPolarHBondContact O-CB 3.32Å; A206-A210 PolarHBondContact O-N 3.27Å; A206-W217 HydrophobicContact CB-CD2 3.81Å; A206-W217 HydrophobicContact CB-CE3 3.93Å; A206-W217 HydrophobicContact CB-CH2 3.63Å; A206-W217 HydrophobicContact CB-CZ2 3.49Å; A206-W217 VanDerWaalsContact CB-CZ2 3.49Å; A206-W217 HydrophobicContact CB-CZ3 3.85Å
207T93.8Very high93.2Very high5 Ų556.3 Ų56.33%0.03127%0.269CS..Hα-helixtrans-68.7-37177.566.10000112.4A203 A204 Q205 A210 Q211 F212 W217 L221A203-T207 WeakPolarHBondContact O-CG2 3.49Å; A203-T207 PolarHBondContact O-N 2.92Å; A204-T207 PolarHBondContact O-N 2.88Å; A204-T207 VanDerWaalsContact O-N 3.1Å; A204-T207 PolarHBondContact O-OG1 2.98Å; Q205-T207 VanDerWaalsContact C-N 3.33Å; Q205-T207 PolarHBondContact O-N 3.43Å; T207-A210 CarbonylContact O-C 3.47Å; T207-A210 PolarHBondContact O-N 3.37Å; T207-Q211 PolarHBondContact O-N 2.93Å; T207-Q211 VanDerWaalsContact O-N 3.1Å; T207-F212 PolarHBondContact O-N 2.85Å; T207-W217 HydrophobicContact CG2-CB 3.53Å; T207-W217 HydrophobicContact CG2-CG 4.25Å; T207-L221 HydrophobicContact CG2-CD1 3.53Å; T207-L221 HydrophobicContact CG2-CG 4.09Å
208E93.7Very high93.4Very high126 Ų12649.5 Ų49.559%0.58924%0.239SC*.Hα-helixtrans-64.5-45.6175-70.1179.4179.400110.9A204 Q205 A210 Q211 F212A204-E208 PolarHBondContact O-N 3.2Å; A204-E208 VanDerWaalsContact O-N 3.1Å; Q205-E208 PolarHBondContact O-N 2.87Å; E208-A210 VanDerWaalsContact C-N 3.3Å; E208-A210 PolarHBondContact O-N 3.43Å; E208-Q211 PolarHBondContact O-N 3.33Å; E208-F212 HydrophobicContact CG-CZ 4.06Å
209H93.1Very high93.6Very high101 Ų10147.1 Ų47.147%0.46823%0.226SC..Hα-helixtrans-63.2-35.9175.2-73-56000112.8S176 Q205 A206 Q211S176-H209 PolarHBondContact OG-CD2 3.18Å; S176-H209 PolarHBondContact OG-NE2 3.01Å; Q205-H209 PolarHBondContact O-CD2 3.38Å; Q205-H209 PolarHBondContact O-N 3.06Å; Q205-H209 VanDerWaalsContact O-N 3.17Å; A206-H209 PolarHBondContact O-N 2.98Å; H209-Q211 PolarHBondContact O-N 3.32Å
210A90.1Very high93.7Very high25 Ų2547.6 Ų47.621%0.20723%0.229CC..THydrogen-bonded Turntrans-78.74.1173.500000113.7A206 T207 E208 F212 K213 D214A206-A210 WeakPolarHBondContact O-CB 3.32Å; A206-A210 PolarHBondContact O-N 3.27Å; T207-A210 CarbonylContact O-C 3.47Å; T207-A210 PolarHBondContact O-N 3.37Å; E208-A210 VanDerWaalsContact C-N 3.3Å; E208-A210 PolarHBondContact O-N 3.43Å; A210-F212 PolarHBondContact O-N 2.68Å; A210-F212 VanDerWaalsContact O-N 3.14Å; A210-K213 PolarHBondContact O-N 2.92Å; A210-K213 VanDerWaalsContact O-N 3.14Å; A210-D214 HydrophobicContact CB-CB 4.36Å
211Q91.6Very high93.7Very high127 Ų12746.2 Ų46.259%0.59322%0.222SC*.THydrogen-bonded Turntrans52.334.3-179-56.8175.4-1400113.2T207 E208 H209 K213T207-Q211 PolarHBondContact O-N 2.93Å; T207-Q211 VanDerWaalsContact O-N 3.1Å; E208-Q211 PolarHBondContact O-N 3.33Å; H209-Q211 PolarHBondContact O-N 3.32Å; Q211-K213 HydrophobicContact CB-CD 4.42Å; Q211-K213 PolarHBondContact O-N 2.91Å; Q211-K213 VanDerWaalsContact O-N 3.11Å
212F91.3Very high93.8Very high115 Ų11542.9 Ų42.950%0.50420%0.204SC..THydrogen-bonded Turntrans57.419.1-178.4-54.2-79.9000115.8T207 E208 A210 K218 Q244T207-F212 PolarHBondContact O-N 2.85Å; E208-F212 HydrophobicContact CG-CZ 4.06Å; A210-F212 PolarHBondContact O-N 2.68Å; A210-F212 VanDerWaalsContact O-N 3.14Å; F212-K218 WeakPolarHBondContact O-CE 3.26Å; F212-K218 PolarHBondContact O-NZ 3.21Å; F212-Q244 PolarHBondContact O-NE2 3.43Å
213K90.5Very high93.7Very high137 Ų13743.5 Ų43.560%0.59621%0.206SC*.  trans-84.8-26.3-178.5-70.4168.5-179.6165.90113.7A210 Q211 Q244A210-K213 PolarHBondContact O-N 2.92Å; A210-K213 VanDerWaalsContact O-N 3.14Å; Q211-K213 HydrophobicContact CB-CD 4.42Å; Q211-K213 PolarHBondContact O-N 2.91Å; Q211-K213 VanDerWaalsContact O-N 3.11Å; K213-Q244 VanDerWaalsContact O-CD 3.24Å; K213-Q244 PolarHBondContact O-NE2 2.87Å; K213-Q244 VanDerWaalsContact O-NE2 3.15Å; K213-Q244 PolarHBondContact O-OE1 3.36Å
214D92.2Very high93.7Very high58 Ų5843.5 Ų43.531%0.3121%0.206SC..  trans-84.6120.7-175.7-72.53.8000111.8R183 A210 W216R183-D214 IonicContact NH2-OD2 3.6Å; A210-D214 HydrophobicContact CB-CB 4.36Å; D214-W216 PolarHBondContact O-N 3.11Å
215W93.8Very high93.7Very high62 Ų6244.3 Ų44.324%0.23520%0.204CC..Hα-helixtrans-66-37.6177.671.2-96000112.4W217 K218 V219 A241 Q244 Q245 V247W215-W217 VanDerWaalsContact C-N 3.3Å; W215-W217 PolarHBondContact O-N 3.37Å; W215-K218 WeakPolarHBondContact O-CB 3.37Å; W215-K218 PolarHBondContact O-N 3.44Å; W215-K218 VanDerWaalsContact O-N 3.08Å; W215-V219 HydrophobicContact CE3-CB 4.49Å; W215-V219 HydrophobicContact CE3-CG2 3.73Å; W215-V219 HydrophobicContact CZ3-CG2 4.04Å; W215-V219 WeakPolarHBondContact O-CG2 3.36Å; W215-V219 PolarHBondContact O-N 2.99Å; W215-A241 HydrophobicContact CB-CB 4.37Å; W215-Q244 HydrophobicContact CB-CB 4.29Å; W215-Q245 HydrophobicContact CG-CB 4.24Å; W215-V247 HydrophobicContact CD2-CG2 4.32Å; W215-V247 HydrophobicContact CE3-CG2 4.31Å; W215-V247 HydrophobicContact CH2-CG1 4.11Å; W215-V247 HydrophobicContact CH2-CG2 4.04Å; W215-V247 HydrophobicContact CZ2-CG2 4.02Å; W215-V247 HydrophobicContact CZ3-CB 4.46Å; W215-V247 HydrophobicContact CZ3-CG1 4.35Å; W215-V247 HydrophobicContact CZ3-CG2 4.18Å
216W94.7Very high93.5Very high39 Ų3943.3 Ų43.315%0.14820%0.199CC..Hα-helixtrans-57.4-44.5-176-177.389000111.4R183 F186 E187 D214 K218 V219 Q220R183-W216 HydrophobicContact CB-CH2 3.88Å; R183-W216 HydrophobicContact CB-CZ2 4.42Å; R183-W216 HydrophobicContact CB-CZ3 4.2Å; R183-W216 HydrophobicContact CG-CE3 4.08Å; R183-W216 HydrophobicContact CG-CH2 3.81Å; R183-W216 HydrophobicContact CG-CZ2 4.43Å; R183-W216 HydrophobicContact CG-CZ3 3.62Å; F186-W216 HydrophobicContact CB-CH2 4.37Å; F186-W216 AromaticContact CD1-CH2 3.92Å; F186-W216 HydrophobicContact CD1-CH2 3.92Å; F186-W216 HydrophobicContact CG-CH2 4.39Å; E187-W216 HydrophobicContact CG-CZ2 4.32Å; D214-W216 PolarHBondContact O-N 3.11Å; W216-K218 PolarHBondContact O-N 2.97Å; W216-V219 WeakPolarHBondContact O-CB 3.42Å; W216-V219 PolarHBondContact O-N 3.09Å; W216-Q220 HydrophobicContact CD2-CG 3.9Å; W216-Q220 VanDerWaalsContact CE2-NE2 3.27Å; W216-Q220 HydrophobicContact CE3-CG 3.77Å; W216-Q220 HydrophobicContact CH2-CG 3.68Å; W216-Q220 HydrophobicContact CZ2-CG 3.81Å; W216-Q220 HydrophobicContact CZ3-CG 3.64Å; W216-Q220 WeakPolarHBondContact O-CG 3.28Å; W216-Q220 PolarHBondContact O-N 3.41Å
217W95.2Very high93.2Very high4 Ų445.5 Ų45.52%0.01521%0.207CC..Hα-helixtrans-67.9-34.6179.1-80.9120.3000113.2S182 R183 F186 L202 A203 A206 T207 W215 Q220 L221S182-W217 WeakPolarHBondContact OG-CZ2 3.34Å; R183-W217 HydrophobicContact CG-CZ2 3.86Å; F186-W217 HydrophobicContact CB-CH2 4Å; F186-W217 HydrophobicContact CB-CZ3 4Å; F186-W217 HydrophobicContact CD2-CZ3 4.01Å; F186-W217 HydrophobicContact CG-CH2 4.47Å; F186-W217 AromaticContact CG-CZ3 3.98Å; F186-W217 HydrophobicContact CG-CZ3 3.98Å; L202-W217 HydrophobicContact CD2-CH2 3.8Å; L202-W217 HydrophobicContact CD2-CZ3 3.99Å; A203-W217 HydrophobicContact CB-CE3 3.98Å; A203-W217 HydrophobicContact CB-CZ3 4Å; A206-W217 HydrophobicContact CB-CD2 3.81Å; A206-W217 HydrophobicContact CB-CE3 3.93Å; A206-W217 HydrophobicContact CB-CH2 3.63Å; A206-W217 HydrophobicContact CB-CZ2 3.49Å; A206-W217 VanDerWaalsContact CB-CZ2 3.49Å; A206-W217 HydrophobicContact CB-CZ3 3.85Å; T207-W217 HydrophobicContact CG2-CB 3.53Å; T207-W217 HydrophobicContact CG2-CG 4.25Å; W215-W217 VanDerWaalsContact C-N 3.3Å; W215-W217 PolarHBondContact O-N 3.37Å; W217-Q220 PolarHBondContact O-N 3.22Å; W217-L221 PolarHBondContact O-N 2.87Å
218K95.3Very high93Very high13 Ų1348.9 Ų48.96%0.05722%0.224CC..Hα-helixtrans-65.5-40.6173-64.6-177.8-177.7-177.70111.6F212 W215 W216 L221 G222 S240 A241 Q244F212-K218 WeakPolarHBondContact O-CE 3.26Å; F212-K218 PolarHBondContact O-NZ 3.21Å; W215-K218 WeakPolarHBondContact O-CB 3.37Å; W215-K218 PolarHBondContact O-N 3.44Å; W215-K218 VanDerWaalsContact O-N 3.08Å; W216-K218 PolarHBondContact O-N 2.97Å; K218-L221 PolarHBondContact O-N 3.18Å; K218-G222 PolarHBondContact O-N 3.48Å; K218-S240 PolarHBondContact NZ-O 3.24Å; K218-S240 VanDerWaalsContact NZ-O 3.07Å; K218-S240 PolarHBondContact NZ-OG 3.01Å; K218-A241 HydrophobicContact CB-CB 4.06Å; K218-Q244 VanDerWaalsContact NZ-OE1 3.11Å
219V96.1Very high92.7Very high3 Ų344.2 Ų44.22%0.01821%0.21CC..Hα-helixtrans-61.4-46.5174.2172.40000110.3W215 W216 L221 G222 K223 F238 A241 T250 Y253W215-V219 HydrophobicContact CE3-CB 4.49Å; W215-V219 HydrophobicContact CE3-CG2 3.73Å; W215-V219 HydrophobicContact CZ3-CG2 4.04Å; W215-V219 WeakPolarHBondContact O-CG2 3.36Å; W215-V219 PolarHBondContact O-N 2.99Å; W216-V219 WeakPolarHBondContact O-CB 3.42Å; W216-V219 PolarHBondContact O-N 3.09Å; V219-L221 PolarHBondContact O-N 2.9Å; V219-G222 CarbonylContact O-C 3.59Å; V219-G222 WeakPolarHBondContact O-CA 3.44Å; V219-G222 PolarHBondContact O-N 3.29Å; V219-G222 VanDerWaalsContact O-N 3.13Å; V219-K223 WeakPolarHBondContact O-CG 3.45Å; V219-K223 PolarHBondContact O-N 3.2Å; V219-F238 HydrophobicContact CG1-CE1 4.2Å; V219-F238 WeakPolarHBondContact O-CE1 3.29Å; V219-A241 HydrophobicContact CG2-CB 3.76Å; V219-T250 HydrophobicContact CG2-CG2 3.39Å; V219-Y253 HydrophobicContact CG1-CD2 3.86Å; V219-Y253 HydrophobicContact CG1-CE2 3.83Å
220Q95.2Very high92.7Very high10 Ų1043.1 Ų43.15%0.04721%0.207CC..Hα-helixtrans-60.9-43.4176.9-65.1-33-3800113F186 W216 W217 G222 K223 C224F186-Q220 HydrophobicContact CD1-CB 4.23Å; F186-Q220 HydrophobicContact CD1-CG 3.86Å; F186-Q220 HydrophobicContact CE1-CB 3.58Å; F186-Q220 HydrophobicContact CE1-CG 3.48Å; F186-Q220 VanDerWaalsContact CE1-CG 3.48Å; F186-Q220 VanDerWaalsContact CE1-OE1 3.29Å; F186-Q220 HydrophobicContact CE2-CB 4.12Å; F186-Q220 HydrophobicContact CZ-CB 3.52Å; F186-Q220 HydrophobicContact CZ-CG 4.01Å; W216-Q220 HydrophobicContact CD2-CG 3.9Å; W216-Q220 VanDerWaalsContact CE2-NE2 3.27Å; W216-Q220 HydrophobicContact CE3-CG 3.77Å; W216-Q220 HydrophobicContact CH2-CG 3.68Å; W216-Q220 HydrophobicContact CZ2-CG 3.81Å; W216-Q220 HydrophobicContact CZ3-CG 3.64Å; W216-Q220 WeakPolarHBondContact O-CG 3.28Å; W216-Q220 PolarHBondContact O-N 3.41Å; W217-Q220 PolarHBondContact O-N 3.22Å; Q220-G222 VanDerWaalsContact C-N 3.33Å; Q220-G222 PolarHBondContact O-N 3.43Å; Q220-K223 PolarHBondContact O-N 3.38Å; Q220-C224 PolarHBondContact O-N 2.96Å
221L94.9Very high92.8Very high8 Ų843.1 Ų43.14%0.04220%0.202CC..Hα-helixtrans-58.6-44.8171.4-82.6179.3000111.8L200 A203 A204 T207 W217 K218 V219 K223 C224 Y225 Q237L200-L221 HydrophobicContact CG-CD2 4.41Å; A203-L221 HydrophobicContact CB-CD2 3.66Å; A203-L221 HydrophobicContact CB-CG 3.99Å; A204-L221 HydrophobicContact CB-CD2 4.39Å; T207-L221 HydrophobicContact CG2-CD1 3.53Å; T207-L221 HydrophobicContact CG2-CG 4.09Å; W217-L221 PolarHBondContact O-N 2.87Å; K218-L221 PolarHBondContact O-N 3.18Å; V219-L221 PolarHBondContact O-N 2.9Å; L221-K223 VanDerWaalsContact C-N 3.32Å; L221-K223 PolarHBondContact O-N 3.03Å; L221-C224 WeakPolarHBondContact O-CB 3.43Å; L221-C224 PolarHBondContact O-N 3.49Å; L221-Y225 HydrophobicContact CB-CE2 4.21Å; L221-Y225 WeakPolarHBondContact O-CD2 3.31Å; L221-Y225 PolarHBondContact O-N 3.44Å; L221-Q237 HydrophobicContact CB-CG 4.37Å
222G95.2Very high92.9Very high0 Ų042.6 Ų42.60%020%0.195CC..Hα-helixtrans-57.7-42175.600000112.6K218 V219 Q220 Y225 Y226 A234K218-G222 PolarHBondContact O-N 3.48Å; V219-G222 CarbonylContact O-C 3.59Å; V219-G222 WeakPolarHBondContact O-CA 3.44Å; V219-G222 PolarHBondContact O-N 3.29Å; V219-G222 VanDerWaalsContact O-N 3.13Å; Q220-G222 VanDerWaalsContact C-N 3.33Å; Q220-G222 PolarHBondContact O-N 3.43Å; G222-Y225 PolarHBondContact O-N 3.47Å; G222-Y226 WeakPolarHBondContact O-CB 3.35Å; G222-Y226 PolarHBondContact O-N 2.92Å; G222-A234 WeakPolarHBondContact O-CB 3.23Å
223K93.7Very high93.1Very high12 Ų1241.6 Ų41.65%0.05219%0.191CC..Hα-helixtrans-63.6-41.9174.6-64.7-175.8-156.7-165.30112.1E56 F190 V219 Q220 L221 Y226 R227 Y253E56-K223 HydrophobicContact CB-CD 4.34Å; E56-K223 HydrophobicContact CG-CD 4.33Å; F190-K223 HydrophobicContact CE1-CD 4.49Å; F190-K223 HydrophobicContact CE2-CB 4.29Å; F190-K223 HydrophobicContact CZ-CB 3.84Å; V219-K223 WeakPolarHBondContact O-CG 3.45Å; V219-K223 PolarHBondContact O-N 3.2Å; Q220-K223 PolarHBondContact O-N 3.38Å; L221-K223 VanDerWaalsContact C-N 3.32Å; L221-K223 PolarHBondContact O-N 3.03Å; K223-Y226 WeakPolarHBondContact O-CB 3.49Å; K223-Y226 PolarHBondContact O-N 2.94Å; K223-R227 PolarHBondContact O-N 3.43Å; K223-Y253 HydrophobicContact CD-CE1 4.4Å; K223-Y253 HydrophobicContact CD-CE2 4.48Å; K223-Y253 VanDerWaalsContact CE-CE2 3.41Å; K223-Y253 VanDerWaalsContact CE-OH 3.24Å; K223-Y253 WeakPolarHBondContact CE-OH 3.48Å; K223-Y253 HydrophobicContact CG-CE1 4.42Å; K223-Y253 PolarHBondContact NZ-OH 3.4Å
224C93.8Very high93.4Very high0 Ų035 Ų350%016%0.163CC..Hα-helixtrans-61-47.4174.6-720000111.6V196 L200 Q220 L221 Y226 R227 L228V196-C224 HydrophobicContact CG1-CB 4.04Å; V196-C224 WeakPolarHBondContact CG1-O 3.29Å; L200-C224 HydrophobicContact CB-CB 4.01Å; L200-C224 HydrophobicContact CD1-CB 4.2Å; L200-C224 HydrophobicContact CG-CB 4.22Å; Q220-C224 PolarHBondContact O-N 2.96Å; L221-C224 WeakPolarHBondContact O-CB 3.43Å; L221-C224 PolarHBondContact O-N 3.49Å; C224-Y226 VanDerWaalsContact C-N 3.32Å; C224-Y226 PolarHBondContact O-N 2.9Å; C224-R227 PolarHBondContact O-N 2.93Å; C224-L228 WeakPolarHBondContact O-CG 3.31Å; C224-L228 PolarHBondContact O-N 3.15Å
225Y94.4Very high93.5Very high43 Ų4333.1 Ų33.117%0.16915%0.152CC..Hα-helixtrans-62.1-40176.1-69-50.8000112.4L200 L221 G222 L228 G229 L230 E233 Q237L200-Y225 HydrophobicContact CD1-CD1 4.04Å; L200-Y225 HydrophobicContact CD1-CE1 3.8Å; L221-Y225 HydrophobicContact CB-CE2 4.21Å; L221-Y225 WeakPolarHBondContact O-CD2 3.31Å; L221-Y225 PolarHBondContact O-N 3.44Å; G222-Y225 PolarHBondContact O-N 3.47Å; Y225-L228 PolarHBondContact O-N 3.05Å; Y225-G229 PolarHBondContact O-N 3.5Å; Y225-L230 HydrophobicContact CD1-CB 4.48Å; Y225-L230 HydrophobicContact CD1-CD1 4.2Å; Y225-L230 PolarHBondContact O-N 3.42Å; Y225-E233 HydrophobicContact CD1-CB 4.33Å; Y225-E233 HydrophobicContact CD2-CB 4.27Å; Y225-E233 WeakPolarHBondContact CE1-OE2 3.42Å; Y225-E233 HydrophobicContact CG-CB 4.12Å; Y225-Q237 HydrophobicContact CD2-CG 3.91Å; Y225-Q237 HydrophobicContact CE2-CG 3.83Å
226Y92Very high93.7Very high19 Ų1937.4 Ų37.48%0.07517%0.172CC..Hα-helixtrans-58.8-49.5175.8-176.2-95.4000111.7D60 G222 K223 C224 L228 G229 Y231 K256 V257 R260D60-Y226 PolarHBondContact OD1-OH 3.02Å; G222-Y226 WeakPolarHBondContact O-CB 3.35Å; G222-Y226 PolarHBondContact O-N 2.92Å; K223-Y226 WeakPolarHBondContact O-CB 3.49Å; K223-Y226 PolarHBondContact O-N 2.94Å; C224-Y226 VanDerWaalsContact C-N 3.32Å; C224-Y226 PolarHBondContact O-N 2.9Å; Y226-L228 PolarHBondContact O-N 3.41Å; Y226-G229 PolarHBondContact O-N 2.86Å; Y226-Y231 AromaticContact CD2-CD1 3.78Å; Y226-Y231 HydrophobicContact CD2-CD1 3.78Å; Y226-Y231 AromaticContact CD2-CE1 3.94Å; Y226-Y231 HydrophobicContact CD2-CE1 3.94Å; Y226-Y231 AromaticContact CE2-CD1 3.86Å; Y226-Y231 HydrophobicContact CE2-CD1 3.86Å; Y226-Y231 AromaticContact CE2-CE1 3.75Å; Y226-Y231 HydrophobicContact CE2-CE1 3.75Å; Y226-K256 HydrophobicContact CE1-CD 4.03Å; Y226-K256 VanDerWaalsContact CE1-CE 3.48Å; Y226-K256 HydrophobicContact CE1-CG 4.5Å; Y226-K256 HydrophobicContact CE2-CD 4.39Å; Y226-K256 HydrophobicContact CE2-CG 4.13Å; Y226-K256 VanDerWaalsContact OH-CE 3.29Å; Y226-K256 WeakPolarHBondContact OH-CE 3.37Å; Y226-K256 WeakPolarHBondContact OH-CG 3.32Å; Y226-V257 HydrophobicContact CD2-CG2 3.73Å; Y226-V257 HydrophobicContact CE2-CG2 4.15Å; Y226-R260 HydrophobicContact CE2-CG 3.81Å; Y226-R260 WeakPolarHBondContact OH-CG 3.38Å; Y226-R260 PolarHBondContact OH-NE 3.47Å; Y226-R260 VanDerWaalsContact OH-NE 3.13Å
227R87.4Confident93.7Very high49 Ų4937.4 Ų37.419%0.18517%0.174CC..Hα-helixtrans-64.9-26.6177-74.9-168.3175.7-178.3-1113.6E56 F190 V196 K223 C224 G229E56-R227 IonicContact OE1-CZ 3.26Å; E56-R227 IonicContact OE1-NE 2.59Å; E56-R227 PolarHBondContact OE1-NE 2.92Å; E56-R227 IonicContact OE1-NH2 3.79Å; E56-R227 IonicContact OE2-CZ 2.82Å; E56-R227 IonicContact OE2-NE 3.81Å; E56-R227 PolarHBondContact OE2-NE 3.36Å; E56-R227 IonicContact OE2-NH2 3.23Å; E56-R227 PolarHBondContact OE2-NH2 3.45Å; F190-R227 HydrophobicContact CZ-CG 4.29Å; F190-R227 PolarHBondContact O-NH1 3.15Å; V196-R227 HydrophobicContact CG1-CB 4.07Å; V196-R227 HydrophobicContact CG2-CB 4.03Å; K223-R227 PolarHBondContact O-N 3.43Å; C224-R227 PolarHBondContact O-N 2.93Å; R227-G229 VanDerWaalsContact C-N 3.28Å
228L88.6Confident93.8Very high75 Ų7537.3 Ų37.339%0.39317%0.174SC..THydrogen-bonded Turntrans-80-6.5173.8-69.5173000113.4V196 L200 C224 Y225 Y226 L230V196-L228 HydrophobicContact CG1-CD1 4.48Å; V196-L228 HydrophobicContact CG1-CD2 4.25Å; V196-L228 HydrophobicContact CG1-CG 3.96Å; L200-L228 HydrophobicContact CD1-CD1 3.46Å; L200-L228 VanDerWaalsContact CD1-CD1 3.46Å; C224-L228 WeakPolarHBondContact O-CG 3.31Å; C224-L228 PolarHBondContact O-N 3.15Å; Y225-L228 PolarHBondContact O-N 3.05Å; Y226-L228 PolarHBondContact O-N 3.41Å; L228-L230 HydrophobicContact CB-CG 4.45Å
229G88.1Confident93.8Very high29 Ų2942.9 Ų42.930%0.29919%0.194SC..THydrogen-bonded Turntrans84.33.9-176.700000114.6Y225 Y226 R227 Y231Y225-G229 PolarHBondContact O-N 3.5Å; Y226-G229 PolarHBondContact O-N 2.86Å; R227-G229 VanDerWaalsContact C-N 3.28Å; G229-Y231 VanDerWaalsContact C-N 3.29Å; G229-Y231 WeakPolarHBondContact O-CD2 3.2Å; G229-Y231 PolarHBondContact O-N 3.29Å
230L91.9Very high93.7Very high77 Ų7744.7 Ų44.740%0.40321%0.207SC..  trans-85.668-179.8-60.1177000110.8Y225 L228 R232 E233 A234Y225-L230 HydrophobicContact CD1-CB 4.48Å; Y225-L230 HydrophobicContact CD1-CD1 4.2Å; Y225-L230 PolarHBondContact O-N 3.42Å; L228-L230 HydrophobicContact CB-CG 4.45Å; L230-R232 VanDerWaalsContact C-N 3.34Å; L230-R232 PolarHBondContact O-N 3.09Å; L230-E233 HydrophobicContact CB-CB 4.3Å; L230-E233 HydrophobicContact CB-CG 4.48Å; L230-E233 WeakPolarHBondContact CD1-OE2 3.34Å; L230-E233 PolarHBondContact O-N 3.49Å; L230-A234 PolarHBondContact O-N 2.9Å
231Y92.6Very high93.7Very high26 Ų2644.2 Ų44.210%0.10221%0.205CC..Hα-helixtrans-62.1-35.2-171.1-56.1-57.6000114.2Y226 G229 A234 E235 V257 R260 M261Y226-Y231 AromaticContact CD2-CD1 3.78Å; Y226-Y231 HydrophobicContact CD2-CD1 3.78Å; Y226-Y231 AromaticContact CD2-CE1 3.94Å; Y226-Y231 HydrophobicContact CD2-CE1 3.94Å; Y226-Y231 AromaticContact CE2-CD1 3.86Å; Y226-Y231 HydrophobicContact CE2-CD1 3.86Å; Y226-Y231 AromaticContact CE2-CE1 3.75Å; Y226-Y231 HydrophobicContact CE2-CE1 3.75Å; G229-Y231 VanDerWaalsContact C-N 3.29Å; G229-Y231 WeakPolarHBondContact O-CD2 3.2Å; G229-Y231 PolarHBondContact O-N 3.29Å; Y231-A234 PolarHBondContact O-N 3.14Å; Y231-E235 WeakPolarHBondContact O-CB 3.49Å; Y231-E235 PolarHBondContact O-N 3.32Å; Y231-V257 WeakPolarHBondContact O-CG1 3.39Å; Y231-R260 HydrophobicContact CD1-CB 4.16Å; Y231-R260 HydrophobicContact CE1-CB 3.95Å; Y231-R260 HydrophobicContact CE1-CG 4.03Å; Y231-R260 HydrophobicContact CE2-CB 4.39Å; Y231-R260 HydrophobicContact CG-CB 4.48Å; Y231-M261 VanDerWaalsContact C-CE 3.46Å; Y231-M261 WeakPolarHBondContact O-CE 3.38Å
232R94.5Very high93.7Very high116 Ų11644.8 Ų44.844%0.43821%0.208SC..Hα-helixtrans-71.1-36.8179.3-68.7-68.6179.5-165.1-3.6112.8L230 E235 K236 M261L230-R232 VanDerWaalsContact C-N 3.34Å; L230-R232 PolarHBondContact O-N 3.09Å; R232-E235 IonicContact CZ-OE2 3.61Å; R232-E235 IonicContact NH1-OE2 3.64Å; R232-E235 PolarHBondContact NH1-OE2 2.94Å; R232-E235 PolarHBondContact O-N 3.25Å; R232-K236 PolarHBondContact O-N 3.46Å; R232-K236 VanDerWaalsContact O-N 3.16Å; R232-M261 HydrophobicContact CG-CE 4.1Å; R232-M261 PolarHBondContact NH1-SD 3.43Å
233E95.3Very high93.6Very high93 Ų9351.7 Ų51.744%0.43525%0.245SC..Hα-helixtrans-70.2-40.3175.2-63.5-175.6174.100110.4Y225 L230 K236 Q237Y225-E233 HydrophobicContact CD1-CB 4.33Å; Y225-E233 HydrophobicContact CD2-CB 4.27Å; Y225-E233 WeakPolarHBondContact CE1-OE2 3.42Å; Y225-E233 HydrophobicContact CG-CB 4.12Å; L230-E233 HydrophobicContact CB-CB 4.3Å; L230-E233 HydrophobicContact CB-CG 4.48Å; L230-E233 WeakPolarHBondContact CD1-OE2 3.34Å; L230-E233 PolarHBondContact O-N 3.49Å; E233-K236 WeakPolarHBondContact O-CB 3.46Å; E233-K236 PolarHBondContact O-N 2.95Å; E233-Q237 WeakPolarHBondContact O-CG 3.33Å; E233-Q237 PolarHBondContact O-N 3.29Å; E233-Q237 VanDerWaalsContact O-N 3.14Å
234A95.9Very high93.5Very high0 Ų054.7 Ų54.70%026%0.259CS..Hα-helixtrans-58.6-47.9171.900000111.8G222 L230 Y231 K236 Q237 F238 V257G222-A234 WeakPolarHBondContact O-CB 3.23Å; L230-A234 PolarHBondContact O-N 2.9Å; Y231-A234 PolarHBondContact O-N 3.14Å; A234-K236 VanDerWaalsContact C-N 3.28Å; A234-K236 PolarHBondContact O-N 2.91Å; A234-Q237 PolarHBondContact O-N 2.9Å; A234-Q237 VanDerWaalsContact O-N 3.09Å; A234-F238 HydrophobicContact CB-CD2 4.35Å; A234-F238 HydrophobicContact CB-CE2 3.92Å; A234-F238 WeakPolarHBondContact O-CD2 3.36Å; A234-F238 WeakPolarHBondContact O-CG 3.45Å; A234-F238 PolarHBondContact O-N 3.43Å; A234-V257 HydrophobicContact CB-CG2 4.21Å
235E96Very high93.4Very high17 Ų1759.5 Ų59.58%0.07928%0.281CS..Hα-helixtrans-52.7-46.4175.8-173.9-173.5173.900111.6Y231 R232 Q237 F238 R239 V257 Y258 M261Y231-E235 WeakPolarHBondContact O-CB 3.49Å; Y231-E235 PolarHBondContact O-N 3.32Å; R232-E235 IonicContact CZ-OE2 3.61Å; R232-E235 IonicContact NH1-OE2 3.64Å; R232-E235 PolarHBondContact NH1-OE2 2.94Å; R232-E235 PolarHBondContact O-N 3.25Å; E235-Q237 VanDerWaalsContact C-N 3.35Å; E235-Q237 PolarHBondContact O-N 3.26Å; E235-F238 PolarHBondContact O-N 3.32Å; E235-R239 WeakPolarHBondContact O-CB 3.42Å; E235-R239 WeakPolarHBondContact O-CG 3.49Å; E235-R239 PolarHBondContact O-N 3.47Å; E235-R239 IonicContact OE1-CZ 3.87Å; E235-R239 VanDerWaalsContact OE1-CZ 3.23Å; E235-R239 IonicContact OE1-NE 3.26Å; E235-R239 PolarHBondContact OE1-NE 3.12Å; E235-R239 IonicContact OE1-NH1 3.88Å; E235-R239 IonicContact OE1-NH2 3.36Å; E235-R239 PolarHBondContact OE1-NH2 3.43Å; E235-V257 HydrophobicContact CB-CG1 4.04Å; E235-Y258 HydrophobicContact CG-CE1 4.22Å; E235-Y258 VanDerWaalsContact OE1-CE1 3.28Å; E235-Y258 WeakPolarHBondContact OE1-CE1 3.07Å; E235-Y258 PolarHBondContact OE1-OH 2.81Å; E235-M261 HydrophobicContact CB-CE 4.31Å
236K96.3Very high93.2Very high153 Ų15360.8 Ų60.867%0.66529%0.291SS*.Hα-helixtrans-61.1-42.4178.8-175.7-177.7176.3-175.80111.9R232 E233 A234 S240R232-K236 PolarHBondContact O-N 3.46Å; R232-K236 VanDerWaalsContact O-N 3.16Å; E233-K236 WeakPolarHBondContact O-CB 3.46Å; E233-K236 PolarHBondContact O-N 2.95Å; A234-K236 VanDerWaalsContact C-N 3.28Å; A234-K236 PolarHBondContact O-N 2.91Å; K236-S240 WeakPolarHBondContact O-CB 3.46Å; K236-S240 PolarHBondContact O-N 3.01Å
237Q96.1Very high93.3Very high39 Ų3961 Ų6118%0.18230%0.295CS..Hα-helixtrans-67.8-43.4178.4-63.8-56.4-28.500111.8L221 Y225 E233 A234 E235 S240 A241L221-Q237 HydrophobicContact CB-CG 4.37Å; Y225-Q237 HydrophobicContact CD2-CG 3.91Å; Y225-Q237 HydrophobicContact CE2-CG 3.83Å; E233-Q237 WeakPolarHBondContact O-CG 3.33Å; E233-Q237 PolarHBondContact O-N 3.29Å; E233-Q237 VanDerWaalsContact O-N 3.14Å; A234-Q237 PolarHBondContact O-N 2.9Å; A234-Q237 VanDerWaalsContact O-N 3.09Å; E235-Q237 VanDerWaalsContact C-N 3.35Å; E235-Q237 PolarHBondContact O-N 3.26Å; Q237-S240 CarbonylContact O-C 3.45Å; Q237-S240 WeakPolarHBondContact O-CB 3.33Å; Q237-S240 PolarHBondContact O-N 3.24Å; Q237-A241 PolarHBondContact O-N 3.27Å
238F96.5Very high93.7Very high2 Ų259.9 Ų59.91%0.00929%0.293CS..Hα-helixtrans-65.4-42.1178.2-63.3-47.4000112.4V219 A234 E235 S240 A241 L242 Y253 L254 V257V219-F238 HydrophobicContact CG1-CE1 4.2Å; V219-F238 WeakPolarHBondContact O-CE1 3.29Å; A234-F238 HydrophobicContact CB-CD2 4.35Å; A234-F238 HydrophobicContact CB-CE2 3.92Å; A234-F238 WeakPolarHBondContact O-CD2 3.36Å; A234-F238 WeakPolarHBondContact O-CG 3.45Å; A234-F238 PolarHBondContact O-N 3.43Å; E235-F238 PolarHBondContact O-N 3.32Å; F238-S240 VanDerWaalsContact C-N 3.3Å; F238-S240 PolarHBondContact O-N 2.95Å; F238-A241 WeakPolarHBondContact O-CB 3.36Å; F238-A241 PolarHBondContact O-N 3.3Å; F238-A241 VanDerWaalsContact O-N 3.14Å; F238-L242 PolarHBondContact O-N 2.88Å; F238-Y253 HydrophobicContact CE1-CD2 4.23Å; F238-Y253 HydrophobicContact CE1-CG 4.1Å; F238-Y253 HydrophobicContact CZ-CG 4.13Å; F238-L254 HydrophobicContact CB-CB 4.16Å; F238-L254 HydrophobicContact CB-CD1 4.1Å; F238-L254 HydrophobicContact CB-CG 4.17Å; F238-V257 HydrophobicContact CD2-CG2 3.9Å; F238-V257 HydrophobicContact CE2-CG2 3.67Å
239R95.6Very high93.9Very high130 Ų13059.6 Ų59.649%0.49129%0.292SS..Hα-helixtrans-61-39.4171.8-74-176.9171.6-166.9-4112.1E235 A241 L242 N243 L254 Y258E235-R239 WeakPolarHBondContact O-CB 3.42Å; E235-R239 WeakPolarHBondContact O-CG 3.49Å; E235-R239 PolarHBondContact O-N 3.47Å; E235-R239 IonicContact OE1-CZ 3.87Å; E235-R239 VanDerWaalsContact OE1-CZ 3.23Å; E235-R239 IonicContact OE1-NE 3.26Å; E235-R239 PolarHBondContact OE1-NE 3.12Å; E235-R239 IonicContact OE1-NH1 3.88Å; E235-R239 IonicContact OE1-NH2 3.36Å; E235-R239 PolarHBondContact OE1-NH2 3.43Å; R239-A241 VanDerWaalsContact C-N 3.28Å; R239-A241 PolarHBondContact O-N 3.17Å; R239-L242 PolarHBondContact O-N 3.16Å; R239-N243 VanDerWaalsContact O-CG 3.27Å; R239-N243 PolarHBondContact O-N 3.23Å; R239-N243 VanDerWaalsContact O-N 3.08Å; R239-N243 PolarHBondContact O-OD1 3.47Å; R239-L254 HydrophobicContact CG-CD1 3.73Å; R239-Y258 PolarHBondContact NE-OH 3.44Å; R239-Y258 PolarHBondContact NH2-OH 3.42Å
240S94.4Very high94.2Very high41 Ų4158.2 Ų58.229%0.28728%0.278SS..Hα-helixtrans-68.8-26.7176.6-164.20000113.2K218 K236 Q237 F238K218-S240 PolarHBondContact NZ-O 3.24Å; K218-S240 VanDerWaalsContact NZ-O 3.07Å; K218-S240 PolarHBondContact NZ-OG 3.01Å; K236-S240 WeakPolarHBondContact O-CB 3.46Å; K236-S240 PolarHBondContact O-N 3.01Å; Q237-S240 CarbonylContact O-C 3.45Å; Q237-S240 WeakPolarHBondContact O-CB 3.33Å; Q237-S240 PolarHBondContact O-N 3.24Å; F238-S240 VanDerWaalsContact C-N 3.3Å; F238-S240 PolarHBondContact O-N 2.95Å
