A0A077Z264_TRITR Loading...

TWiK family of potassium channels protein 9

AlphaFold DB , UniProt , Accession A0A077Z264, Species TRITR (Trichuris trichiura, Whipworm), Gene n/a, Length 799 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
1M29.8Very low29.9Very low242 Ų242151.4 Ų151.4100%1.19276%0.756SS**  011.90-133.3179.5-91.300114.5
2F23.2Very low30.3Very low200 Ų200149.9 Ų149.988%0.87775%0.751SS**  trans-120.811.7-175.9-105.3-84.9000116.6
3Y25.8Very low30.5Very low220 Ų220152.9 Ų152.986%0.86376%0.757SS**SBendtrans-109.25.7-175.9-96-83.3000116.5
4W29.9Very low30.3Very low235 Ų235146.4 Ų146.489%0.8975%0.748SS**SBendtrans-108.9-1.7-176.2-82.758.5000115.5
5S33.4Very low30.6Very low118 Ų118143.1 Ų143.183%0.82574%0.737SS**SBendtrans-79.9-24.6-176.51750000114
6K29.3Very low30.5Very low188 Ų188148.1 Ų148.182%0.81774%0.744SS**SBendtrans-93-16.7-175.2-120.5175.4-179.8178.70115.4G8K6-G8 VanDerWaalsContact C-N 3.35Å
7A30.6Very low31Very low57 Ų57146.4 Ų146.447%0.47173%0.731SS.*THydrogen-bonded Turntrans-79.8-14.8179.600000113.7
8G29.7Very low30.9Very low39 Ų39147.5 Ų147.540%0.40274%0.738SS.*THydrogen-bonded Turntrans-73.5-22.5-177.500000115.4K6K6-G8 VanDerWaalsContact C-N 3.35Å
9S32.5Very low30.8Very low83 Ų83143.7 Ų143.758%0.5874%0.74SS**THydrogen-bonded Turntrans-98.2-15-179.576.30000114.4
10E31.1Very low30.9Very low152 Ų152140.7 Ų140.771%0.7174%0.737SS**THydrogen-bonded Turntrans-92-25.8176.6-69.9-157.4154.500113.1L12 K13E10-L12 PolarHBondContact O-N 3.31Å; E10-K13 PolarHBondContact O-N 3.05Å
11L33.5Very low30.9Very low131 Ų131144.2 Ų144.269%0.68675%0.746SS**THydrogen-bonded Turntrans-66.8-20.4176.3-91.6157.8000114.2
12L35.1Very low30.9Very low134 Ų134137.1 Ų137.170%0.70273%0.727SS**THydrogen-bonded Turntrans-81.4-13.7172.7-81.5161.6000113.5E10E10-L12 PolarHBondContact O-N 3.31Å
13K32.1Very low31.6Very low189 Ų189136.4 Ų136.482%0.82273%0.728SS**THydrogen-bonded Turntrans-96.8-6179.6-70.3-176.8177.8178.60113.8E10E10-K13 PolarHBondContact O-N 3.05Å
14G28.5Very low32Very low61 Ų61130 Ų13063%0.62972%0.72SS**  trans-99.6-9.2-172.100000117.1R16G14-R16 VanDerWaalsContact C-N 3.32Å; G14-R16 PolarHBondContact O-N 3.01Å
15V33.8Very low32.9Very low98 Ų98125.4 Ų125.459%0.59471%0.713SS**  trans-86.573.4-178.1-166.60000110.4F17V15-F17 HydrophobicContact CB-CE2 4.49Å; V15-F17 HydrophobicContact CG1-CD2 3.6Å; V15-F17 HydrophobicContact CG1-CE2 3.33Å; V15-F17 HydrophobicContact CG1-CG 4.35Å; V15-F17 HydrophobicContact CG1-CZ 3.89Å; V15-F17 PolarHBondContact O-N 3.37Å
16R29.5Very low34.2Very low223 Ų223125.8 Ų125.884%0.84271%0.711SS**  trans-75.4100.2159.5-84.4-174.4175.9-179.8-0.4107.8G14 I18G14-R16 VanDerWaalsContact C-N 3.32Å; G14-R16 PolarHBondContact O-N 3.01Å; R16-I18 PolarHBondContact O-N 3.43Å
17F38.9Very low36.1Very low119 Ų119117.9 Ų117.952%0.52268%0.677SS.*  trans-63.499.8167.5-81-85.5000109.5V15 G19V15-F17 HydrophobicContact CB-CE2 4.49Å; V15-F17 HydrophobicContact CG1-CD2 3.6Å; V15-F17 HydrophobicContact CG1-CE2 3.33Å; V15-F17 HydrophobicContact CG1-CG 4.35Å; V15-F17 HydrophobicContact CG1-CZ 3.89Å; V15-F17 PolarHBondContact O-N 3.37Å; F17-G19 PolarHBondContact O-N 2.89Å
18I29.6Very low38.2Very low166 Ų166118 Ų11885%0.85167%0.67SS**  trans-88.998171.8-60171.7000106.7R16R16-I18 PolarHBondContact O-N 3.43Å
19G28.7Very low40.8Very low76 Ų76121.9 Ų121.978%0.78467%0.672SS**  trans146.553.5171.900000116.2F17F17-G19 PolarHBondContact O-N 2.89Å
20A33.5Very low43.2Very low83 Ų83122.7 Ų122.769%0.68667%0.667SS**  trans-149.547.8166.100000110.5
21K29.8Very low45.7Very low214 Ų214115.6 Ų115.693%0.9363%0.634SS**  trans-101.156.5-178.6-158.4-177.1-172.5-177.20109.9
22A31.4Very low48.2Very low94 Ų94109.5 Ų109.578%0.77760%0.602SS**SBendtrans17557.6165.800000112.8
23M36Very low50.5Low184 Ų184104.2 Ų104.291%0.90658%0.579SS**  trans-152.1127.2148-98.5-170.1-170.800107.1
24A34.2Very low53Low85 Ų8599.2 Ų99.270%0.70256%0.555SS**  trans-83.8170.5-160.200000113.1
25D49.9Very low55.8Low139 Ų13996.5 Ų96.574%0.74353%0.526SS*.  trans92139.6155.9-55.6-22000120.6
26T60Low58.3Low127 Ų12795.8 Ų95.878%0.77952%0.516SS*.  trans-86.4121.3-146.939.30000111.8D28T26-D28 PolarHBondContact O-N 3.2Å
27F70.4Confident61Low22 Ų2293.2 Ų93.210%0.09651%0.507CS..  trans-63.6120.7161.4-170.7-89.5000107.8W29 F32 L51 Q54 L59 V67F27-W29 AromaticContact CD1-CD2 3.99Å; F27-W29 HydrophobicContact CD1-CD2 3.99Å; F27-W29 AromaticContact CD1-CE2 3.83Å; F27-W29 HydrophobicContact CD1-CE3 4.46Å; F27-W29 HydrophobicContact CD1-CG 4.28Å; F27-W29 HydrophobicContact CD1-CZ2 4.16Å; F27-W29 HydrophobicContact CE1-CD2 4.42Å; F27-W29 HydrophobicContact CE1-CE3 4.47Å; F27-W29 PolarHBondContact O-N 3.27Å; F27-W29 VanDerWaalsContact O-N 3.14Å; F27-F32 HydrophobicContact CE1-CD2 4.07Å; F27-F32 AromaticContact CE1-CE2 3.52Å; F27-F32 HydrophobicContact CE1-CE2 3.52Å; F27-F32 HydrophobicContact CE1-CZ 4.48Å; F27-F32 AromaticContact CZ-CE2 3.94Å; F27-F32 HydrophobicContact CZ-CE2 3.94Å; F27-L51 HydrophobicContact CE1-CD2 4.35Å; F27-L51 HydrophobicContact CZ-CD2 3.9Å; F27-Q54 HydrophobicContact CD2-CB 4.26Å; F27-Q54 HydrophobicContact CE2-CB 3.97Å; F27-L59 HydrophobicContact CD2-CD2 3.77Å; F27-L59 HydrophobicContact CE2-CD1 4.46Å; F27-L59 HydrophobicContact