241A95.1Very high94.4Very high0 Ų054.9 Ų54.90%026%0.26CS..Hα-helixtrans-74.9-4517300000111.4W215 K218 V219 Q237 F238 R239 N243 Q244 Q245 T250W215-A241 HydrophobicContact CB-CB 4.37Å; K218-A241 HydrophobicContact CB-CB 4.06Å; V219-A241 HydrophobicContact CG2-CB 3.76Å; Q237-A241 PolarHBondContact O-N 3.27Å; F238-A241 WeakPolarHBondContact O-CB 3.36Å; F238-A241 PolarHBondContact O-N 3.3Å; F238-A241 VanDerWaalsContact O-N 3.14Å; R239-A241 VanDerWaalsContact C-N 3.28Å; R239-A241 PolarHBondContact O-N 3.17Å; A241-N243 VanDerWaalsContact C-N 3.32Å; A241-N243 PolarHBondContact O-N 3.36Å; A241-Q244 WeakPolarHBondContact O-CB 3.44Å; A241-Q244 PolarHBondContact O-N 3.19Å; A241-Q245 PolarHBondContact O-N 3.04Å; A241-T250 HydrophobicContact CB-CG2 3.87Å
242L93.9Very high94.5Very high19 Ų1954.8 Ų54.810%0.09926%0.261CS..Hα-helixtrans-56.2-46174.6-76.4171.4000111.7F238 R239 Q244 Q245 T250 Y251 L254F238-L242 PolarHBondContact O-N 2.88Å; R239-L242 PolarHBondContact O-N 3.16Å; L242-Q244 PolarHBondContact O-N 3.26Å; L242-Q245 CarbonylContact O-C 3.6Å; L242-Q245 PolarHBondContact O-N 3.45Å; L242-T250 WeakPolarHBondContact CD2-OG1 3.38Å; L242-Y251 HydrophobicContact CD1-CE1 4.46Å; L242-Y251 HydrophobicContact CD2-CD1 4.43Å; L242-Y251 HydrophobicContact CD2-CD2 4.01Å; L242-Y251 HydrophobicContact CD2-CE1 4.15Å; L242-Y251 HydrophobicContact CD2-CE2 3.68Å; L242-Y251 HydrophobicContact CD2-CG 4.36Å; L242-L254 HydrophobicContact CD1-CD1 3.5Å
243N93.2Very high94.5Very high145 Ų14549.7 Ų49.778%0.77524%0.242SC*.THydrogen-bonded Turntrans-59.1-18.1176.9-69.7-9.6000114.4R239 A241R239-N243 VanDerWaalsContact O-CG 3.27Å; R239-N243 PolarHBondContact O-N 3.23Å; R239-N243 VanDerWaalsContact O-N 3.08Å; R239-N243 PolarHBondContact O-OD1 3.47Å; A241-N243 VanDerWaalsContact C-N 3.32Å; A241-N243 PolarHBondContact O-N 3.36Å
244Q92Very high94.6Very high75 Ų7545.3 Ų45.335%0.3522%0.221SC..THydrogen-bonded Turntrans-93.8-48.9177-73.4-179.7-3700112.3F212 K213 W215 K218 A241 L242F212-Q244 PolarHBondContact O-NE2 3.43Å; K213-Q244 VanDerWaalsContact O-CD 3.24Å; K213-Q244 PolarHBondContact O-NE2 2.87Å; K213-Q244 VanDerWaalsContact O-NE2 3.15Å; K213-Q244 PolarHBondContact O-OE1 3.36Å; W215-Q244 HydrophobicContact CB-CB 4.29Å; K218-Q244 VanDerWaalsContact NZ-OE1 3.11Å; A241-Q244 WeakPolarHBondContact O-CB 3.44Å; A241-Q244 PolarHBondContact O-N 3.19Å; L242-Q244 PolarHBondContact O-N 3.26Å
245Q92.2Very high94.5Very high101 Ų10145.4 Ų45.447%0.47222%0.222SC..  trans-150.6127.7179.5-173.7174.2-4.400109.4W215 A241 L242 V247W215-Q245 HydrophobicContact CG-CB 4.24Å; A241-Q245 PolarHBondContact O-N 3.04Å; L242-Q245 CarbonylContact O-C 3.6Å; L242-Q245 PolarHBondContact O-N 3.45Å; Q245-V247 HydrophobicContact CB-CG2 4.48Å; Q245-V247 HydrophobicContact CG-CG2 3.97Å; Q245-V247 PolarHBondContact O-N 3.37Å
246D90.8Very high94.3Very high71 Ų7145 Ų4538%0.3822%0.22SC..  trans-73.2118.7172.8-57-36.4000108.8H277 F278D246-H277 IonicContact OD2-CE1 3.94Å; D246-H277 IonicContact OD2-ND1 3.62Å; D246-F278 HydrophobicContact CB-CE2 4.31Å; D246-F278 HydrophobicContact CB-CZ 4.17Å; D246-F278 WeakPolarHBondContact O-CZ 3.26Å
247V93.2Very high94.2Very high24 Ų2437.8 Ų37.815%0.14519%0.188CC..  trans-134.9143177.3-177.40000108.5W215 Q245 D249 T250 Y251W215-V247 HydrophobicContact CD2-CG2 4.32Å; W215-V247 HydrophobicContact CE3-CG2 4.31Å; W215-V247 HydrophobicContact CH2-CG1 4.11Å; W215-V247 HydrophobicContact CH2-CG2 4.04Å; W215-V247 HydrophobicContact CZ2-CG2 4.02Å; W215-V247 HydrophobicContact CZ3-CB 4.46Å; W215-V247 HydrophobicContact CZ3-CG1 4.35Å; W215-V247 HydrophobicContact CZ3-CG2 4.18Å; Q245-V247 HydrophobicContact CB-CG2 4.48Å; Q245-V247 HydrophobicContact CG-CG2 3.97Å; Q245-V247 PolarHBondContact O-N 3.37Å; V247-D249 VanDerWaalsContact C-N 3.31Å; V247-D249 HydrophobicContact CG1-CB 4.11Å; V247-D249 PolarHBondContact O-N 3.15Å; V247-T250 PolarHBondContact O-N 3.3Å; V247-T250 PolarHBondContact O-OG1 3.47Å; V247-Y251 VanDerWaalsContact O-CD2 3.25Å; V247-Y251 WeakPolarHBondContact O-CD2 3.45Å
248V94.9Very high94.1Very high25 Ų2536.4 Ų36.415%0.15218%0.182CC..Hα-helixtrans-57.2-44.9179.3179.60000111.4T250 Y251 L252 F278 E281 T283 L284V248-T250 VanDerWaalsContact C-N 3.25Å; V248-T250 PolarHBondContact O-N 2.91Å; V248-Y251 WeakPolarHBondContact O-CB 3.46Å; V248-Y251 PolarHBondContact O-N 3.25Å; V248-L252 HydrophobicContact CG1-CD1 4.07Å; V248-L252 HydrophobicContact CG1-CG 4.38Å; V248-L252 PolarHBondContact O-N 3.41Å; V248-L252 VanDerWaalsContact O-N 3.12Å; V248-F278 HydrophobicContact CG2-CD1 4.49Å; V248-F278 HydrophobicContact CG2-CD2 3.9Å; V248-F278 HydrophobicContact CG2-CE2 4.07Å; V248-F278 HydrophobicContact CG2-CG 4.11Å; V248-F278 HydrophobicContact CG2-CZ 4.45Å; V248-E281 HydrophobicContact CG1-CG 3.87Å; V248-E281 HydrophobicContact CG2-CG 3.98Å; V248-T283 VanDerWaalsContact CG1-OG1 3.26Å; V248-T283 WeakPolarHBondContact CG1-OG1 3.27Å; V248-L284 HydrophobicContact CG1-CD2 4.16Å; V248-L284 HydrophobicContact CG1-CG 4.3Å
249D92.9Very high93.9Very high68 Ų6838.3 Ų38.336%0.36419%0.191SC..Hα-helixtrans-52.2-41.3178.4-60.9-7.7000113V247 Y251 L252 Y253V247-D249 VanDerWaalsContact C-N 3.31Å; V247-D249 HydrophobicContact CG1-CB 4.11Å; V247-D249 PolarHBondContact O-N 3.15Å; D249-Y251 PolarHBondContact O-N 3.3Å; D249-L252 PolarHBondContact O-N 2.89Å; D249-Y253 HydrophobicContact CB-CD2 4.3Å; D249-Y253 HydrophobicContact CB-CE2 3.97Å; D249-Y253 WeakPolarHBondContact O-CD2 3.27Å; D249-Y253 PolarHBondContact O-N 3.13Å
250T94.7Very high93.6Very high0 Ų032.7 Ų32.70%017%0.169CC..Hα-helixtrans-65.3-37.6179.934.50000112.6V219 A241 L242 V247 V248 L254V219-T250 HydrophobicContact CG2-CG2 3.39Å; A241-T250 HydrophobicContact CB-CG2 3.87Å; L242-T250 WeakPolarHBondContact CD2-OG1 3.38Å; V247-T250 PolarHBondContact O-N 3.3Å; V247-T250 PolarHBondContact O-OG1 3.47Å; V248-T250 VanDerWaalsContact C-N 3.25Å; V248-T250 PolarHBondContact O-N 2.91Å; T250-L254 WeakPolarHBondContact O-CB 3.4Å; T250-L254 PolarHBondContact O-N 3.27Å
251Y95.9Very high93.4Very high8 Ų831 Ų313%0.03116%0.157CC..Hα-helixtrans-66.3-41.3173.9-70.5-79.2000111.5L242 V247 V248 D249 L254 T255 L270 H277 F278L242-Y251 HydrophobicContact CD1-CE1 4.46Å; L242-Y251 HydrophobicContact CD2-CD1 4.43Å; L242-Y251 HydrophobicContact CD2-CD2 4.01Å; L242-Y251 HydrophobicContact CD2-CE1 4.15Å; L242-Y251 HydrophobicContact CD2-CE2 3.68Å; L242-Y251 HydrophobicContact CD2-CG 4.36Å; V247-Y251 VanDerWaalsContact O-CD2 3.25Å; V247-Y251 WeakPolarHBondContact O-CD2 3.45Å; V248-Y251 WeakPolarHBondContact O-CB 3.46Å; V248-Y251 PolarHBondContact O-N 3.25Å; D249-Y251 PolarHBondContact O-N 3.3Å; Y251-L254 PolarHBondContact O-N 3.37Å; Y251-T255 WeakPolarHBondContact O-CB 3.29Å; Y251-T255 PolarHBondContact O-N 3.33Å; Y251-T255 PolarHBondContact O-OG1 3.24Å; Y251-L270 HydrophobicContact CD1-CD1 3.94Å; Y251-L270 HydrophobicContact CD1-CG 3.93Å; Y251-L270 HydrophobicContact CE1-CD1 4.13Å; Y251-H277 PolarHBondContact OH-CD2 2.73Å; Y251-F278 HydrophobicContact CD2-CE2 4.34Å; Y251-F278 HydrophobicContact CE2-CD2 4.39Å; Y251-F278 AromaticContact CE2-CE2 3.97Å; Y251-F278 HydrophobicContact CE2-CE2 3.97Å
252L95.3Very high93.2Very high24 Ų2431.9 Ų31.913%0.12616%0.162CC..Hα-helixtrans-63-47.7177.2-64.4172.3000111.4V57 V248 D249 T255 K256 F271 L284V57-L252 HydrophobicContact CG1-CB 3.93Å; V57-L252 HydrophobicContact CG1-CD1 4.2Å; V57-L252 HydrophobicContact CG2-CB 4.19Å; V57-L252 HydrophobicContact CG2-CD1 4.38Å; V248-L252 HydrophobicContact CG1-CD1 4.07Å; V248-L252 HydrophobicContact CG1-CG 4.38Å; V248-L252 PolarHBondContact O-N 3.41Å; V248-L252 VanDerWaalsContact O-N 3.12Å; D249-L252 PolarHBondContact O-N 2.89Å; L252-T255 PolarHBondContact O-N 3.42Å; L252-K256 WeakPolarHBondContact O-CB 3.41Å; L252-K256 PolarHBondContact O-N 2.88Å; L252-F271 HydrophobicContact CD2-CE1 3.99Å; L252-F271 HydrophobicContact CD2-CZ 4.35Å; L252-L284 HydrophobicContact CD2-CD2 4.06Å; L252-L284 HydrophobicContact CG-CD2 4.36Å
253Y95.5Very high93.1Very high8 Ų833.2 Ų33.23%0.03117%0.168CC..Hα-helixtrans-65-40.5178.1-69.8-51.6000113.1D55 E56 V57 V219 K223 F238 D249 K256 V257D55-Y253 PolarHBondContact OD1-OH 2.86Å; E56-Y253 HydrophobicContact CB-CE1 4.06Å; E56-Y253 HydrophobicContact CG-CE1 4.35Å; V57-Y253 HydrophobicContact CB-CE1 4.37Å; V57-Y253 HydrophobicContact CG2-CD1 4.12Å; V57-Y253 HydrophobicContact CG2-CE1 3.46Å; V57-Y253 VanDerWaalsContact CG2-CE1 3.46Å; V57-Y253 HydrophobicContact CG2-CE2 4.39Å; V219-Y253 HydrophobicContact CG1-CD2 3.86Å; V219-Y253 HydrophobicContact CG1-CE2 3.83Å; K223-Y253 HydrophobicContact CD-CE1 4.4Å; K223-Y253 HydrophobicContact CD-CE2 4.48Å; K223-Y253 VanDerWaalsContact CE-CE2 3.41Å; K223-Y253 VanDerWaalsContact CE-OH 3.24Å; K223-Y253 WeakPolarHBondContact CE-OH 3.48Å; K223-Y253 HydrophobicContact CG-CE1 4.42Å; K223-Y253 PolarHBondContact NZ-OH 3.4Å; F238-Y253 HydrophobicContact CE1-CD2 4.23Å; F238-Y253 HydrophobicContact CE1-CG 4.1Å; F238-Y253 HydrophobicContact CZ-CG 4.13Å; D249-Y253 HydrophobicContact CB-CD2 4.3Å; D249-Y253 HydrophobicContact CB-CE2 3.97Å; D249-Y253 WeakPolarHBondContact O-CD2 3.27Å; D249-Y253 PolarHBondContact O-N 3.13Å; Y253-K256 WeakPolarHBondContact O-CB 3.4Å; Y253-K256 PolarHBondContact O-N 3.29Å; Y253-V257 WeakPolarHBondContact O-CG2 3.47Å; Y253-V257 PolarHBondContact O-N 3.03Å
254L95.5Very high93.1Very high1 Ų126.4 Ų26.41%0.00513%0.131CC..Hα-helixtrans-69.9-37.6-180-159.5167000110.7F238 R239 L242 T250 Y251 V257 Y258 L270F238-L254 HydrophobicContact CB-CB 4.16Å; F238-L254 HydrophobicContact CB-CD1 4.1Å; F238-L254 HydrophobicContact CB-CG 4.17Å; R239-L254 HydrophobicContact CG-CD1 3.73Å; L242-L254 HydrophobicContact CD1-CD1 3.5Å; T250-L254 WeakPolarHBondContact O-CB 3.4Å; T250-L254 PolarHBondContact O-N 3.27Å; Y251-L254 PolarHBondContact O-N 3.37Å; L254-V257 WeakPolarHBondContact O-CB 3.43Å; L254-V257 PolarHBondContact O-N 3.38Å; L254-Y258 HydrophobicContact CD2-CD2 3.52Å; L254-Y258 HydrophobicContact CD2-CE1 4.3Å; L254-Y258 HydrophobicContact CD2-CE2 2.94Å; L254-Y258 HydrophobicContact CD2-CG 4.39Å; L254-Y258 HydrophobicContact CG-CE2 4.43Å; L254-Y258 PolarHBondContact O-N 3.04Å; L254-L270 HydrophobicContact CB-CD2 3.81Å; L254-L270 HydrophobicContact CD1-CD1 4.47Å; L254-L270 HydrophobicContact CD1-CD2 4.4Å; L254-L270 HydrophobicContact CD2-CD1 4.29Å; L254-L270 HydrophobicContact CD2-CD2 3.37Å; L254-L270 HydrophobicContact CD2-CG 4.43Å; L254-L270 HydrophobicContact CG-CD2 4.02Å
255T94.4Very high93.1Very high2 Ų226.7 Ų26.71%0.01213%0.134CC..Hα-helixtrans-62-44.3171.4-56.20000111.7Y251 L252 V257 Y258 Q259 A267 L270 F271 I291Y251-T255 WeakPolarHBondContact O-CB 3.29Å; Y251-T255 PolarHBondContact O-N 3.33Å; Y251-T255 PolarHBondContact O-OG1 3.24Å; L252-T255 PolarHBondContact O-N 3.42Å; T255-V257 VanDerWaalsContact C-N 3.26Å; T255-V257 PolarHBondContact O-N 2.9Å; T255-Y258 CarbonylContact O-C 3.51Å; T255-Y258 WeakPolarHBondContact O-CA 3.46Å; T255-Y258 PolarHBondContact O-N 2.98Å; T255-Q259 HydrophobicContact CG2-CG 4.4Å; T255-Q259 WeakPolarHBondContact O-CG 2.93Å; T255-Q259 PolarHBondContact O-N 3.28Å; T255-A267 HydrophobicContact CG2-CB 3.56Å; T255-L270 WeakPolarHBondContact OG1-CD2 3.49Å; T255-F271 VanDerWaalsContact CB-CZ 3.44Å; T255-F271 HydrophobicContact CG2-CD2 3.95Å; T255-F271 HydrophobicContact CG2-CE1 3.86Å; T255-F271 HydrophobicContact CG2-CE2 3.2Å; T255-F271 HydrophobicContact CG2-CZ 3.15Å; T255-F271 WeakPolarHBondContact OG1-CD1 3.38Å; T255-F271 WeakPolarHBondContact OG1-CE1 3.46Å; T255-F271 VanDerWaalsContact OG1-CZ 3.31Å; T255-F271 WeakPolarHBondContact OG1-CZ 3.36Å; T255-I291 HydrophobicContact CG2-CD1 3.89Å
256K92.6Very high93.3Very high10 Ų1024.4 Ų24.44%0.04313%0.127CC..Hα-helixtrans-56.4-42.7175.4-170.3-176.1-174.9-1750111.5E56 V59 D60 Y226 L252 Y253 Y258 Q259 R260E56-K256 PolarHBondContact O-NZ 3.35Å; V59-K256 PolarHBondContact O-NZ 2.7Å; D60-K256 WeakPolarHBondContact OD1-CE 3.29Å; D60-K256 IonicContact OD1-NZ 2.77Å; Y226-K256 HydrophobicContact CE1-CD 4.03Å; Y226-K256 VanDerWaalsContact CE1-CE 3.48Å; Y226-K256 HydrophobicContact CE1-CG 4.5Å; Y226-K256 HydrophobicContact CE2-CD 4.39Å; Y226-K256 HydrophobicContact CE2-CG 4.13Å; Y226-K256 VanDerWaalsContact OH-CE 3.29Å; Y226-K256 WeakPolarHBondContact OH-CE 3.37Å; Y226-K256 WeakPolarHBondContact OH-CG 3.32Å; L252-K256 WeakPolarHBondContact O-CB 3.41Å; L252-K256 PolarHBondContact O-N 2.88Å; Y253-K256 WeakPolarHBondContact O-CB 3.4Å; Y253-K256 PolarHBondContact O-N 3.29Å; K256-Y258 PolarHBondContact O-N 3.46Å; K256-Q259 PolarHBondContact O-N 3.36Å; K256-R260 PolarHBondContact O-N 3.1Å
257V93.9Very high93.5Very high0 Ų021 Ų210%011%0.109CC..Hα-helixtrans-59.6-44.9172.6171.50000111.7Y226 Y231 A234 E235 F238 Y253 L254 T255 R260 M261Y226-V257 HydrophobicContact CD2-CG2 3.73Å; Y226-V257 HydrophobicContact CE2-CG2 4.15Å; Y231-V257 WeakPolarHBondContact O-CG1 3.39Å; A234-V257 HydrophobicContact CB-CG2 4.21Å; E235-V257 HydrophobicContact CB-CG1 4.04Å; F238-V257 HydrophobicContact CD2-CG2 3.9Å; F238-V257 HydrophobicContact CE2-CG2 3.67Å; Y253-V257 WeakPolarHBondContact O-CG2 3.47Å; Y253-V257 PolarHBondContact O-N 3.03Å; L254-V257 WeakPolarHBondContact O-CB 3.43Å; L254-V257 PolarHBondContact O-N 3.38Å; T255-V257 VanDerWaalsContact C-N 3.26Å; T255-V257 PolarHBondContact O-N 2.9Å; V257-R260 PolarHBondContact O-N 2.85Å; V257-M261 HydrophobicContact CG1-CE 3.42Å; V257-M261 VanDerWaalsContact CG1-CE 3.42Å; V257-M261 HydrophobicContact CG1-SD 4.44Å; V257-M261 WeakPolarHBondContact O-CG 3.46Å; V257-M261 PolarHBondContact O-N 2.57Å
258Y94.3Very high93.6Very high10 Ų1020.5 Ų20.54%0.03911%0.106CC..Hα-helixtrans-68.5-34.2177.6-73-36.3000114.1E235 R239 L254 T255 K256 R260 M261 D262 Q263 L270E235-Y258 HydrophobicContact CG-CE1 4.22Å; E235-Y258 VanDerWaalsContact OE1-CE1 3.28Å; E235-Y258 WeakPolarHBondContact OE1-CE1 3.07Å; E235-Y258 PolarHBondContact OE1-OH 2.81Å; R239-Y258 PolarHBondContact NE-OH 3.44Å; R239-Y258 PolarHBondContact NH2-OH 3.42Å; L254-Y258 HydrophobicContact CD2-CD2 3.52Å; L254-Y258 HydrophobicContact CD2-CE1 4.3Å; L254-Y258 HydrophobicContact CD2-CE2 2.94Å; L254-Y258 HydrophobicContact CD2-CG 4.39Å; L254-Y258 HydrophobicContact CG-CE2 4.43Å; L254-Y258 PolarHBondContact O-N 3.04Å; T255-Y258 CarbonylContact O-C 3.51Å; T255-Y258 WeakPolarHBondContact O-CA 3.46Å; T255-Y258 PolarHBondContact O-N 2.98Å; K256-Y258 PolarHBondContact O-N 3.46Å; Y258-R260 VanDerWaalsContact C-N 3.32Å; Y258-M261 HydrophobicContact CD1-SD 4.29Å; Y258-M261 CarbonylContact O-C 3.24Å; Y258-M261 PolarHBondContact O-N 3.28Å; Y258-D262 PolarHBondContact O-N 3.47Å; Y258-Q263 PolarHBondContact O-N 3.38Å; Y258-L270 HydrophobicContact CD2-CD2 4.28Å; Y258-L270 HydrophobicContact CE2-CD2 4.25Å
259Q91.3Very high93.6Very high43 Ų4323.1 Ų23.120%0.20112%0.119CC..Hα-helixtrans-61-43.4171.3-73175.8-15.600110.6L84 T255 K256 M261 D262 I291L84-Q259 HydrophobicContact CD1-CB 4.37Å; L84-Q259 HydrophobicContact CD1-CG 4.4Å; T255-Q259 HydrophobicContact CG2-CG 4.4Å; T255-Q259 WeakPolarHBondContact O-CG 2.93Å; T255-Q259 PolarHBondContact O-N 3.28Å; K256-Q259 PolarHBondContact O-N 3.36Å; Q259-M261 VanDerWaalsContact C-N 3.3Å; Q259-M261 PolarHBondContact O-N 3.37Å; Q259-D262 PolarHBondContact O-N 2.9Å; Q259-I291 VanDerWaalsContact NE2-CG1 3.25Å
260R89Confident93.8Very high12 Ų1220.5 Ų20.55%0.04511%0.105CC..Hα-helixtrans-66.5-26.7174.6-67.3-47.7-174.9111.2-16.2114.6D60 Q61 E62 E66 S72 Y226 Y231 K256 V257 Y258 D262D60-R260 VanDerWaalsContact CG-NE 3.34Å; D60-R260 IonicContact OD1-CZ 2.68Å; D60-R260 IonicContact OD1-NE 3.8Å; D60-R260 PolarHBondContact OD1-NE 3.25Å; D60-R260 IonicContact OD1-NH2 3.46Å; D60-R260 PolarHBondContact OD1-NH2 3.25Å; D60-R260 IonicContact OD2-CZ 3.57Å; D60-R260 VanDerWaalsContact OD2-CZ 3.26Å; D60-R260 IonicContact OD2-NE 3.25Å; D60-R260 PolarHBondContact OD2-NE 3.39Å; D60-R260 IonicContact OD2-NH2 3.47Å; D60-R260 PolarHBondContact OD2-NH2 3.49Å; Q61-R260 PolarHBondContact O-NH2 3.47Å; Q61-R260 VanDerWaalsContact O-NH2 3.16Å; E62-R260 VanDerWaalsContact CG-NH1 3.29Å; E62-R260 WeakPolarHBondContact OE1-CD 3.45Å; E62-R260 IonicContact OE1-CZ 3.18Å; E62-R260 VanDerWaalsContact OE1-CZ 3.23Å; E62-R260 IonicContact OE1-NE 3.74Å; E62-R260 PolarHBondContact OE1-NE 2.83Å; E62-R260 IonicContact OE1-NH1 3.26Å; E62-R260 PolarHBondContact OE1-NH1 3.5Å; E62-R260 IonicContact OE1-NH2 3.38Å; E66-R260 IonicContact OE2-NH1 2.92Å; S72-R260 PolarHBondContact OG-O 2.67Å; Y226-R260 HydrophobicContact CE2-CG 3.81Å; Y226-R260 WeakPolarHBondContact OH-CG 3.38Å; Y226-R260 PolarHBondContact OH-NE 3.47Å; Y226-R260 VanDerWaalsContact OH-NE 3.13Å; Y231-R260 HydrophobicContact CD1-CB 4.16Å; Y231-R260 HydrophobicContact CE1-CB 3.95Å; Y231-R260 HydrophobicContact CE1-CG 4.03Å; Y231-R260 HydrophobicContact CE2-CB 4.39Å; Y231-R260 HydrophobicContact CG-CB 4.48Å; K256-R260 PolarHBondContact O-N 3.1Å; V257-R260 PolarHBondContact O-N 2.85Å; Y258-R260 VanDerWaalsContact C-N 3.32Å; R260-D262 VanDerWaalsContact C-N 3.25Å
261M90.4Very high93.9Very high4 Ų420.8 Ų20.82%0.0211%0.106CC..THydrogen-bonded Turntrans-83.21.3171.5-64.9-179.1-166.800113.5Y231 R232 E235 V257 Y258 Q259 Q263Y231-M261 VanDerWaalsContact C-CE 3.46Å; Y231-M261 WeakPolarHBondContact O-CE 3.38Å; R232-M261 HydrophobicContact CG-CE 4.1Å; R232-M261 PolarHBondContact NH1-SD 3.43Å; E235-M261 HydrophobicContact CB-CE 4.31Å; V257-M261 HydrophobicContact CG1-CE 3.42Å; V257-M261 VanDerWaalsContact CG1-CE 3.42Å; V257-M261 HydrophobicContact CG1-SD 4.44Å; V257-M261 WeakPolarHBondContact O-CG 3.46Å; V257-M261 PolarHBondContact O-N 2.57Å; Y258-M261 HydrophobicContact CD1-SD 4.29Å; Y258-M261 CarbonylContact O-C 3.24Å; Y258-M261 PolarHBondContact O-N 3.28Å; Q259-M261 VanDerWaalsContact C-N 3.3Å; Q259-M261 PolarHBondContact O-N 3.37Å; M261-Q263 HydrophobicContact CB-CG 4.25Å
262D90.8Very high93.8Very high19 Ų1924.9 Ų24.910%0.10212%0.124CC..THydrogen-bonded Turntrans5941.5-174.7-166.135.3000113.6S83 L84 Y258 Q259 R260 P264S83-D262 WeakPolarHBondContact CB-OD2 3.42Å; S83-D262 VanDerWaalsContact OG-CG 3.24Å; S83-D262 PolarHBondContact OG-OD1 3.42Å; S83-D262 PolarHBondContact OG-OD2 3.33Å; L84-D262 WeakPolarHBondContact CB-OD1 3.27Å; L84-D262 PolarHBondContact N-OD1 3.07Å; Y258-D262 PolarHBondContact O-N 3.47Å; Q259-D262 PolarHBondContact O-N 2.9Å; R260-D262 VanDerWaalsContact C-N 3.25Å; D262-P264 VanDerWaalsContact C-CD 3.47Å; D262-P264 VanDerWaalsContact O-CD 3.31Å; D262-P264 WeakPolarHBondContact O-CD 3.3Å
263Q92.1Very high93.8Very high48 Ų4828.7 Ų28.722%0.22414%0.141CC..  trans-116.476.2176.7-58.1-172.5-25.700111.3Y258 M261 I265 T266 A267Y258-Q263 PolarHBondContact O-N 3.38Å; M261-Q263 HydrophobicContact CB-CG 4.25Å; Q263-I265 PolarHBondContact O-N 3.28Å; Q263-T266 HydrophobicContact CB-CG2 4.49Å; Q263-T266 WeakPolarHBondContact CB-OG1 3.45Å; Q263-T266 PolarHBondContact O-OG1 3.36Å; Q263-A267 PolarHBondContact O-N 3.11Å
264P92.9Very high93.8Very high1 Ų128.3 Ų28.31%0.00614%0.14CC..Hα-helixtrans-69.6-31.9-176.826.3-34000113.3T82 L84 D262 A267 L268 I291 M295T82-P264 WeakPolarHBondContact O-CD 3.37Å; T82-P264 WeakPolarHBondContact O-CG 3.11Å; L84-P264 HydrophobicContact CD2-CB 3.83Å; L84-P264 HydrophobicContact CD2-CG 4.27Å; L84-P264 HydrophobicContact CG-CB 4.08Å; L84-P264 HydrophobicContact CG-CG 4.21Å; D262-P264 VanDerWaalsContact C-CD 3.47Å; D262-P264 VanDerWaalsContact O-CD 3.31Å; D262-P264 WeakPolarHBondContact O-CD 3.3Å; P264-A267 WeakPolarHBondContact O-CB 3.23Å; P264-A267 PolarHBondContact O-N 3.34Å; P264-L268 VanDerWaalsContact O-CG 3.29Å; P264-L268 WeakPolarHBondContact O-CG 3.32Å; P264-L268 PolarHBondContact O-N 2.94Å; P264-I291 HydrophobicContact CB-CG2 3.78Å; P264-M295 HydrophobicContact CB-CG 4.41Å; P264-M295 HydrophobicContact CB-SD 3.97Å; P264-M295 HydrophobicContact CG-SD 4.15Å
265I93.5Very high93.7Very high81 Ų8129.7 Ų29.742%0.41515%0.147SC..Hα-helixtrans-70.3-40.4-177.7-59.5168.7000111.2T82 Q263 A267 L268 N269T82-I265 HydrophobicContact CG2-CD1 3.84Å; Q263-I265 PolarHBondContact O-N 3.28Å; I265-A267 VanDerWaalsContact C-N 3.34Å; I265-L268 PolarHBondContact O-N 2.85Å; I265-N269 PolarHBondContact O-N 3.47Å
266T94.9Very high93.8Very high54 Ų5436.2 Ų36.233%0.33118%0.181SC..Hα-helixtrans-66.6-40.117653.90000110.7Q263 N269 L270Q263-T266 HydrophobicContact CB-CG2 4.49Å; Q263-T266 WeakPolarHBondContact CB-OG1 3.45Å; Q263-T266 PolarHBondContact O-OG1 3.36Å; T266-N269 PolarHBondContact O-N 3.13Å; T266-L270 WeakPolarHBondContact O-CB 3.28Å; T266-L270 PolarHBondContact O-N 2.86Å
267A95.2Very high93.8Very high0 Ų040.6 Ų40.60%020%0.202CC..Hα-helixtrans-57.9-44.8171.300000112.6T255 Q263 P264 I265 L270 F271 I291T255-A267 HydrophobicContact CG2-CB 3.56Å; Q263-A267 PolarHBondContact O-N 3.11Å; P264-A267 WeakPolarHBondContact O-CB 3.23Å; P264-A267 PolarHBondContact O-N 3.34Å; I265-A267 VanDerWaalsContact C-N 3.34Å; A267-L270 PolarHBondContact O-N 3.31Å; A267-F271 PolarHBondContact O-N 3.28Å; A267-I291 HydrophobicContact CB-CD1 3.73Å
268L95.2Very high93.9Very high13 Ų1343.5 Ų43.57%0.06821%0.214CC..Hα-helixtrans-64.2-41.4176.5-73.3175.5000112.9P264 I265 L270 F271 K272 I288 I291 M295P264-L268 VanDerWaalsContact O-CG 3.29Å; P264-L268 WeakPolarHBondContact O-CG 3.32Å; P264-L268 PolarHBondContact O-N 2.94Å; I265-L268 PolarHBondContact O-N 2.85Å; L268-L270 VanDerWaalsContact C-N 3.34Å; L268-F271 PolarHBondContact O-N 3.44Å; L268-K272 WeakPolarHBondContact O-CG 3.44Å; L268-K272 PolarHBondContact O-N 3.47Å; L268-I288 HydrophobicContact CD2-CB 4.23Å; L268-I288 HydrophobicContact CD2-CG1 4.26Å; L268-I288 HydrophobicContact CD2-CG2 3.82Å; L268-I291 HydrophobicContact CD1-CG2 4.17Å; L268-I291 HydrophobicContact CD2-CB 4Å; L268-I291 HydrophobicContact CD2-CD1 4.16Å; L268-I291 HydrophobicContact CD2-CG2 3.96Å; L268-I291 HydrophobicContact CG-CB 4.47Å; L268-I291 HydrophobicContact CG-CD1 4.44Å; L268-I291 HydrophobicContact CG-CG2 3.9Å; L268-M295 HydrophobicContact CD1-CE 3.65Å
269N96.1Very high93.8Very high80 Ų8048.5 Ų48.543%0.42825%0.249SC..Hα-helixtrans-64.5-42.1176.2-69.9-13.7000111.1I265 T266 F271 K272 E273I265-N269 PolarHBondContact O-N 3.47Å; T266-N269 PolarHBondContact O-N 3.13Å; N269-F271 VanDerWaalsContact C-N 3.34Å; N269-F271 PolarHBondContact O-N 3.03Å; N269-K272 WeakPolarHBondContact O-CB 3.3Å; N269-K272 PolarHBondContact O-N 3.13Å; N269-K272 VanDerWaalsContact O-N 3.15Å; N269-E273 WeakPolarHBondContact O-CG 3.31Å; N269-E273 PolarHBondContact O-N 2.96Å
270L96.3Very high93.8Very high13 Ų1347.7 Ų47.77%0.06825%0.251CS..Hα-helixtrans-62-40.9176.8-177.376000112Y251 L254 T255 Y258 T266 A267 L268 K272 E273 G274Y251-L270 HydrophobicContact CD1-CD1 3.94Å; Y251-L270 HydrophobicContact CD1-CG 3.93Å; Y251-L270 HydrophobicContact CE1-CD1 4.13Å; L254-L270 HydrophobicContact CB-CD2 3.81Å; L254-L270 HydrophobicContact CD1-CD1 4.47Å; L254-L270 HydrophobicContact CD1-CD2 4.4Å; L254-L270 HydrophobicContact CD2-CD1 4.29Å; L254-L270 HydrophobicContact CD2-CD2 3.37Å; L254-L270 HydrophobicContact CD2-CG 4.43Å; L254-L270 HydrophobicContact CG-CD2 4.02Å; T255-L270 WeakPolarHBondContact OG1-CD2 3.49Å; Y258-L270 HydrophobicContact CD2-CD2 4.28Å; Y258-L270 HydrophobicContact CE2-CD2 4.25Å; T266-L270 WeakPolarHBondContact O-CB 3.28Å; T266-L270 PolarHBondContact O-N 2.86Å; A267-L270 PolarHBondContact O-N 3.31Å; L268-L270 VanDerWaalsContact C-N 3.34Å; L270-K272 VanDerWaalsContact C-N 3.34Å; L270-E273 PolarHBondContact O-N 3.14Å; L270-G274 PolarHBondContact O-N 2.93Å
271F96.1Very high94.1Very high5 Ų550 Ų502%0.02226%0.263CS..Hα-helixtrans-66-36.1174.2-77-36.8000112.8L252 T255 A267 L268 N269 G274 L275 L284 I288 I291L252-F271 HydrophobicContact CD2-CE1 3.99Å; L252-F271 HydrophobicContact CD2-CZ 4.35Å; T255-F271 VanDerWaalsContact CB-CZ 3.44Å; T255-F271 HydrophobicContact CG2-CD2 3.95Å; T255-F271 HydrophobicContact CG2-CE1 3.86Å; T255-F271 HydrophobicContact CG2-CE2 3.2Å; T255-F271 HydrophobicContact CG2-CZ 3.15Å; T255-F271 WeakPolarHBondContact OG1-CD1 3.38Å; T255-F271 WeakPolarHBondContact OG1-CE1 3.46Å; T255-F271 VanDerWaalsContact OG1-CZ 3.31Å; T255-F271 WeakPolarHBondContact OG1-CZ 3.36Å; A267-F271 PolarHBondContact O-N 3.28Å; L268-F271 PolarHBondContact O-N 3.44Å; N269-F271 VanDerWaalsContact C-N 3.34Å; N269-F271 PolarHBondContact O-N 3.03Å; F271-G274 PolarHBondContact O-N 2.7Å; F271-L275 WeakPolarHBondContact O-CG 3.48Å; F271-L275 PolarHBondContact O-N 3.43Å; F271-L284 HydrophobicContact CD1-CB 4.44Å; F271-L284 HydrophobicContact CD1-CD2 3.73Å; F271-L284 HydrophobicContact CE1-CD2 3.88Å; F271-I288 HydrophobicContact CB-CD1 3.73Å; F271-I288 HydrophobicContact CB-CG1 3.42Å; F271-I288 VanDerWaalsContact CB-CG1 3.42Å; F271-I288 HydrophobicContact CD2-CG1 3.67Å; F271-I288 HydrophobicContact CG-CG1 3.91Å; F271-I291 HydrophobicContact CD2-CD1 3.89Å; F271-I291 HydrophobicContact CE2-CD1 3.6Å
272K95.2Very high94.4Very high94 Ų9451.2 Ų51.241%0.40927%0.27SS..Hα-helixtrans-64.2-44.5173.6-71.2172.5-177.7178.40111.6L268 N269 L270 G274 L275 D276L268-K272 WeakPolarHBondContact O-CG 3.44Å; L268-K272 PolarHBondContact O-N 3.47Å; N269-K272 WeakPolarHBondContact O-CB 3.3Å; N269-K272 PolarHBondContact O-N 3.13Å; N269-K272 VanDerWaalsContact O-N 3.15Å; L270-K272 VanDerWaalsContact C-N 3.34Å; K272-G274 VanDerWaalsContact C-N 3.29Å; K272-G274 PolarHBondContact O-N 3.29Å; K272-L275 WeakPolarHBondContact O-CB 3.41Å; K272-L275 PolarHBondContact O-N 2.82Å; K272-L275 VanDerWaalsContact O-N 3.09Å; K272-D276 PolarHBondContact O-N 3.48Å
273E94.8Very high94.6Very high105 Ų10552.8 Ų52.849%0.49128%0.28SS..Hα-helixtrans-56.2-46.7171.7-70171.9-173.100110.4N269 L270 L275 D276 H277N269-E273 WeakPolarHBondContact O-CG 3.31Å; N269-E273 PolarHBondContact O-N 2.96Å; L270-E273 PolarHBondContact O-N 3.14Å; E273-L275 VanDerWaalsContact C-N 3.28Å; E273-L275 PolarHBondContact O-N 3.42Å; E273-D276 WeakPolarHBondContact O-CB 3.4Å; E273-D276 PolarHBondContact O-N 2.89Å; E273-D276 VanDerWaalsContact O-N 3.11Å; E273-H277 PolarHBondContact O-CD2 3.23Å; E273-H277 PolarHBondContact O-N 3.43Å
274G94.8Very high94.8Very high0 Ų050.5 Ų50.50%027%0.27CS..Hα-helixtrans-59.4-35.2175.800000113.8L270 F271 K272 H277 F278L270-G274 PolarHBondContact O-N 2.93Å; F271-G274 PolarHBondContact O-N 2.7Å; K272-G274 VanDerWaalsContact C-N 3.29Å; K272-G274 PolarHBondContact O-N 3.29Å; G274-H277 PolarHBondContact O-N 3.41Å; G274-F278 WeakPolarHBondContact O-CB 3.45Å; G274-F278 PolarHBondContact O-N 3.06Å
275L94.8Very high95Very high30 Ų3050.8 Ų50.816%0.15727%0.271CS..Hα-helixtrans-73.6-29.5175.3-72.3172.1000113.2F271 K272 E273 H277 F278 P279 L284 L285 I288F271-L275 WeakPolarHBondContact O-CG 3.48Å; F271-L275 PolarHBondContact O-N 3.43Å; K272-L275 WeakPolarHBondContact O-CB 3.41Å; K272-L275 PolarHBondContact O-N 2.82Å; K272-L275 VanDerWaalsContact O-N 3.09Å; E273-L275 VanDerWaalsContact C-N 3.28Å; E273-L275 PolarHBondContact O-N 3.42Å; L275-H277 VanDerWaalsContact C-N 3.29Å; L275-F278 CarbonylContact O-C 3.27Å; L275-F278 VanDerWaalsContact O-C 3.24Å; L275-P279 WeakPolarHBondContact O-CA 3.21Å; L275-L284 HydrophobicContact CD2-CB 3.88Å; L275-L284 HydrophobicContact CD2-CD1 4.26Å; L275-L284 HydrophobicContact CG-CB 4.16Å; L275-L284 HydrophobicContact CG-CD1 4.42Å; L275-L285 HydrophobicContact CD1-CD2 3.68Å; L275-L285 HydrophobicContact CD1-CG 4.29Å; L275-L285 HydrophobicContact CD2-CD2 4.15Å; L275-L285 HydrophobicContact CD2-CG 3.93Å; L275-I288 HydrophobicContact CD1-CD1 3.49Å; L275-I288 VanDerWaalsContact CD1-CD1 3.49Å
276D95.1Very high95.1Very high138 Ų13847.2 Ų47.274%0.73825%0.253SS*.Hα-helixtrans-65.9-35.9172.4-65.7-28.5000110.8K272 E273K272-D276 PolarHBondContact O-N 3.48Å; E273-D276 WeakPolarHBondContact O-CB 3.4Å; E273-D276 PolarHBondContact O-N 2.89Å; E273-D276 VanDerWaalsContact O-N 3.11Å
277H93.6Very high95Very high103 Ų10344.9 Ų44.948%0.47724%0.24SC..Hα-helixtrans-77.8-42.2174.1-69.1-76.2000113D246 Y251 E273 G274 L275 P279D246-H277 IonicContact OD2-CE1 3.94Å; D246-H277 IonicContact OD2-ND1 3.62Å; Y251-H277 PolarHBondContact OH-CD2 2.73Å; E273-H277 PolarHBondContact O-CD2 3.23Å; E273-H277 PolarHBondContact O-N 3.43Å; G274-H277 PolarHBondContact O-N 3.41Å; L275-H277 VanDerWaalsContact C-N 3.29Å; H277-P279 WeakPolarHBondContact O-CD 3.48Å
278F94.9Very high95Very high60 Ų6044.9 Ų44.926%0.26324%0.24SC..SBendtrans-118.381.7-178.6-58.7-68.6000110.6D246 V248 Y251 G274 L275 G280 E281D246-F278 HydrophobicContact CB-CE2 4.31Å; D246-F278 HydrophobicContact CB-CZ 4.17Å; D246-F278 WeakPolarHBondContact O-CZ 3.26Å; V248-F278 HydrophobicContact CG2-CD1 4.49Å; V248-F278 HydrophobicContact CG2-CD2 3.9Å; V248-F278 HydrophobicContact CG2-CE2 4.07Å; V248-F278 HydrophobicContact CG2-CG 4.11Å; V248-F278 HydrophobicContact CG2-CZ 4.45Å; Y251-F278 HydrophobicContact CD2-CE2 4.34Å; Y251-F278 HydrophobicContact CE2-CD2 4.39Å; Y251-F278 AromaticContact CE2-CE2 3.97Å; Y251-F278 HydrophobicContact CE2-CE2 3.97Å; G274-F278 WeakPolarHBondContact O-CB 3.45Å; G274-F278 PolarHBondContact O-N 3.06Å; L275-F278 CarbonylContact O-C 3.27Å; L275-F278 VanDerWaalsContact O-C 3.24Å; F278-G280 PolarHBondContact O-N 3.44Å; F278-E281 HydrophobicContact CB-CB 3.97Å; F278-E281 PolarHBondContact O-N 3.32Å
279P93.8Very high95Very high116 Ų11644.2 Ų44.275%0.75324%0.236SC*.THydrogen-bonded Turntrans-65.8121-178.226-33.6000110.3L275 H277L275-P279 WeakPolarHBondContact O-CA 3.21Å; H277-P279 WeakPolarHBondContact O-CD 3.48Å
280G89.9Confident94.9Very high25 Ų2542.5 Ų42.526%0.25822%0.224SC..THydrogen-bonded Turntrans88.112.3176.300000115.4F278 V282F278-G280 PolarHBondContact O-N 3.44Å; G280-V282 PolarHBondContact O-N 2.93Å
281E96.2Very high94.7Very high62 Ų6241.9 Ų41.929%0.2922%0.221SC..  trans-66.2120.9175-178.753.1-136.100111.5V248 F278 T283 L284 L285V248-E281 HydrophobicContact CG1-CG 3.87Å; V248-E281 HydrophobicContact CG2-CG 3.98Å; F278-E281 HydrophobicContact CB-CB 3.97Å; F278-E281 PolarHBondContact O-N 3.32Å; E281-T283 WeakPolarHBondContact CG-OG1 3.38Å; E281-T283 PolarHBondContact OE1-N 3.43Å; E281-T283 PolarHBondContact OE1-OG1 3.45Å; E281-L284 HydrophobicContact CB-CD1 4.1Å; E281-L284 HydrophobicContact CB-CG 4.22Å; E281-L284 HydrophobicContact CG-CB 4.46Å; E281-L284 HydrophobicContact CG-CD1 4.1Å; E281-L284 HydrophobicContact CG-CG 3.84Å; E281-L285 PolarHBondContact O-N 3.44Å
282V96.4Very high94.5Very high29 Ų2942.6 Ų42.618%0.17622%0.224CC..Hα-helixtrans-68.7-42.6-173173.90000111.3G280 L284 L285 T286 V308 Q311 D312G280-V282 PolarHBondContact O-N 2.93Å; V282-L284 VanDerWaalsContact C-N 3.33Å; V282-L284 PolarHBondContact O-N 3.01Å; V282-L285 PolarHBondContact O-N 3.43Å; V282-T286 HydrophobicContact CG1-CG2 4.03Å; V282-T286 VanDerWaalsContact O-CG2 3.23Å; V282-T286 WeakPolarHBondContact O-CG2 3.49Å; V282-T286 PolarHBondContact O-N 3.45Å; V282-T286 PolarHBondContact O-OG1 3.09Å; V282-V308 HydrophobicContact CG1-CG1 3.9Å; V282-Q311 HydrophobicContact CG2-CB 3.84Å; V282-D312 HydrophobicContact CG1-CB 4.47Å; V282-D312 HydrophobicContact CG2-CB 3.95Å
283T95Very high94.2Very high51 Ų5139.5 Ų39.531%0.31321%0.211SC..Hα-helixtrans-61.1-40.6-176.553.80000112.3V248 E281 T286 G287V248-T283 VanDerWaalsContact CG1-OG1 3.26Å; V248-T283 WeakPolarHBondContact CG1-OG1 3.27Å; E281-T283 WeakPolarHBondContact CG-OG1 3.38Å; E281-T283 PolarHBondContact OE1-N 3.43Å; E281-T283 PolarHBondContact OE1-OG1 3.45Å; T283-T286 WeakPolarHBondContact CA-OG1 3.35Å; T283-T286 PolarHBondContact O-N 3.11Å; T283-T286 PolarHBondContact O-OG1 3.18Å; T283-G287 PolarHBondContact O-N 3.42Å
284L96.2Very high93.8Very high0 Ų036.2 Ų36.20%020%0.196CC..Hα-helixtrans-67.6-45.2177.3-57.5-179.2000111.9V248 L252 F271 L275 E281 V282 T286 G287 I288V248-L284 HydrophobicContact CG1-CD2 4.16Å; V248-L284 HydrophobicContact CG1-CG 4.3Å; L252-L284 HydrophobicContact CD2-CD2 4.06Å; L252-L284 HydrophobicContact CG-CD2 4.36Å; F271-L284 HydrophobicContact CD1-CB 4.44Å; F271-L284 HydrophobicContact CD1-CD2 3.73Å; F271-L284 HydrophobicContact CE1-CD2 3.88Å; L275-L284 HydrophobicContact CD2-CB 3.88Å; L275-L284 HydrophobicContact CD2-CD1 4.26Å; L275-L284 HydrophobicContact CG-CB 4.16Å; L275-L284 HydrophobicContact CG-CD1 4.42Å; E281-L284 HydrophobicContact CB-CD1 4.1Å; E281-L284 HydrophobicContact CB-CG 4.22Å; E281-L284 HydrophobicContact CG-CB 4.46Å; E281-L284 HydrophobicContact CG-CD1 4.1Å; E281-L284 HydrophobicContact CG-CG 3.84Å; V282-L284 VanDerWaalsContact C-N 3.33Å; V282-L284 PolarHBondContact O-N 3.01Å; L284-T286 VanDerWaalsContact C-N 3.31Å; L284-T286 PolarHBondContact O-N 3.31Å; L284-G287 PolarHBondContact O-N 2.91Å; L284-G287 VanDerWaalsContact O-N 3.14Å; L284-I288 WeakPolarHBondContact O-CG1 3.46Å; L284-I288 PolarHBondContact O-N 3.28Å
285L96.7Very high93.4Very high8 Ų836.6 Ų36.64%0.04220%0.198CC..Hα-helixtrans-60.4-41.3175.3-71.2169000111.7L275 E281 V282 G287 I288 A289 Y304 E307 V308 Q311L275-L285 HydrophobicContact CD1-CD2 3.68Å; L275-L285 HydrophobicContact CD1-CG 4.29Å; L275-L285 HydrophobicContact CD2-CD2 4.15Å; L275-L285 HydrophobicContact CD2-CG 3.93Å; E281-L285 PolarHBondContact O-N 3.44Å; V282-L285 PolarHBondContact O-N 3.43Å; L285-G287 VanDerWaalsContact C-N 3.35Å; L285-I288 PolarHBondContact O-N 2.91Å; L285-A289 PolarHBondContact O-N 3.19Å; L285-Y304 HydrophobicContact CD2-CD1 4.13Å; L285-E307 HydrophobicContact CD1-CB 4.37Å; L285-E307 HydrophobicContact CD2-CB 4.44Å; L285-V308 HydrophobicContact CB-CG2 3.51Å; L285-Q311 HydrophobicContact CD1-CG 4.2Å
286T95.6Very high93Very high5 Ų537.1 Ų37.13%0.03120%0.2CC..Hα-helixtrans-64.7-39.3174.864.20000111.5V282 T283 L284 I288 A289 R290 V308 H315V282-T286 HydrophobicContact CG1-CG2 4.03Å; V282-T286 VanDerWaalsContact O-CG2 3.23Å; V282-T286 WeakPolarHBondContact O-CG2 3.49Å; V282-T286 PolarHBondContact O-N 3.45Å; V282-T286 PolarHBondContact O-OG1 3.09Å; T283-T286 WeakPolarHBondContact CA-OG1 3.35Å; T283-T286 PolarHBondContact O-N 3.11Å; T283-T286 PolarHBondContact O-OG1 3.18Å; L284-T286 VanDerWaalsContact C-N 3.31Å; L284-T286 PolarHBondContact O-N 3.31Å; T286-I288 PolarHBondContact O-N 3.08Å; T286-A289 PolarHBondContact O-N 3.37Å; T286-R290 WeakPolarHBondContact O-CB 3.31Å; T286-R290 WeakPolarHBondContact O-CG 3.04Å; T286-R290 PolarHBondContact O-N 2.83Å; T286-V308 HydrophobicContact CG2-CB 4.45Å; T286-V308 HydrophobicContact CG2-CG1 3.94Å; T286-V308 HydrophobicContact CG2-CG2 3.66Å; T286-H315 VanDerWaalsContact CG2-NE2 3.32Å; T286-H315 WeakPolarHBondContact CG2-NE2 3.43Å
287G94Very high92.7Very high5 Ų533 Ų335%0.05218%0.178CC..Hα-helixtrans-60.4-43.2174.800000112.9T283 L284 L285 R290 I291T283-G287 PolarHBondContact O-N 3.42Å; L284-G287 PolarHBondContact O-N 2.91Å; L284-G287 VanDerWaalsContact O-N 3.14Å; L285-G287 VanDerWaalsContact C-N 3.35Å; G287-R290 PolarHBondContact O-N 3.22Å; G287-I291 WeakPolarHBondContact O-CG1 3.34Å; G287-I291 PolarHBondContact O-N 3.29Å; G287-I291 VanDerWaalsContact O-N 3.08Å
288I95.4Very high92.4Very high0 Ų029 Ų290%016%0.161CC..Hα-helixtrans-61-48.7174.1-68.2170.8000110.6L268 F271 L275 L284 L285 T286 R290 I291 H292 Y304L268-I288 HydrophobicContact CD2-CB 4.23Å; L268-I288 HydrophobicContact CD2-CG1 4.26Å; L268-I288 HydrophobicContact CD2-CG2 3.82Å; F271-I288 HydrophobicContact CB-CD1 3.73Å; F271-I288 HydrophobicContact CB-CG1 3.42Å; F271-I288 VanDerWaalsContact CB-CG1 3.42Å; F271-I288 HydrophobicContact CD2-CG1 3.67Å; F271-I288 HydrophobicContact CG-CG1 3.91Å; L275-I288 HydrophobicContact CD1-CD1 3.49Å; L275-I288 VanDerWaalsContact CD1-CD1 3.49Å; L284-I288 WeakPolarHBondContact O-CG1 3.46Å; L284-I288 PolarHBondContact O-N 3.28Å; L285-I288 PolarHBondContact O-N 2.91Å; T286-I288 PolarHBondContact O-N 3.08Å; I288-R290 VanDerWaalsContact C-N 3.32Å; I288-R290 PolarHBondContact O-N 3.23Å; I288-I291 PolarHBondContact O-N 2.88Å; I288-H292 PolarHBondContact O-CD2 2.98Å; I288-H292 PolarHBondContact O-N 2.69Å; I288-Y304 HydrophobicContact CB-CG 4.47Å; I288-Y304 HydrophobicContact CD1-CE1 4.38Å; I288-Y304 HydrophobicContact CG2-CD1 3.82Å; I288-Y304 HydrophobicContact CG2-CD2 3.46Å; I288-Y304 VanDerWaalsContact CG2-CD2 3.46Å; I288-Y304 HydrophobicContact CG2-CE1 3.8Å; I288-Y304 HydrophobicContact CG2-CE2 3.45Å; I288-Y304 VanDerWaalsContact CG2-CE2 3.45Å; I288-Y304 HydrophobicContact CG2-CG 3.65Å
289A94.9Very high92.1Very high0 Ų029.8 Ų29.80%017%0.17CC..Hα-helixtrans-59.7-43.3179.500000111.7L285 T286 I291 H292 E293 Y305L285-A289 PolarHBondContact O-N 3.19Å; T286-A289 PolarHBondContact O-N 3.37Å; A289-I291 PolarHBondContact O-N 3.12Å; A289-H292 PolarHBondContact O-N 3.45Å; A289-E293 PolarHBondContact O-N 3.31Å; A289-Y305 HydrophobicContact CB-CD1 3.71Å; A289-Y305 HydrophobicContact CB-CD2 3.9Å; A289-Y305 HydrophobicContact CB-CE1 3.52Å; A289-Y305 HydrophobicContact CB-CE2 3.68Å; A289-Y305 HydrophobicContact CB-CG 3.9Å; A289-Y305 VanDerWaalsContact CB-CZ 3.5Å
290R92.7Very high92Very high44 Ų4426 Ų2617%0.16615%0.146CC..Hα-helixtrans-58.6-46.2175.3-71.5168.6-176.6177.63.5112.2D58 T286 G287 I288 H292 E293 E294 E317D58-R290 IonicContact OD1-NH1 2.93Å; T286-R290 WeakPolarHBondContact O-CB 3.31Å; T286-R290 WeakPolarHBondContact O-CG 3.04Å; T286-R290 PolarHBondContact O-N 2.83Å; G287-R290 PolarHBondContact O-N 3.22Å; I288-R290 VanDerWaalsContact C-N 3.32Å; I288-R290 PolarHBondContact O-N 3.23Å; R290-H292 VanDerWaalsContact C-N 3.31Å; R290-H292 PolarHBondContact O-N 2.95Å; R290-E293 PolarHBondContact O-N 2.9Å; R290-E294 WeakPolarHBondContact O-CB 3.43Å; R290-E294 WeakPolarHBondContact O-CG 3.4Å; R290-E294 PolarHBondContact O-N 3.38Å; R290-E317 VanDerWaalsContact CG-OE1 3.28Å; R290-E317 WeakPolarHBondContact CG-OE1 3.46Å; R290-E317 IonicContact CZ-OE1 3.84Å; R290-E317 IonicContact CZ-OE2 2.85Å; R290-E317 IonicContact NE-OE1 3.35Å; R290-E317 PolarHBondContact NE-OE1 3.03Å; R290-E317 IonicContact NE-OE2 3.58Å; R290-E317 PolarHBondContact NE-OE2 3.44Å; R290-E317 IonicContact NH2-OE1 3.23Å; R290-E317 IonicContact NH2-OE2 2.78Å; R290-E317 PolarHBondContact NH2-OE2 3.21Å
291I92.4Very high92.2Very high0 Ų024.8 Ų24.80%013%0.134CC..Hα-helixtrans-63.4-39.4177.4-66.4167.8000110.7T255 Q259 P264 A267 L268 F271 G287 I288 A289 E294 M295T255-I291 HydrophobicContact CG2-CD1 3.89Å; Q259-I291 VanDerWaalsContact NE2-CG1 3.25Å; P264-I291 HydrophobicContact CB-CG2 3.78Å; A267-I291 HydrophobicContact CB-CD1 3.73Å; L268-I291 HydrophobicContact CD1-CG2 4.17Å; L268-I291 HydrophobicContact CD2-CB 4Å; L268-I291 HydrophobicContact CD2-CD1 4.16Å; L268-I291 HydrophobicContact CD2-CG2 3.96Å; L268-I291 HydrophobicContact CG-CB 4.47Å; L268-I291 HydrophobicContact CG-CD1 4.44Å; L268-I291 HydrophobicContact CG-CG2 3.9Å; F271-I291 HydrophobicContact CD2-CD1 3.89Å; F271-I291 HydrophobicContact CE2-CD1 3.6Å; G287-I291 WeakPolarHBondContact O-CG1 3.34Å; G287-I291 PolarHBondContact O-N 3.29Å; G287-I291 VanDerWaalsContact O-N 3.08Å; I288-I291 PolarHBondContact O-N 2.88Å; A289-I291 PolarHBondContact O-N 3.12Å; I291-E294 CarbonylContact O-C 3.28Å; I291-E294 PolarHBondContact O-N 3.4Å; I291-M295 HydrophobicContact CG2-CE 4.14Å; I291-M295 HydrophobicContact CG2-CG 4.46Å; I291-M295 HydrophobicContact CG2-SD 4.41Å; I291-M295 WeakPolarHBondContact O-CG 3.36Å; I291-M295 PolarHBondContact O-N 2.91Å
292H91.6Very high92Very high20 Ų2023.2 Ų23.29%0.09313%0.129CC..Hα-helixtrans-66.2-39.7176.1-79.5-68.8000112.8I288 A289 R290 E294 M295 N296 N297 A301 Y304I288-H292 PolarHBondContact O-CD2 2.98Å; I288-H292 PolarHBondContact O-N 2.69Å; A289-H292 PolarHBondContact O-N 3.45Å; R290-H292 VanDerWaalsContact C-N 3.31Å; R290-H292 PolarHBondContact O-N 2.95Å; H292-E294 VanDerWaalsContact C-N 3.34Å; H292-M295 WeakPolarHBondContact ND1-CE 3.5Å; H292-M295 CarbonylContact O-C 3.36Å; H292-M295 PolarHBondContact O-N 3.34Å; H292-N296 PolarHBondContact O-N 2.92Å; H292-N297 PolarHBondContact O-N 3.34Å; H292-A301 HydrophobicContact CB-CB 3.9Å; H292-Y304 AromaticContact CD2-CD2 3.79Å; H292-Y304 AromaticContact CD2-CE2 3.7Å; H292-Y304 AromaticContact NE2-CE2 3.59Å
293E88.8Confident91.9Very high29 Ų2927.4 Ų27.414%0.13615%0.146CC..Hα-helixtrans-61.8-42.4170.6-70.3-162.5152.500111.4R107 A289 R290 M295 N296 A301 Y305R107-E293 PolarHBondContact NH1-O 3.31Å; A289-E293 PolarHBondContact O-N 3.31Å; R290-E293 PolarHBondContact O-N 2.9Å; E293-M295 VanDerWaalsContact C-N 3.27Å; E293-M295 PolarHBondContact O-N 3.42Å; E293-N296 WeakPolarHBondContact O-CA 3.22Å; E293-N296 PolarHBondContact O-N 2.68Å; E293-A301 HydrophobicContact CG-CB 3.61Å; E293-Y305 HydrophobicContact CG-CE2 3.97Å; E293-Y305 VanDerWaalsContact OE1-CE2 3.26Å; E293-Y305 WeakPolarHBondContact OE1-CE2 3.42Å; E293-Y305 PolarHBondContact OE2-OH 3.37Å
294E87.4Confident91.9Very high36 Ų3627.2 Ų27.217%0.16814%0.14CC..Hα-helixtrans-69.1-22.3175.7-69.3173.7-170.700112.8L84 R107 R114 R290 I291 H292 N296L84-E294 HydrophobicContact CD2-CB 3.77Å; R107-E294 VanDerWaalsContact NH1-C 3.29Å; R107-E294 PolarHBondContact NH1-O 3.49Å; R107-E294 PolarHBondContact NH2-O 3Å; R114-E294 IonicContact CZ-OE1 2.67Å; R114-E294 IonicContact NH2-OE1 3.76Å; R114-E294 PolarHBondContact NH2-OE1 3.36Å; R290-E294 WeakPolarHBondContact O-CB 3.43Å; R290-E294 WeakPolarHBondContact O-CG 3.4Å; R290-E294 PolarHBondContact O-N 3.38Å; I291-E294 CarbonylContact O-C 3.28Å; I291-E294 PolarHBondContact O-N 3.4Å; H292-E294 VanDerWaalsContact C-N 3.34Å; E294-N296 VanDerWaalsContact C-N 3.26Å
295M86.4Confident92Very high8 Ų827.2 Ų27.24%0.03914%0.14CC..THydrogen-bonded Turntrans-84.5-0.2167.9-69.2-171.7-55.300113.1L84 P264 L268 I291 H292 E293 N297L84-M295 HydrophobicContact CD2-CG 4.08Å; P264-M295 HydrophobicContact CB-CG 4.41Å; P264-M295 HydrophobicContact CB-SD 3.97Å; P264-M295 HydrophobicContact CG-SD 4.15Å; L268-M295 HydrophobicContact CD1-CE 3.65Å; I291-M295 HydrophobicContact CG2-CE 4.14Å; I291-M295 HydrophobicContact CG2-CG 4.46Å; I291-M295 HydrophobicContact CG2-SD 4.41Å; I291-M295 WeakPolarHBondContact O-CG 3.36Å; I291-M295 PolarHBondContact O-N 2.91Å; H292-M295 WeakPolarHBondContact ND1-CE 3.5Å; H292-M295 CarbonylContact O-C 3.36Å; H292-M295 PolarHBondContact O-N 3.34Å; E293-M295 VanDerWaalsContact C-N 3.27Å; E293-M295 PolarHBondContact O-N 3.42Å; M295-N297 PolarHBondContact O-N 3.28Å
296N86.4Confident92Very high40 Ų4031.5 Ų31.521%0.21416%0.159CC..THydrogen-bonded Turntrans63.822.5-173.7-155.422.2000114.4P87 H292 E293 E294 I298P87-N296 HydrophobicContact CB-CB 4.04Å; H292-N296 PolarHBondContact O-N 2.92Å; E293-N296 WeakPolarHBondContact O-CA 3.22Å; E293-N296 PolarHBondContact O-N 2.68Å; E294-N296 VanDerWaalsContact C-N 3.26Å; N296-I298 PolarHBondContact O-N 3.05Å
297N87.9Confident92Very high52 Ų5235 Ų3528%0.27818%0.175SC..  trans-94.475.8175.5-72.8-21.9000109.9H292 M295 T299 A301H292-N297 PolarHBondContact O-N 3.34Å; M295-N297 PolarHBondContact O-N 3.28Å; N297-T299 VanDerWaalsContact C-N 3.3Å; N297-T299 PolarHBondContact O-N 2.8Å; N297-A301 PolarHBondContact O-N 3.3Å; N297-A301 VanDerWaalsContact O-N 3.15Å
298I87.4Confident92.1Very high20 Ų2034.8 Ų34.810%0.10317%0.172CC..Hα-helixtrans-64.2-33.8-173.3-57.3179.3000112N296 A301 T302N296-I298 PolarHBondContact O-N 3.05Å; I298-A301 PolarHBondContact O-N 3.36Å; I298-T302 HydrophobicContact CG2-CG2 4.01Å; I298-T302 WeakPolarHBondContact O-CG2 3.42Å; I298-T302 PolarHBondContact O-N 3.41Å
299T90.1Very high92.1Very high76 Ų7635.8 Ų35.847%0.46618%0.178SC..Hα-helixtrans-58.4-57.5179.850.70000111.6N297 A301 T302 E303N297-T299 VanDerWaalsContact C-N 3.3Å; N297-T299 PolarHBondContact O-N 2.8Å; T299-A301 VanDerWaalsContact C-N 3.33Å; T299-A301 PolarHBondContact O-N 2.6Å; T299-T302 PolarHBondContact O-N 3.36Å; T299-T302 PolarHBondContact O-OG1 2.82Å; T299-E303 PolarHBondContact O-N 2.58Å
300S91.4Very high92.2Very high35 Ų3543.2 Ų43.225%0.24521%0.21CC..Hα-helixtrans-62.5-39.1176.5-56.80000112T302 E303 Y304S300-T302 VanDerWaalsContact C-N 3.3Å; S300-T302 PolarHBondContact O-N 3.46Å; S300-E303 WeakPolarHBondContact O-CB 3.34Å; S300-E303 PolarHBondContact O-N 3.08Å; S300-E303 VanDerWaalsContact O-N 3.15Å; S300-Y304 WeakPolarHBondContact O-CD2 3.43Å; S300-Y304 PolarHBondContact O-N 3.49Å; S300-Y304 VanDerWaalsContact O-N 3.08Å
301A92.8Very high92.3Very high0 Ų046.6 Ų46.60%023%0.228CC..Hα-helixtrans-57.5-44.3175.500000111.6H292 E293 N297 I298 T299 E303 Y304 Y305H292-A301 HydrophobicContact CB-CB 3.9Å; E293-A301 HydrophobicContact CG-CB 3.61Å; N297-A301 PolarHBondContact O-N 3.3Å; N297-A301 VanDerWaalsContact O-N 3.15Å; I298-A301 PolarHBondContact O-N 3.36Å; T299-A301 VanDerWaalsContact C-N 3.33Å; T299-A301 PolarHBondContact O-N 2.6Å; A301-E303 VanDerWaalsContact C-N 3.31Å; A301-E303 PolarHBondContact O-N 3.15Å; A301-Y304 PolarHBondContact O-N 3.02Å; A301-Y305 HydrophobicContact CB-CD2 4.46Å; A301-Y305 HydrophobicContact CB-CE2 4.33Å; A301-Y305 WeakPolarHBondContact O-CD2 3.21Å; A301-Y305 PolarHBondContact O-N 3.44Å
302T92.3Very high92.4Very high30 Ų3048.8 Ų48.818%0.18424%0.239CC..Hα-helixtrans-66.7-30.9178.169.20000113.1I298 T299 S300 K306 N325I298-T302 HydrophobicContact CG2-CG2 4.01Å; I298-T302 WeakPolarHBondContact O-CG2 3.42Å; I298-T302 PolarHBondContact O-N 3.41Å; T299-T302 PolarHBondContact O-N 3.36Å; T299-T302 PolarHBondContact O-OG1 2.82Å; S300-T302 VanDerWaalsContact C-N 3.3Å; S300-T302 PolarHBondContact O-N 3.46Å; T302-K306 WeakPolarHBondContact O-CB 3.33Å; T302-K306 WeakPolarHBondContact O-CD 3.44Å; T302-K306 WeakPolarHBondContact O-CG 3.31Å; T302-K306 PolarHBondContact O-N 2.71Å; T302-N325 HydrophobicContact CG2-CB 4.49Å; T302-N325 WeakPolarHBondContact CG2-ND2 3.45Å
303E94.7Very high92.5Very high117 Ų11752.3 Ų52.355%0.54726%0.259SS..Hα-helixtrans-65.5-49.5174.3-69.5175.9167.100110.8T299 S300 A301 Y305 K306 E307T299-E303 PolarHBondContact O-N 2.58Å; S300-E303 WeakPolarHBondContact O-CB 3.34Å; S300-E303 PolarHBondContact O-N 3.08Å; S300-E303 VanDerWaalsContact O-N 3.15Å; A301-E303 VanDerWaalsContact C-N 3.31Å; A301-E303 PolarHBondContact O-N 3.15Å; E303-Y305 PolarHBondContact O-N 3.29Å; E303-K306 WeakPolarHBondContact O-CB 3.46Å; E303-K306 PolarHBondContact O-N 3.07Å; E303-K306 VanDerWaalsContact O-N 3.12Å; E303-E307 PolarHBondContact O-N 3.4Å
304Y96Very high92.8Very high46 Ų4653.8 Ų53.818%0.1827%0.27CS..Hα-helixtrans-66.3-38176.8-72.1-69.3000112.4L285 I288 H292 S300 A301 K306 E307 V308L285-Y304 HydrophobicContact CD2-CD1 4.13Å; I288-Y304 HydrophobicContact CB-CG 4.47Å; I288-Y304 HydrophobicContact CD1-CE1 4.38Å; I288-Y304 HydrophobicContact CG2-CD1 3.82Å; I288-Y304 HydrophobicContact CG2-CD2 3.46Å; I288-Y304 VanDerWaalsContact CG2-CD2 3.46Å; I288-Y304 HydrophobicContact CG2-CE1 3.8Å; I288-Y304 HydrophobicContact CG2-CE2 3.45Å; I288-Y304 VanDerWaalsContact CG2-CE2 3.45Å; I288-Y304 HydrophobicContact CG2-CG 3.65Å; H292-Y304 AromaticContact CD2-CD2 3.79Å; H292-Y304 AromaticContact CD2-CE2 3.7Å; H292-Y304 AromaticContact NE2-CE2 3.59Å; S300-Y304 WeakPolarHBondContact O-CD2 3.43Å; S300-Y304 PolarHBondContact O-N 3.49Å; S300-Y304 VanDerWaalsContact O-N 3.08Å; A301-Y304 PolarHBondContact O-N 3.02Å; Y304-K306 VanDerWaalsContact C-N 3.28Å; Y304-K306 PolarHBondContact O-N 3.33Å; Y304-E307 WeakPolarHBondContact O-CB 3.41Å; Y304-E307 PolarHBondContact O-N 3.26Å; Y304-E307 VanDerWaalsContact O-N 3.1Å; Y304-V308 WeakPolarHBondContact O-CG2 3.5Å; Y304-V308 PolarHBondContact O-N 3Å
305Y96.8Very high93.3Very high0 Ų054 Ų540%027%0.271CS..Hα-helixtrans-63.8-33.4172.1-74.5-54.1000112.4A289 E293 A301 E303 E307 V308 L309 E317 A318 C321A289-Y305 HydrophobicContact CB-CD1 3.71Å; A289-Y305 HydrophobicContact CB-CD2 3.9Å; A289-Y305 HydrophobicContact CB-CE1 3.52Å; A289-Y305 HydrophobicContact CB-CE2 3.68Å; A289-Y305 HydrophobicContact CB-CG 3.9Å; A289-Y305 VanDerWaalsContact CB-CZ 3.5Å; E293-Y305 HydrophobicContact CG-CE2 3.97Å; E293-Y305 VanDerWaalsContact OE1-CE2 3.26Å; E293-Y305 WeakPolarHBondContact OE1-CE2 3.42Å; E293-Y305 PolarHBondContact OE2-OH 3.37Å; A301-Y305 HydrophobicContact CB-CD2 4.46Å; A301-Y305 HydrophobicContact CB-CE2 4.33Å; A301-Y305 WeakPolarHBondContact O-CD2 3.21Å; A301-Y305 PolarHBondContact O-N 3.44Å; E303-Y305 PolarHBondContact O-N 3.29Å; Y305-E307 VanDerWaalsContact C-N 3.33Å; Y305-V308 WeakPolarHBondContact O-CB 3.2Å; Y305-V308 PolarHBondContact O-N 3.19Å; Y305-L309 WeakPolarHBondContact O-CG 3.42Å; Y305-L309 PolarHBondContact O-N 2.93Å; Y305-E317 HydrophobicContact CE1-CG 4.22Å; Y305-E317 PolarHBondContact OH-OE1 3.12Å; Y305-A318 HydrophobicContact CD1-CB 3.7Å; Y305-A318 HydrophobicContact CG-CB 4.29Å; Y305-C321 HydrophobicContact CD2-CB 4.15Å; Y305-C321 HydrophobicContact CE2-CB 3.87Å
306K96.3Very high93.7Very high99 Ų9956.4 Ų56.443%0.4329%0.285SS..Hα-helixtrans-66.9-36172-74.7165.4-175.41700111.5T302 E303 Y304 L309 K310 I322T302-K306 WeakPolarHBondContact O-CB 3.33Å; T302-K306 WeakPolarHBondContact O-CD 3.44Å; T302-K306 WeakPolarHBondContact O-CG 3.31Å; T302-K306 PolarHBondContact O-N 2.71Å; E303-K306 WeakPolarHBondContact O-CB 3.46Å; E303-K306 PolarHBondContact O-N 3.07Å; E303-K306 VanDerWaalsContact O-N 3.12Å; Y304-K306 VanDerWaalsContact C-N 3.28Å; Y304-K306 PolarHBondContact O-N 3.33Å; K306-L309 PolarHBondContact O-N 3.36Å; K306-K310 WeakPolarHBondContact O-CG 3.36Å; K306-K310 PolarHBondContact O-N 2.81Å; K306-I322 HydrophobicContact CG-CD1 4.11Å
307E96.3Very high94.1Very high79 Ų7954.7 Ų54.737%0.36928%0.276SS..Hα-helixtrans-65.2-41.8172-67.2-175.8168.100112.1L285 E303 Y304 Y305 L309 K310 Q311L285-E307 HydrophobicContact CD1-CB 4.37Å; L285-E307 HydrophobicContact CD2-CB 4.44Å; E303-E307 PolarHBondContact O-N 3.4Å; Y304-E307 WeakPolarHBondContact O-CB 3.41Å; Y304-E307 PolarHBondContact O-N 3.26Å; Y304-E307 VanDerWaalsContact O-N 3.1Å; Y305-E307 VanDerWaalsContact C-N 3.33Å; E307-L309 VanDerWaalsContact C-N 3.3Å; E307-L309 PolarHBondContact O-N 3.23Å; E307-K310 WeakPolarHBondContact O-CB 3.07Å; E307-K310 PolarHBondContact O-N 3.32Å; E307-K310 VanDerWaalsContact O-N 3.11Å; E307-Q311 PolarHBondContact O-N 3.09Å
308V97.3Very high94.5Very high0 Ų052.2 Ų52.20%026%0.263CS..Hα-helixtrans-55.1-48170.8169.30000110.2V282 L285 T286 Y304 Y305 K310 Q311 D312 H315 A318V282-V308 HydrophobicContact CG1-CG1 3.9Å; L285-V308 HydrophobicContact CB-CG2 3.51Å; T286-V308 HydrophobicContact CG2-CB 4.45Å; T286-V308 HydrophobicContact CG2-CG1 3.94Å; T286-V308 HydrophobicContact CG2-CG2 3.66Å; Y304-V308 WeakPolarHBondContact O-CG2 3.5Å; Y304-V308 PolarHBondContact O-N 3Å; Y305-V308 WeakPolarHBondContact O-CB 3.2Å; Y305-V308 PolarHBondContact O-N 3.19Å; V308-K310 VanDerWaalsContact C-N 3.29Å; V308-K310 PolarHBondContact O-N 3.46Å; V308-Q311 PolarHBondContact O-N 3.08Å; V308-Q311 VanDerWaalsContact O-N 3.09Å; V308-D312 PolarHBondContact O-N 2.99Å; V308-H315 HydrophobicContact CG1-CB 3.88Å; V308-A318 HydrophobicContact CB-CB 4.19Å; V308-A318 HydrophobicContact CG1-CB 3.76Å
309L95.4Very high95Very high21 Ų2151.4 Ų51.411%0.1126%0.259CS..Hα-helixtrans-62.9-34178.3-67.8-176.3000113.1Y305 K306 E307 Q311 D312 N313 A318 I319 I322 F338Y305-L309 WeakPolarHBondContact O-CG 3.42Å; Y305-L309 PolarHBondContact O-N 2.93Å; K306-L309 PolarHBondContact O-N 3.36Å; E307-L309 VanDerWaalsContact C-N 3.3Å; E307-L309 PolarHBondContact O-N 3.23Å; L309-Q311 VanDerWaalsContact C-N 3.27Å; L309-Q311 PolarHBondContact O-N 3.37Å; L309-D312 WeakPolarHBondContact CA-O 3.12Å; L309-D312 CarbonylContact O-C 3.37Å; L309-N313 WeakPolarHBondContact O-CA 3.22Å; L309-N313 PolarHBondContact O-N 3.39Å; L309-N313 PolarHBondContact O-OD1 3.05Å; L309-A318 HydrophobicContact CD2-CB 3.8Å; L309-A318 HydrophobicContact CG-CB 4.1Å; L309-I319 HydrophobicContact CD2-CD1 4.35Å; L309-I319 HydrophobicContact CD2-CG1 3.5Å; L309-I322 HydrophobicContact CD1-CD1 3.47Å; L309-I322 VanDerWaalsContact CD1-CD1 3.47Å; L309-I322 HydrophobicContact CG-CD1 4.13Å; L309-F338 HydrophobicContact CD1-CE1 3.82Å
310K96Very high95.2Very high156 Ų15648.1 Ų48.168%0.67824%0.239SC*.Hα-helixtrans-62.8-36174.8-70.1171-170.9170.60111.8K306 E307 V308K306-K310 WeakPolarHBondContact O-CG 3.36Å; K306-K310 PolarHBondContact O-N 2.81Å; E307-K310 WeakPolarHBondContact O-CB 3.07Å; E307-K310 PolarHBondContact O-N 3.32Å; E307-K310 VanDerWaalsContact O-N 3.11Å; V308-K310 VanDerWaalsContact C-N 3.29Å; V308-K310 PolarHBondContact O-N 3.46Å
311Q95.4Very high95.4Very high115 Ų11546.4 Ų46.454%0.53723%0.227SC..Hα-helixtrans-80.9-53.4177.3-60.7-60.7-13.300111.5V282 L285 E307 V308 L309V282-Q311 HydrophobicContact CG2-CB 3.84Å; L285-Q311 HydrophobicContact CD1-CG 4.2Å; E307-Q311 PolarHBondContact O-N 3.09Å; V308-Q311 PolarHBondContact O-N 3.08Å; V308-Q311 VanDerWaalsContact O-N 3.09Å; L309-Q311 VanDerWaalsContact C-N 3.27Å; L309-Q311 PolarHBondContact O-N 3.37Å