CE2-CD2 4.38Å; F27-V67 HydrophobicContact CD1-CG2 4.16Å; F27-V67 HydrophobicContact CD2-CG2 4.25Å; F27-V67 HydrophobicContact CE1-CG1 4.23Å; F27-V67 HydrophobicContact CE1-CG2 3.87Å; F27-V67 HydrophobicContact CE2-CG1 3.99Å; F27-V67 HydrophobicContact CE2-CG2 3.91Å; F27-V67 HydrophobicContact CG-CG2 4.34Å; F27-V67 HydrophobicContact CZ-CB 4.28Å; F27-V67 HydrophobicContact CZ-CG1 3.51Å; F27-V67 HydrophobicContact CZ-CG2 3.72Å
28D75.2Confident63.3Low59 Ų5987.7 Ų87.732%0.31648%0.483SS..  trans-82.896.5-174.9176.916.1000109.7T26 E30T26-D28 PolarHBondContact O-N 3.2Å; D28-E30 PolarHBondContact O-N 3.2Å; D28-E30 WeakPolarHBondContact OD1-CB 3.43Å; D28-E30 PolarHBondContact OD1-N 3.08Å
29W83Confident66Low121 Ų12185 Ų8546%0.45847%0.474SS..THydrogen-bonded Turntrans-68.3-12177.7-66.593.7000113.3F27 E31 F32 T66 V67 K70F27-W29 AromaticContact CD1-CD2 3.99Å; F27-W29 HydrophobicContact CD1-CD2 3.99Å; F27-W29 AromaticContact CD1-CE2 3.83Å; F27-W29 HydrophobicContact CD1-CE3 4.46Å; F27-W29 HydrophobicContact CD1-CG 4.28Å; F27-W29 HydrophobicContact CD1-CZ2 4.16Å; F27-W29 HydrophobicContact CE1-CD2 4.42Å; F27-W29 HydrophobicContact CE1-CE3 4.47Å; F27-W29 PolarHBondContact O-N 3.27Å; F27-W29 VanDerWaalsContact O-N 3.14Å; W29-E31 PolarHBondContact O-N 2.89Å; W29-F32 AromaticContact CE3-CD2 3.58Å; W29-F32 HydrophobicContact CE3-CD2 3.58Å; W29-F32 AromaticContact CE3-CE2 3.91Å; W29-F32 HydrophobicContact CE3-CE2 3.91Å; W29-F32 AromaticContact CZ3-CD2 3.87Å; W29-F32 HydrophobicContact CZ3-CD2 3.87Å; W29-F32 AromaticContact CZ3-CE2 3.75Å; W29-F32 HydrophobicContact CZ3-CE2 3.75Å; W29-F32 PolarHBondContact O-N 3.32Å; W29-T66 HydrophobicContact CH2-CG2 3.68Å; W29-T66 HydrophobicContact CZ2-CG2 4.4Å; W29-T66 HydrophobicContact CZ3-CG2 4.43Å; W29-V67 HydrophobicContact CH2-CG2 4.03Å; W29-V67 HydrophobicContact CZ2-CG2 4.43Å; W29-K70 HydrophobicContact CZ3-CB 4.26Å; W29-K70 HydrophobicContact CZ3-CG 4.34Å
30E83.1Confident68.8Low99 Ų9983.5 Ų83.546%0.46345%0.452SS..Hα-helixtrans-63.4-32.3178.9-157.3-161.8139.600111.5D28 F32 G33 R34D28-E30 PolarHBondContact O-N 3.2Å; D28-E30 WeakPolarHBondContact OD1-CB 3.43Å; D28-E30 PolarHBondContact OD1-N 3.08Å; E30-F32 VanDerWaalsContact C-N 3.28Å; E30-F32 PolarHBondContact O-N 3.35Å; E30-G33 CarbonylContact O-C 3.56Å; E30-G33 WeakPolarHBondContact O-CA 3.36Å; E30-G33 PolarHBondContact O-N 3.19Å; E30-R34 VanDerWaalsContact CD-NH2 3.33Å; E30-R34 PolarHBondContact O-N 3.02Å; E30-R34 IonicContact OE1-CZ 2.79Å; E30-R34 IonicContact OE1-NE 3.59Å; E30-R34 PolarHBondContact OE1-NE 2.96Å; E30-R34 VanDerWaalsContact OE1-NE 3.14Å; E30-R34 IonicContact OE1-NH2 2.8Å; E30-R34 PolarHBondContact OE1-NH2 3.17Å; E30-R34 IonicContact OE2-NH2 3.58Å; E30-R34 PolarHBondContact OE2-NH2 3.12Å