312D94.3Very high95.5Very high45 Ų4546.5 Ų46.524%0.24123%0.228CC..  trans-123.2100.4177.9-178.812000111.3V282 V308 L309 T314 H315V282-D312 HydrophobicContact CG1-CB 4.47Å; V282-D312 HydrophobicContact CG2-CB 3.95Å; V308-D312 PolarHBondContact O-N 2.99Å; L309-D312 WeakPolarHBondContact CA-O 3.12Å; L309-D312 CarbonylContact O-C 3.37Å; D312-T314 PolarHBondContact O-N 2.93Å; D312-T314 VanDerWaalsContact O-N 3.11Å; D312-T314 WeakPolarHBondContact OD1-CA 3.46Å; D312-T314 WeakPolarHBondContact OD1-CB 3.47Å; D312-T314 PolarHBondContact OD1-N 2.98Å; D312-T314 PolarHBondContact OD1-OG1 3.17Å; D312-H315 HydrophobicContact CB-CB 4.28Å; D312-H315 PolarHBondContact O-N 3.24Å; D312-H315 PolarHBondContact OD2-N 3.39Å; D312-H315 IonicContact OD2-ND1 2.77Å
313N93.6Very high95.7Very high95 Ų9545 Ų4551%0.50822%0.219SC..THydrogen-bonded Turntrans-71.51176.7-69.8-68.1000114L309L309-N313 WeakPolarHBondContact O-CA 3.22Å; L309-N313 PolarHBondContact O-N 3.39Å; L309-N313 PolarHBondContact O-OD1 3.05Å
314T95.4Very high95.6Very high60 Ų6039.8 Ų39.837%0.36820%0.195SC..THydrogen-bonded Turntrans-113.8-2.6-177.570.90000113.3D312 V316 M345D312-T314 PolarHBondContact O-N 2.93Å; D312-T314 VanDerWaalsContact O-N 3.11Å; D312-T314 WeakPolarHBondContact OD1-CA 3.46Å; D312-T314 WeakPolarHBondContact OD1-CB 3.47Å; D312-T314 PolarHBondContact OD1-N 2.98Å; D312-T314 PolarHBondContact OD1-OG1 3.17Å; T314-V316 PolarHBondContact O-N 3.01Å; T314-V316 VanDerWaalsContact O-N 3.13Å; T314-M345 HydrophobicContact CG2-CE 3.33Å; T314-M345 HydrophobicContact CG2-SD 3.81Å
315H96.1Very high95.5Very high41 Ų4138.1 Ų38.119%0.1919%0.189CC..  trans-64.1113.3-174.7-163.569.1000112.2T286 V308 D312 E317 A318 I319T286-H315 VanDerWaalsContact CG2-NE2 3.32Å; T286-H315 WeakPolarHBondContact CG2-NE2 3.43Å; V308-H315 HydrophobicContact CG1-CB 3.88Å; D312-H315 HydrophobicContact CB-CB 4.28Å; D312-H315 PolarHBondContact O-N 3.24Å; D312-H315 PolarHBondContact OD2-N 3.39Å; D312-H315 IonicContact OD2-ND1 2.77Å; H315-E317 PolarHBondContact O-N 2.95Å; H315-A318 HydrophobicContact CB-CB 4.32Å; H315-A318 PolarHBondContact CD2-N 3.28Å; H315-I319 VanDerWaalsContact O-CG1 3.24Å; H315-I319 WeakPolarHBondContact O-CG1 3.43Å; H315-I319 PolarHBondContact O-N 3.36Å
316V95.8Very high95.4Very high57 Ų5739.9 Ų39.935%0.34520%0.198SC..Hα-helixtrans-63.7-43.9-171.2178.60000112.3F112 T314 I319 A320 L342 V347F112-V316 HydrophobicContact CD2-CG1 4.43Å; F112-V316 HydrophobicContact CE2-CG1 4.23Å; T314-V316 PolarHBondContact O-N 3.01Å; T314-V316 VanDerWaalsContact O-N 3.13Å; V316-I319 PolarHBondContact O-N 2.96Å; V316-A320 VanDerWaalsContact O-CB 3.28Å; V316-A320 WeakPolarHBondContact O-CB 3.41Å; V316-A320 PolarHBondContact O-N 2.94Å; V316-L342 HydrophobicContact CB-CD2 4.28Å; V316-L342 HydrophobicContact CG1-CD2 4.09Å; V316-L342 HydrophobicContact CG2-CD2 4.18Å; V316-V347 HydrophobicContact CG2-CG2 4.44Å
317E95.3Very high95.4Very high5 Ų536.7 Ų36.72%0.02318%0.184CC..Hα-helixtrans-62.5-48.9-178.1176.6176.9173.300111.5F112 R290 Y305 H315 I319 A320 C321F112-E317 HydrophobicContact CB-CB 4.27Å; F112-E317 HydrophobicContact CB-CG 3.92Å; F112-E317 HydrophobicContact CD1-CB 3.88Å; F112-E317 HydrophobicContact CD1-CG 3.72Å; F112-E317 HydrophobicContact CD2-CB 4.23Å; F112-E317 HydrophobicContact CE1-CB 4.25Å; F112-E317 HydrophobicContact CE1-CG 4.43Å; F112-E317 HydrophobicContact CG-CB 3.87Å; F112-E317 HydrophobicContact CG-CG 3.88Å; R290-E317 VanDerWaalsContact CG-OE1 3.28Å; R290-E317 WeakPolarHBondContact CG-OE1 3.46Å; R290-E317 IonicContact CZ-OE1 3.84Å; R290-E317 IonicContact CZ-OE2 2.85Å; R290-E317 IonicContact NE-OE1 3.35Å; R290-E317 PolarHBondContact NE-OE1 3.03Å; R290-E317 IonicContact NE-OE2 3.58Å; R290-E317 PolarHBondContact NE-OE2 3.44Å; R290-E317 IonicContact NH2-OE1 3.23Å; R290-E317 IonicContact NH2-OE2 2.78Å; R290-E317 PolarHBondContact NH2-OE2 3.21Å; Y305-E317 HydrophobicContact CE1-CG 4.22Å; Y305-E317 PolarHBondContact OH-OE1 3.12Å; H315-E317 PolarHBondContact O-N 2.95Å; E317-I319 PolarHBondContact O-N 3.45Å; E317-A320 PolarHBondContact O-N 3.35Å; E317-C321 WeakPolarHBondContact O-CB 3.45Å; E317-C321 PolarHBondContact O-N 3.18Å; E317-C321 PolarHBondContact O-SG 3.04Å; E317-C321 VanDerWaalsContact O-SG 3.41Å
318A96.3Very high95.2Very high0 Ų034.8 Ų34.80%017%0.173CC..Hα-helixtrans-62.7-43.4-179.500000111.5Y305 V308 L309 H315 I322Y305-A318 HydrophobicContact CD1-CB 3.7Å; Y305-A318 HydrophobicContact CG-CB 4.29Å; V308-A318 HydrophobicContact CB-CB 4.19Å; V308-A318 HydrophobicContact CG1-CB 3.76Å; L309-A318 HydrophobicContact CD2-CB 3.8Å; L309-A318 HydrophobicContact CG-CB 4.1Å; H315-A318 HydrophobicContact CB-CB 4.32Å; H315-A318 PolarHBondContact CD2-N 3.28Å; A318-I322 VanDerWaalsContact O-CB 3.28Å; A318-I322 WeakPolarHBondContact O-CB 3.47Å; A318-I322 VanDerWaalsContact O-CG1 3.27Å; A318-I322 WeakPolarHBondContact O-CG1 3.2Å; A318-I322 PolarHBondContact O-N 3.01Å
319I96.8Very high95Very high3 Ų338 Ų382%0.01519%0.193CC..Hα-helixtrans-63.6-43.9177.7-64.1170.2000110.7L309 H315 V316 E317 G323 F338 R341 L342L309-I319 HydrophobicContact CD2-CD1 4.35Å; L309-I319 HydrophobicContact CD2-CG1 3.5Å; H315-I319 VanDerWaalsContact O-CG1 3.24Å; H315-I319 WeakPolarHBondContact O-CG1 3.43Å; H315-I319 PolarHBondContact O-N 3.36Å; V316-I319 PolarHBondContact O-N 2.96Å; E317-I319 PolarHBondContact O-N 3.45Å; I319-G323 PolarHBondContact O-N 3.48Å; I319-F338 HydrophobicContact CG2-CB 3.86Å; I319-F338 HydrophobicContact CG2-CD1 4.08Å; I319-F338 HydrophobicContact CG2-CG 4.45Å; I319-F338 WeakPolarHBondContact CG2-O 3.46Å; I319-R341 HydrophobicContact CD1-CG 4.06Å; I319-L342 HydrophobicContact CB-CD2 3.91Å; I319-L342 HydrophobicContact CB-CG 4.23Å; I319-L342 HydrophobicContact CD1-CD2 3.84Å; I319-L342 HydrophobicContact CG1-CD2 4.46Å; I319-L342 HydrophobicContact CG2-CD1 4.04Å; I319-L342 HydrophobicContact CG2-CD2 3.84Å; I319-L342 HydrophobicContact CG2-CG 3.61Å
320A95.9Very high94.8Very high6 Ų643.6 Ų43.65%0.0522%0.223CC..Hα-helixtrans-69.6-43.4-178.400000112.4G111 V316 E317 G323 S324 L342G111-A320 WeakPolarHBondContact O-CB 3.36Å; V316-A320 VanDerWaalsContact O-CB 3.28Å; V316-A320 WeakPolarHBondContact O-CB 3.41Å; V316-A320 PolarHBondContact O-N 2.94Å; E317-A320 PolarHBondContact O-N 3.35Å; A320-G323 PolarHBondContact O-N 3.34Å; A320-S324 WeakPolarHBondContact O-CB 3.2Å; A320-S324 PolarHBondContact O-N 3.49Å; A320-S324 PolarHBondContact O-OG 2.98Å; A320-L342 HydrophobicContact CB-CD1 4.45Å
321C94.7Very high94.8Very high0 Ų040.2 Ų40.20%021%0.21CC..Hα-helixtrans-64.3-47.1176.7-69.60000111.2Y305 E317 G323 S324 N325Y305-C321 HydrophobicContact CD2-CB 4.15Å; Y305-C321 HydrophobicContact CE2-CB 3.87Å; E317-C321 WeakPolarHBondContact O-CB 3.45Å; E317-C321 PolarHBondContact O-N 3.18Å; E317-C321 PolarHBondContact O-SG 3.04Å; E317-C321 VanDerWaalsContact O-SG 3.41Å; C321-G323 PolarHBondContact O-N 2.61Å; C321-S324 PolarHBondContact O-N 2.92Å; C321-S324 PolarHBondContact O-OG 3.4Å; C321-N325 WeakPolarHBondContact O-CB 3.4Å; C321-N325 PolarHBondContact O-N 3.35Å; C321-N325 PolarHBondContact O-ND2 3.2Å
322I95.2Very high94.8Very high1 Ų135.8 Ų35.81%0.00519%0.191CC..Hα-helixtrans-62.3-44.1175.7-70.8168.8000111.1K306 L309 A318 N325 H326 F338K306-I322 HydrophobicContact CG-CD1 4.11Å; L309-I322 HydrophobicContact CD1-CD1 3.47Å; L309-I322 VanDerWaalsContact CD1-CD1 3.47Å; L309-I322 HydrophobicContact CG-CD1 4.13Å; A318-I322 VanDerWaalsContact O-CB 3.28Å; A318-I322 WeakPolarHBondContact O-CB 3.47Å; A318-I322 VanDerWaalsContact O-CG1 3.27Å; A318-I322 WeakPolarHBondContact O-CG1 3.2Å; A318-I322 PolarHBondContact O-N 3.01Å; I322-N325 PolarHBondContact O-N 3.22Å; I322-H326 VanDerWaalsContact CG2-CD2 3.43Å; I322-H326 WeakPolarHBondContact CG2-CD2 3.43Å; I322-H326 PolarHBondContact O-CD2 3.37Å; I322-H326 PolarHBondContact O-N 3.01Å; I322-F338 HydrophobicContact CG2-CD1 4.48Å; I322-F338 HydrophobicContact CG2-CD2 4.02Å; I322-F338 HydrophobicContact CG2-CE1 4.09Å; I322-F338 HydrophobicContact CG2-CE2 3.59Å; I322-F338 HydrophobicContact CG2-CG 4.45Å; I322-F338 HydrophobicContact CG2-CZ 3.63Å
323G95.3Very high94.8Very high0 Ų040.3 Ų40.30%021%0.211CC..Hα-helixtrans-59.2-47.6177.400000112.3I319 A320 C321 H326 F327 A335I319-G323 PolarHBondContact O-N 3.48Å; A320-G323 PolarHBondContact O-N 3.34Å; C321-G323 PolarHBondContact O-N 2.61Å; G323-H326 PolarHBondContact O-N 3.22Å; G323-F327 WeakPolarHBondContact O-CB 3.47Å; G323-F327 PolarHBondContact O-N 2.72Å; G323-A335 WeakPolarHBondContact O-CB 3.49Å
324S94.2Very high94.9Very high7 Ų739 Ų395%0.04920%0.203CC..Hα-helixtrans-63.8-42.5178.169.80000112A320 C321 H326 F327 Y328 Y339A320-S324 WeakPolarHBondContact O-CB 3.2Å; A320-S324 PolarHBondContact O-N 3.49Å; A320-S324 PolarHBondContact O-OG 2.98Å; C321-S324 PolarHBondContact O-N 2.92Å; C321-S324 PolarHBondContact O-OG 3.4Å; S324-H326 PolarHBondContact O-N 3.34Å; S324-F327 WeakPolarHBondContact O-CB 3.12Å; S324-F327 PolarHBondContact O-N 3Å; S324-Y328 WeakPolarHBondContact O-CD2 3.34Å; S324-Y328 PolarHBondContact O-N 2.73Å; S324-Y328 VanDerWaalsContact O-N 3.1Å; S324-Y339 PolarHBondContact N-OH 2.82Å
325N93.4Very high95Very high11 Ų1136.2 Ų36.26%0.05919%0.186CC..Hα-helixtrans-61.7-45.8176.5-68.6-22.4000111.4R100 T302 C321 I322 F327 Y328 T329R100-N325 PolarHBondContact NH1-OD1 3.18Å; T302-N325 HydrophobicContact CG2-CB 4.49Å; T302-N325 WeakPolarHBondContact CG2-ND2 3.45Å; C321-N325 WeakPolarHBondContact O-CB 3.4Å; C321-N325 PolarHBondContact O-N 3.35Å; C321-N325 PolarHBondContact O-ND2 3.2Å; I322-N325 PolarHBondContact O-N 3.22Å; N325-F327 VanDerWaalsContact C-N 3.33Å; N325-F327 PolarHBondContact O-N 3.26Å; N325-Y328 PolarHBondContact O-N 2.9Å; N325-T329 VanDerWaalsContact O-CG2 3.28Å; N325-T329 WeakPolarHBondContact O-CG2 3.36Å; N325-T329 PolarHBondContact O-N 2.64Å; N325-T329 VanDerWaalsContact O-N 3.08Å; N325-T329 PolarHBondContact O-OG1 3.31Å; N325-T329 VanDerWaalsContact O-OG1 3.13Å
326H94.6Very high95Very high37 Ų3734.4 Ų34.417%0.17118%0.178CC..Hα-helixtrans-64.2-36.2176.7-79.6-64.9000113.2I322 G323 S324 T329 Q331 I334 A335 F338I322-H326 VanDerWaalsContact CG2-CD2 3.43Å; I322-H326 WeakPolarHBondContact CG2-CD2 3.43Å; I322-H326 PolarHBondContact O-CD2 3.37Å; I322-H326 PolarHBondContact O-N 3.01Å; G323-H326 PolarHBondContact O-N 3.22Å; S324-H326 PolarHBondContact O-N 3.34Å; H326-T329 WeakPolarHBondContact CA-OG1 3.25Å; H326-T329 PolarHBondContact O-N 3.25Å; H326-T329 PolarHBondContact O-OG1 3.47Å; H326-Q331 HydrophobicContact CB-CB 4.38Å; H326-Q331 PolarHBondContact ND1-OE1 2.85Å; H326-Q331 CarbonylContact O-C 3.47Å; H326-Q331 WeakPolarHBondContact O-CA 3.5Å; H326-Q331 WeakPolarHBondContact O-CB 3.46Å; H326-Q331 PolarHBondContact O-N 3.02Å; H326-I334 HydrophobicContact CB-CB 4.45Å; H326-I334 HydrophobicContact CB-CG2 4.27Å; H326-A335 HydrophobicContact CB-CB 4.28Å; H326-F338 AromaticContact CD2-CE2 3.88Å
327F95.3Very high95.1Very high32 Ų3241.2 Ų41.214%0.1420%0.197CC..Hα-helixtrans-61.3-47.7176.9178.7-99.6000111.3G323 S324 N325 T329 D330 P332 A335 L358 Y362G323-F327 WeakPolarHBondContact O-CB 3.47Å; G323-F327 PolarHBondContact O-N 2.72Å; S324-F327 WeakPolarHBondContact O-CB 3.12Å; S324-F327 PolarHBondContact O-N 3Å; N325-F327 VanDerWaalsContact C-N 3.33Å; N325-F327 PolarHBondContact O-N 3.26Å; F327-T329 VanDerWaalsContact C-N 3.31Å; F327-T329 PolarHBondContact O-N 2.93Å; F327-D330 PolarHBondContact O-N 3.28Å; F327-P332 HydrophobicContact CD2-CB 4.16Å; F327-P332 HydrophobicContact CE2-CB 4.44Å; F327-A335 HydrophobicContact CB-CB 3.78Å; F327-L358 HydrophobicContact CE2-CB 4.39Å; F327-L358 HydrophobicContact CZ-CB 4.27Å; F327-Y362 AromaticContact CE2-CD2 3.56Å; F327-Y362 HydrophobicContact CE2-CD2 3.56Å; F327-Y362 HydrophobicContact CE2-CE2 4.32Å; F327-Y362 HydrophobicContact CE2-CG 4.14Å; F327-Y362 AromaticContact CZ-CD2 3.45Å; F327-Y362 HydrophobicContact CZ-CD2 3.45Å; F327-Y362 VanDerWaalsContact CZ-CD2 3.45Å; F327-Y362 AromaticContact CZ-CE2 3.74Å; F327-Y362 HydrophobicContact CZ-CE2 3.74Å; F327-Y362 HydrophobicContact CZ-CG 4.27Å
328Y93.3Very high95.1Very high38 Ų3843.4 Ų43.415%0.14921%0.207CC..Hα-helixtrans-78.4-9.2180-67.8-62.7000114.6V99 R100 P101 I109 S324 N325 D330V99-Y328 HydrophobicContact CG1-CD1 4.43Å; V99-Y328 VanDerWaalsContact CG1-O 3.23Å; V99-Y328 WeakPolarHBondContact CG1-O 3.25Å; V99-Y328 WeakPolarHBondContact O-CD1 3.49Å; R100-Y328 HydrophobicContact CB-CD1 3.98Å; R100-Y328 HydrophobicContact CB-CD2 4.33Å; R100-Y328 HydrophobicContact CB-CE1 4.42Å; R100-Y328 HydrophobicContact CB-CG 3.95Å; R100-Y328 HydrophobicContact CG-CD1 4.11Å; R100-Y328 HydrophobicContact CG-CD2 3.7Å; R100-Y328 HydrophobicContact CG-CE1 4.27Å; R100-Y328 HydrophobicContact CG-CE2 3.89Å; R100-Y328 HydrophobicContact CG-CG 3.84Å; P101-Y328 VanDerWaalsContact CD-CE1 3.49Å; I109-Y328 HydrophobicContact CD1-CE2 4.22Å; I109-Y328 WeakPolarHBondContact CD1-OH 3.35Å; I109-Y328 HydrophobicContact CG1-CE2 4.38Å; S324-Y328 WeakPolarHBondContact O-CD2 3.34Å; S324-Y328 PolarHBondContact O-N 2.73Å; S324-Y328 VanDerWaalsContact O-N 3.1Å; N325-Y328 PolarHBondContact O-N 2.9Å; Y328-D330 VanDerWaalsContact C-N 3.34Å
329T91.9Very high95.1Very high69 Ų6943.9 Ų43.942%0.42321%0.209SC..THydrogen-bonded Turntrans-98.931.4171.861.60000112.1N325 H326 F327 Q331N325-T329 VanDerWaalsContact O-CG2 3.28Å; N325-T329 WeakPolarHBondContact O-CG2 3.36Å; N325-T329 PolarHBondContact O-N 2.64Å; N325-T329 VanDerWaalsContact O-N 3.08Å; N325-T329 PolarHBondContact O-OG1 3.31Å; N325-T329 VanDerWaalsContact O-OG1 3.13Å; H326-T329 WeakPolarHBondContact CA-OG1 3.25Å; H326-T329 PolarHBondContact O-N 3.25Å; H326-T329 PolarHBondContact O-OG1 3.47Å; F327-T329 VanDerWaalsContact C-N 3.31Å; F327-T329 PolarHBondContact O-N 2.93Å; T329-Q331 VanDerWaalsContact C-N 3.27Å; T329-Q331 PolarHBondContact O-N 3.15Å
330D91.8Very high95.1Very high138 Ų13848.4 Ų48.474%0.73823%0.226SC*.THydrogen-bonded Turntrans58.628179.8-61.8-30.3000115.4F327 Y328 P332F327-D330 PolarHBondContact O-N 3.28Å; Y328-D330 VanDerWaalsContact C-N 3.34Å; D330-P332 VanDerWaalsContact O-CD 3.31Å; D330-P332 WeakPolarHBondContact O-CD 3.5Å
331Q95.4Very high95.1Very high84 Ų8452.6 Ų52.639%0.39324%0.24SC..  trans-119.861.5176.3-65.3175.5-3.500112.1H326 T329 E333 I334 A335H326-Q331 HydrophobicContact CB-CB 4.38Å; H326-Q331 PolarHBondContact ND1-OE1 2.85Å; H326-Q331 CarbonylContact O-C 3.47Å; H326-Q331 WeakPolarHBondContact O-CA 3.5Å; H326-Q331 WeakPolarHBondContact O-CB 3.46Å; H326-Q331 PolarHBondContact O-N 3.02Å; T329-Q331 VanDerWaalsContact C-N 3.27Å; T329-Q331 PolarHBondContact O-N 3.15Å; Q331-E333 VanDerWaalsContact C-N 3.29Å; Q331-E333 PolarHBondContact O-N 2.99Å; Q331-I334 HydrophobicContact CB-CB 4.44Å; Q331-I334 HydrophobicContact CB-CD1 4.23Å; Q331-I334 HydrophobicContact CG-CD1 4.49Å; Q331-I334 PolarHBondContact O-N 3.47Å; Q331-A335 PolarHBondContact O-N 2.91Å
332P95.6Very high95.1Very high22 Ų2252.9 Ų52.914%0.14324%0.241CC..Hα-helixtrans-66.4-27.2-175.728.4-35.9000113.2F327 D330 I334 A335 L336 A363F327-P332 HydrophobicContact CD2-CB 4.16Å; F327-P332 HydrophobicContact CE2-CB 4.44Å; D330-P332 VanDerWaalsContact O-CD 3.31Å; D330-P332 WeakPolarHBondContact O-CD 3.5Å; P332-I334 PolarHBondContact O-N 3.49Å; P332-A335 PolarHBondContact O-N 3.22Å; P332-L336 VanDerWaalsContact O-CB 3.3Å; P332-L336 WeakPolarHBondContact O-CB 3.45Å; P332-L336 PolarHBondContact O-N 3.27Å; P332-A363 HydrophobicContact CB-CB 4.27Å; P332-A363 HydrophobicContact CG-CB 4.41Å
333E95.8Very high95.2Very high140 Ų14055.8 Ų55.865%0.65426%0.257SS*.Hα-helixtrans-63.8-40.2176.5-64.4-178.9-174.200112.5Q331 L336 R337 A363Q331-E333 VanDerWaalsContact C-N 3.29Å; Q331-E333 PolarHBondContact O-N 2.99Å; E333-L336 WeakPolarHBondContact O-CB 3.28Å; E333-L336 PolarHBondContact O-N 3.48Å; E333-R337 PolarHBondContact O-N 3.03Å; E333-A363 HydrophobicContact CG-CB 3.97Å
334I96Very high95.2Very high69 Ų6962.5 Ų62.535%0.35429%0.288SS..Hα-helixtrans-71.8-44.3178.1-64.1175.2000109.3H326 Q331 P332 L336 R337 F338H326-I334 HydrophobicContact CB-CB 4.45Å; H326-I334 HydrophobicContact CB-CG2 4.27Å; Q331-I334 HydrophobicContact CB-CB 4.44Å; Q331-I334 HydrophobicContact CB-CD1 4.23Å; Q331-I334 HydrophobicContact CG-CD1 4.49Å; Q331-I334 PolarHBondContact O-N 3.47Å; P332-I334 PolarHBondContact O-N 3.49Å; I334-L336 VanDerWaalsContact C-N 3.27Å; I334-L336 PolarHBondContact O-N 3.5Å; I334-R337 WeakPolarHBondContact O-CB 3.16Å; I334-R337 PolarHBondContact O-N 2.87Å; I334-R337 VanDerWaalsContact O-N 3.09Å; I334-F338 HydrophobicContact CG2-CD2 3.91Å; I334-F338 HydrophobicContact CG2-CE2 3.58Å; I334-F338 VanDerWaalsContact O-CD2 3.24Å; I334-F338 WeakPolarHBondContact O-CD2 3.01Å; I334-F338 PolarHBondContact O-N 3.1Å
335A96.6Very high95.2Very high0 Ų066.2 Ų66.20%031%0.306CS..Hα-helixtrans-56.3-43.617400000111.7G323 H326 F327 Q331 P332 R337 F338 Y339G323-A335 WeakPolarHBondContact O-CB 3.49Å; H326-A335 HydrophobicContact CB-CB 4.28Å; F327-A335 HydrophobicContact CB-CB 3.78Å; Q331-A335 PolarHBondContact O-N 2.91Å; P332-A335 PolarHBondContact O-N 3.22Å; A335-R337 VanDerWaalsContact C-N 3.29Å; A335-R337 PolarHBondContact O-N 3.31Å; A335-F338 PolarHBondContact O-N 3.48Å; A335-F338 VanDerWaalsContact O-N 3.08Å; A335-Y339 HydrophobicContact CB-CE2 4.42Å; A335-Y339 VanDerWaalsContact O-CD2 3.26Å; A335-Y339 WeakPolarHBondContact O-CD2 3.47Å; A335-Y339 PolarHBondContact O-N 3.05Å
336L96.8Very high95.2Very high4 Ų468.6 Ų68.62%0.02133%0.333CS..Hα-helixtrans-58.3-40.2176.4-178.559.6000112P332 E333 I334 F338 Y339 R340 L356 C359 C360 A363 Q365P332-L336 VanDerWaalsContact O-CB 3.3Å; P332-L336 WeakPolarHBondContact O-CB 3.45Å; P332-L336 PolarHBondContact O-N 3.27Å; E333-L336 WeakPolarHBondContact O-CB 3.28Å; E333-L336 PolarHBondContact O-N 3.48Å; I334-L336 VanDerWaalsContact C-N 3.27Å; I334-L336 PolarHBondContact O-N 3.5Å; L336-F338 VanDerWaalsContact C-N 3.35Å; L336-F338 PolarHBondContact O-N 3Å; L336-Y339 PolarHBondContact O-N 3.4Å; L336-R340 HydrophobicContact CD1-CG 4.21Å; L336-R340 HydrophobicContact CG-CG 4.44Å; L336-R340 VanDerWaalsContact O-CB 3.28Å; L336-R340 WeakPolarHBondContact O-CB 3.49Å; L336-R340 VanDerWaalsContact O-CG 3.25Å; L336-R340 WeakPolarHBondContact O-CG 3.47Å; L336-R340 PolarHBondContact O-N 2.99Å; L336-L356 HydrophobicContact CD1-CD2 3.81Å; L336-C359 HydrophobicContact CB-CB 3.98Å; L336-C359 HydrophobicContact CD1-CB 4Å; L336-C360 VanDerWaalsContact CD1-SG 3.52Å; L336-A363 HydrophobicContact CD2-CB 4.29Å; L336-Q365 VanDerWaalsContact CD2-OE1 3.29Å
337R96.5Very high95.1Very high199 Ų19968.5 Ų68.575%0.75133%0.334SS*.Hα-helixtrans-62-42.5175.5-176.3-178.6175.1-175.7-1.5111.7E333 I334 A335 R341E333-R337 PolarHBondContact O-N 3.03Å; I334-R337 WeakPolarHBondContact O-CB 3.16Å; I334-R337 PolarHBondContact O-N 2.87Å; I334-R337 VanDerWaalsContact O-N 3.09Å; A335-R337 VanDerWaalsContact C-N 3.29Å; A335-R337 PolarHBondContact O-N 3.31Å; R337-R341 PolarHBondContact O-N 3.33Å
338F96.4Very high95.1Very high51 Ų5173.1 Ų73.122%0.22435%0.352CS..Hα-helixtrans-66.9-44.8177.5-77.3-68.9000112.1L309 I319 I322 H326 I334 A335 L336 R340 R341 L342L309-F338 HydrophobicContact CD1-CE1 3.82Å; I319-F338 HydrophobicContact CG2-CB 3.86Å; I319-F338 HydrophobicContact CG2-CD1 4.08Å; I319-F338 HydrophobicContact CG2-CG 4.45Å; I319-F338 WeakPolarHBondContact CG2-O 3.46Å; I322-F338 HydrophobicContact CG2-CD1 4.48Å; I322-F338 HydrophobicContact CG2-CD2 4.02Å; I322-F338 HydrophobicContact CG2-CE1 4.09Å; I322-F338 HydrophobicContact CG2-CE2 3.59Å; I322-F338 HydrophobicContact CG2-CG 4.45Å; I322-F338 HydrophobicContact CG2-CZ 3.63Å; H326-F338 AromaticContact CD2-CE2 3.88Å; I334-F338 HydrophobicContact CG2-CD2 3.91Å; I334-F338 HydrophobicContact CG2-CE2 3.58Å; I334-F338 VanDerWaalsContact O-CD2 3.24Å; I334-F338 WeakPolarHBondContact O-CD2 3.01Å; I334-F338 PolarHBondContact O-N 3.1Å; A335-F338 PolarHBondContact O-N 3.48Å; A335-F338 VanDerWaalsContact O-N 3.08Å; L336-F338 VanDerWaalsContact C-N 3.35Å; L336-F338 PolarHBondContact O-N 3Å; F338-R340 PolarHBondContact O-N 3.03Å; F338-R341 VanDerWaalsContact O-CB 3.27Å; F338-R341 WeakPolarHBondContact O-CB 3.2Å; F338-R341 PolarHBondContact O-N 3.42Å; F338-R341 VanDerWaalsContact O-N 3.14Å; F338-L342 PolarHBondContact O-N 3.31Å
339Y96.8Very high95.1Very high11 Ų1175.3 Ų75.34%0.04337%0.366CS..Hα-helixtrans-68.3-34.5176.2-69.5-59000112.9S324 A335 L336 R341 L342 L343 L352 N355 L356 C359S324-Y339 PolarHBondContact N-OH 2.82Å; A335-Y339 HydrophobicContact CB-CE2 4.42Å; A335-Y339 VanDerWaalsContact O-CD2 3.26Å; A335-Y339 WeakPolarHBondContact O-CD2 3.47Å; A335-Y339 PolarHBondContact O-N 3.05Å; L336-Y339 PolarHBondContact O-N 3.4Å; Y339-R341 VanDerWaalsContact C-N 3.25Å; Y339-R341 PolarHBondContact O-N 2.95Å; Y339-L342 HydrophobicContact CD1-CD1 4.1Å; Y339-L342 WeakPolarHBondContact O-CB 3.43Å; Y339-L342 PolarHBondContact O-N 2.77Å; Y339-L343 PolarHBondContact O-N 3.13Å; Y339-L343 VanDerWaalsContact O-N 3.1Å; Y339-L352 HydrophobicContact CD1-CD1 3.84Å; Y339-L352 HydrophobicContact CG-CD1 4.44Å; Y339-N355 HydrophobicContact CD1-CB 4.27Å; Y339-N355 HydrophobicContact CD2-CB 4.34Å; Y339-N355 HydrophobicContact CE1-CB 4.11Å; Y339-N355 HydrophobicContact CE2-CB 4.16Å; Y339-N355 HydrophobicContact CG-CB 4.4Å; Y339-L356 VanDerWaalsContact CB-CD2 3.49Å; Y339-C359 VanDerWaalsContact CD2-SG 3.5Å
340R96Very high95.2Very high98 Ų9872.2 Ų72.237%0.3735%0.347SS..Hα-helixtrans-62.5-34171-79.2179.7175.3173.23112L336 F338 L343 Q344 L356L336-R340 HydrophobicContact CD1-CG 4.21Å; L336-R340 HydrophobicContact CG-CG 4.44Å; L336-R340 VanDerWaalsContact O-CB 3.28Å; L336-R340 WeakPolarHBondContact O-CB 3.49Å; L336-R340 VanDerWaalsContact O-CG 3.25Å; L336-R340 WeakPolarHBondContact O-CG 3.47Å; L336-R340 PolarHBondContact O-N 2.99Å; F338-R340 PolarHBondContact O-N 3.03Å; R340-L343 PolarHBondContact O-N 3Å; R340-Q344 WeakPolarHBondContact O-CG 3.39Å; R340-Q344 PolarHBondContact O-N 3.01Å; R340-L356 HydrophobicContact CG-CD2 4.03Å
341R95.9Very high95.4Very high93 Ų9369.7 Ų69.735%0.35133%0.331SS..Hα-helixtrans-61.9-44.9173.3179.862.2172.8174.62.1111.1I319 R337 F338 Y339 L343 Q344 M345I319-R341 HydrophobicContact CD1-CG 4.06Å; R337-R341 PolarHBondContact O-N 3.33Å; F338-R341 VanDerWaalsContact O-CB 3.27Å; F338-R341 WeakPolarHBondContact O-CB 3.2Å; F338-R341 PolarHBondContact O-N 3.42Å; F338-R341 VanDerWaalsContact O-N 3.14Å; Y339-R341 VanDerWaalsContact C-N 3.25Å; Y339-R341 PolarHBondContact O-N 2.95Å; R341-L343 VanDerWaalsContact C-N 3.29Å; R341-L343 PolarHBondContact O-N 3.38Å; R341-Q344 WeakPolarHBondContact O-CB 3.35Å; R341-Q344 PolarHBondContact O-N 2.92Å; R341-Q344 VanDerWaalsContact O-N 3.17Å; R341-M345 WeakPolarHBondContact O-CG 3.4Å; R341-M345 PolarHBondContact O-N 2.73Å; R341-M345 VanDerWaalsContact O-N 3.08Å
342L95.7Very high95.4Very high6 Ų666.1 Ų66.13%0.03132%0.315CS..Hα-helixtrans-59.1-41.7174.8-67.3179.2000112.1V316 I319 A320 F338 Y339 Q344 M345 V347 L352V316-L342 HydrophobicContact CB-CD2 4.28Å; V316-L342 HydrophobicContact CG1-CD2 4.09Å; V316-L342 HydrophobicContact CG2-CD2 4.18Å; I319-L342 HydrophobicContact CB-CD2 3.91Å; I319-L342 HydrophobicContact CB-CG 4.23Å; I319-L342 HydrophobicContact CD1-CD2 3.84Å; I319-L342 HydrophobicContact CG1-CD2 4.46Å; I319-L342 HydrophobicContact CG2-CD1 4.04Å; I319-L342 HydrophobicContact CG2-CD2 3.84Å; I319-L342 HydrophobicContact CG2-CG 3.61Å; A320-L342 HydrophobicContact CB-CD1 4.45Å; F338-L342 PolarHBondContact O-N 3.31Å; Y339-L342 HydrophobicContact CD1-CD1 4.1Å; Y339-L342 WeakPolarHBondContact O-CB 3.43Å; Y339-L342 PolarHBondContact O-N 2.77Å; L342-Q344 PolarHBondContact O-N 2.77Å; L342-M345 PolarHBondContact O-N 3.33Å; L342-V347 WeakPolarHBondContact O-CB 3.19Å; L342-V347 PolarHBondContact O-N 3.18Å; L342-L352 HydrophobicContact CB-CD1 3.88Å; L342-L352 HydrophobicContact CB-CD2 4.04Å; L342-L352 HydrophobicContact CD1-CD1 3.98Å
343L95.4Very high95.4Very high63 Ų6365.7 Ų65.733%0.3331%0.31SS..Hα-helixtrans-63.2-41176-175.5148.9000111.9Y339 R340 R341 M345 G346 L352 Y353 L356Y339-L343 PolarHBondContact O-N 3.13Å; Y339-L343 VanDerWaalsContact O-N 3.1Å; R340-L343 PolarHBondContact O-N 3Å; R341-L343 VanDerWaalsContact C-N 3.29Å; R341-L343 PolarHBondContact O-N 3.38Å; L343-M345 PolarHBondContact O-N 3.03Å; L343-G346 PolarHBondContact O-N 3.4Å; L343-L352 HydrophobicContact CB-CD2 4.36Å; L343-Y353 HydrophobicContact CD1-CE1 3.83Å; L343-L356 HydrophobicContact CB-CD1 4.26Å; L343-L356 HydrophobicContact CD1-CD1 3.49Å; L343-L356 VanDerWaalsContact CD1-CD1 3.49Å
344Q95.7Very high95.5Very high140 Ų14059.7 Ų59.765%0.65428%0.283SS*.Hα-helixtrans-63.6-29.7175.5-73171.7-1.600113R340 R341 L342 G346R340-Q344 WeakPolarHBondContact O-CG 3.39Å; R340-Q344 PolarHBondContact O-N 3.01Å; R341-Q344 WeakPolarHBondContact O-CB 3.35Å; R341-Q344 PolarHBondContact O-N 2.92Å; R341-Q344 VanDerWaalsContact O-N 3.17Å; L342-Q344 PolarHBondContact O-N 2.77Å; Q344-G346 PolarHBondContact O-N 2.56Å
345M94.1Very high95.5Very high86 Ų8658.8 Ų58.842%0.42428%0.279SS..THydrogen-bonded Turntrans-74.5-3.6174.9-63.1-51.6-54.300113.2T314 R341 L342 L343T314-M345 HydrophobicContact CG2-CE 3.33Å; T314-M345 HydrophobicContact CG2-SD 3.81Å; R341-M345 WeakPolarHBondContact O-CG 3.4Å; R341-M345 PolarHBondContact O-N 2.73Å; R341-M345 VanDerWaalsContact O-N 3.08Å; L342-M345 PolarHBondContact O-N 3.33Å; L343-M345 PolarHBondContact O-N 3.03Å
346G93.3Very high95.5Very high60 Ų6059.3 Ų59.362%0.61928%0.281SS*.THydrogen-bonded Turntrans87.612.4179.400000114.3L343 Q344 Y348L343-G346 PolarHBondContact O-N 3.4Å; Q344-G346 PolarHBondContact O-N 2.56Å; G346-Y348 PolarHBondContact O-N 3.38Å
347V94.2Very high95.4Very high35 Ų3559.1 Ų59.121%0.21228%0.28CS..  trans-68.6124.6170.9-176.70000108.4V316 L342 L352V316-V347 HydrophobicContact CG2-CG2 4.44Å; L342-V347 WeakPolarHBondContact O-CB 3.19Å; L342-V347 PolarHBondContact O-N 3.18Å; V347-L352 HydrophobicContact CB-CD2 3.87Å; V347-L352 HydrophobicContact CG1-CD2 3.85Å; V347-L352 VanDerWaalsContact O-CD2 3.27Å; V347-L352 WeakPolarHBondContact O-CD2 2.87Å
348Y93.8Very high95.4Very high129 Ų12950.5 Ų50.551%0.50625%0.249SC..  trans-13477.4-172.9-167.9-105.1000110.1G346 Y353 L379G346-Y348 PolarHBondContact O-N 3.38Å; Y348-Y353 AromaticContact CD2-CE2 3.44Å; Y348-Y353 HydrophobicContact CD2-CE2 3.44Å; Y348-Y353 VanDerWaalsContact CD2-CE2 3.44Å; Y348-Y353 AromaticContact CD2-CZ 3.89Å; Y348-Y353 WeakPolarHBondContact CD2-OH 3.22Å; Y348-Y353 AromaticContact CE2-CE2 3.39Å; Y348-Y353 HydrophobicContact CE2-CE2 3.39Å; Y348-Y353 AromaticContact CE2-CZ 3.65Å; Y348-Y353 WeakPolarHBondContact CE2-OH 3.38Å; Y348-Y353 HydrophobicContact CG-CE2 4.27Å; Y348-L379 HydrophobicContact CD1-CD1 3.75Å; Y348-L379 HydrophobicContact CD1-CD2 3.9Å; Y348-L379 HydrophobicContact CD1-CG 4.47Å; Y348-L379 HydrophobicContact CD2-CD1 4.34Å; Y348-L379 HydrophobicContact CE1-CD1 3.42Å; Y348-L379 VanDerWaalsContact CE1-CD1 3.42Å; Y348-L379 HydrophobicContact CE1-CD2 3.15Å; Y348-L379 HydrophobicContact CE1-CG 3.86Å; Y348-L379 HydrophobicContact CE2-CD1 3.99Å; Y348-L379 HydrophobicContact CG-CD1 4.19Å; Y348-L379 VanDerWaalsContact CZ-CD1 3.49Å
349N93.9Very high95.4Very high84 Ų8448.2 Ų48.245%0.44924%0.239SC..  trans-124.2153.2-174-64.51.7000111.2Q351 L352 Y353N349-Q351 PolarHBondContact O-N 2.97Å; N349-L352 HydrophobicContact CB-CB 4.34Å; N349-L352 PolarHBondContact O-N 3.08Å; N349-Y353 WeakPolarHBondContact O-CD2 3.42Å; N349-Y353 PolarHBondContact O-N 3.44Å
350C94.9Very high95.4Very high4 Ų447.9 Ų47.93%0.02724%0.238CC..Hα-helixtrans-55-50.7173.6178.80000111.8L352 Y353 N354 A376 L379C350-L352 VanDerWaalsContact C-N 3.29Å; C350-L352 PolarHBondContact O-N 2.94Å; C350-Y353 PolarHBondContact O-N 3.45Å; C350-N354 WeakPolarHBondContact O-CB 3.29Å; C350-N354 PolarHBondContact O-N 3.14Å; C350-A376 PolarHBondContact SG-O 2.73Å; C350-A376 VanDerWaalsContact SG-O 3.41Å; C350-L379 HydrophobicContact CB-CB 4.3Å
351Q94.1Very high95.5Very high85 Ų8544.1 Ų44.140%0.39723%0.225SC..Hα-helixtrans-60.6-37.5-178.4-60.282.7100112.5N349 N354 N355 E385N349-Q351 PolarHBondContact O-N 2.97Å; Q351-N354 PolarHBondContact O-N 3.41Å; Q351-N355 WeakPolarHBondContact O-CB 3.39Å; Q351-N355 PolarHBondContact O-N 3Å; Q351-N355 PolarHBondContact O-ND2 3.43Å; Q351-E385 VanDerWaalsContact NE2-CD 3.25Å; Q351-E385 PolarHBondContact NE2-OE1 3.5Å
352L95.7Very high95.4Very high9 Ų945.1 Ų45.15%0.04723%0.23CC..Hα-helixtrans-66-45.1179.4178.463000111.1Y339 L342 L343 V347 N349 C350 N354 N355 L356Y339-L352 HydrophobicContact CD1-CD1 3.84Å; Y339-L352 HydrophobicContact CG-CD1 4.44Å; L342-L352 HydrophobicContact CB-CD1 3.88Å; L342-L352 HydrophobicContact CB-CD2 4.04Å; L342-L352 HydrophobicContact CD1-CD1 3.98Å; L343-L352 HydrophobicContact CB-CD2 4.36Å; V347-L352 HydrophobicContact CB-CD2 3.87Å; V347-L352 HydrophobicContact CG1-CD2 3.85Å; V347-L352 VanDerWaalsContact O-CD2 3.27Å; V347-L352 WeakPolarHBondContact O-CD2 2.87Å; N349-L352 HydrophobicContact CB-CB 4.34Å; N349-L352 PolarHBondContact O-N 3.08Å; C350-L352 VanDerWaalsContact C-N 3.29Å; C350-L352 PolarHBondContact O-N 2.94Å; L352-N354 VanDerWaalsContact C-N 3.33Å; L352-N355 PolarHBondContact O-N 3.25Å; L352-L356 HydrophobicContact CG-CD1 4.22Å; L352-L356 WeakPolarHBondContact O-CB 3.37Å; L352-L356 WeakPolarHBondContact O-CG 3.42Å; L352-L356 PolarHBondContact O-N 3.49Å
353Y96.7Very high95.4Very high14 Ų1445.3 Ų45.36%0.05523%0.232CC..Hα-helixtrans-67.1-35.7176.9-83.9-71.9000112.5L343 Y348 N349 C350 L356 G357 R375 L379L343-Y353 HydrophobicContact CD1-CE1 3.83Å; Y348-Y353 AromaticContact CD2-CE2 3.44Å; Y348-Y353 HydrophobicContact CD2-CE2 3.44Å; Y348-Y353 VanDerWaalsContact CD2-CE2 3.44Å; Y348-Y353 AromaticContact CD2-CZ 3.89Å; Y348-Y353 WeakPolarHBondContact CD2-OH 3.22Å; Y348-Y353 AromaticContact CE2-CE2 3.39Å; Y348-Y353 HydrophobicContact CE2-CE2 3.39Å; Y348-Y353 AromaticContact CE2-CZ 3.65Å; Y348-Y353 WeakPolarHBondContact CE2-OH 3.38Å; Y348-Y353 HydrophobicContact CG-CE2 4.27Å; N349-Y353 WeakPolarHBondContact O-CD2 3.42Å; N349-Y353 PolarHBondContact O-N 3.44Å; C350-Y353 PolarHBondContact O-N 3.45Å; Y353-L356 HydrophobicContact CD1-CD1 4.38Å; Y353-L356 PolarHBondContact O-N 2.92Å; Y353-G357 PolarHBondContact O-N 2.78Å; Y353-R375 HydrophobicContact CD1-CB 3.88Å; Y353-R375 HydrophobicContact CD2-CB 4.38Å; Y353-R375 HydrophobicContact CE1-CB 4.12Å; Y353-R375 HydrophobicContact CG-CB 4.03Å; Y353-L379 HydrophobicContact CD2-CD1 3.63Å; Y353-L379 HydrophobicContact CE2-CD1 3.76Å
354N96.6Very high95.4Very high13 Ų1349.3 Ų49.37%0.0725%0.249CC..Hα-helixtrans-60.1-50.3172.5-167.44.7000111.1C350 Q351 L352 L356 G357 L358 F373 A376 V389 N392C350-N354 WeakPolarHBondContact O-CB 3.29Å; C350-N354 PolarHBondContact O-N 3.14Å; Q351-N354 PolarHBondContact O-N 3.41Å; L352-N354 VanDerWaalsContact C-N 3.33Å; N354-L356 VanDerWaalsContact C-N 3.34Å; N354-L356 PolarHBondContact O-N 3.06Å; N354-G357 PolarHBondContact O-N 2.85Å; N354-G357 VanDerWaalsContact O-N 3.13Å; N354-L358 PolarHBondContact O-N 2.93Å; N354-F373 WeakPolarHBondContact OD1-CE1 3.35Å; N354-A376 HydrophobicContact CB-CB 4.41Å; N354-V389 HydrophobicContact CB-CG2 4.15Å; N354-N392 VanDerWaalsContact CG-ND2 3.26Å; N354-N392 PolarHBondContact ND2-ND2 3.3Å; N354-N392 PolarHBondContact OD1-ND2 3.02Å
355N96.3Very high95.3Very high51 Ų5146.2 Ų46.227%0.27323%0.234SC..Hα-helixtrans-62.1-38.8176.7-69.3-16.4000112.5Y339 Q351 L352 C359Y339-N355 HydrophobicContact CD1-CB 4.27Å; Y339-N355 HydrophobicContact CD2-CB 4.34Å; Y339-N355 HydrophobicContact CE1-CB 4.11Å; Y339-N355 HydrophobicContact CE2-CB 4.16Å; Y339-N355 HydrophobicContact CG-CB 4.4Å; Q351-N355 WeakPolarHBondContact O-CB 3.39Å; Q351-N355 PolarHBondContact O-N 3Å; Q351-N355 PolarHBondContact O-ND2 3.43Å; L352-N355 PolarHBondContact O-N 3.25Å; N355-C359 WeakPolarHBondContact O-CB 3.31Å; N355-C359 PolarHBondContact O-N 3.27Å; N355-C359 PolarHBondContact O-SG 3.26Å
356L96.3Very high95.3Very high10 Ų1048.4 Ų48.45%0.05224%0.239CC..Hα-helixtrans-63.9-40.3173.9-78.8171.1000112.1L336 Y339 R340 L343 L352 Y353 N354 C359 C360L336-L356 HydrophobicContact CD1-CD2 3.81Å; Y339-L356 VanDerWaalsContact CB-CD2 3.49Å; R340-L356 HydrophobicContact CG-CD2 4.03Å; L343-L356 HydrophobicContact CB-CD1 4.26Å; L343-L356 HydrophobicContact CD1-CD1 3.49Å; L343-L356 VanDerWaalsContact CD1-CD1 3.49Å; L352-L356 HydrophobicContact CG-CD1 4.22Å; L352-L356 WeakPolarHBondContact O-CB 3.37Å; L352-L356 WeakPolarHBondContact O-CG 3.42Å; L352-L356 PolarHBondContact O-N 3.49Å; Y353-L356 HydrophobicContact CD1-CD1 4.38Å; Y353-L356 PolarHBondContact O-N 2.92Å; N354-L356 VanDerWaalsContact C-N 3.34Å; N354-L356 PolarHBondContact O-N 3.06Å; L356-C359 PolarHBondContact O-N 3.28Å; L356-C360 VanDerWaalsContact O-CB 3.27Å; L356-C360 WeakPolarHBondContact O-CB 3.41Å; L356-C360 PolarHBondContact O-N 3.06Å; L356-C360 PolarHBondContact O-SG 3.1Å
357G96.1Very high95.3Very high0 Ų053 Ų530%025%0.249CC..Hα-helixtrans-63.7-46.4176.900000112.2Y353 N354 C360 F361 S372 F373Y353-G357 PolarHBondContact O-N 2.78Å; N354-G357 PolarHBondContact O-N 2.85Å; N354-G357 VanDerWaalsContact O-N 3.13Å; G357-C360 PolarHBondContact O-N 3.45Å; G357-F361 WeakPolarHBondContact O-CB 3.46Å; G357-F361 PolarHBondContact O-N 3.36Å; G357-S372 WeakPolarHBondContact CA-OG 3.49Å; G357-S372 PolarHBondContact N-OG 3.35Å; G357-F373 VanDerWaalsContact C-CZ 3.42Å
358L96.1Very high95.2Very high19 Ų1955.7 Ų55.710%0.09926%0.261CS..Hα-helixtrans-58.9-52.9173-71.8176.4000111.2F327 N354 C360 F361 Y362 F373 N392F327-L358 HydrophobicContact CE2-CB 4.39Å; F327-L358 HydrophobicContact CZ-CB 4.27Å; N354-L358 PolarHBondContact O-N 2.93Å; L358-C360 VanDerWaalsContact C-N 3.33Å; L358-C360 PolarHBondContact O-N 2.94Å; L358-F361 PolarHBondContact O-N 3.42Å; L358-F361 VanDerWaalsContact O-N 3.1Å; L358-Y362 HydrophobicContact CD2-CE2 4.11Å; L358-Y362 WeakPolarHBondContact O-CD2 3.36Å; L358-Y362 PolarHBondContact O-N 3.49Å; L358-F373 HydrophobicContact CD2-CZ 4.24Å; L358-F373 HydrophobicContact CG-CZ 4.27Å; L358-N392 HydrophobicContact CD1-CB 4.5Å; L358-N392 HydrophobicContact CD2-CB 3.86Å; L358-N392 HydrophobicContact CG-CB 4.28Å
359C96.6Very high95.3Very high2 Ų249.9 Ų49.91%0.01424%0.238CC..Hα-helixtrans-60.6-41.6-179.2-68.80000112.1L336 Y339 N355 L356 F361 A363L336-C359 HydrophobicContact CB-CB 3.98Å; L336-C359 HydrophobicContact CD1-CB 4Å; Y339-C359 VanDerWaalsContact CD2-SG 3.5Å; N355-C359 WeakPolarHBondContact O-CB 3.31Å; N355-C359 PolarHBondContact O-N 3.27Å; N355-C359 PolarHBondContact O-SG 3.26Å; L356-C359 PolarHBondContact O-N 3.28Å; C359-F361 VanDerWaalsContact C-N 3.33Å; C359-F361 PolarHBondContact O-N 2.7Å; C359-A363 WeakPolarHBondContact O-CB 3.44Å; C359-A363 PolarHBondContact O-N 3.36Å
360C96.6Very high95.2Very high4 Ų450.9 Ų50.93%0.02724%0.243CC..Hα-helixtrans-61.2-41.9175.2-73.20000111.4L336 L356 G357 L358 A363 Q364 Q365 T369L336-C360 VanDerWaalsContact CD1-SG 3.52Å; L356-C360 VanDerWaalsContact O-CB 3.27Å; L356-C360 WeakPolarHBondContact O-CB 3.41Å; L356-C360 PolarHBondContact O-N 3.06Å; L356-C360 PolarHBondContact O-SG 3.1Å; G357-C360 PolarHBondContact O-N 3.45Å; L358-C360 VanDerWaalsContact C-N 3.33Å; L358-C360 PolarHBondContact O-N 2.94Å; C360-A363 CarbonylContact O-C 3.55Å; C360-A363 PolarHBondContact O-N 3.22Å; C360-Q364 PolarHBondContact O-N 3.21Å; C360-Q365 HydrophobicContact CB-CB 4.4Å; C360-Q365 PolarHBondContact O-N 2.74Å; C360-T369 HydrophobicContact CB-CG2 3.62Å
361F96.7Very high95.3Very high20 Ų2052.2 Ų52.29%0.08825%0.253CS..Hα-helixtrans-67.6-50-177.7179.1-105.3000111.6G357 L358 C359 A363 Q364 Y366 T369 V396 I400G357-F361 WeakPolarHBondContact O-CB 3.46Å; G357-F361 PolarHBondContact O-N 3.36Å; L358-F361 PolarHBondContact O-N 3.42Å; L358-F361 VanDerWaalsContact O-N 3.1Å; C359-F361 VanDerWaalsContact C-N 3.33Å; C359-F361 PolarHBondContact O-N 2.7Å; F361-A363 VanDerWaalsContact C-N 3.3Å; F361-A363 PolarHBondContact O-N 3.38Å; F361-Q364 PolarHBondContact O-N 3.5Å; F361-Y366 AromaticContact CD2-CD1 3.97Å; F361-Y366 HydrophobicContact CD2-CD1 3.97Å; F361-Y366 AromaticContact CD2-CE1 3.83Å; F361-Y366 HydrophobicContact CD2-CE1 3.83Å; F361-Y366 HydrophobicContact CE2-CD1 4.23Å; F361-Y366 AromaticContact CE2-CE1 3.83Å; F361-Y366 HydrophobicContact CE2-CE1 3.83Å; F361-T369 VanDerWaalsContact CA-CG2 3.48Å; F361-T369 HydrophobicContact CB-CG2 3.73Å; F361-T369 HydrophobicContact CD2-CG2 4.43Å; F361-T369 VanDerWaalsContact N-CG2 3.32Å; F361-V396 HydrophobicContact CB-CG2 4.14Å; F361-V396 HydrophobicContact CD1-CG2 3.92Å; F361-V396 HydrophobicContact CD2-CB 4.4Å; F361-V396 HydrophobicContact CD2-CG1 3.7Å; F361-V396 HydrophobicContact CD2-CG2 4.18Å; F361-V396 HydrophobicContact CE1-CG2 4.37Å; F361-V396 HydrophobicContact CE2-CB 4.44Å; F361-V396 HydrophobicContact CE2-CG1 3.73Å; F361-V396 HydrophobicContact CG-CB 4.46Å; F361-V396 HydrophobicContact CG-CG1 4.2Å; F361-V396 HydrophobicContact CG-CG2 3.81Å; F361-V396 HydrophobicContact CZ-CG1 4.25Å; F361-I400 HydrophobicContact CE2-CG1 4.06Å; F361-I400 HydrophobicContact CZ-CG1 4.47Å
362Y95.4Very high95.4Very high114 Ų11448.6 Ų48.645%0.44724%0.237SC..Hα-helixtrans-70.3-25.7178.4-70.7-72.4000112.9F327 L358 Q364F327-Y362 AromaticContact CE2-CD2 3.56Å; F327-Y362 HydrophobicContact CE2-CD2 3.56Å; F327-Y362 HydrophobicContact CE2-CE2 4.32Å; F327-Y362 HydrophobicContact CE2-CG 4.14Å; F327-Y362 AromaticContact CZ-CD2 3.45Å; F327-Y362 HydrophobicContact CZ-CD2 3.45Å; F327-Y362 VanDerWaalsContact CZ-CD2 3.45Å; F327-Y362 AromaticContact CZ-CE2 3.74Å; F327-Y362 HydrophobicContact CZ-CE2 3.74Å; F327-Y362 HydrophobicContact CZ-CG 4.27Å; L358-Y362 HydrophobicContact CD2-CE2 4.11Å; L358-Y362 WeakPolarHBondContact O-CD2 3.36Å; L358-Y362 PolarHBondContact O-N 3.49Å; Y362-Q364 PolarHBondContact O-N 2.79Å
363A95.4Very high95.4Very high9 Ų948.4 Ų48.47%0.07424%0.235CC..THydrogen-bonded Turntrans-82.89169.500000113.8P332 E333 L336 C359 C360 F361 Q365P332-A363 HydrophobicContact CB-CB 4.27Å; P332-A363 HydrophobicContact CG-CB 4.41Å; E333-A363 HydrophobicContact CG-CB 3.97Å; L336-A363 HydrophobicContact CD2-CB 4.29Å; C359-A363 WeakPolarHBondContact O-CB 3.44Å; C359-A363 PolarHBondContact O-N 3.36Å; C360-A363 CarbonylContact O-C 3.55Å; C360-A363 PolarHBondContact O-N 3.22Å; F361-A363 VanDerWaalsContact C-N 3.3Å; F361-A363 PolarHBondContact O-N 3.38Å; A363-Q365 PolarHBondContact O-N 2.68Å
364Q94.9Very high95.4Very high147 Ų14754.1 Ų54.169%0.68726%0.263SS*.THydrogen-bonded Turntrans6220.3177.7-53.6177.7-2.800115.3C360 F361 Y362 Y366C360-Q364 PolarHBondContact O-N 3.21Å; F361-Q364 PolarHBondContact O-N 3.5Å; Y362-Q364 PolarHBondContact O-N 2.79Å; Q364-Y366 HydrophobicContact CB-CE2 4.19Å; Q364-Y366 PolarHBondContact O-N 2.67Å
365Q94.5Very high95.3Very high76 Ų7659.1 Ų59.136%0.35528%0.281SS..  trans-91.968.1174.8-64.9-174.210.400110.8L336 C360 A363 D367 M368 T369L336-Q365 VanDerWaalsContact CD2-OE1 3.29Å; C360-Q365 HydrophobicContact CB-CB 4.4Å; C360-Q365 PolarHBondContact O-N 2.74Å; A363-Q365 PolarHBondContact O-N 2.68Å; Q365-D367 VanDerWaalsContact C-N 3.26Å; Q365-D367 PolarHBondContact O-N 3.08Å; Q365-M368 PolarHBondContact O-N 2.84Å; Q365-T369 WeakPolarHBondContact O-CG2 3.41Å
366Y92.9Very high95.3Very high131 Ų13156.7 Ų56.751%0.51427%0.268SS..Hα-helixtrans-62.1-27.4-171.6-56.8-59.9000114.6F361 Q364 M368 T369F361-Y366 AromaticContact CD2-CD1 3.97Å; F361-Y366 HydrophobicContact CD2-CD1 3.97Å; F361-Y366 AromaticContact CD2-CE1 3.83Å; F361-Y366 HydrophobicContact CD2-CE1 3.83Å; F361-Y366 HydrophobicContact CE2-CD1 4.23Å; F361-Y366 AromaticContact CE2-CE1 3.83Å; F361-Y366 HydrophobicContact CE2-CE1 3.83Å; Q364-Y366 HydrophobicContact CB-CE2 4.19Å; Q364-Y366 PolarHBondContact O-N 2.67Å; Y366-M368 PolarHBondContact O-N 3.44Å; Y366-T369 PolarHBondContact O-N 3.46Å; Y366-T369 PolarHBondContact O-OG1 2.82Å
367D92.8Very high95.3Very high158 Ų15858.3 Ų58.385%0.84528%0.276SS*.Hα-helixtrans-59.8-33.6-178-58.8-20000113Q365Q365-D367 VanDerWaalsContact C-N 3.26Å; Q365-D367 PolarHBondContact O-N 3.08Å
368M93.4Very high95.2Very high91 Ų9162.2 Ų62.245%0.44831%0.309SS..Hα-helixtrans-97.3-15.3-173.2-67.3-62-61.500113.5Q365 Y366 S371 S372Q365-M368 PolarHBondContact O-N 2.84Å; Y366-M368 PolarHBondContact O-N 3.44Å; M368-S371 PolarHBondContact O-N 2.97Å; M368-S371 PolarHBondContact O-OG 2.89Å; M368-S372 PolarHBondContact O-N 3.3Å; M368-S372 VanDerWaalsContact O-N 3.09Å; M368-S372 PolarHBondContact O-OG 3.15Å
369T94.9Very high95.1Very high6 Ų663.6 Ų63.64%0.03732%0.316CS..Hα-helixtrans-62-55.5-169.855.90000112.7C360 F361 Q365 Y366 S371 S372 F373C360-T369 HydrophobicContact CB-CG2 3.62Å; F361-T369 VanDerWaalsContact CA-CG2 3.48Å; F361-T369 HydrophobicContact CB-CG2 3.73Å; F361-T369 HydrophobicContact CD2-CG2 4.43Å; F361-T369 VanDerWaalsContact N-CG2 3.32Å; Q365-T369 WeakPolarHBondContact O-CG2 3.41Å; Y366-T369 PolarHBondContact O-N 3.46Å; Y366-T369 PolarHBondContact O-OG1 2.82Å; T369-S371 VanDerWaalsContact C-N 3.33Å; T369-S371 PolarHBondContact O-N 3.13Å; T369-S372 PolarHBondContact O-N 3.16Å; T369-S372 PolarHBondContact O-OG 3.4Å; T369-F373 WeakPolarHBondContact O-CD2 3.26Å; T369-F373 PolarHBondContact O-N 3.08Å; T369-F373 VanDerWaalsContact O-N 3.11Å
370L93Very high95Very high105 Ų10565.2 Ų65.255%0.5533%0.326SS..Hα-helixtrans-63.2-42.9-177.3-63.6179.5000110.8S372 F373 E374L370-S372 VanDerWaalsContact C-N 3.26Å; L370-S372 PolarHBondContact O-N 3.26Å; L370-F373 PolarHBondContact O-N 3.29Å; L370-F373 VanDerWaalsContact O-N 3.12Å; L370-E374 WeakPolarHBondContact O-CG 3.35Å; L370-E374 PolarHBondContact O-N 3.4Å
371S95.5Very high94.6Very high33 Ų3369.5 Ų69.523%0.23136%0.361CS..Hα-helixtrans-60.3-35.4177.879.10000112.8M368 T369 R375M368-S371 PolarHBondContact O-N 2.97Å; M368-S371 PolarHBondContact O-OG 2.89Å; T369-S371 VanDerWaalsContact C-N 3.33Å; T369-S371 PolarHBondContact O-N 3.13Å; S371-R375 VanDerWaalsContact O-CG 3.29Å; S371-R375 WeakPolarHBondContact O-CG 3.42Å; S371-R375 PolarHBondContact O-N 3.47Å; S371-R375 VanDerWaalsContact O-N 3.16Å
372S96.4Very high94.3Very high9 Ų970.5 Ų70.56%0.06337%0.371CS..Hα-helixtrans-71.6-39.9175.140.90000112.6G357 M368 T369 L370 R375 A376G357-S372 WeakPolarHBondContact CA-OG 3.49Å; G357-S372 PolarHBondContact N-OG 3.35Å; M368-S372 PolarHBondContact O-N 3.3Å; M368-S372 VanDerWaalsContact O-N 3.09Å; M368-S372 PolarHBondContact O-OG 3.15Å; T369-S372 PolarHBondContact O-N 3.16Å; T369-S372 PolarHBondContact O-OG 3.4Å; L370-S372 VanDerWaalsContact C-N 3.26Å; L370-S372 PolarHBondContact O-N 3.26Å; S372-R375 PolarHBondContact O-N 3.03Å; S372-A376 PolarHBondContact O-N 2.66Å
373F96.6Very high94.2Very high4 Ų470.2 Ų70.22%0.01838%0.377CS..Hα-helixtrans-68.7-38.6176.3-71.9-62.3000112.5N354 G357 L358 T369 L370 R375 A376 L377 V389 N392 I393 V396N354-F373 WeakPolarHBondContact OD1-CE1 3.35Å; G357-F373 VanDerWaalsContact C-CZ 3.42Å; L358-F373 HydrophobicContact CD2-CZ 4.24Å; L358-F373 HydrophobicContact CG-CZ 4.27Å; T369-F373 WeakPolarHBondContact O-CD2 3.26Å; T369-F373 PolarHBondContact O-N 3.08Å; T369-F373 VanDerWaalsContact O-N 3.11Å; L370-F373 PolarHBondContact O-N 3.29Å; L370-F373 VanDerWaalsContact O-N 3.12Å; F373-R375 VanDerWaalsContact C-N 3.3Å; F373-R375 PolarHBondContact O-N 3.17Å; F373-A376 WeakPolarHBondContact O-CB 3.24Å; F373-A376 PolarHBondContact O-N 3.04Å; F373-A376 VanDerWaalsContact O-N 3.15Å; F373-L377 PolarHBondContact O-N 2.83Å; F373-V389 HydrophobicContact CD1-CG1 4.3Å; F373-N392 HydrophobicContact CE1-CB 4Å; F373-N392 HydrophobicContact CZ-CB 4.48Å; F373-I393 HydrophobicContact CB-CD1 4.02Å; F373-I393 HydrophobicContact CB-CG1 3.9Å; F373-I393 HydrophobicContact CD1-CG1 3.91Å; F373-I393 HydrophobicContact CD2-CG1 4.31Å; F373-I393 HydrophobicContact CG-CD1 4.42Å; F373-I393 HydrophobicContact CG-CG1 3.79Å; F373-V396 HydrophobicContact CE2-CG2 3.73Å; F373-V396 HydrophobicContact CZ-CG2 3.94Å
374E95.6Very high93.9Very high134 Ų13475.4 Ų75.463%0.62640%0.4SS*.Hα-helixtrans-59.3-42.6172.8-73.9176.517700111.5L370 L377 A378L370-E374 WeakPolarHBondContact O-CG 3.35Å; L370-E374 PolarHBondContact O-N 3.4Å; E374-L377 PolarHBondContact O-N 2.95Å; E374-A378 PolarHBondContact O-N 3.27Å
375R95.8Very high93.7Very high118 Ų11870.5 Ų70.545%0.44538%0.377SS..Hα-helixtrans-66.5-39.1173.6-72.7177.5-169.7-174.56.3112.3Y353 S371 S372 F373 A378 L379Y353-R375 HydrophobicContact CD1-CB 3.88Å; Y353-R375 HydrophobicContact CD2-CB 4.38Å; Y353-R375 HydrophobicContact CE1-CB 4.12Å; Y353-R375 HydrophobicContact CG-CB 4.03Å; S371-R375 VanDerWaalsContact O-CG 3.29Å; S371-R375 WeakPolarHBondContact O-CG 3.42Å; S371-R375 PolarHBondContact O-N 3.47Å; S371-R375 VanDerWaalsContact O-N 3.16Å; S372-R375 PolarHBondContact O-N 3.03Å; F373-R375 VanDerWaalsContact C-N 3.3Å; F373-R375 PolarHBondContact O-N 3.17Å; R375-A378 PolarHBondContact O-N 2.92Å; R375-L379 VanDerWaalsContact O-CG 3.27Å; R375-L379 WeakPolarHBondContact O-CG 3.27Å; R375-L379 PolarHBondContact O-N 3.26Å
376A95.9Very high93.7Very high0 Ų069 Ų690%037%0.37CS..Hα-helixtrans-58.2-50.4175.100000110.2C350 N354 S372 F373 A378 L379 V380 V389C350-A376 PolarHBondContact SG-O 2.73Å; C350-A376 VanDerWaalsContact SG-O 3.41Å; N354-A376 HydrophobicContact CB-CB 4.41Å; S372-A376 PolarHBondContact O-N 2.66Å; F373-A376 WeakPolarHBondContact O-CB 3.24Å; F373-A376 PolarHBondContact O-N 3.04Å; F373-A376 VanDerWaalsContact O-N 3.15Å; A376-A378 VanDerWaalsContact C-N 3.28Å; A376-A378 PolarHBondContact O-N 3.07Å; A376-L379 PolarHBondContact O-N 2.9Å; A376-V380 WeakPolarHBondContact O-CG2 3.44Å; A376-V380 PolarHBondContact O-N 3.43Å; A376-V389 HydrophobicContact CB-CG1 4.06Å; A376-V389 HydrophobicContact CB-CG2 4Å
377L95.1Very high93.8Very high45 Ų4562.8 Ų62.824%0.23635%0.345CS..Hα-helixtrans-59.1-34.8177.1-72176000113.3F373 E374 L379 Q386 V389 W390 I393F373-L377 PolarHBondContact O-N 2.83Å; E374-L377 PolarHBondContact O-N 2.95Å; L377-L379 VanDerWaalsContact C-N 3.28Å; L377-L379 PolarHBondContact O-N 3.01Å; L377-Q386 HydrophobicContact CD2-CG 4.21Å; L377-V389 HydrophobicContact CD2-CB 3.98Å; L377-V389 HydrophobicContact CD2-CG1 3.56Å; L377-V389 HydrophobicContact CG-CG1 3.68Å; L377-W390 HydrophobicContact CD1-CH2 4.06Å; L377-W390 HydrophobicContact CD1-CZ2 3.81Å; L377-W390 HydrophobicContact CD2-CD2 4.5Å; L377-W390 HydrophobicContact CD2-CZ2 4.43Å; L377-I393 HydrophobicContact CD1-CD1 3.94Å; L377-I393 HydrophobicContact CG-CD1 4.47Å
378A95.7Very high93.9Very high82 Ų8258.6 Ų58.668%0.67832%0.323SS*.Hα-helixtrans-71.4-19.8176.700000114E374 R375 A376E374-A378 PolarHBondContact O-N 3.27Å; R375-A378 PolarHBondContact O-N 2.92Å; A376-A378 VanDerWaalsContact C-N 3.28Å; A376-A378 PolarHBondContact O-N 3.07Å
379L94.1Very high94.1Very high48 Ų4854.2 Ų54.225%0.25130%0.301SS..THydrogen-bonded Turntrans-1073.2-176.5-61.2176.1000114.1Y348 C350 Y353 R375 A376 L377 A381Y348-L379 HydrophobicContact CD1-CD1 3.75Å; Y348-L379 HydrophobicContact CD1-CD2 3.9Å; Y348-L379 HydrophobicContact CD1-CG 4.47Å; Y348-L379 HydrophobicContact CD2-CD1 4.34Å; Y348-L379 HydrophobicContact CE1-CD1 3.42Å; Y348-L379 VanDerWaalsContact CE1-CD1 3.42Å; Y348-L379 HydrophobicContact CE1-CD2 3.15Å; Y348-L379 HydrophobicContact CE1-CG 3.86Å; Y348-L379 HydrophobicContact CE2-CD1 3.99Å; Y348-L379 HydrophobicContact CG-CD1 4.19Å; Y348-L379 VanDerWaalsContact CZ-CD1 3.49Å; C350-L379 HydrophobicContact CB-CB 4.3Å; Y353-L379 HydrophobicContact CD2-CD1 3.63Å; Y353-L379 HydrophobicContact CE2-CD1 3.76Å; R375-L379 VanDerWaalsContact O-CG 3.27Å; R375-L379 WeakPolarHBondContact O-CG 3.27Å; R375-L379 PolarHBondContact O-N 3.26Å; A376-L379 PolarHBondContact O-N 2.9Å; L377-L379 VanDerWaalsContact C-N 3.28Å; L377-L379 PolarHBondContact O-N 3.01Å; L379-A381 PolarHBondContact O-N 3.19Å
380V93.3Very high94.2Very high36 Ų3656.7 Ų56.722%0.21831%0.31CS..  trans-56.1129.5177.5168.80000110.2A376 S382 E385 Q386A376-V380 WeakPolarHBondContact O-CG2 3.44Å; A376-V380 PolarHBondContact O-N 3.43Å; V380-S382 WeakPolarHBondContact CG1-O 3.43Å; V380-E385 HydrophobicContact CG1-CB 4.45Å; V380-Q386 HydrophobicContact CG1-CB 3.72Å; V380-Q386 HydrophobicContact CG1-CG 4.2Å; V380-Q386 HydrophobicContact CG2-CB 4.31Å; V380-Q386 HydrophobicContact CG2-CG 4.33Å
381A89.6Confident94.4Very high94 Ų9452.7 Ų52.778%0.77729%0.288SS*.  trans-106.5-18.5173.200000113.1L379 E385L379-A381 PolarHBondContact O-N 3.19Å; A381-E385 PolarHBondContact N-OE2 3.37Å; A381-E385 VanDerWaalsContact N-OE2 3.15Å
382S90.4Very high94.5Very high41 Ų4152.2 Ų52.229%0.28728%0.283SS..SBendtrans-137.3152-177.167.10000112.7V380 E384 E385 Q386V380-S382 WeakPolarHBondContact CG1-O 3.43Å; S382-E384 PolarHBondContact O-N 2.94Å; S382-E385 PolarHBondContact O-N 3.44Å; S382-E385 WeakPolarHBondContact OG-CB 3.49Å; S382-E385 WeakPolarHBondContact OG-CG 3.48Å; S382-E385 PolarHBondContact OG-N 3.14Å; S382-Q386 PolarHBondContact O-N 2.89Å; S382-Q386 VanDerWaalsContact O-N 3.07Å
383D91.6Very high94.5Very high107 Ų10753 Ų5357%0.57229%0.286SS*.Hα-helixtrans-63.3-30.8177.9-60.2-23.8000112Q386 A387D383-Q386 WeakPolarHBondContact O-CB 3.47Å; D383-Q386 PolarHBondContact O-N 3.3Å; D383-A387 PolarHBondContact O-N 3.47Å
384E89.4Confident94.5Very high119 Ų11952.8 Ų52.856%0.55629%0.285SS*.Hα-helixtrans-63.1-48.4174.2-66.7176.3-174.700111.5S382 Q386 A387 D388S382-E384 PolarHBondContact O-N 2.94Å; E384-Q386 VanDerWaalsContact C-N 3.25Å; E384-Q386 PolarHBondContact O-N 3.04Å; E384-A387 WeakPolarHBondContact O-CB 3.41Å; E384-A387 PolarHBondContact O-N 3.48Å; E384-D388 PolarHBondContact O-N 3.38Å
385E92Very high94.5Very high43 Ų4348.7 Ų48.720%0.20127%0.266CS..Hα-helixtrans-61.2-38175.3-74.3171.7-17300111.3Q351 V380 A381 S382 D388 V389Q351-E385 VanDerWaalsContact NE2-CD 3.25Å; Q351-E385 PolarHBondContact NE2-OE1 3.5Å; V380-E385 HydrophobicContact CG1-CB 4.45Å; A381-E385 PolarHBondContact N-OE2 3.37Å; A381-E385 VanDerWaalsContact N-OE2 3.15Å; S382-E385 PolarHBondContact O-N 3.44Å; S382-E385 WeakPolarHBondContact OG-CB 3.49Å; S382-E385 WeakPolarHBondContact OG-CG 3.48Å; S382-E385 PolarHBondContact OG-N 3.14Å; E385-D388 PolarHBondContact O-N 3.09Å; E385-V389 VanDerWaalsContact O-CG2 3.29Å; E385-V389 WeakPolarHBondContact O-CG2 3.16Å; E385-V389 PolarHBondContact O-N 3.49Å
386Q94.3Very high94.5Very high46 Ų4643.3 Ų43.322%0.21525%0.246CC..Hα-helixtrans-62.8-44.6176.8-156.3169.51.400111.6L377 V380 S382 D383 E384 V389 W390 F416L377-Q386 HydrophobicContact CD2-CG 4.21Å; V380-Q386 HydrophobicContact CG1-CB 3.72Å; V380-Q386 HydrophobicContact CG1-CG 4.2Å; V380-Q386 HydrophobicContact CG2-CB 4.31Å; V380-Q386 HydrophobicContact CG2-CG 4.33Å; S382-Q386 PolarHBondContact O-N 2.89Å; S382-Q386 VanDerWaalsContact O-N 3.07Å; D383-Q386 WeakPolarHBondContact O-CB 3.47Å; D383-Q386 PolarHBondContact O-N 3.3Å; E384-Q386 VanDerWaalsContact C-N 3.25Å; E384-Q386 PolarHBondContact O-N 3.04Å; Q386-V389 PolarHBondContact O-N 3.17Å; Q386-W390 PolarHBondContact O-N 2.97Å; Q386-F416 HydrophobicContact CB-CG 4.38Å; Q386-F416 VanDerWaalsContact CD-CE1 3.5Å; Q386-F416 HydrophobicContact CG-CD1 4.46Å; Q386-F416 HydrophobicContact CG-CD2 4.19Å; Q386-F416 HydrophobicContact CG-CE1 4.44Å; Q386-F416 HydrophobicContact CG-CE2 4.19Å; Q386-F416 HydrophobicContact CG-CG 4.36Å; Q386-F416 HydrophobicContact CG-CZ 4.32Å
387A95.5Very high94.5Very high0 Ų043.4 Ų43.40%025%0.247CC..Hα-helixtrans-60.8-45.4176.900000111.1D383 E384 V389 W390 Y391 T413 F416 N417D383-A387 PolarHBondContact O-N 3.47Å; E384-A387 WeakPolarHBondContact O-CB 3.41Å; E384-A387 PolarHBondContact O-N 3.48Å; A387-V389 VanDerWaalsContact C-N 3.33Å; A387-V389 PolarHBondContact O-N 3.35Å; A387-W390 PolarHBondContact O-N 3.25Å; A387-Y391 VanDerWaalsContact O-CB 3.32Å; A387-Y391 WeakPolarHBondContact O-CB 3.02Å; A387-Y391 PolarHBondContact O-N 3.36Å; A387-T413 VanDerWaalsContact O-CG2 3.29Å; A387-T413 WeakPolarHBondContact O-CG2 3.48Å; A387-F416 HydrophobicContact CB-CB 4.05Å; A387-N417 HydrophobicContact CB-CB 3.49Å; A387-N417 VanDerWaalsContact CB-CB 3.49Å
388D94.8Very high94.5Very high69 Ų6944 Ų4437%0.36925%0.252SS..Hα-helixtrans-64.1-37.1179.5-67.5-16.3000112.4E384 E385 Y391 N392 H420E384-D388 PolarHBondContact O-N 3.38Å; E385-D388 PolarHBondContact O-N 3.09Å; D388-Y391 WeakPolarHBondContact O-CB 3.35Å; D388-Y391 PolarHBondContact O-N 3.47Å; D388-N392 VanDerWaalsContact O-CG 3.28Å; D388-N392 PolarHBondContact O-N 2.59Å; D388-N392 PolarHBondContact O-ND2 3.17Å; D388-H420 IonicContact OD1-CE1 2.74Å; D388-H420 PolarHBondContact OD1-CE1 2.97Å; D388-H420 IonicContact OD1-ND1 3.46Å
389V96.9Very high94.4Very high0 Ų042.7 Ų42.70%025%0.247CC..Hα-helixtrans-67-46.6175.41760000111N354 F373 A376 L377 E385 Q386 A387 Y391 N392 I393N354-V389 HydrophobicContact CB-CG2 4.15Å; F373-V389 HydrophobicContact CD1-CG1 4.3Å; A376-V389 HydrophobicContact CB-CG1 4.06Å; A376-V389 HydrophobicContact CB-CG2 4Å; L377-V389 HydrophobicContact CD2-CB 3.98Å; L377-V389 HydrophobicContact CD2-CG1 3.56Å; L377-V389 HydrophobicContact CG-CG1 3.68Å; E385-V389 VanDerWaalsContact O-CG2 3.29Å; E385-V389 WeakPolarHBondContact O-CG2 3.16Å; E385-V389 PolarHBondContact O-N 3.49Å; Q386-V389 PolarHBondContact O-N 3.17Å; A387-V389 VanDerWaalsContact C-N 3.33Å; A387-V389 PolarHBondContact O-N 3.35Å; V389-Y391 PolarHBondContact O-N 3.29Å; V389-N392 PolarHBondContact O-N 3.28Å; V389-I393 HydrophobicContact CG1-CD1 3.98Å; V389-I393 VanDerWaalsContact O-CG1 3.31Å; V389-I393 WeakPolarHBondContact O-CG1 3.36Å; V389-I393 PolarHBondContact O-N 3.24Å