31E84.4Confident71.3Confident4 Ų481.5 Ų81.52%0.01943%0.432CS..Hα-helixtrans-63.1-30.8177.6-70.8-64.9148.600112.7W29 R34 L35 R50 L51W29-E31 PolarHBondContact O-N 2.89Å; E31-R34 PolarHBondContact O-N 2.85Å; E31-R34 IonicContact OE1-CZ 3.32Å; E31-R34 IonicContact OE1-NE 3.67Å; E31-R34 IonicContact OE1-NH1 2.74Å; E31-R34 PolarHBondContact OE1-NH1 2.73Å; E31-L35 WeakPolarHBondContact O-CB 3.29Å; E31-L35 PolarHBondContact O-N 2.98Å; E31-R50 VanDerWaalsContact CD-CD 3.46Å; E31-R50 HydrophobicContact CG-CB 4.37Å; E31-R50 VanDerWaalsContact OE1-CD 3.28Å; E31-R50 WeakPolarHBondContact OE1-CD 3.39Å; E31-R50 IonicContact OE1-CZ 2.7Å; E31-R50 IonicContact OE1-NE 3.94Å; E31-R50 IonicContact OE1-NH1 3.4Å; E31-R50 PolarHBondContact OE1-NH1 3.23Å; E31-R50 WeakPolarHBondContact OE2-CD 3.47Å; E31-R50 IonicContact OE2-NH1 3.14Å; E31-L51 HydrophobicContact CB-CD2 3.93Å; E31-L51 HydrophobicContact CB-CG 4.28Å
32F84.5Confident74Confident3 Ų375.1 Ų75.11%0.01342%0.415CS..Hα-helixtrans-68.3-38.1171-78-62.5000112.1F27 W29 E30 R34 L35 E36 L51 V67 K70 L71 C74F27-F32 HydrophobicContact CE1-CD2 4.07Å; F27-F32 AromaticContact CE1-CE2 3.52Å; F27-F32 HydrophobicContact CE1-CE2 3.52Å; F27-F32 HydrophobicContact CE1-CZ 4.48Å; F27-F32 AromaticContact CZ-CE2 3.94Å; F27-F32 HydrophobicContact CZ-CE2 3.94Å; W29-F32 AromaticContact CE3-CD2 3.58Å; W29-F32 HydrophobicContact CE3-CD2 3.58Å; W29-F32 AromaticContact CE3-CE2 3.91Å; W29-F32 HydrophobicContact CE3-CE2 3.91Å; W29-F32 AromaticContact CZ3-CD2 3.87Å; W29-F32 HydrophobicContact CZ3-CD2 3.87Å; W29-F32 AromaticContact CZ3-CE2 3.75Å; W29-F32 HydrophobicContact CZ3-CE2 3.75Å; W29-F32 PolarHBondContact O-N 3.32Å; E30-F32 VanDerWaalsContact C-N 3.28Å; E30-F32 PolarHBondContact O-N 3.35Å; F32-R34 VanDerWaalsContact C-N 3.26Å; F32-R34 PolarHBondContact O-N 3.49Å; F32-L35 HydrophobicContact CD1-CD2 4.35Å; F32-L35 PolarHBondContact O-N 3.42Å; F32-E36 WeakPolarHBondContact O-CG 3.37Å; F32-E36 PolarHBondContact O-N 3.07Å; F32-L51 HydrophobicContact CD1-CD1 4.26Å; F32-L51 HydrophobicContact CD2-CD2 4.39Å; F32-L51 HydrophobicContact CE1-CD1 3.92Å; F32-L51 HydrophobicContact CE1-CD2 4.33Å; F32-L51 HydrophobicContact CE2-CD2 4.14Å; F32-L51 HydrophobicContact CZ-CD1 4.38Å; F32-L51 HydrophobicContact CZ-CD2 4.08Å; F32-V67 HydrophobicContact CE2-CG1 4.1Å; F32-V67 HydrophobicContact CZ-CG1 3.8Å; F32-V67 VanDerWaalsContact CZ-O 3.25Å; F32-V67 WeakPolarHBondContact CZ-O 3.23Å; F32-K70 HydrophobicContact