390W97.4Very high94.3Very high57 Ų5745.2 Ų45.222%0.21626%0.259CS..Hα-helixtrans-62-32.8175.9-79.7117.8000112.6L377 Q386 A387 I393 G394 L412 T413 F416L377-W390 HydrophobicContact CD1-CH2 4.06Å; L377-W390 HydrophobicContact CD1-CZ2 3.81Å; L377-W390 HydrophobicContact CD2-CD2 4.5Å; L377-W390 HydrophobicContact CD2-CZ2 4.43Å; Q386-W390 PolarHBondContact O-N 2.97Å; A387-W390 PolarHBondContact O-N 3.25Å; W390-I393 HydrophobicContact CD2-CD1 4.45Å; W390-I393 HydrophobicContact CE3-CB 4.5Å; W390-I393 HydrophobicContact CE3-CD1 3.9Å; W390-I393 HydrophobicContact CZ3-CD1 4.13Å; W390-I393 PolarHBondContact O-N 2.77Å; W390-G394 PolarHBondContact O-N 3.34Å; W390-L412 HydrophobicContact CD2-CB 4.36Å; W390-L412 HydrophobicContact CD2-CD1 4.12Å; W390-L412 HydrophobicContact CE3-CD1 4.04Å; W390-L412 HydrophobicContact CG-CB 4.26Å; W390-L412 HydrophobicContact CH2-CD1 4.13Å; W390-L412 HydrophobicContact CZ2-CD1 4.19Å; W390-L412 HydrophobicContact CZ3-CD1 4.05Å; W390-T413 VanDerWaalsContact C-CG2 3.43Å; W390-T413 HydrophobicContact CB-CG2 3.57Å; W390-F416 AromaticContact CD1-CD2 3.72Å; W390-F416 AromaticContact CD1-CE2 3.56Å; W390-F416 AromaticContact NE1-CE2 3.45Å
391Y97.4Very high94.4Very high21 Ų2145.6 Ų45.68%0.08227%0.27CS..Hα-helixtrans-65.7-46.1177.5175-105.4000110.8A387 D388 V389 G394 H395 F410 H420 E422 A423 N426A387-Y391 VanDerWaalsContact O-CB 3.32Å; A387-Y391 WeakPolarHBondContact O-CB 3.02Å; A387-Y391 PolarHBondContact O-N 3.36Å; D388-Y391 WeakPolarHBondContact O-CB 3.35Å; D388-Y391 PolarHBondContact O-N 3.47Å; V389-Y391 PolarHBondContact O-N 3.29Å; Y391-G394 WeakPolarHBondContact O-CA 3.32Å; Y391-G394 PolarHBondContact O-N 3.26Å; Y391-G394 VanDerWaalsContact O-N 3.08Å; Y391-H395 AromaticContact CD1-CD2 3.89Å; Y391-H395 AromaticContact CE1-CD2 3.47Å; Y391-H395 VanDerWaalsContact CE1-CD2 3.47Å; Y391-H395 WeakPolarHBondContact CE1-CD2 3.11Å; Y391-H395 AromaticContact CE1-NE2 3.23Å; Y391-H395 WeakPolarHBondContact CE1-NE2 3.28Å; Y391-H395 AromaticContact CE2-NE2 3.65Å; Y391-H395 AromaticContact CZ-CD2 3.66Å; Y391-H395 AromaticContact CZ-NE2 2.97Å; Y391-H395 PolarHBondContact O-N 2.93Å; Y391-H395 PolarHBondContact OH-NE2 3.01Å; Y391-F410 AromaticContact CD2-CD1 3.8Å; Y391-F410 HydrophobicContact CD2-CD1 3.8Å; Y391-F410 AromaticContact CD2-CE1 3.66Å; Y391-F410 HydrophobicContact CD2-CE1 3.66Å; Y391-F410 HydrophobicContact CE2-CD1 4.29Å; Y391-F410 AromaticContact CE2-CE1 3.89Å; Y391-F410 HydrophobicContact CE2-CE1 3.89Å; Y391-F410 HydrophobicContact CG-CE1 4.49Å; Y391-H420 AromaticContact CD2-NE2 3.45Å; Y391-H420 WeakPolarHBondContact CD2-NE2 3.32Å; Y391-H420 AromaticContact CE2-NE2 3.79Å; Y391-H420 AromaticContact CG-NE2 3.59Å; Y391-E422 HydrophobicContact CE1-CB 4.4Å; Y391-E422 WeakPolarHBondContact CE1-OE2 3.4Å; Y391-E422 HydrophobicContact CE2-CB 3.71Å; Y391-E422 WeakPolarHBondContact OH-CB 3.29Å; Y391-E422 PolarHBondContact OH-OE2 3.19Å; Y391-A423 HydrophobicContact CD2-CB 4.12Å; Y391-A423 HydrophobicContact CE2-CB 4.44Å; Y391-N426 WeakPolarHBondContact CE2-ND2 3.47Å; Y391-N426 PolarHBondContact OH-ND2 3.48Å
392N96.9Very high94.7Very high24 Ų2445.3 Ų45.313%0.12826%0.256CS..Hα-helixtrans-66.4-37.2176.3-70.8-19000112.7N354 L358 F373 D388 V389 G394 H395 V396N354-N392 VanDerWaalsContact CG-ND2 3.26Å; N354-N392 PolarHBondContact ND2-ND2 3.3Å; N354-N392 PolarHBondContact OD1-ND2 3.02Å; L358-N392 HydrophobicContact CD1-CB 4.5Å; L358-N392 HydrophobicContact CD2-CB 3.86Å; L358-N392 HydrophobicContact CG-CB 4.28Å; F373-N392 HydrophobicContact CE1-CB 4Å; F373-N392 HydrophobicContact CZ-CB 4.48Å; D388-N392 VanDerWaalsContact O-CG 3.28Å; D388-N392 PolarHBondContact O-N 2.59Å; D388-N392 PolarHBondContact O-ND2 3.17Å; V389-N392 PolarHBondContact O-N 3.28Å; N392-G394 VanDerWaalsContact C-N 3.27Å; N392-G394 PolarHBondContact O-N 3.16Å; N392-H395 WeakPolarHBondContact O-CB 3.34Å; N392-H395 PolarHBondContact O-N 3.27Å; N392-V396 WeakPolarHBondContact O-CG2 3.13Å; N392-V396 PolarHBondContact O-N 3.13Å
393I96.4Very high94.9Very high24 Ų2445.7 Ų45.712%0.12325%0.254CS..Hα-helixtrans-62.2-38.7170.7-64.8165.5000110.5F373 L377 V389 W390 H395 V396 A397F373-I393 HydrophobicContact CB-CD1 4.02Å; F373-I393 HydrophobicContact CB-CG1 3.9Å; F373-I393 HydrophobicContact CD1-CG1 3.91Å; F373-I393 HydrophobicContact CD2-CG1 4.31Å; F373-I393 HydrophobicContact CG-CD1 4.42Å; F373-I393 HydrophobicContact CG-CG1 3.79Å; L377-I393 HydrophobicContact CD1-CD1 3.94Å; L377-I393 HydrophobicContact CG-CD1 4.47Å; V389-I393 HydrophobicContact CG1-CD1 3.98Å; V389-I393 VanDerWaalsContact O-CG1 3.31Å; V389-I393 WeakPolarHBondContact O-CG1 3.36Å; V389-I393 PolarHBondContact O-N 3.24Å; W390-I393 HydrophobicContact CD2-CD1 4.45Å; W390-I393 HydrophobicContact CE3-CB 4.5Å; W390-I393 HydrophobicContact CE3-CD1 3.9Å; W390-I393 HydrophobicContact CZ3-CD1 4.13Å; W390-I393 PolarHBondContact O-N 2.77Å; I393-H395 VanDerWaalsContact C-N 3.35Å; I393-H395 PolarHBondContact O-N 3.36Å; I393-V396 WeakPolarHBondContact O-CB 3.44Å; I393-V396 PolarHBondContact O-N 2.98Å; I393-A397 PolarHBondContact O-N 3.21Å
394G96.3Very high95.1Very high0 Ų045.6 Ų45.60%026%0.258CS..Hα-helixtrans-58.4-44.5173.700000112.4W390 Y391 N392 A397 V398W390-G394 PolarHBondContact O-N 3.34Å; Y391-G394 WeakPolarHBondContact O-CA 3.32Å; Y391-G394 PolarHBondContact O-N 3.26Å; Y391-G394 VanDerWaalsContact O-N 3.08Å; N392-G394 VanDerWaalsContact C-N 3.27Å; N392-G394 PolarHBondContact O-N 3.16Å; G394-A397 WeakPolarHBondContact O-CB 3.44Å; G394-A397 PolarHBondContact O-N 2.97Å; G394-V398 WeakPolarHBondContact O-CG2 3.49Å; G394-V398 PolarHBondContact O-N 3.46Å
395H95.4Very high95.5Very high49 Ų4943.3 Ų43.323%0.22725%0.249CC..Hα-helixtrans-61.5-43173.8-81.8-55.5000113.2Y391 N392 I393 A397 V398 G399 N426Y391-H395 AromaticContact CD1-CD2 3.89Å; Y391-H395 AromaticContact CE1-CD2 3.47Å; Y391-H395 VanDerWaalsContact CE1-CD2 3.47Å; Y391-H395 WeakPolarHBondContact CE1-CD2 3.11Å; Y391-H395 AromaticContact CE1-NE2 3.23Å; Y391-H395 WeakPolarHBondContact CE1-NE2 3.28Å; Y391-H395 AromaticContact CE2-NE2 3.65Å; Y391-H395 AromaticContact CZ-CD2 3.66Å; Y391-H395 AromaticContact CZ-NE2 2.97Å; Y391-H395 PolarHBondContact O-N 2.93Å; Y391-H395 PolarHBondContact OH-NE2 3.01Å; N392-H395 WeakPolarHBondContact O-CB 3.34Å; N392-H395 PolarHBondContact O-N 3.27Å; I393-H395 VanDerWaalsContact C-N 3.35Å; I393-H395 PolarHBondContact O-N 3.36Å; H395-A397 VanDerWaalsContact C-N 3.31Å; H395-A397 PolarHBondContact O-N 3.4Å; H395-V398 PolarHBondContact O-N 2.9Å; H395-G399 PolarHBondContact O-N 3.26Å; H395-N426 PolarHBondContact CE1-ND2 3.37Å; H395-N426 PolarHBondContact NE2-ND2 2.89Å
396V95.8Very high95.7Very high4 Ų441.3 Ų41.32%0.02424%0.239CC..Hα-helixtrans-59.7-43.9174.1169.70000110.7F361 F373 N392 I393 V398 G399 I400F361-V396 HydrophobicContact CB-CG2 4.14Å; F361-V396 HydrophobicContact CD1-CG2 3.92Å; F361-V396 HydrophobicContact CD2-CB 4.4Å; F361-V396 HydrophobicContact CD2-CG1 3.7Å; F361-V396 HydrophobicContact CD2-CG2 4.18Å; F361-V396 HydrophobicContact CE1-CG2 4.37Å; F361-V396 HydrophobicContact CE2-CB 4.44Å; F361-V396 HydrophobicContact CE2-CG1 3.73Å; F361-V396 HydrophobicContact CG-CB 4.46Å; F361-V396 HydrophobicContact CG-CG1 4.2Å; F361-V396 HydrophobicContact CG-CG2 3.81Å; F361-V396 HydrophobicContact CZ-CG1 4.25Å; F373-V396 HydrophobicContact CE2-CG2 3.73Å; F373-V396 HydrophobicContact CZ-CG2 3.94Å; N392-V396 WeakPolarHBondContact O-CG2 3.13Å; N392-V396 PolarHBondContact O-N 3.13Å; I393-V396 WeakPolarHBondContact O-CB 3.44Å; I393-V396 PolarHBondContact O-N 2.98Å; V396-V398 PolarHBondContact O-N 2.88Å; V396-G399 PolarHBondContact O-N 3.23Å; V396-I400 HydrophobicContact CG1-CD1 3.89Å; V396-I400 VanDerWaalsContact O-CG1 3.32Å; V396-I400 WeakPolarHBondContact O-CG1 3.48Å; V396-I400 PolarHBondContact O-N 2.79Å
397A96.1Very high95.8Very high2 Ų240.8 Ų40.82%0.01724%0.236CC..Hα-helixtrans-63.8-39.5176.700000112.7I393 G394 H395 G399 I400 G401 D402 L405 A406I393-A397 PolarHBondContact O-N 3.21Å; G394-A397 WeakPolarHBondContact O-CB 3.44Å; G394-A397 PolarHBondContact O-N 2.97Å; H395-A397 VanDerWaalsContact C-N 3.31Å; H395-A397 PolarHBondContact O-N 3.4Å; A397-G399 VanDerWaalsContact C-N 3.33Å; A397-I400 PolarHBondContact O-N 3.03Å; A397-G401 PolarHBondContact O-N 3.49Å; A397-D402 PolarHBondContact O-N 3.27Å; A397-L405 HydrophobicContact CB-CB 4.13Å; A397-L405 HydrophobicContact CB-CD2 3.88Å; A397-L405 HydrophobicContact CB-CG 3.88Å; A397-A406 HydrophobicContact CB-CB 3.94Å
398V95.8Very high95.9Very high59 Ų5946.6 Ų46.636%0.35826%0.263SS..Hα-helixtrans-61.3-43.4172174.30000110.8G394 H395 V396 I400 G401 A406 F410G394-V398 WeakPolarHBondContact O-CG2 3.49Å; G394-V398 PolarHBondContact O-N 3.46Å; H395-V398 PolarHBondContact O-N 2.9Å; V396-V398 PolarHBondContact O-N 2.88Å; V398-I400 VanDerWaalsContact C-N 3.33Å; V398-I400 PolarHBondContact O-N 3.22Å; V398-G401 PolarHBondContact O-N 3.35Å; V398-G401 VanDerWaalsContact O-N 3.09Å; V398-A406 HydrophobicContact CG2-CB 3.48Å; V398-A406 VanDerWaalsContact CG2-CB 3.48Å; V398-F410 HydrophobicContact CG2-CE2 4.04Å; V398-F410 HydrophobicContact CG2-CZ 4.28Å
399G92.7Very high96Very high54 Ų5443.4 Ų43.456%0.55725%0.246SC*.Hα-helixtrans-66-32.1178.500000113.8H395 V396 A397 G401H395-G399 PolarHBondContact O-N 3.26Å; V396-G399 PolarHBondContact O-N 3.23Å; A397-G399 VanDerWaalsContact C-N 3.33Å; G399-G401 VanDerWaalsContact C-N 3.32Å
400I93.6Very high96.1Very high101 Ų10143.4 Ų43.452%0.51825%0.246SC..Hα-helixtrans-71.7-30.4171.6-66.5164.7000111.1F361 V396 A397 V398F361-I400 HydrophobicContact CE2-CG1 4.06Å; F361-I400 HydrophobicContact CZ-CG1 4.47Å; V396-I400 HydrophobicContact CG1-CD1 3.89Å; V396-I400 VanDerWaalsContact O-CG1 3.32Å; V396-I400 WeakPolarHBondContact O-CG1 3.48Å; V396-I400 PolarHBondContact O-N 2.79Å; A397-I400 PolarHBondContact O-N 3.03Å; V398-I400 VanDerWaalsContact C-N 3.33Å; V398-I400 PolarHBondContact O-N 3.22Å
401G94.1Very high96Very high44 Ų4445.6 Ų45.645%0.45426%0.257SS..THydrogen-bonded Turntrans104.9-1.5-178.400000114.2A397 V398 G399 L403A397-G401 PolarHBondContact O-N 3.49Å; V398-G401 PolarHBondContact O-N 3.35Å; V398-G401 VanDerWaalsContact O-N 3.09Å; G399-G401 VanDerWaalsContact C-N 3.32Å; G401-L403 PolarHBondContact O-N 2.94Å
402D95.9Very high96Very high87 Ų8747.9 Ų47.947%0.46527%0.27SS..  trans-81.179.6179.9-73.2-24.9000111.1A397 T404 L405 A406A397-D402 PolarHBondContact O-N 3.27Å; D402-T404 PolarHBondContact O-N 2.99Å; D402-L405 HydrophobicContact CB-CB 4.15Å; D402-L405 PolarHBondContact O-N 2.75Å; D402-A406 PolarHBondContact O-N 2.67Å
403L95.8Very high96Very high50 Ų5046.7 Ų46.726%0.26226%0.264SS..Hα-helixtrans-63.1-26.6-176.2-55.1179.6000113.7G401 Y407 L430G401-L403 PolarHBondContact O-N 2.94Å; L403-Y407 VanDerWaalsContact O-CB 3.25Å; L403-Y407 WeakPolarHBondContact O-CB 3.39Å; L403-Y407 PolarHBondContact O-N 3.37Å; L403-L430 HydrophobicContact CB-CD2 4.49Å; L403-L430 HydrophobicContact CD2-CD2 3.92Å
404T95.8Very high96Very high104 Ų10446.5 Ų46.564%0.63826%0.263SS*.Hα-helixtrans-70.4-43.7177.649.80000111.3D402 Y407 Q408D402-T404 PolarHBondContact O-N 2.99Å; T404-Y407 PolarHBondContact O-N 3.14Å; T404-Q408 WeakPolarHBondContact O-CG 3.48Å; T404-Q408 PolarHBondContact O-N 3.14Å; T404-Q408 VanDerWaalsContact O-N 3.12Å
405L96.3Very high96Very high72 Ų7249.9 Ų49.938%0.37729%0.291SS..Hα-helixtrans-65.3-48.3174.9179.362.3000110.1A397 D402 Y407 Q408 C409A397-L405 HydrophobicContact CB-CB 4.13Å; A397-L405 HydrophobicContact CB-CD2 3.88Å; A397-L405 HydrophobicContact CB-CG 3.88Å; D402-L405 HydrophobicContact CB-CB 4.15Å; D402-L405 PolarHBondContact O-N 2.75Å; L405-Y407 VanDerWaalsContact C-N 3.26Å; L405-Y407 PolarHBondContact O-N 2.87Å; L405-Q408 WeakPolarHBondContact O-CB 3.35Å; L405-Q408 PolarHBondContact O-N 3.46Å; L405-C409 PolarHBondContact O-N 3.39Å; L405-C409 PolarHBondContact O-SG 2.92Å
406A97.1Very high96Very high0 Ų051 Ų510%030%0.296CS..Hα-helixtrans-53.5-44.7176.100000112.2A397 V398 D402 Q408 C409 F410 L430A397-A406 HydrophobicContact CB-CB 3.94Å; V398-A406 HydrophobicContact CG2-CB 3.48Å; V398-A406 VanDerWaalsContact CG2-CB 3.48Å; D402-A406 PolarHBondContact O-N 2.67Å; A406-Q408 PolarHBondContact O-N 3.02Å; A406-C409 PolarHBondContact O-N 3.41Å; A406-F410 HydrophobicContact CB-CE2 4.23Å; A406-F410 WeakPolarHBondContact O-CD2 3.49Å; A406-F410 WeakPolarHBondContact O-CG 3.2Å; A406-F410 PolarHBondContact O-N 2.92Å; A406-L430 HydrophobicContact CB-CD1 4.18Å
407Y96.8Very high95.8Very high36 Ų3652.5 Ų52.514%0.14130%0.304CS..Hα-helixtrans-62-39.9176.9-176.4-99000113.2L403 T404 L405 K411 L427 L430 E431 K434L403-Y407 VanDerWaalsContact O-CB 3.25Å; L403-Y407 WeakPolarHBondContact O-CB 3.39Å; L403-Y407 PolarHBondContact O-N 3.37Å; T404-Y407 PolarHBondContact O-N 3.14Å; L405-Y407 VanDerWaalsContact C-N 3.26Å; L405-Y407 PolarHBondContact O-N 2.87Å; Y407-K411 HydrophobicContact CD1-CD 4.26Å; Y407-K411 HydrophobicContact CE1-CD 3.71Å; Y407-K411 HydrophobicContact CE1-CG 4.46Å; Y407-K411 VanDerWaalsContact CE1-NZ 3.29Å; Y407-K411 WeakPolarHBondContact O-CG 3.44Å; Y407-K411 PolarHBondContact O-N 3.45Å; Y407-K411 VanDerWaalsContact O-N 3.1Å; Y407-K411 WeakPolarHBondContact OH-CE 3.19Å; Y407-K411 PolarHBondContact OH-NZ 3.35Å; Y407-L427 HydrophobicContact CD2-CD2 3.48Å; Y407-L427 VanDerWaalsContact CD2-CD2 3.48Å; Y407-L427 HydrophobicContact CE2-CD2 3.68Å; Y407-L427 HydrophobicContact CG-CD2 4.25Å; Y407-L430 HydrophobicContact CD2-CD1 4.45Å; Y407-E431 HydrophobicContact CE2-CG 4.2Å; Y407-E431 WeakPolarHBondContact CE2-OE1 3.4Å; Y407-E431 PolarHBondContact OH-OE1 3.17Å; Y407-K434 VanDerWaalsContact CD2-NZ 3.32Å
408Q97.1Very high95.7Very high121 Ų12157.5 Ų57.557%0.56533%0.33SS*.Hα-helixtrans-67.6-44.5175-71.1176.7-0.100111.2T404 L405 A406 K411 L412T404-Q408 WeakPolarHBondContact O-CG 3.48Å; T404-Q408 PolarHBondContact O-N 3.14Å; T404-Q408 VanDerWaalsContact O-N 3.12Å; L405-Q408 WeakPolarHBondContact O-CB 3.35Å; L405-Q408 PolarHBondContact O-N 3.46Å; A406-Q408 PolarHBondContact O-N 3.02Å; Q408-K411 WeakPolarHBondContact O-CB 3.28Å; Q408-K411 PolarHBondContact O-N 3.35Å; Q408-K411 VanDerWaalsContact O-N 3.13Å; Q408-L412 WeakPolarHBondContact O-CG 3.27Å; Q408-L412 PolarHBondContact O-N 3Å
409C97.3Very high95.6Very high2 Ų260.1 Ų60.11%0.01434%0.342CS..Hα-helixtrans-57.4-52.8177.3-66.70000110.8L405 A406 K411 L412 T413L405-C409 PolarHBondContact O-N 3.39Å; L405-C409 PolarHBondContact O-SG 2.92Å; A406-C409 PolarHBondContact O-N 3.41Å; C409-K411 PolarHBondContact O-N 3.23Å; C409-L412 CarbonylContact O-C 3.58Å; C409-L412 WeakPolarHBondContact O-CA 3.22Å; C409-L412 WeakPolarHBondContact O-CB 3.35Å; C409-L412 PolarHBondContact O-N 3.37Å; C409-T413 WeakPolarHBondContact O-CG2 3.35Å; C409-T413 PolarHBondContact O-N 2.86Å
410F97.6Very high95.7Very high0 Ų058.4 Ų58.40%032%0.319CS..Hα-helixtrans-65.8-23.1177.7-59.4-47.5000113.8Y391 V398 A406 T413 L414 A423 N426 L427 L430Y391-F410 AromaticContact CD2-CD1 3.8Å; Y391-F410 HydrophobicContact CD2-CD1 3.8Å; Y391-F410 AromaticContact CD2-CE1 3.66Å; Y391-F410 HydrophobicContact CD2-CE1 3.66Å; Y391-F410 HydrophobicContact CE2-CD1 4.29Å; Y391-F410 AromaticContact CE2-CE1 3.89Å; Y391-F410 HydrophobicContact CE2-CE1 3.89Å; Y391-F410 HydrophobicContact CG-CE1 4.49Å; V398-F410 HydrophobicContact CG2-CE2 4.04Å; V398-F410 HydrophobicContact CG2-CZ 4.28Å; A406-F410 HydrophobicContact CB-CE2 4.23Å; A406-F410 WeakPolarHBondContact O-CD2 3.49Å; A406-F410 WeakPolarHBondContact O-CG 3.2Å; A406-F410 PolarHBondContact O-N 2.92Å; F410-T413 WeakPolarHBondContact CA-OG1 3.1Å; F410-T413 PolarHBondContact O-OG1 3.34Å; F410-L414 WeakPolarHBondContact O-CG 2.94Å; F410-L414 PolarHBondContact O-N 3.07Å; F410-A423 HydrophobicContact CB-CB 4.49Å; F410-N426 HydrophobicContact CD2-CB 4.03Å; F410-N426 HydrophobicContact CE1-CB 4.18Å; F410-N426 HydrophobicContact CE2-CB 3.66Å; F410-N426 HydrophobicContact CG-CB 4.45Å; F410-N426 HydrophobicContact CZ-CB 3.74Å; F410-L427 HydrophobicContact CB-CD1 3.94Å; F410-L427 HydrophobicContact CB-CD2 3.67Å; F410-L427 HydrophobicContact CB-CG 3.5Å; F410-L427 VanDerWaalsContact CB-CG 3.5Å; F410-L427 HydrophobicContact CD2-CD2 4.49Å; F410-L427 HydrophobicContact CG-CG 4.4Å; F410-L430 HydrophobicContact CD2-CD1 3.75Å; F410-L430 HydrophobicContact CE2-CD1 3.91Å
411K96.8Very high95.7Very high104 Ų10454 Ų5445%0.45230%0.298SS..Hα-helixtrans-72.2-38.3168.3-83.3-170.8169.8-179.70112.3Y407 Q408 C409 T413 L414 A415 L427Y407-K411 HydrophobicContact CD1-CD 4.26Å; Y407-K411 HydrophobicContact CE1-CD 3.71Å; Y407-K411 HydrophobicContact CE1-CG 4.46Å; Y407-K411 VanDerWaalsContact CE1-NZ 3.29Å; Y407-K411 WeakPolarHBondContact O-CG 3.44Å; Y407-K411 PolarHBondContact O-N 3.45Å; Y407-K411 VanDerWaalsContact O-N 3.1Å; Y407-K411 WeakPolarHBondContact OH-CE 3.19Å; Y407-K411 PolarHBondContact OH-NZ 3.35Å; Q408-K411 WeakPolarHBondContact O-CB 3.28Å; Q408-K411 PolarHBondContact O-N 3.35Å; Q408-K411 VanDerWaalsContact O-N 3.13Å; C409-K411 PolarHBondContact O-N 3.23Å; K411-T413 VanDerWaalsContact C-N 3.34Å; K411-L414 PolarHBondContact O-N 2.95Å; K411-A415 PolarHBondContact O-N 3.01Å; K411-L427 HydrophobicContact CG-CD1 4.47Å; K411-L427 HydrophobicContact CG-CD2 4.34Å
412L96.8Very high95.7Very high68 Ų6854.5 Ų54.536%0.35629%0.289SS..Hα-helixtrans-64.7-39.8174.2-68.8172.8000110.9W390 Q408 C409 L414 A415 F416W390-L412 HydrophobicContact CD2-CB 4.36Å; W390-L412 HydrophobicContact CD2-CD1 4.12Å; W390-L412 HydrophobicContact CE3-CD1 4.04Å; W390-L412 HydrophobicContact CG-CB 4.26Å; W390-L412 HydrophobicContact CH2-CD1 4.13Å; W390-L412 HydrophobicContact CZ2-CD1 4.19Å; W390-L412 HydrophobicContact CZ3-CD1 4.05Å; Q408-L412 WeakPolarHBondContact O-CG 3.27Å; Q408-L412 PolarHBondContact O-N 3Å; C409-L412 CarbonylContact O-C 3.58Å; C409-L412 WeakPolarHBondContact O-CA 3.22Å; C409-L412 WeakPolarHBondContact O-CB 3.35Å; C409-L412 PolarHBondContact O-N 3.37Å; L412-L414 VanDerWaalsContact C-N 3.3Å; L412-L414 PolarHBondContact O-N 2.92Å; L412-A415 WeakPolarHBondContact O-CB 3.38Å; L412-A415 PolarHBondContact O-N 3.01Å; L412-A415 VanDerWaalsContact O-N 3.08Å; L412-F416 HydrophobicContact CB-CE2 4.41Å; L412-F416 WeakPolarHBondContact O-CD2 3.36Å; L412-F416 PolarHBondContact O-N 2.85Å; L412-F416 VanDerWaalsContact O-N 3.09Å
413T96.9Very high95.8Very high0 Ų050.4 Ų50.40%027%0.267CS..Hα-helixtrans-57.1-46175.262.90000111.4A387 W390 C409 F410 K411 A415 F416 N417 A423A387-T413 VanDerWaalsContact O-CG2 3.29Å; A387-T413 WeakPolarHBondContact O-CG2 3.48Å; W390-T413 VanDerWaalsContact C-CG2 3.43Å; W390-T413 HydrophobicContact CB-CG2 3.57Å; C409-T413 WeakPolarHBondContact O-CG2 3.35Å; C409-T413 PolarHBondContact O-N 2.86Å; F410-T413 WeakPolarHBondContact CA-OG1 3.1Å; F410-T413 PolarHBondContact O-OG1 3.34Å; K411-T413 VanDerWaalsContact C-N 3.34Å; T413-A415 VanDerWaalsContact C-N 3.31Å; T413-A415 PolarHBondContact O-N 3.42Å; T413-F416 PolarHBondContact O-N 2.86Å; T413-N417 PolarHBondContact O-N 3.11Å; T413-A423 WeakPolarHBondContact OG1-CB 3.42Å
414L96Very high95.8Very high19 Ų1949.9 Ų49.910%0.09926%0.262CS..Hα-helixtrans-66.7-33.3177.4-68.3-176.8000112.4F410 K411 L412 F416 N417 N418 H420 A423 Y424 L427F410-L414 WeakPolarHBondContact O-CG 2.94Å; F410-L414 PolarHBondContact O-N 3.07Å; K411-L414 PolarHBondContact O-N 2.95Å; L412-L414 VanDerWaalsContact C-N 3.3Å; L412-L414 PolarHBondContact O-N 2.92Å; L414-F416 VanDerWaalsContact C-N 3.31Å; L414-F416 PolarHBondContact O-N 3.19Å; L414-N417 WeakPolarHBondContact CA-O 3.43Å; L414-N417 CarbonylContact O-C 3.44Å; L414-N417 VanDerWaalsContact O-C 3.27Å; L414-N418 WeakPolarHBondContact O-CA 3.44Å; L414-N418 PolarHBondContact O-N 3.42Å; L414-N418 PolarHBondContact O-OD1 3.29Å; L414-H420 HydrophobicContact CD2-CB 4.44Å; L414-A423 HydrophobicContact CD2-CB 4.02Å; L414-A423 HydrophobicContact CG-CB 4.23Å; L414-Y424 HydrophobicContact CD1-CD1 3.63Å; L414-Y424 HydrophobicContact CD1-CE1 3.4Å; L414-Y424 HydrophobicContact CD1-CE2 4.5Å; L414-Y424 HydrophobicContact CD1-CG 4.27Å; L414-Y424 HydrophobicContact CD2-CD1 4.15Å; L414-Y424 HydrophobicContact CD2-CD2 3.71Å; L414-Y424 HydrophobicContact CD2-CE1 3.94Å; L414-Y424 HydrophobicContact CD2-CE2 3.47Å; L414-Y424 VanDerWaalsContact CD2-CE2 3.47Å; L414-Y424 HydrophobicContact CD2-CG 4.04Å; L414-Y424 HydrophobicContact CG-CE1 4.31Å; L414-L427 HydrophobicContact CD1-CD1 3.37Å; L414-L427 HydrophobicContact CG-CD1 4.16Å
415A96.3Very high95.9Very high72 Ų7245.5 Ų45.560%0.59523%0.234SC*.Hα-helixtrans-65.8-33.7176.900000112.9K411 L412 T413K411-A415 PolarHBondContact O-N 3.01Å; L412-A415 WeakPolarHBondContact O-CB 3.38Å; L412-A415 PolarHBondContact O-N 3.01Å; L412-A415 VanDerWaalsContact O-N 3.08Å; T413-A415 VanDerWaalsContact C-N 3.31Å; T413-A415 PolarHBondContact O-N 3.42Å
416F94.5Very high95.9Very high72 Ų7243.6 Ų43.632%0.31622%0.224SC..Hα-helixtrans-84.5-42.8175.1-67.8-66.4000112.2Q386 A387 W390 L412 T413 L414Q386-F416 HydrophobicContact CB-CG 4.38Å; Q386-F416 VanDerWaalsContact CD-CE1 3.5Å; Q386-F416 HydrophobicContact CG-CD1 4.46Å; Q386-F416 HydrophobicContact CG-CD2 4.19Å; Q386-F416 HydrophobicContact CG-CE1 4.44Å; Q386-F416 HydrophobicContact CG-CE2 4.19Å; Q386-F416 HydrophobicContact CG-CG 4.36Å; Q386-F416 HydrophobicContact CG-CZ 4.32Å; A387-F416 HydrophobicContact CB-CB 4.05Å; W390-F416 AromaticContact CD1-CD2 3.72Å; W390-F416 AromaticContact CD1-CE2 3.56Å; W390-F416 AromaticContact NE1-CE2 3.45Å; L412-F416 HydrophobicContact CB-CE2 4.41Å; L412-F416 WeakPolarHBondContact O-CD2 3.36Å; L412-F416 PolarHBondContact O-N 2.85Å; L412-F416 VanDerWaalsContact O-N 3.09Å; T413-F416 PolarHBondContact O-N 2.86Å; L414-F416 VanDerWaalsContact C-N 3.31Å; L414-F416 PolarHBondContact O-N 3.19Å
417N93.6Very high95.9Very high36 Ų3643.7 Ų43.719%0.19323%0.225CC..  trans-128.3100177.6-174.6-1.1000110.8A387 T413 L414 D419 H420A387-N417 HydrophobicContact CB-CB 3.49Å; A387-N417 VanDerWaalsContact CB-CB 3.49Å; T413-N417 PolarHBondContact O-N 3.11Å; L414-N417 WeakPolarHBondContact CA-O 3.43Å; L414-N417 CarbonylContact O-C 3.44Å; L414-N417 VanDerWaalsContact O-C 3.27Å; N417-D419 PolarHBondContact O-N 3.32Å; N417-D419 PolarHBondContact OD1-N 2.76Å; N417-H420 HydrophobicContact CB-CB 4.17Å; N417-H420 WeakPolarHBondContact O-CB 3.36Å; N417-H420 PolarHBondContact O-N 3.2Å
418N93.8Very high95.9Very high106 Ų10642 Ų4257%0.56722%0.218SC*.THydrogen-bonded Turntrans-65.5-21.3179.3-68.6-36.6000113.4L414 Y424L414-N418 WeakPolarHBondContact O-CA 3.44Å; L414-N418 PolarHBondContact O-N 3.42Å; L414-N418 PolarHBondContact O-OD1 3.29Å; N418-Y424 WeakPolarHBondContact O-CE2 3.12Å; N418-Y424 PolarHBondContact O-OH 2.91Å; N418-Y424 VanDerWaalsContact O-OH 3.05Å
419D92.4Very high95.9Very high114 Ų11439.2 Ų39.261%0.6121%0.21SC*.THydrogen-bonded Turntrans-97.814.6-174.7-65.5-20.4000112.4N417 A421 L450N417-D419 PolarHBondContact O-N 3.32Å; N417-D419 PolarHBondContact OD1-N 2.76Å; D419-A421 PolarHBondContact O-N 3.41Å; D419-L450 HydrophobicContact CB-CD2 4.14Å
420H94.3Very high95.8Very high18 Ų1839.8 Ų39.88%0.08321%0.212CC..  trans-8493.6-176.2-166.896000112.1D388 Y391 L414 N417 E422 A423 Y424D388-H420 IonicContact OD1-CE1 2.74Å; D388-H420 PolarHBondContact OD1-CE1 2.97Å; D388-H420 IonicContact OD1-ND1 3.46Å; Y391-H420 AromaticContact CD2-NE2 3.45Å; Y391-H420 WeakPolarHBondContact CD2-NE2 3.32Å; Y391-H420 AromaticContact CE2-NE2 3.79Å; Y391-H420 AromaticContact CG-NE2 3.59Å; L414-H420 HydrophobicContact CD2-CB 4.44Å; N417-H420 HydrophobicContact CB-CB 4.17Å; N417-H420 WeakPolarHBondContact O-CB 3.36Å; N417-H420 PolarHBondContact O-N 3.2Å; H420-E422 PolarHBondContact O-N 2.99Å; H420-A423 WeakPolarHBondContact CD2-CB 3.44Å; H420-A423 PolarHBondContact CD2-N 3.35Å; H420-A423 VanDerWaalsContact CD2-N 3.28Å; H420-A423 PolarHBondContact O-N 3.38Å; H420-Y424 WeakPolarHBondContact O-CD2 3.49Å; H420-Y424 PolarHBondContact O-N 3.1Å
421A94.7Very high95.7Very high9 Ų939.9 Ų39.97%0.07421%0.213CC..Hα-helixtrans-61.6-36.5-173.400000114.4D419 A423 Y424 N425 A447 L450 A451 M454D419-A421 PolarHBondContact O-N 3.41Å; A421-A423 PolarHBondContact O-N 3.19Å; A421-Y424 PolarHBondContact O-N 3.03Å; A421-N425 PolarHBondContact O-N 3.34Å; A421-N425 VanDerWaalsContact O-N 3.11Å; A421-A447 WeakPolarHBondContact O-CB 3.39Å; A421-L450 HydrophobicContact CB-CB 3.94Å; A421-A451 HydrophobicContact CB-CB 3.47Å; A421-A451 VanDerWaalsContact CB-CB 3.47Å; A421-M454 HydrophobicContact CB-CE 3.6Å; A421-M454 HydrophobicContact CB-SD 4Å
422E94.6Very high95.6Very high55 Ų5537.4 Ų37.426%0.25720%0.204SC..Hα-helixtrans-67.8-36.6-176.4-50-177-176.900112.3Y391 H420 N425 N426 M454Y391-E422 HydrophobicContact CE1-CB 4.4Å; Y391-E422 WeakPolarHBondContact CE1-OE2 3.4Å; Y391-E422 HydrophobicContact CE2-CB 3.71Å; Y391-E422 WeakPolarHBondContact OH-CB 3.29Å; Y391-E422 PolarHBondContact OH-OE2 3.19Å; H420-E422 PolarHBondContact O-N 2.99Å; E422-N425 WeakPolarHBondContact O-CB 3.49Å; E422-N425 PolarHBondContact O-N 3.22Å; E422-N426 PolarHBondContact O-N 3.34Å; E422-N426 PolarHBondContact O-ND2 3.31Å; E422-M454 HydrophobicContact CG-CE 4.4Å; E422-M454 HydrophobicContact CG-SD 3.81Å
423A96.5Very high95.4Very high0 Ų043 Ų430%022%0.221CC..Hα-helixtrans-68-39.4176.200000111.6Y391 F410 T413 L414 H420 A421 N425 N426 L427Y391-A423 HydrophobicContact CD2-CB 4.12Å; Y391-A423 HydrophobicContact CE2-CB 4.44Å; F410-A423 HydrophobicContact CB-CB 4.49Å; T413-A423 WeakPolarHBondContact OG1-CB 3.42Å; L414-A423 HydrophobicContact CD2-CB 4.02Å; L414-A423 HydrophobicContact CG-CB 4.23Å; H420-A423 WeakPolarHBondContact CD2-CB 3.44Å; H420-A423 PolarHBondContact CD2-N 3.35Å; H420-A423 VanDerWaalsContact CD2-N 3.28Å; H420-A423 PolarHBondContact O-N 3.38Å; A421-A423 PolarHBondContact O-N 3.19Å; A423-N425 VanDerWaalsContact C-N 3.3Å; A423-N425 PolarHBondContact O-N 3.18Å; A423-N426 PolarHBondContact O-N 3.46Å; A423-L427 VanDerWaalsContact O-CB 3.3Å; A423-L427 WeakPolarHBondContact O-CB 3.1Å; A423-L427 WeakPolarHBondContact O-CG 3.32Å; A423-L427 PolarHBondContact O-N 3.5Å
424Y97.6Very high95.2Very high40 Ų4047.9 Ų47.916%0.15724%0.242CC..Hα-helixtrans-59.6-43.2172-78.2-64.9000111.4L414 N418 H420 A421 A428 F443 L450L414-Y424 HydrophobicContact CD1-CD1 3.63Å; L414-Y424 HydrophobicContact CD1-CE1 3.4Å; L414-Y424 HydrophobicContact CD1-CE2 4.5Å; L414-Y424 HydrophobicContact CD1-CG 4.27Å; L414-Y424 HydrophobicContact CD2-CD1 4.15Å; L414-Y424 HydrophobicContact CD2-CD2 3.71Å; L414-Y424 HydrophobicContact CD2-CE1 3.94Å; L414-Y424 HydrophobicContact CD2-CE2 3.47Å; L414-Y424 VanDerWaalsContact CD2-CE2 3.47Å; L414-Y424 HydrophobicContact CD2-CG 4.04Å; L414-Y424 HydrophobicContact CG-CE1 4.31Å; N418-Y424 WeakPolarHBondContact O-CE2 3.12Å; N418-Y424 PolarHBondContact O-OH 2.91Å; N418-Y424 VanDerWaalsContact O-OH 3.05Å; H420-Y424 WeakPolarHBondContact O-CD2 3.49Å; H420-Y424 PolarHBondContact O-N 3.1Å; A421-Y424 PolarHBondContact O-N 3.03Å; Y424-A428 VanDerWaalsContact O-CB 3.28Å; Y424-A428 WeakPolarHBondContact O-CB 3.49Å; Y424-A428 PolarHBondContact O-N 2.83Å; Y424-F443 HydrophobicContact CD1-CB 4.4Å; Y424-F443 AromaticContact CD1-CD1 3.65Å; Y424-F443 HydrophobicContact CD1-CD1 3.65Å; Y424-F443 HydrophobicContact CD1-CE1 4.31Å; Y424-F443 HydrophobicContact CD1-CG 4.3Å; Y424-F443 HydrophobicContact CE1-CD1 4.02Å; Y424-F443 HydrophobicContact CE1-CE1 4.32Å; Y424-L450 HydrophobicContact CD2-CD1 3.76Å; Y424-L450 HydrophobicContact CE2-CD1 3.62Å
425N97.1Very high95.1Very high11 Ų1149.3 Ų49.36%0.05926%0.261CS..Hα-helixtrans-61.1-49.1176.8-174.740000111.7A421 E422 A423 L427 A428 V429 L444 E456 P457 N460A421-N425 PolarHBondContact O-N 3.34Å; A421-N425 VanDerWaalsContact O-N 3.11Å; E422-N425 WeakPolarHBondContact O-CB 3.49Å; E422-N425 PolarHBondContact O-N 3.22Å; A423-N425 VanDerWaalsContact C-N 3.3Å; A423-N425 PolarHBondContact O-N 3.18Å; N425-L427 PolarHBondContact O-N 2.96Å; N425-A428 WeakPolarHBondContact O-CB 3.34Å; N425-A428 PolarHBondContact O-N 3Å; N425-V429 WeakPolarHBondContact O-CG2 3.27Å; N425-V429 PolarHBondContact O-N 2.79Å; N425-L444 VanDerWaalsContact OD1-CD2 3.29Å; N425-L444 WeakPolarHBondContact OD1-CD2 3.26Å; N425-E456 VanDerWaalsContact ND2-CB 3.3Å; N425-E456 WeakPolarHBondContact ND2-CB 2.9Å; N425-P457 HydrophobicContact CB-CG 4.24Å; N425-N460 PolarHBondContact OD1-ND2 3.33Å
426N96.9Very high95.1Very high32 Ų3250.2 Ų50.217%0.17125%0.253CS..Hα-helixtrans-66.6-39.7-179.8-67.5-23.8000112.4Y391 H395 F410 E422 A423 A428 V429 L430Y391-N426 WeakPolarHBondContact CE2-ND2 3.47Å; Y391-N426 PolarHBondContact OH-ND2 3.48Å; H395-N426 PolarHBondContact CE1-ND2 3.37Å; H395-N426 PolarHBondContact NE2-ND2 2.89Å; F410-N426 HydrophobicContact CD2-CB 4.03Å; F410-N426 HydrophobicContact CE1-CB 4.18Å; F410-N426 HydrophobicContact CE2-CB 3.66Å; F410-N426 HydrophobicContact CG-CB 4.45Å; F410-N426 HydrophobicContact CZ-CB 3.74Å; E422-N426 PolarHBondContact O-N 3.34Å; E422-N426 PolarHBondContact O-ND2 3.31Å; A423-N426 PolarHBondContact O-N 3.46Å; N426-A428 VanDerWaalsContact C-N 3.31Å; N426-A428 PolarHBondContact O-N 3.35Å; N426-V429 PolarHBondContact O-N 2.92Å; N426-L430 WeakPolarHBondContact O-CG 3.41Å; N426-L430 PolarHBondContact O-N 3.32Å
427L96.6Very high95.1Very high2 Ų250.7 Ų50.71%0.0126%0.258CS..Hα-helixtrans-60.9-41.5171.7-80.4169.9000111.6Y407 F410 K411 L414 A423 N425 V429 L430 E431 F443Y407-L427 HydrophobicContact CD2-CD2 3.48Å; Y407-L427 VanDerWaalsContact CD2-CD2 3.48Å; Y407-L427 HydrophobicContact CE2-CD2 3.68Å; Y407-L427 HydrophobicContact CG-CD2 4.25Å; F410-L427 HydrophobicContact CB-CD1 3.94Å; F410-L427 HydrophobicContact CB-CD2 3.67Å; F410-L427 HydrophobicContact CB-CG 3.5Å; F410-L427 VanDerWaalsContact CB-CG 3.5Å; F410-L427 HydrophobicContact CD2-CD2 4.49Å; F410-L427 HydrophobicContact CG-CG 4.4Å; K411-L427 HydrophobicContact CG-CD1 4.47Å; K411-L427 HydrophobicContact CG-CD2 4.34Å; L414-L427 HydrophobicContact CD1-CD1 3.37Å; L414-L427 HydrophobicContact CG-CD1 4.16Å; A423-L427 VanDerWaalsContact O-CB 3.3Å; A423-L427 WeakPolarHBondContact O-CB 3.1Å; A423-L427 WeakPolarHBondContact O-CG 3.32Å; A423-L427 PolarHBondContact O-N 3.5Å; N425-L427 PolarHBondContact O-N 2.96Å; L427-V429 VanDerWaalsContact C-N 3.32Å; L427-V429 PolarHBondContact O-N 3.27Å; L427-L430 PolarHBondContact O-N 2.9Å; L427-E431 WeakPolarHBondContact O-CG 3.41Å; L427-E431 PolarHBondContact O-N 3.31Å; L427-F443 HydrophobicContact CB-CD2 4.49Å
428A96.5Very high95.1Very high0 Ų057.1 Ų57.10%029%0.287CS..Hα-helixtrans-61.7-41.8177.200000111.9Y424 N425 N426 E431 L432 S440 F443 L444Y424-A428 VanDerWaalsContact O-CB 3.28Å; Y424-A428 WeakPolarHBondContact O-CB 3.49Å; Y424-A428 PolarHBondContact O-N 2.83Å; N425-A428 WeakPolarHBondContact O-CB 3.34Å; N425-A428 PolarHBondContact O-N 3Å; N426-A428 VanDerWaalsContact C-N 3.31Å; N426-A428 PolarHBondContact O-N 3.35Å; A428-E431 PolarHBondContact O-N 2.92Å; A428-L432 WeakPolarHBondContact O-CG 3.31Å; A428-L432 PolarHBondContact O-N 3.36Å; A428-S440 WeakPolarHBondContact CB-OG 3Å; A428-S440 WeakPolarHBondContact O-CB 3.47Å; A428-S440 PolarHBondContact O-OG 3.29Å; A428-F443 HydrophobicContact CB-CB 3.74Å; A428-L444 HydrophobicContact CB-CD1 4.36Å; A428-L444 HydrophobicContact CB-CD2 3.69Å; A428-L444 HydrophobicContact CB-CG 3.59Å
429V96.3Very high95.1Very high64 Ų6456.8 Ų56.839%0.38828%0.282SS..Hα-helixtrans-63.3-43175.1173.50000111N425 N426 L427 E431 L432 R433N425-V429 WeakPolarHBondContact O-CG2 3.27Å; N425-V429 PolarHBondContact O-N 2.79Å; N426-V429 PolarHBondContact O-N 2.92Å; L427-V429 VanDerWaalsContact C-N 3.32Å; L427-V429 PolarHBondContact O-N 3.27Å; V429-E431 PolarHBondContact O-N 3.21Å; V429-L432 PolarHBondContact O-N 2.9Å; V429-R433 PolarHBondContact O-N 3.19Å; V429-R433 VanDerWaalsContact O-N 3.07Å
430L95.9Very high95.3Very high14 Ų1451.3 Ų51.37%0.07325%0.253CS..Hα-helixtrans-64.2-38.6175.7-68.8179.3000112.4L403 A406 Y407 F410 N426 L427 R433 K434L403-L430 HydrophobicContact CB-CD2 4.49Å; L403-L430 HydrophobicContact CD2-CD2 3.92Å; A406-L430 HydrophobicContact CB-CD1 4.18Å; Y407-L430 HydrophobicContact CD2-CD1 4.45Å; F410-L430 HydrophobicContact CD2-CD1 3.75Å; F410-L430 HydrophobicContact CE2-CD1 3.91Å; N426-L430 WeakPolarHBondContact O-CG 3.41Å; N426-L430 PolarHBondContact O-N 3.32Å; L427-L430 PolarHBondContact O-N 2.9Å; L430-R433 PolarHBondContact O-N 3.24Å; L430-K434 WeakPolarHBondContact O-CG 3.41Å; L430-K434 PolarHBondContact O-N 3.37Å; L430-K434 VanDerWaalsContact O-N 3.13Å
431E95.6Very high95.4Very high2 Ų253.1 Ų53.11%0.00926%0.26CS..Hα-helixtrans-70.2-36.4176.6-72.2-63.6178.500112.5Y407 L427 A428 V429 R433 K434 G435 H436 F443Y407-E431 HydrophobicContact CE2-CG 4.2Å; Y407-E431 WeakPolarHBondContact CE2-OE1 3.4Å; Y407-E431 PolarHBondContact OH-OE1 3.17Å; L427-E431 WeakPolarHBondContact O-CG 3.41Å; L427-E431 PolarHBondContact O-N 3.31Å; A428-E431 PolarHBondContact O-N 2.92Å; V429-E431 PolarHBondContact O-N 3.21Å; E431-R433 VanDerWaalsContact C-N 3.27Å; E431-R433 PolarHBondContact O-N 3.3Å; E431-K434 CarbonylContact O-C 3.56Å; E431-K434 PolarHBondContact O-N 2.81Å; E431-K434 VanDerWaalsContact O-N 3.14Å; E431-G435 PolarHBondContact O-N 3.02Å; E431-H436 HydrophobicContact CB-CB 4.37Å; E431-H436 PolarHBondContact O-N 3.39Å; E431-H436 IonicContact OE2-CE1 3.36Å; E431-H436 IonicContact OE2-CG 3.98Å; E431-H436 IonicContact OE2-ND1 3.89Å; E431-H436 PolarHBondContact OE2-ND1 3.09Å; E431-F443 HydrophobicContact CG-CD2 4.42Å; E431-F443 HydrophobicContact CG-CE2 4.15Å
432L94.3Very high95.4Very high52 Ų5255 Ų5527%0.27228%0.276SS..Hα-helixtrans-60.3-41170.6-71.5176.8000111.6A428 V429 K434 G435 I437 S440 L464A428-L432 WeakPolarHBondContact O-CG 3.31Å; A428-L432 PolarHBondContact O-N 3.36Å; V429-L432 PolarHBondContact O-N 2.9Å; L432-K434 VanDerWaalsContact C-N 3.25Å; L432-K434 PolarHBondContact O-N 3.47Å; L432-G435 PolarHBondContact O-N 3.28Å; L432-I437 HydrophobicContact CD2-CG1 4.45Å; L432-S440 WeakPolarHBondContact CD1-OG 3.32Å; L432-S440 WeakPolarHBondContact CD2-OG 3.46Å; L432-S440 WeakPolarHBondContact CG-OG 3.36Å; L432-L464 HydrophobicContact CD1-CD1 4.13Å; L432-L464 HydrophobicContact CD2-CD1 3.31Å; L432-L464 HydrophobicContact CD2-CD2 3.99Å; L432-L464 HydrophobicContact CD2-CG 4.25Å; L432-L464 HydrophobicContact CG-CD1 4.36Å
433R92.9Very high95.5Very high185 Ų18554.9 Ų54.970%0.69827%0.274SS*.Hα-helixtrans-65.5-29.9177.5-168.4172179.5-179.9-0.3112.4V429 L430 E431 G435V429-R433 PolarHBondContact O-N 3.19Å; V429-R433 VanDerWaalsContact O-N 3.07Å; L430-R433 PolarHBondContact O-N 3.24Å; E431-R433 VanDerWaalsContact C-N 3.27Å; E431-R433 PolarHBondContact O-N 3.3Å; R433-G435 VanDerWaalsContact C-N 3.33Å
434K93.7Very high95.5Very high102 Ų10254.9 Ų54.944%0.44327%0.274SS..Hα-helixtrans-78-15.5171.5-68.9173.9-176.2172.10113.4Y407 L430 E431 L432Y407-K434 VanDerWaalsContact CD2-NZ 3.32Å; L430-K434 WeakPolarHBondContact O-CG 3.41Å; L430-K434 PolarHBondContact O-N 3.37Å; L430-K434 VanDerWaalsContact O-N 3.13Å; E431-K434 CarbonylContact O-C 3.56Å; E431-K434 PolarHBondContact O-N 2.81Å; E431-K434 VanDerWaalsContact O-N 3.14Å; L432-K434 VanDerWaalsContact C-N 3.25Å; L432-K434 PolarHBondContact O-N 3.47Å
435G92.8Very high95.4Very high49 Ų4957.4 Ų57.451%0.50529%0.287SS..THydrogen-bonded Turntrans96.33.7-178.800000115E431 L432 R433 I437E431-G435 PolarHBondContact O-N 3.02Å; L432-G435 PolarHBondContact O-N 3.28Å; R433-G435 VanDerWaalsContact C-N 3.33Å; G435-I437 PolarHBondContact O-N 2.92Å
436H95.6Very high95.4Very high91 Ų9159.4 Ų59.442%0.42130%0.3SS..  trans-84.279.1179.2-54.4131.2000111.3E431 Q439 S440E431-H436 HydrophobicContact CB-CB 4.37Å; E431-H436 PolarHBondContact O-N 3.39Å; E431-H436 IonicContact OE2-CE1 3.36Å; E431-H436 IonicContact OE2-CG 3.98Å; E431-H436 IonicContact OE2-ND1 3.89Å; E431-H436 PolarHBondContact OE2-ND1 3.09Å; H436-Q439 HydrophobicContact CB-CB 4.34Å; H436-S440 PolarHBondContact O-N 2.86Å
437I94.9Very high95.3Very high82 Ų8257.9 Ų57.942%0.42129%0.292SS..Hα-helixtrans-62.1-44.9-174.4-67.3171.8000112.8L432 G435 S440 K441 L464 I468L432-I437 HydrophobicContact CD2-CG1 4.45Å; G435-I437 PolarHBondContact O-N 2.92Å; I437-S440 PolarHBondContact O-N 3.41Å; I437-K441 PolarHBondContact O-N 2.84Å; I437-L464 HydrophobicContact CG2-CD1 4.05Å; I437-I468 HydrophobicContact CG2-CD1 3.65Å; I437-I468 HydrophobicContact CG2-CG1 4.24Å
438E94Very high95.2Very high172 Ų17258.6 Ų58.680%0.80430%0.298SS*.Hα-helixtrans-66.8-43.7-175.5-64.8177.9173.700112.5K441 A442E438-K441 PolarHBondContact O-N 3.19Å; E438-A442 PolarHBondContact O-N 2.9Å; E438-A442 VanDerWaalsContact O-N 3.13Å
439Q94.9Very high95Very high98 Ų9865.4 Ų65.446%0.45833%0.334SS..Hα-helixtrans-63.8-43.5177.6-66.7-178.33.100110.9H436 K441 A442 F443H436-Q439 HydrophobicContact CB-CB 4.34Å; Q439-K441 PolarHBondContact O-N 3.1Å; Q439-A442 PolarHBondContact O-N 3.02Å; Q439-F443 HydrophobicContact CB-CE2 4.43Å; Q439-F443 VanDerWaalsContact O-CD2 3.3Å; Q439-F443 WeakPolarHBondContact O-CD2 3.27Å; Q439-F443 WeakPolarHBondContact O-CG 3.41Å; Q439-F443 PolarHBondContact O-N 3.06Å
440S95.8Very high94.7Very high0 Ų065 Ų650%033%0.329CS..Hα-helixtrans-59.3-45.7174.61760000112.3A428 L432 H436 I437 A442 F443 L444A428-S440 WeakPolarHBondContact CB-OG 3Å; A428-S440 WeakPolarHBondContact O-CB 3.47Å; A428-S440 PolarHBondContact O-OG 3.29Å; L432-S440 WeakPolarHBondContact CD1-OG 3.32Å; L432-S440 WeakPolarHBondContact CD2-OG 3.46Å; L432-S440 WeakPolarHBondContact CG-OG 3.36Å; H436-S440 PolarHBondContact O-N 2.86Å; I437-S440 PolarHBondContact O-N 3.41Å; S440-A442 VanDerWaalsContact C-N 3.28Å; S440-A442 PolarHBondContact O-N 3.29Å; S440-F443 PolarHBondContact O-N 3.33Å; S440-F443 VanDerWaalsContact O-N 3.13Å; S440-L444 WeakPolarHBondContact O-CG 3.34Å; S440-L444 PolarHBondContact O-N 3.26Å
441K95.4Very high94.4Very high56 Ų5664.6 Ų64.624%0.24333%0.328CS..Hα-helixtrans-57.4-42.6178.2-170.4174.5-177.6172.30111.6I437 E438 Q439 L444 Q445 L464I437-K441 PolarHBondContact O-N 2.84Å; E438-K441 PolarHBondContact O-N 3.19Å; Q439-K441 PolarHBondContact O-N 3.1Å; K441-L444 PolarHBondContact O-N 3.35Å; K441-Q445 WeakPolarHBondContact O-CB 3.34Å; K441-Q445 VanDerWaalsContact O-CG 3.27Å; K441-Q445 WeakPolarHBondContact O-CG 3.45Å; K441-Q445 PolarHBondContact O-N 3.33Å; K441-L464 HydrophobicContact CB-CD2 3.87Å; K441-L464 HydrophobicContact CG-CD2 4.43Å
442A95.9Very high94.1Very high48 Ų4868.5 Ų68.540%0.39735%0.354SS..Hα-helixtrans-64.5-42.2176.600000112.4E438 Q439 S440 Q445 T446E438-A442 PolarHBondContact O-N 2.9Å; E438-A442 VanDerWaalsContact O-N 3.13Å; Q439-A442 PolarHBondContact O-N 3.02Å; S440-A442 VanDerWaalsContact C-N 3.28Å; S440-A442 PolarHBondContact O-N 3.29Å; A442-Q445 PolarHBondContact O-N 3.29Å; A442-T446 WeakPolarHBondContact O-CG2 3.45Å; A442-T446 PolarHBondContact O-N 3.03Å; A442-T446 PolarHBondContact O-OG1 3.16Å
443F96.9Very high93.8Very high53 Ų5368 Ų6823%0.23235%0.35CS..Hα-helixtrans-65.9-39.3175.9-67.3-37000112.9Y424 L427 A428 E431 Q439 S440 T446 A447Y424-F443 HydrophobicContact CD1-CB 4.4Å; Y424-F443 AromaticContact CD1-CD1 3.65Å; Y424-F443 HydrophobicContact CD1-CD1 3.65Å; Y424-F443 HydrophobicContact CD1-CE1 4.31Å; Y424-F443 HydrophobicContact CD1-CG 4.3Å; Y424-F443 HydrophobicContact CE1-CD1 4.02Å; Y424-F443 HydrophobicContact CE1-CE1 4.32Å; L427-F443 HydrophobicContact CB-CD2 4.49Å; A428-F443 HydrophobicContact CB-CB 3.74Å; E431-F443 HydrophobicContact CG-CD2 4.42Å; E431-F443 HydrophobicContact CG-CE2 4.15Å; Q439-F443 HydrophobicContact CB-CE2 4.43Å; Q439-F443 VanDerWaalsContact O-CD2 3.3Å; Q439-F443 WeakPolarHBondContact O-CD2 3.27Å; Q439-F443 WeakPolarHBondContact O-CG 3.41Å; Q439-F443 PolarHBondContact O-N 3.06Å; S440-F443 PolarHBondContact O-N 3.33Å; S440-F443 VanDerWaalsContact O-N 3.13Å; F443-T446 VanDerWaalsContact CA-OG1 3.31Å; F443-T446 WeakPolarHBondContact CA-OG1 3.4Å; F443-T446 PolarHBondContact O-N 3.24Å; F443-T446 PolarHBondContact O-OG1 2.94Å; F443-A447 WeakPolarHBondContact O-CB 3.29Å; F443-A447 PolarHBondContact O-N 3.11Å
444L96.6Very high93.7Very high0 Ų059.9 Ų59.90%032%0.32CS..Hα-helixtrans-67.1-39.6175.6-68.7170.2000112.2N425 A428 S440 K441 A447 A448 P457 N460 L461 L464N425-L444 VanDerWaalsContact OD1-CD2 3.29Å; N425-L444 WeakPolarHBondContact OD1-CD2 3.26Å; A428-L444 HydrophobicContact CB-CD1 4.36Å; A428-L444 HydrophobicContact CB-CD2 3.69Å; A428-L444 HydrophobicContact CB-CG 3.59Å; S440-L444 WeakPolarHBondContact O-CG 3.34Å; S440-L444 PolarHBondContact O-N 3.26Å; K441-L444 PolarHBondContact O-N 3.35Å; L444-A447 PolarHBondContact O-N 3.41Å; L444-A448 WeakPolarHBondContact O-CB 3.33Å; L444-A448 PolarHBondContact O-N 2.98Å; L444-P457 HydrophobicContact CD2-CB 4.49Å; L444-N460 HydrophobicContact CD1-CB 3.96Å; L444-N460 HydrophobicContact CD2-CB 3.63Å; L444-N460 HydrophobicContact CG-CB 4.46Å; L444-L461 HydrophobicContact CB-CB 4.22Å; L444-L461 HydrophobicContact CB-CD1 4.34Å; L444-L461 HydrophobicContact CB-CG 4.46Å; L444-L461 HydrophobicContact CD1-CB 4.37Å; L444-L464 HydrophobicContact CD1-CD2 4.14Å
445Q95.8Very high93.7Very high92 Ų9256.4 Ų56.443%0.4330%0.304SS..Hα-helixtrans-63.7-43.4175.9-76176.1-13.600111.8K441 A442 A448 L449 L461K441-Q445 WeakPolarHBondContact O-CB 3.34Å; K441-Q445 VanDerWaalsContact O-CG 3.27Å; K441-Q445 WeakPolarHBondContact O-CG 3.45Å; K441-Q445 PolarHBondContact O-N 3.33Å; A442-Q445 PolarHBondContact O-N 3.29Å; Q445-A448 PolarHBondContact O-N 3.41Å; Q445-L449 VanDerWaalsContact O-CG 3.25Å; Q445-L449 WeakPolarHBondContact O-CG 3.25Å; Q445-L449 PolarHBondContact O-N 3.46Å; Q445-L461 HydrophobicContact CG-CD1 3.7Å
446T95.8Very high93.8Very high53 Ų5356.6 Ų56.633%0.32529%0.292SS..Hα-helixtrans-65.4-43.5176.446.40000111.6A442 F443 A448 L449 L450A442-T446 WeakPolarHBondContact O-CG2 3.45Å; A442-T446 PolarHBondContact O-N 3.03Å; A442-T446 PolarHBondContact O-OG1 3.16Å; F443-T446 VanDerWaalsContact CA-OG1 3.31Å; F443-T446 WeakPolarHBondContact CA-OG1 3.4Å; F443-T446 PolarHBondContact O-N 3.24Å; F443-T446 PolarHBondContact O-OG1 2.94Å; T446-A448 PolarHBondContact O-N 3.33Å; T446-L449 PolarHBondContact O-N 2.88Å; T446-L450 WeakPolarHBondContact O-CG 3.5Å; T446-L450 PolarHBondContact O-N 3.47Å
447A95.3Very high93.8Very high0 Ų052.2 Ų52.20%027%0.272CS..Hα-helixtrans-58-45.8173.900000112.6A421 F443 L444 L449 L450 A451 P457A421-A447 WeakPolarHBondContact O-CB 3.39Å; F443-A447 WeakPolarHBondContact O-CB 3.29Å; F443-A447 PolarHBondContact O-N 3.11Å; L444-A447 PolarHBondContact O-N 3.41Å; A447-L449 VanDerWaalsContact C-N 3.3Å; A447-L449 PolarHBondContact O-N 3.35Å; A447-L450 PolarHBondContact O-N 3.1Å; A447-A451 PolarHBondContact O-N 3.27Å; A447-P457 HydrophobicContact CB-CB 3.78Å; A447-P457 HydrophobicContact CB-CG 3.87Å
448A93.8Very high93.9Very high17 Ų1748.7 Ų48.714%0.1425%0.254CS..Hα-helixtrans-66.5-28.9178.400000113.4L444 Q445 T446 P452 P457 N458L444-A448 WeakPolarHBondContact O-CB 3.33Å; L444-A448 PolarHBondContact O-N 2.98Å; Q445-A448 PolarHBondContact O-N 3.41Å; T446-A448 PolarHBondContact O-N 3.33Å; A448-P452 WeakPolarHBondContact O-CA 3.46Å; A448-P457 HydrophobicContact CB-CB 4.29Å; A448-N458 WeakPolarHBondContact CB-OD1 3.46Å
449L92.1Very high94Very high143 Ų14341.8 Ų41.875%0.74922%0.221SC*.Hα-helixtrans-74.8-41.2174.5-73.4170.7000112.1Q445 T446 A447Q445-L449 VanDerWaalsContact O-CG 3.25Å; Q445-L449 WeakPolarHBondContact O-CG 3.25Å; Q445-L449 PolarHBondContact O-N 3.46Å; T446-L449 PolarHBondContact O-N 2.88Å; A447-L449 VanDerWaalsContact C-N 3.3Å; A447-L449 PolarHBondContact O-N 3.35Å
450L91.3Very high94Very high56 Ų5638.9 Ų38.929%0.29321%0.209SC..Hα-helixtrans-69.7-45.9179.7-71.3169.4000111.7D419 A421 Y424 T446 A447D419-L450 HydrophobicContact CB-CD2 4.14Å; A421-L450 HydrophobicContact CB-CB 3.94Å; Y424-L450 HydrophobicContact CD2-CD1 3.76Å; Y424-L450 HydrophobicContact CE2-CD1 3.62Å; T446-L450 WeakPolarHBondContact O-CG 3.5Å; T446-L450 PolarHBondContact O-N 3.47Å; A447-L450 PolarHBondContact O-N 3.1Å
451A89.6Confident94.1Very high6 Ų639.6 Ų39.65%0.0521%0.213CC..  trans-126.982.4-177.700000111A421 A447 H453 M454A421-A451 HydrophobicContact CB-CB 3.47Å; A421-A451 VanDerWaalsContact CB-CB 3.47Å; A447-A451 PolarHBondContact O-N 3.27Å; A451-H453 PolarHBondContact O-N 2.83Å; A451-M454 HydrophobicContact CB-CB 4.21Å; A451-M454 HydrophobicContact CB-CE 3.89Å; A451-M454 HydrophobicContact CB-CG 3.79Å; A451-M454 HydrophobicContact CB-SD 3.49Å; A451-M454 WeakPolarHBondContact CB-SD 3.47Å; A451-M454 PolarHBondContact O-N 3.24Å
452P89.3Confident94.1Very high84 Ų8437 Ų3755%0.54520%0.201SC..THydrogen-bonded Turntrans-68.7-16.3179.527.7-35.4000113.5A448A448-P452 WeakPolarHBondContact O-CA 3.46Å
453H87.3Confident94Very high41 Ų4136.8 Ų36.819%0.1919%0.193CC..THydrogen-bonded Turntrans-82-14.1177.460.5-88000113.3M102 T103 A451M102-H453 PolarHBondContact O-NE2 3.35Å; T103-H453 PolarHBondContact O-CE1 3.38Å; T103-H453 PolarHBondContact O-NE2 3.32Å; A451-H453 PolarHBondContact O-N 2.83Å
454M91.4Very high93.9Very high15 Ų1534.7 Ų34.77%0.07418%0.184CC..  trans-79.4131.9174.5-73.7177.2400109.7A421 E422 A451 E456 P457 N458A421-M454 HydrophobicContact CB-CE 3.6Å; A421-M454 HydrophobicContact CB-SD 4Å; E422-M454 HydrophobicContact CG-CE 4.4Å; E422-M454 HydrophobicContact CG-SD 3.81Å; A451-M454 HydrophobicContact CB-CB 4.21Å; A451-M454 HydrophobicContact CB-CE 3.89Å; A451-M454 HydrophobicContact CB-CG 3.79Å; A451-M454 HydrophobicContact CB-SD 3.49Å; A451-M454 WeakPolarHBondContact CB-SD 3.47Å; A451-M454 PolarHBondContact O-N 3.24Å; M454-E456 WeakPolarHBondContact CB-OE2 3.24Å; M454-P457 HydrophobicContact CB-CG 4.17Å; M454-P457 HydrophobicContact CE-CG 3.38Å; M454-N458 PolarHBondContact O-ND2 3.1Å
455Y93.4Very high93.8Very high28 Ų2834.7 Ų34.711%0.1118%0.184CC..Hα-helixtrans-87-27.4-177.179.9-79.9000111.8P97 A98 N458 F459 S481 F485 H488P97-Y455 HydrophobicContact CB-CD1 4.26Å; P97-Y455 HydrophobicContact CB-CE1 4.21Å; A98-Y455 WeakPolarHBondContact CA-OH 3.44Å; Y455-N458 PolarHBondContact O-N 2.91Å; Y455-F459 WeakPolarHBondContact O-CB 3.5Å; Y455-F459 PolarHBondContact O-N 3.42Å; Y455-S481 PolarHBondContact O-OG 2.87Å; Y455-F485 HydrophobicContact CD1-CB 4.18Å; Y455-F485 HydrophobicContact CD1-CD1 4.29Å; Y455-F485 HydrophobicContact CD2-CB 4.32Å; Y455-F485 HydrophobicContact CD2-CD1 4.04Å; Y455-F485 HydrophobicContact CE1-CD1 4.35Å; Y455-F485 HydrophobicContact CE2-CD1 4.1Å; Y455-F485 HydrophobicContact CG-CB 3.81Å; Y455-F485 HydrophobicContact CG-CD1 4.15Å; Y455-F485 HydrophobicContact CG-CG 4.46Å; Y455-H488 AromaticContact CE2-CD2 3.86Å; Y455-H488 AromaticContact CE2-NE2 3.79Å
456E94.9Very high93.7Very high53 Ų5333 Ų3325%0.24818%0.176CC..Hα-helixtrans-63.5-47.7-172.5-50.484.4162.500112.8N425 M454 N458 F459 N460N425-E456 VanDerWaalsContact ND2-CB 3.3Å; N425-E456 WeakPolarHBondContact ND2-CB 2.9Å; M454-E456 WeakPolarHBondContact CB-OE2 3.24Å; E456-N458 VanDerWaalsContact C-N 3.34Å; E456-N458 PolarHBondContact O-N 3.49Å; E456-F459 PolarHBondContact O-N 3.5Å; E456-N460 VanDerWaalsContact O-CB 3.31Å; E456-N460 WeakPolarHBondContact O-CB 3.43Å; E456-N460 VanDerWaalsContact O-CG 3.26Å; E456-N460 PolarHBondContact O-N 2.93Å; E456-N460 PolarHBondContact O-ND2 2.99Å
457P96Very high93.4Very high0 Ų038.4 Ų38.40%020%0.195CC..Hα-helixtrans-64.4-40.7179.6-18.530.9000112.1N425 L444 A447 A448 M454 L461N425-P457 HydrophobicContact CB-CG 4.24Å; L444-P457 HydrophobicContact CD2-CB 4.49Å; A447-P457 HydrophobicContact CB-CB 3.78Å; A447-P457 HydrophobicContact CB-CG 3.87Å; A448-P457 HydrophobicContact CB-CB 4.29Å; M454-P457 HydrophobicContact CB-CG 4.17Å; M454-P457 HydrophobicContact CE-CG 3.38Å; P457-L461 VanDerWaalsContact O-CB 3.23Å; P457-L461 WeakPolarHBondContact O-CB 3.3Å; P457-L461 PolarHBondContact O-N 3.24Å
458N95.9Very high93.3Very high7 Ų742.6 Ų42.64%0.03722%0.217CC..Hα-helixtrans-66.7-40.3179.4-74.2-46.2000111.5A448 M454 Y455 E456 L461 S462 K480A448-N458 WeakPolarHBondContact CB-OD1 3.46Å; M454-N458 PolarHBondContact O-ND2 3.1Å; Y455-N458 PolarHBondContact O-N 2.91Å; E456-N458 VanDerWaalsContact C-N 3.34Å; E456-N458 PolarHBondContact O-N 3.49Å; N458-L461 PolarHBondContact O-N 2.99Å; N458-S462 PolarHBondContact O-N 3.1Å; N458-K480 HydrophobicContact CB-CB 4.43Å
459F96.3Very high93.1Very high28 Ų2844.3 Ų44.312%0.12324%0.236CC..Hα-helixtrans-67.2-46.3175.1178-118.6000112.5Y455 E456 L461 S462 I463 H488 D490 T491Y455-F459 WeakPolarHBondContact O-CB 3.5Å; Y455-F459 PolarHBondContact O-N 3.42Å; E456-F459 PolarHBondContact O-N 3.5Å; F459-L461 VanDerWaalsContact C-N 3.26Å; F459-L461 PolarHBondContact O-N 2.65Å; F459-S462 PolarHBondContact O-N 3.22Å; F459-S462 VanDerWaalsContact O-N 3.16Å; F459-S462 PolarHBondContact O-OG 2.92Å; F459-I463 HydrophobicContact CD1-CD1 3.87Å; F459-I463 HydrophobicContact CD2-CD1 4.13Å; F459-I463 HydrophobicContact CD2-CG1 4.48Å; F459-I463 HydrophobicContact CE1-CD1 3.38Å; F459-I463 HydrophobicContact CE2-CD1 3.68Å; F459-I463 HydrophobicContact CE2-CG1 4.16Å; F459-I463 HydrophobicContact CG-CD1 4.24Å; F459-I463 HydrophobicContact CZ-CD1 3.29Å; F459-I463 HydrophobicContact CZ-CG1 4.24Å; F459-I463 PolarHBondContact O-N 3.21Å; F459-H488 AromaticContact CD2-CE1 3.92Å; F459-H488 AromaticContact CE1-CE1 3.93Å; F459-H488 AromaticContact CE2-CE1 3.75Å; F459-H488 AromaticContact CZ-CE1 3.73Å; F459-D490 HydrophobicContact CE2-CB 3.72Å; F459-D490 HydrophobicContact CZ-CB 3.44Å; F459-D490 VanDerWaalsContact CZ-CB 3.44Å; F459-T491 HydrophobicContact CB-CG2 4.31Å; F459-T491 HydrophobicContact CD2-CG2 3.43Å; F459-T491 VanDerWaalsContact CD2-CG2 3.43Å; F459-T491 HydrophobicContact CE2-CG2 4.03Å; F459-T491 HydrophobicContact CG-CG2 4.17Å
460N96.3Very high93.2Very high36 Ų3640.4 Ų40.419%0.19322%0.215CC..Hα-helixtrans-61.8-37.4176.8-74.6-24.4000111.3N425 L444 E456 L464N425-N460 PolarHBondContact OD1-ND2 3.33Å; L444-N460 HydrophobicContact CD1-CB 3.96Å; L444-N460 HydrophobicContact CD2-CB 3.63Å; L444-N460 HydrophobicContact CG-CB 4.46Å; E456-N460 VanDerWaalsContact O-CB 3.31Å; E456-N460 WeakPolarHBondContact O-CB 3.43Å; E456-N460 VanDerWaalsContact O-CG 3.26Å; E456-N460 PolarHBondContact O-N 2.93Å; E456-N460 PolarHBondContact O-ND2 2.99Å; N460-L464 VanDerWaalsContact O-CB 3.31Å; N460-L464 WeakPolarHBondContact O-CB 3.44Å; N460-L464 PolarHBondContact O-N 3.01Å
461L95.8Very high93.3Very high16 Ų1639.6 Ų39.68%0.08421%0.211CC..Hα-helixtrans-66.1-43.6174.8-163.7163.7000110.9L444 Q445 P457 N458 F459 I463 L464 C465 A477L444-L461 HydrophobicContact CB-CB 4.22Å; L444-L461 HydrophobicContact CB-CD1 4.34Å; L444-L461 HydrophobicContact CB-CG 4.46Å; L444-L461 HydrophobicContact CD1-CB 4.37Å; Q445-L461 HydrophobicContact CG-CD1 3.7Å; P457-L461 VanDerWaalsContact O-CB 3.23Å; P457-L461 WeakPolarHBondContact O-CB 3.3Å; P457-L461 PolarHBondContact O-N 3.24Å; N458-L461 PolarHBondContact O-N 2.99Å; F459-L461 VanDerWaalsContact C-N 3.26Å; F459-L461 PolarHBondContact O-N 2.65Å; L461-I463 PolarHBondContact O-N 3.44Å; L461-L464 PolarHBondContact O-N 3.31Å; L461-C465 VanDerWaalsContact CD2-SG 3.57Å; L461-C465 WeakPolarHBondContact O-CB 3.36Å; L461-C465 PolarHBondContact O-N 3.25Å; L461-A477 HydrophobicContact CB-CB 4.41Å; L461-A477 HydrophobicContact CD2-CB 3.81Å
462S95.5Very high93.5Very high0 Ų045.3 Ų45.30%024%0.237CC..Hα-helixtrans-62.3-44.1179.571.30000111.8N458 F459 L464 C465 E466 S474N458-S462 PolarHBondContact O-N 3.1Å; F459-S462 PolarHBondContact O-N 3.22Å; F459-S462 VanDerWaalsContact O-N 3.16Å; F459-S462 PolarHBondContact O-OG 2.92Å; S462-L464 VanDerWaalsContact C-N 3.35Å; S462-L464 PolarHBondContact O-N 3.02Å; S462-C465 PolarHBondContact O-N 3.42Å; S462-E466 WeakPolarHBondContact O-CB 3.49Å; S462-E466 PolarHBondContact O-N 3.37Å; S462-S474 WeakPolarHBondContact CB-O 3.36Å; S462-S474 WeakPolarHBondContact O-CB 3.34Å; S462-S474 PolarHBondContact O-OG 2.85Å
463I95.4Very high93.6Very high45 Ų4542.6 Ų42.623%0.23122%0.22CC..Hα-helixtrans-62.3-43.1175.2-69166.4000110.9F459 L461 E466 K467 L494F459-I463 HydrophobicContact CD1-CD1 3.87Å; F459-I463 HydrophobicContact CD2-CD1 4.13Å; F459-I463 HydrophobicContact CD2-CG1 4.48Å; F459-I463 HydrophobicContact CE1-CD1 3.38Å; F459-I463 HydrophobicContact CE2-CD1 3.68Å; F459-I463 HydrophobicContact CE2-CG1 4.16Å; F459-I463 HydrophobicContact CG-CD1 4.24Å; F459-I463 HydrophobicContact CZ-CD1 3.29Å; F459-I463 HydrophobicContact CZ-CG1 4.24Å; F459-I463 PolarHBondContact O-N 3.21Å; L461-I463 PolarHBondContact O-N 3.44Å; I463-E466 PolarHBondContact O-N 3.5Å; I463-K467 HydrophobicContact CG2-CD 4.26Å; I463-K467 WeakPolarHBondContact O-CG 2.98Å; I463-K467 PolarHBondContact O-N 3.33Å; I463-L494 HydrophobicContact CG1-CD1 3.79Å
464L94.2Very high94Very high8 Ų840.7 Ų40.74%0.04221%0.211CC..Hα-helixtrans-63.4-45.5-179.8-176.361.9000111.6L432 I437 K441 L444 N460 L461 S462 K467 I468L432-L464 HydrophobicContact CD1-CD1 4.13Å; L432-L464 HydrophobicContact CD2-CD1 3.31Å; L432-L464 HydrophobicContact CD2-CD2 3.99Å; L432-L464 HydrophobicContact CD2-CG 4.25Å; L432-L464 HydrophobicContact CG-CD1 4.36Å; I437-L464 HydrophobicContact CG2-CD1 4.05Å; K441-L464 HydrophobicContact CB-CD2 3.87Å; K441-L464 HydrophobicContact CG-CD2 4.43Å; L444-L464 HydrophobicContact CD1-CD2 4.14Å; N460-L464 VanDerWaalsContact O-CB 3.31Å; N460-L464 WeakPolarHBondContact O-CB 3.44Å; N460-L464 PolarHBondContact O-N 3.01Å; L461-L464 PolarHBondContact O-N 3.31Å; S462-L464 VanDerWaalsContact C-N 3.35Å; S462-L464 PolarHBondContact O-N 3.02Å; L464-K467 PolarHBondContact O-N 3.41Å; L464-I468 HydrophobicContact CD1-CD1 4.47Å; L464-I468 HydrophobicContact CG-CD1 4.14Å; L464-I468 WeakPolarHBondContact O-CG1 3.5Å; L464-I468 PolarHBondContact O-N 3.3Å
465C94.1Very high94.2Very high0 Ų042.1 Ų42.10%022%0.216CC..Hα-helixtrans-67-37178.4-750000112.5L461 S462 K467 I468 G469 D470 S473L461-C465 VanDerWaalsContact CD2-SG 3.57Å; L461-C465 WeakPolarHBondContact O-CB 3.36Å; L461-C465 PolarHBondContact O-N 3.25Å; S462-C465 PolarHBondContact O-N 3.42Å; C465-K467 VanDerWaalsContact C-N 3.34Å; C465-K467 PolarHBondContact O-N 2.85Å; C465-I468 PolarHBondContact O-N 3.23Å; C465-G469 PolarHBondContact O-N 2.93Å; C465-D470 HydrophobicContact CB-CB 4.41Å; C465-D470 PolarHBondContact O-N 3.42Å; C465-S473 WeakPolarHBondContact CB-OG 3.38Å; C465-S473 PolarHBondContact SG-OG 3.4Å
466E93.8Very high94.3Very high58 Ų5843.6 Ų43.627%0.27123%0.228SC..Hα-helixtrans-59.8-45173.4-172-172.3169.300111.1S462 I463 I468 G469 L494S462-E466 WeakPolarHBondContact O-CB 3.49Å; S462-E466 PolarHBondContact O-N 3.37Å; I463-E466 PolarHBondContact O-N 3.5Å; E466-I468 VanDerWaalsContact C-N 3.26Å; E466-I468 PolarHBondContact O-N 2.88Å; E466-G469 PolarHBondContact O-N 2.95Å; E466-L494 VanDerWaalsContact OE2-CD1 3.24Å; E466-L494 WeakPolarHBondContact OE2-CD1 3.48Å
467K90.9Very high94.3Very high166 Ų16641.3 Ų41.372%0.72222%0.218SC*.Hα-helixtrans-61.8-31.2175.9-72.6174.8-179176.10113.6I463 L464 C465 G469I463-K467 HydrophobicContact CG2-CD 4.26Å; I463-K467 WeakPolarHBondContact O-CG 2.98Å; I463-K467 PolarHBondContact O-N 3.33Å; L464-K467 PolarHBondContact O-N 3.41Å; C465-K467 VanDerWaalsContact C-N 3.34Å; C465-K467 PolarHBondContact O-N 2.85Å; K467-G469 VanDerWaalsContact C-N 3.34Å
468I91.8Very high94.3Very high88 Ų8841.3 Ų41.345%0.45122%0.218SC..Hα-helixtrans-80.1-20176.3-63.8164.7000111.2I437 L464 C465 E466I437-I468 HydrophobicContact CG2-CD1 3.65Å; I437-I468 HydrophobicContact CG2-CG1 4.24Å; L464-I468 HydrophobicContact CD1-CD1 4.47Å; L464-I468 HydrophobicContact CG-CD1 4.14Å; L464-I468 WeakPolarHBondContact O-CG1 3.5Å; L464-I468 PolarHBondContact O-N 3.3Å; C465-I468 PolarHBondContact O-N 3.23Å; E466-I468 VanDerWaalsContact C-N 3.26Å; E466-I468 PolarHBondContact O-N 2.88Å
469G90.1Very high94.2Very high52 Ų5244.3 Ų44.354%0.53623%0.232SC..THydrogen-bonded Turntrans92.77-176.100000114.6C465 E466 K467 L471C465-G469 PolarHBondContact O-N 2.93Å; E466-G469 PolarHBondContact O-N 2.95Å; K467-G469 VanDerWaalsContact C-N 3.34Å; G469-L471 PolarHBondContact O-N 3.49Å; G469-L471 VanDerWaalsContact O-N 3.12Å
470D93.9Very high94.1Very high61 Ų6148.8 Ų48.833%0.32625%0.252SS..  trans-85.180.4175.5-175.94.9000110.3C465 Q472 S473 S474C465-D470 HydrophobicContact CB-CB 4.41Å; C465-D470 PolarHBondContact O-N 3.42Å; D470-Q472 VanDerWaalsContact C-N 3.31Å; D470-Q472 PolarHBondContact O-N 3.3Å; D470-S473 PolarHBondContact O-OG 3.26Å; D470-S473 PolarHBondContact OD1-N 2.95Å; D470-S473 PolarHBondContact OD1-OG 3.26Å; D470-S473 WeakPolarHBondContact OD2-CB 3.26Å; D470-S473 PolarHBondContact OD2-OG 2.9Å; D470-S474 WeakPolarHBondContact O-CB 3.3Å; D470-S474 PolarHBondContact O-N 3.45Å; D470-S474 VanDerWaalsContact O-N 3.17Å
471L93.5Very high94Very high40 Ų4047.1 Ų47.121%0.20924%0.242CC..Hα-helixtrans-65.2-33.5-175.3-57.8-179.6000112.6G469 Y475 L498 H501 F502 L505G469-L471 PolarHBondContact O-N 3.49Å; G469-L471 VanDerWaalsContact O-N 3.12Å; L471-Y475 WeakPolarHBondContact O-CB 3.41Å; L471-Y475 PolarHBondContact O-N 2.6Å; L471-L498 HydrophobicContact CB-CD2 4.41Å; L471-L498 HydrophobicContact CD2-CD2 3.78Å; L471-H501 HydrophobicContact CD1-CB 3.99Å; L471-F502 HydrophobicContact CB-CE1 3.74Å; L471-F502 HydrophobicContact CB-CZ 4.09Å; L471-L505 HydrophobicContact CD1-CD1 4.27Å
472Q92.8Very high93.8Very high126 Ų12649.2 Ų49.259%0.58925%0.252SS*.Hα-helixtrans-66.6-51.9-177.5-176.367.211.500111D470 S474 Y475 T476D470-Q472 VanDerWaalsContact C-N 3.31Å; D470-Q472 PolarHBondContact O-N 3.3Å; Q472-S474 VanDerWaalsContact C-N 3.3Å; Q472-S474 PolarHBondContact O-N 3.37Å; Q472-Y475 PolarHBondContact O-N 3.41Å; Q472-T476 WeakPolarHBondContact O-CG2 3.3Å; Q472-T476 PolarHBondContact O-N 3.12Å
473S93Very high93.6Very high27 Ų2755.4 Ų55.419%0.18929%0.285CS..Hα-helixtrans-66.8-36.4178.868.80000111.5C465 D470 Y475 T476 A477C465-S473 WeakPolarHBondContact CB-OG 3.38Å; C465-S473 PolarHBondContact SG-OG 3.4Å; D470-S473 PolarHBondContact O-OG 3.26Å; D470-S473 PolarHBondContact OD1-N 2.95Å; D470-S473 PolarHBondContact OD1-OG 3.26Å; D470-S473 WeakPolarHBondContact OD2-CB 3.26Å; D470-S473 PolarHBondContact OD2-OG 2.9Å; S473-Y475 VanDerWaalsContact C-N 3.35Å; S473-Y475 PolarHBondContact O-N 3.35Å; S473-T476 PolarHBondContact O-N 2.95Å; S473-T476 PolarHBondContact O-OG1 3.42Å; S473-A477 PolarHBondContact O-N 3.29Å
474S95.2Very high93.3Very high0 Ų054.1 Ų54.10%028%0.281CS..Hα-helixtrans-56.6-46.9173.6-175.10000112.1S462 D470 Q472 T476 A477 A478S462-S474 WeakPolarHBondContact CB-O 3.36Å; S462-S474 WeakPolarHBondContact O-CB 3.34Å; S462-S474 PolarHBondContact O-OG 2.85Å; D470-S474 WeakPolarHBondContact O-CB 3.3Å; D470-S474 PolarHBondContact O-N 3.45Å; D470-S474 VanDerWaalsContact O-N 3.17Å; Q472-S474 VanDerWaalsContact C-N 3.3Å; Q472-S474 PolarHBondContact O-N 3.37Å; S474-T476 PolarHBondContact O-N 2.89Å; S474-A477 PolarHBondContact O-N 3.35Å; S474-A478 WeakPolarHBondContact O-CB 3.49Å; S474-A478 PolarHBondContact O-N 2.94Å
475Y95.4Very high93Very high45 Ų4554.4 Ų54.418%0.17628%0.282CS..Hα-helixtrans-61.7-45.7178.1-174.8-104.6000112.5L471 Q472 S473 A477 A478 Q479 L495 L498 R499 F502L471-Y475 WeakPolarHBondContact O-CB 3.41Å; L471-Y475 PolarHBondContact O-N 2.6Å; Q472-Y475 PolarHBondContact O-N 3.41Å; S473-Y475 VanDerWaalsContact C-N 3.35Å; S473-Y475 PolarHBondContact O-N 3.35Å; Y475-A477 VanDerWaalsContact C-N 3.3Å; Y475-A477 PolarHBondContact O-N 2.91Å; Y475-A478 PolarHBondContact O-N 3.16Å; Y475-Q479 HydrophobicContact CD1-CG 4.28Å; Y475-Q479 HydrophobicContact CE1-CG 3.95Å; Y475-Q479 HydrophobicContact CE2-CG 4.49Å; Y475-Q479 WeakPolarHBondContact O-CG 3.43Å; Y475-Q479 PolarHBondContact O-N 3.25Å; Y475-Q479 PolarHBondContact OH-NE2 3Å; Y475-Q479 VanDerWaalsContact OH-NE2 3.16Å; Y475-L495 HydrophobicContact CD2-CD2 3.74Å; Y475-L495 HydrophobicContact CE2-CD2 3.65Å; Y475-L498 HydrophobicContact CD2-CB 4.11Å; Y475-L498 HydrophobicContact CD2-CD1 4.23Å; Y475-R499 HydrophobicContact CE2-CG 4.04Å; Y475-F502 HydrophobicContact CD1-CE2 4.21Å; Y475-F502 HydrophobicContact CD2-CD2 4.48Å; Y475-F502 AromaticContact CD2-CE2 3.75Å; Y475-F502 HydrophobicContact CD2-CE2 3.75Å; Y475-F502 HydrophobicContact CE2-CE2 4.43Å; Y475-F502 AromaticContact CG-CE2 3.62Å; Y475-F502 HydrophobicContact CG-CE2 3.62Å; Y475-F502 HydrophobicContact CG-CZ 4.31Å
476T95.3Very high92.7Very high59 Ų5958.1 Ų58.136%0.36231%0.306SS..Hα-helixtrans-62.9-3617961.40000112.9Q472 S473 S474 K480Q472-T476 WeakPolarHBondContact O-CG2 3.3Å; Q472-T476 PolarHBondContact O-N 3.12Å; S473-T476 PolarHBondContact O-N 2.95Å; S473-T476 PolarHBondContact O-OG1 3.42Å; S474-T476 PolarHBondContact O-N 2.89Å; T476-K480 WeakPolarHBondContact O-CG 3.49Å; T476-K480 PolarHBondContact O-N 2.78Å
477A95Very high92.5Very high5 Ų560.4 Ų60.44%0.04132%0.317CS..Hα-helixtrans-74.3-39.3177.600000111.6L461 S473 S474 Y475 Q479 K480 S481L461-A477 HydrophobicContact CB-CB 4.41Å; L461-A477 HydrophobicContact CD2-CB 3.81Å; S473-A477 PolarHBondContact O-N 3.29Å; S474-A477 PolarHBondContact O-N 3.35Å; Y475-A477 VanDerWaalsContact C-N 3.3Å; Y475-A477 PolarHBondContact O-N 2.91Å; A477-Q479 VanDerWaalsContact C-N 3.34Å; A477-Q479 PolarHBondContact O-N 3.14Å; A477-K480 PolarHBondContact O-N 3.14Å; A477-S481 PolarHBondContact O-N 3.31Å
478A95.3Very high92.5Very high0 Ų053.5 Ų53.50%029%0.287CS..Hα-helixtrans-63.3-38.7175.500000112.3S474 Y475 S481 E482 L494 L495S474-A478 WeakPolarHBondContact O-CB 3.49Å; S474-A478 PolarHBondContact O-N 2.94Å; Y475-A478 PolarHBondContact O-N 3.16Å; A478-S481 WeakPolarHBondContact O-CB 3.39Å; A478-S481 PolarHBondContact O-N 3.05Å; A478-E482 PolarHBondContact O-N 3.11Å; A478-L494 HydrophobicContact CB-CD2 3.46Å; A478-L494 VanDerWaalsContact CB-CD2 3.46Å; A478-L495 HydrophobicContact CB-CD2 3.59Å; A478-L495 HydrophobicContact CB-CG 3.86Å
479Q94.9Very high92.6Very high70 Ų7054.5 Ų54.533%0.32729%0.292SS..Hα-helixtrans-61-46.9172.6-74.2-175.3-44.300111.9Y475 A477 S481 E482 D483 L495Y475-Q479 HydrophobicContact CD1-CG 4.28Å; Y475-Q479 HydrophobicContact CE1-CG 3.95Å; Y475-Q479 HydrophobicContact CE2-CG 4.49Å; Y475-Q479 WeakPolarHBondContact O-CG 3.43Å; Y475-Q479 PolarHBondContact O-N 3.25Å; Y475-Q479 PolarHBondContact OH-NE2 3Å; Y475-Q479 VanDerWaalsContact OH-NE2 3.16Å; A477-Q479 VanDerWaalsContact C-N 3.34Å; A477-Q479 PolarHBondContact O-N 3.14Å; Q479-S481 PolarHBondContact O-N 3.29Å; Q479-E482 WeakPolarHBondContact O-CB 3.36Å; Q479-E482 PolarHBondContact O-N 2.69Å; Q479-E482 VanDerWaalsContact O-N 3.14Å; Q479-D483 PolarHBondContact O-N 3.24Å; Q479-L495 HydrophobicContact CG-CD2 4.15Å
480K93.5Very high92.8Very high123 Ų12355.9 Ų55.954%0.53529%0.287SS..Hα-helixtrans-62-33.9175.7-69.8176.8-178.5-178.30112.6N458 T476 A477 D483 A484N458-K480 HydrophobicContact CB-CB 4.43Å; T476-K480 WeakPolarHBondContact O-CG 3.49Å; T476-K480 PolarHBondContact O-N 2.78Å; A477-K480 PolarHBondContact O-N 3.14Å; K480-D483 PolarHBondContact O-N 3.49Å; K480-A484 WeakPolarHBondContact O-CB 3.26Å; K480-A484 PolarHBondContact O-N 3.29Å; K480-A484 VanDerWaalsContact O-N 3.09Å
481S93.9Very high92.8Very high0 Ų053 Ų530%027%0.272CS..Hα-helixtrans-69-39.6175.1-167.10000111.7Y455 A477 A478 Q479 A484 F485 T491Y455-S481 PolarHBondContact O-OG 2.87Å; A477-S481 PolarHBondContact O-N 3.31Å; A478-S481 WeakPolarHBondContact O-CB 3.39Å; A478-S481 PolarHBondContact O-N 3.05Å; Q479-S481 PolarHBondContact O-N 3.29Å; S481-A484 PolarHBondContact O-N 3.22Å; S481-F485 PolarHBondContact O-N 3.2Å; S481-T491 WeakPolarHBondContact OG-CG2 3.35Å
482E93.4Very high92.9Very high61 Ų6154.4 Ų54.429%0.28528%0.277SS..Hα-helixtrans-62.7-40.6171.9-176179.3-154.500111.7A478 Q479 A484 F485 P486 L495A478-E482 PolarHBondContact O-N 3.11Å; Q479-E482 WeakPolarHBondContact O-CB 3.36Å; Q479-E482 PolarHBondContact O-N 2.69Å; Q479-E482 VanDerWaalsContact O-N 3.14Å; E482-A484 VanDerWaalsContact C-N 3.3Å; E482-A484 PolarHBondContact O-N 3.06Å; E482-F485 CarbonylContact O-C 3.57Å; E482-F485 VanDerWaalsContact O-C 3.28Å; E482-F485 PolarHBondContact O-N 3.17Å; E482-P486 WeakPolarHBondContact O-CA 3.4Å; E482-P486 VanDerWaalsContact O-N 3.09Å; E482-L495 HydrophobicContact CB-CD1 4Å; E482-L495 HydrophobicContact CG-CD1 4.33Å; E482-L495 WeakPolarHBondContact OE2-CD1 3.44Å
483D90.3Very high93Very high130 Ų13053.1 Ų53.170%0.69527%0.271SS*.Hα-helixtrans-63.5-36.3175.6-66.7-28.4000112.2Q479 K480Q479-D483 PolarHBondContact O-N 3.24Å; K480-D483 PolarHBondContact O-N 3.49Å
484A88.2Confident93Very high17 Ų1752.3 Ų52.314%0.1427%0.265CS..Hα-helixtrans-76.1-43.6178.100000112.5K480 S481 E482K480-A484 WeakPolarHBondContact O-CB 3.26Å; K480-A484 PolarHBondContact O-N 3.29Å; K480-A484 VanDerWaalsContact O-N 3.09Å; S481-A484 PolarHBondContact O-N 3.22Å; E482-A484 VanDerWaalsContact C-N 3.3Å; E482-A484 PolarHBondContact O-N 3.06Å
485F89.7Confident92.9Very high15 Ų1552.5 Ų52.57%0.06627%0.266CS..  trans-138.792.5178.2-177-149.4000111.2P97 A98 Y455 S481 E482 E487 H488P97-F485 HydrophobicContact CB-CD1 4.45Å; P97-F485 HydrophobicContact CB-CD2 4.33Å; P97-F485 HydrophobicContact CB-CG 4.24Å; P97-F485 HydrophobicContact CG-CD2 3.77Å; P97-F485 HydrophobicContact CG-CE2 4.12Å; P97-F485 HydrophobicContact CG-CG 4.15Å; A98-F485 HydrophobicContact CB-CE1 4.35Å; Y455-F485 HydrophobicContact CD1-CB 4.18Å; Y455-F485 HydrophobicContact CD1-CD1 4.29Å; Y455-F485 HydrophobicContact CD2-CB 4.32Å; Y455-F485 HydrophobicContact CD2-CD1 4.04Å; Y455-F485 HydrophobicContact CE1-CD1 4.35Å; Y455-F485 HydrophobicContact CE2-CD1 4.1Å; Y455-F485 HydrophobicContact CG-CB 3.81Å; Y455-F485 HydrophobicContact CG-CD1 4.15Å; Y455-F485 HydrophobicContact CG-CG 4.46Å; S481-F485 PolarHBondContact O-N 3.2Å; E482-F485 CarbonylContact O-C 3.57Å; E482-F485 VanDerWaalsContact O-C 3.28Å; E482-F485 PolarHBondContact O-N 3.17Å; F485-E487 HydrophobicContact CD2-CB 4.42Å; F485-E487 HydrophobicContact CE2-CB 3.7Å; F485-E487 HydrophobicContact CZ-CB 4.13Å; F485-E487 PolarHBondContact O-N 2.95Å; F485-H488 HydrophobicContact CB-CB 4.43Å; F485-H488 HydrophobicContact CD1-CB 3.35Å; F485-H488 AromaticContact CD1-CD2 3.86Å; F485-H488 AromaticContact CD1-CG 3.85Å; F485-H488 HydrophobicContact CE1-CB 3.58Å; F485-H488 AromaticContact CE1-CD2 3.72Å; F485-H488 HydrophobicContact CG-CB 3.97Å; F485-H488 HydrophobicContact CZ-CB 4.4Å; F485-H488 WeakPolarHBondContact O-CB 3.41Å; F485-H488 PolarHBondContact O-N 3.02Å
486P87.8Confident92.9Very high78 Ų7856.3 Ų56.351%0.50628%0.283SS..THydrogen-bonded Turntrans-73-26-171.326.1-34.7000113.8E482 H488 Q492E482-P486 WeakPolarHBondContact O-CA 3.4Å; E482-P486 VanDerWaalsContact O-N 3.09Å; P486-H488 VanDerWaalsContact C-N 3.25Å; P486-H488 PolarHBondContact O-N 3.07Å; P486-Q492 PolarHBondContact O-NE2 2.77Å
487E87.8Confident92.8Very high105 Ų10557.4 Ų57.449%0.49128%0.284SS..THydrogen-bonded Turntrans-83.20.7-179.4-58.1176.5175.600112.9S90 F485 I489S90-E487 PolarHBondContact OG-OE1 3.42Å; F485-E487 HydrophobicContact CD2-CB 4.42Å; F485-E487 HydrophobicContact CE2-CB 3.7Å; F485-E487 HydrophobicContact CZ-CB 4.13Å; F485-E487 PolarHBondContact O-N 2.95Å; E487-I489 PolarHBondContact O-N 3.35Å
488H91.9Very high92.7Very high22 Ų2257.2 Ų57.210%0.10228%0.282CS..  trans-68.1124.6-178.7-170.5-119.4000112Y455 F459 F485 P486 T491 Q492Y455-H488 AromaticContact CE2-CD2 3.86Å; Y455-H488 AromaticContact CE2-NE2 3.79Å; F459-H488 AromaticContact CD2-CE1 3.92Å; F459-H488 AromaticContact CE1-CE1 3.93Å; F459-H488 AromaticContact CE2-CE1 3.75Å; F459-H488 AromaticContact CZ-CE1 3.73Å; F485-H488 HydrophobicContact CB-CB 4.43Å; F485-H488 HydrophobicContact CD1-CB 3.35Å; F485-H488 AromaticContact CD1-CD2 3.86Å; F485-H488 AromaticContact CD1-CG 3.85Å; F485-H488 HydrophobicContact CE1-CB 3.58Å; F485-H488 AromaticContact CE1-CD2 3.72Å; F485-H488 HydrophobicContact CG-CB 3.97Å; F485-H488 HydrophobicContact CZ-CB 4.4Å; F485-H488 WeakPolarHBondContact O-CB 3.41Å; F485-H488 PolarHBondContact O-N 3.02Å; P486-H488 VanDerWaalsContact C-N 3.25Å; P486-H488 PolarHBondContact O-N 3.07Å; H488-T491 VanDerWaalsContact CB-OG1 3.27Å; H488-T491 WeakPolarHBondContact CB-OG1 3.23Å; H488-T491 WeakPolarHBondContact ND1-CB 3.31Å; H488-T491 WeakPolarHBondContact ND1-CG2 3.37Å; H488-T491 PolarHBondContact ND1-N 3.46Å; H488-T491 VanDerWaalsContact ND1-N 3.18Å; H488-T491 PolarHBondContact ND1-OG1 2.98Å; H488-T491 PolarHBondContact O-OG1 3.49Å; H488-Q492 VanDerWaalsContact O-CG 3.28Å; H488-Q492 WeakPolarHBondContact O-CG 3.38Å; H488-Q492 PolarHBondContact O-N 3.07Å
489I93.4Very high92.7Very high108 Ų10863.3 Ų63.355%0.55431%0.305SS*.Hα-helixtrans-73.3-44.5-172.4-60.4169.9000111E487 T491 Q492 Q493E487-I489 PolarHBondContact O-N 3.35Å; I489-T491 PolarHBondContact O-N 3.14Å; I489-Q492 WeakPolarHBondContact O-CB 3.5Å; I489-Q492 PolarHBondContact O-N 3.3Å; I489-Q493 HydrophobicContact CG2-CG 4.45Å; I489-Q493 WeakPolarHBondContact O-CG 3.41Å; I489-Q493 PolarHBondContact O-N 3.39Å
490D94.6Very high92.6Very high82 Ų8266.2 Ų66.244%0.43932%0.319SS..Hα-helixtrans-71.5-33.9-172-61.7-15.8000112F459 Q493 L494F459-D490 HydrophobicContact CE2-CB 3.72Å; F459-D490 HydrophobicContact CZ-CB 3.44Å; F459-D490 VanDerWaalsContact CZ-CB 3.44Å; D490-Q493 PolarHBondContact O-N 3.42Å; D490-L494 VanDerWaalsContact O-CB 3.31Å; D490-L494 WeakPolarHBondContact O-CB 3.45Å; D490-L494 PolarHBondContact O-N 2.96Å
491T94.7Very high92.4Very high0 Ų064.9 Ų64.90%032%0.315CS..Hα-helixtrans-65.7-41.4172.746.50000111F459 S481 H488 I489 Q493 L494 L495F459-T491 HydrophobicContact CB-CG2 4.31Å; F459-T491 HydrophobicContact CD2-CG2 3.43Å; F459-T491 VanDerWaalsContact CD2-CG2 3.43Å; F459-T491 HydrophobicContact CE2-CG2 4.03Å; F459-T491 HydrophobicContact CG-CG2 4.17Å; S481-T491 WeakPolarHBondContact OG-CG2 3.35Å; H488-T491 VanDerWaalsContact CB-OG1 3.27Å; H488-T491 WeakPolarHBondContact CB-OG1 3.23Å; H488-T491 WeakPolarHBondContact ND1-CB 3.31Å; H488-T491 WeakPolarHBondContact ND1-CG2 3.37Å; H488-T491 PolarHBondContact ND1-N 3.46Å; H488-T491 VanDerWaalsContact ND1-N 3.18Å; H488-T491 PolarHBondContact ND1-OG1 2.98Å; H488-T491 PolarHBondContact O-OG1 3.49Å; I489-T491 PolarHBondContact O-N 3.14Å; T491-Q493 VanDerWaalsContact C-N 3.31Å; T491-Q493 PolarHBondContact O-N 3.27Å; T491-L494 PolarHBondContact O-N 2.84Å; T491-L495 WeakPolarHBondContact O-CB 3.42Å; T491-L495 WeakPolarHBondContact O-CG 3.24Å; T491-L495 PolarHBondContact O-N 2.72Å
492Q94.4Very high92.3Very high69 Ų6968.1 Ų68.132%0.32233%0.329SS..Hα-helixtrans-63.6-38.3176.2-70.5177.215.400111.9P486 H488 I489 K496P486-Q492 PolarHBondContact O-NE2 2.77Å; H488-Q492 VanDerWaalsContact O-CG 3.28Å; H488-Q492 WeakPolarHBondContact O-CG 3.38Å; H488-Q492 PolarHBondContact O-N 3.07Å; I489-Q492 WeakPolarHBondContact O-CB 3.5Å; I489-Q492 PolarHBondContact O-N 3.3Å; Q492-K496 WeakPolarHBondContact O-CD 3.33Å; Q492-K496 VanDerWaalsContact O-CG 3.24Å; Q492-K496 WeakPolarHBondContact O-CG 3.43Å; Q492-K496 PolarHBondContact O-N 2.88Å; Q492-K496 VanDerWaalsContact O-N 3.08Å
493Q94.8Very high92.2Very high100 Ų10069.2 Ų69.247%0.46735%0.348SS..Hα-helixtrans-65.4-47.3175-70.5-178.312.800111.3I489 D490 T491 L495 K496 Q497I489-Q493 HydrophobicContact CG2-CG 4.45Å; I489-Q493 WeakPolarHBondContact O-CG 3.41Å; I489-Q493 PolarHBondContact O-N 3.39Å; D490-Q493 PolarHBondContact O-N 3.42Å; T491-Q493 VanDerWaalsContact C-N 3.31Å; T491-Q493 PolarHBondContact O-N 3.27Å; Q493-L495 PolarHBondContact O-N 3Å; Q493-K496 WeakPolarHBondContact O-CB 3.48Å; Q493-K496 PolarHBondContact O-N 3.16Å; Q493-K496 VanDerWaalsContact O-N 3.17Å; Q493-Q497 WeakPolarHBondContact O-CG 3.45Å; Q493-Q497 PolarHBondContact O-N 3.03Å
494L93.6Very high91.9Very high9 Ų969 Ų695%0.04735%0.352CS..Hα-helixtrans-61.8-42.9178.1-175.2147.7000111.4I463 E466 A478 D490 T491 K496 Q497 L498I463-L494 HydrophobicContact CG1-CD1 3.79Å; E466-L494 VanDerWaalsContact OE2-CD1 3.24Å; E466-L494 WeakPolarHBondContact OE2-CD1 3.48Å; A478-L494 HydrophobicContact CB-CD2 3.46Å; A478-L494 VanDerWaalsContact CB-CD2 3.46Å; D490-L494 VanDerWaalsContact O-CB 3.31Å; D490-L494 WeakPolarHBondContact O-CB 3.45Å; D490-L494 PolarHBondContact O-N 2.96Å; T491-L494 PolarHBondContact O-N 2.84Å; L494-K496 VanDerWaalsContact C-N 3.34Å; L494-K496 PolarHBondContact O-N 2.89Å; L494-Q497 PolarHBondContact O-N 3.18Å; L494-L498 HydrophobicContact CD2-CD1 3.5Å; L494-L498 HydrophobicContact CD2-CG 4.16Å; L494-L498 HydrophobicContact CG-CD1 4.43Å; L494-L498 WeakPolarHBondContact O-CG 3.48Å; L494-L498 PolarHBondContact O-N 3.22Å
495L94.2Very high90.7Very high4 Ų476.7 Ų76.72%0.02139%0.389CS..Hα-helixtrans-62.2-38.4174.4-78.2169.7000112.7Y475 A478 Q479 E482 T491 Q493 R499Y475-L495 HydrophobicContact CD2-CD2 3.74Å; Y475-L495 HydrophobicContact CE2-CD2 3.65Å; A478-L495 HydrophobicContact CB-CD2 3.59Å; A478-L495 HydrophobicContact CB-CG 3.86Å; Q479-L495 HydrophobicContact CG-CD2 4.15Å; E482-L495 HydrophobicContact CB-CD1 4Å; E482-L495 HydrophobicContact CG-CD1 4.33Å; E482-L495 WeakPolarHBondContact OE2-CD1 3.44Å; T491-L495 WeakPolarHBondContact O-CB 3.42Å; T491-L495 WeakPolarHBondContact O-CG 3.24Å; T491-L495 PolarHBondContact O-N 2.72Å; Q493-L495 PolarHBondContact O-N 3Å; L495-R499 WeakPolarHBondContact O-CB 3.33Å; L495-R499 WeakPolarHBondContact O-CG 3.32Å; L495-R499 PolarHBondContact O-N 3.16Å
496K94.4Very high90.8Very high125 Ų12579.8 Ų79.854%0.54341%0.405SS..Hα-helixtrans-64.1-43.5174.4-74.4167-174.51700111.2Q492 Q493 L494 R499 Q500Q492-K496 WeakPolarHBondContact O-CD 3.33Å; Q492-K496 VanDerWaalsContact O-CG 3.24Å; Q492-K496 WeakPolarHBondContact O-CG 3.43Å; Q492-K496 PolarHBondContact O-N 2.88Å; Q492-K496 VanDerWaalsContact O-N 3.08Å; Q493-K496 WeakPolarHBondContact O-CB 3.48Å; Q493-K496 PolarHBondContact O-N 3.16Å; Q493-K496 VanDerWaalsContact O-N 3.17Å; L494-K496 VanDerWaalsContact C-N 3.34Å; L494-K496 PolarHBondContact O-N 2.89Å; K496-R499 PolarHBondContact O-N 3.48Å; K496-Q500 WeakPolarHBondContact O-CG 3.44Å; K496-Q500 PolarHBondContact O-N 3.23Å
497Q93.3Very high90.9Very high83 Ų8379.9 Ų79.939%0.38840%0.4SS..Hα-helixtrans-62.5-49.5177-71169.6-10.800111.3Q493 L494 R499 Q500 H501Q493-Q497 WeakPolarHBondContact O-CG 3.45Å; Q493-Q497 PolarHBondContact O-N 3.03Å; L494-Q497 PolarHBondContact O-N 3.18Å; Q497-R499 VanDerWaalsContact C-N 3.33Å; Q497-R499 PolarHBondContact O-N 3.09Å; Q497-Q500 WeakPolarHBondContact O-CB 3.2Å; Q497-Q500 PolarHBondContact O-N 2.93Å; Q497-H501 PolarHBondContact O-CD2 3.08Å; Q497-H501 PolarHBondContact O-N 3.48Å
498L93.4Very high91.1Very high0 Ų078.5 Ų78.50%040%0.395CS..Hα-helixtrans-60.6-40.7177.8-67.6178.6000112.4L471 Y475 L494 Q500 H501 F502L471-L498 HydrophobicContact CB-CD2 4.41Å; L471-L498 HydrophobicContact CD2-CD2 3.78Å; Y475-L498 HydrophobicContact CD2-CB 4.11Å; Y475-L498 HydrophobicContact CD2-CD1 4.23Å; L494-L498 HydrophobicContact CD2-CD1 3.5Å; L494-L498 HydrophobicContact CD2-CG 4.16Å; L494-L498 HydrophobicContact CG-CD1 4.43Å; L494-L498 WeakPolarHBondContact O-CG 3.48Å; L494-L498 PolarHBondContact O-N 3.22Å; L498-Q500 VanDerWaalsContact C-N 3.31Å; L498-Q500 PolarHBondContact O-N 3.27Å; L498-H501 PolarHBondContact O-N 3.26Å; L498-F502 HydrophobicContact CB-CE2 4.42Å; L498-F502 VanDerWaalsContact O-CD2 3.27Å; L498-F502 WeakPolarHBondContact O-CD2 3.3Å; L498-F502 WeakPolarHBondContact O-CG 3.18Å; L498-F502 PolarHBondContact O-N 3.49Å
499R93.8Very high91.1Very high128 Ų12881.8 Ų81.848%0.48341%0.412SS..Hα-helixtrans-62.7-36.3174.1-74.9175-173.7168.710.1112.3Y475 L495 K496 Q497 A503Y475-R499 HydrophobicContact CE2-CG 4.04Å; L495-R499 WeakPolarHBondContact O-CB 3.33Å; L495-R499 WeakPolarHBondContact O-CG 3.32Å; L495-R499 PolarHBondContact O-N 3.16Å; K496-R499 PolarHBondContact O-N 3.48Å; Q497-R499 VanDerWaalsContact C-N 3.33Å; Q497-R499 PolarHBondContact O-N 3.09Å; R499-A503 PolarHBondContact O-N 3.22Å; R499-A503 VanDerWaalsContact O-N 3.13Å
500Q93Very high90.9Very high132 Ų13280.2 Ų80.262%0.61740%0.404SS*.Hα-helixtrans-66-44.1173.3-72.5173.6-2.200111.3K496 Q497 L498 F502 A503 V504K496-Q500 WeakPolarHBondContact O-CG 3.44Å; K496-Q500 PolarHBondContact O-N 3.23Å; Q497-Q500 WeakPolarHBondContact O-CB 3.2Å; Q497-Q500 PolarHBondContact O-N 2.93Å; L498-Q500 VanDerWaalsContact C-N 3.31Å; L498-Q500 PolarHBondContact O-N 3.27Å; Q500-F502 VanDerWaalsContact C-N 3.32Å; Q500-F502 PolarHBondContact O-N 2.78Å; Q500-A503 PolarHBondContact O-N 3.15Å; Q500-A503 VanDerWaalsContact O-N 3.12Å; Q500-V504 WeakPolarHBondContact O-CG2 3.37Å; Q500-V504 PolarHBondContact O-N 3.46Å; Q500-V504 VanDerWaalsContact O-N 3.17Å
501H90.1Very high90.7Very high95 Ų9580.1 Ų80.144%0.4440%0.401SS..Hα-helixtrans-60-40.6176-75.3-69.4000112.5L471 Q497 L498 A503 V504 L505L471-H501 HydrophobicContact CD1-CB 3.99Å; Q497-H501 PolarHBondContact O-CD2 3.08Å; Q497-H501 PolarHBondContact O-N 3.48Å; L498-H501 PolarHBondContact O-N 3.26Å; H501-A503 VanDerWaalsContact C-N 3.3Å; H501-A503 PolarHBondContact O-N 2.67Å; H501-V504 PolarHBondContact O-N 3.13Å; H501-L505 WeakPolarHBondContact O-CG 3.2Å; H501-L505 PolarHBondContact O-N 3.41Å
502F92.5Very high90.4Very high67 Ų6785.8 Ų85.829%0.29443%0.43SS..Hα-helixtrans-71.1-21.2175.9-63-36000114.5L471 Y475 L498 Q500L471-F502 HydrophobicContact CB-CE1 3.74Å; L471-F502 HydrophobicContact CB-CZ 4.09Å; Y475-F502 HydrophobicContact CD1-CE2 4.21Å; Y475-F502 HydrophobicContact CD2-CD2 4.48Å; Y475-F502 AromaticContact CD2-CE2 3.75Å; Y475-F502 HydrophobicContact CD2-CE2 3.75Å; Y475-F502 HydrophobicContact CE2-CE2 4.43Å; Y475-F502 AromaticContact CG-CE2 3.62Å; Y475-F502 HydrophobicContact CG-CE2 3.62Å; Y475-F502 HydrophobicContact CG-CZ 4.31Å; L498-F502 HydrophobicContact CB-CE2 4.42Å; L498-F502 VanDerWaalsContact O-CD2 3.27Å; L498-F502 WeakPolarHBondContact O-CD2 3.3Å; L498-F502 WeakPolarHBondContact O-CG 3.18Å; L498-F502 PolarHBondContact O-N 3.49Å; Q500-F502 VanDerWaalsContact C-N 3.32Å; Q500-F502 PolarHBondContact O-N 2.78Å
503A90.8Very high90.1Very high84 Ų8487.1 Ų87.169%0.69444%0.438SS*.Hα-helixtrans-83.7-19174.600000112.9R499 Q500 H501R499-A503 PolarHBondContact O-N 3.22Å; R499-A503 VanDerWaalsContact O-N 3.13Å; Q500-A503 PolarHBondContact O-N 3.15Å; Q500-A503 VanDerWaalsContact O-N 3.12Å; H501-A503 VanDerWaalsContact C-N 3.3Å; H501-A503 PolarHBondContact O-N 2.67Å
504V83.9Confident89.7Confident127 Ų12786 Ų8677%0.7744%0.436SS*.Hα-helixtrans-91.9-26.9-179.7173.30000112.1Q500 H501Q500-V504 WeakPolarHBondContact O-CG2 3.37Å; Q500-V504 PolarHBondContact O-N 3.46Å; Q500-V504 VanDerWaalsContact O-N 3.17Å; H501-V504 PolarHBondContact O-N 3.13Å
505L63.4Low89.3Confident178 Ų17893 Ų9393%0.93247%0.471SS*.  trans-78.80171.5-69.1168.2000111.1L471 H501L471-L505 HydrophobicContact CD1-CD1 4.27Å; H501-L505 WeakPolarHBondContact O-CG 3.2Å; H501-L505 PolarHBondContact O-N 3.41Å

Retrieved 505 of 505 residues in 249.2 ms (Link to these results)

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