CB-CG 4.13Å; F32-K70 HydrophobicContact CD1-CB 4.31Å; F32-K70 HydrophobicContact CD1-CG 3.75Å; F32-K70 HydrophobicContact CD2-CB 4.42Å; F32-K70 HydrophobicContact CD2-CG 3.9Å; F32-K70 HydrophobicContact CE1-CB 4.13Å; F32-K70 HydrophobicContact CE1-CG 4.09Å; F32-K70 HydrophobicContact CE2-CB 4.17Å; F32-K70 HydrophobicContact CE2-CG 4.16Å; F32-K70 HydrophobicContact CG-CB 4.46Å; F32-K70 HydrophobicContact CG-CG 3.66Å; F32-K70 HydrophobicContact CZ-CB 4.04Å; F32-K70 HydrophobicContact CZ-CG 4.27Å; F32-L71 HydrophobicContact CE1-CB 3.87Å; F32-L71 HydrophobicContact CE1-CD1 4.11Å; F32-L71 HydrophobicContact CZ-CB 4.24Å; F32-C74 HydrophobicContact CD1-CB 4.49Å
33G83.5Confident76.7Confident22 Ų2274.3 Ų74.323%0.22740%0.395CS..Hα-helixtrans-67.2-26.6173.200000113E30 R37E30-G33 CarbonylContact O-C 3.56Å; E30-G33 WeakPolarHBondContact O-CA 3.36Å; E30-G33 PolarHBondContact O-N 3.19Å; G33-R37 WeakPolarHBondContact O-CB 3.41Å; G33-R37 WeakPolarHBondContact O-CG 3.37Å; G33-R37 PolarHBondContact O-N 3.34Å; G33-R37 PolarHBondContact O-NE 3.15Å
34R85.9Confident79.2Confident84 Ų8465.8 Ų65.832%0.31735%0.353SS..Hα-helixtrans-74.4-42.3170.5-67175.2-175.7178-1.2111.1E30 E31 F32 E36 R37 A38E30-R34 VanDerWaalsContact CD-NH2 3.33Å; E30-R34 PolarHBondContact O-N 3.02Å; E30-R34 IonicContact OE1-CZ 2.79Å; E30-R34 IonicContact OE1-NE 3.59Å; E30-R34 PolarHBondContact OE1-NE 2.96Å; E30-R34 VanDerWaalsContact OE1-NE 3.14Å; E30-R34 IonicContact OE1-NH2 2.8Å; E30-R34 PolarHBondContact OE1-NH2 3.17Å; E30-R34 IonicContact OE2-NH2 3.58Å; E30-R34 PolarHBondContact OE2-NH2 3.12Å; E31-R34 PolarHBondContact O-N 2.85Å; E31-R34 IonicContact OE1-CZ 3.32Å; E31-R34 IonicContact OE1-NE 3.67Å; E31-R34 IonicContact OE1-NH1 2.74Å; E31-R34 PolarHBondContact OE1-NH1 2.73Å; F32-R34 VanDerWaalsContact C-N 3.26Å; F32-R34 PolarHBondContact O-N 3.49Å; R34-E36 PolarHBondContact O-N 3.45Å; R34-R37 CarbonylContact O-C 3.53Å; R34-R37 PolarHBondContact O-N 3.06Å; R34-R37 VanDerWaalsContact O-N 3.15Å; R34-A38 PolarHBondContact O-N 3.33Å
35L86.3Confident81.7Confident5 Ų562.8 Ų62.83%0.02633%0.325CS..Hα-helixtrans-60.2-43.3175.4-173.464.7000112E31 F32 R37 A38 T44 C47 L51 L71 C74E31-L35 WeakPolarHBondContact O-CB 3.29Å; E31-L35 PolarHBondContact O-N 2.98Å; F32-L35 HydrophobicContact CD1-CD2 4.35Å; F32-L35 PolarHBondContact O-N 3.42Å; L35-R37 VanDerWaalsContact C-N 3.29Å; L35-R37 PolarHBondContact O-N 3.33Å; L35-A38 WeakPolarHBondContact O-CB 3.47Å; L35-A38 PolarHBondContact O-N 3.46Å; L35-T44 HydrophobicContact CD1-CG2 3.87Å; L35-C47 HydrophobicContact CB-CB 4.26Å; L35-C47 HydrophobicContact CD1-CB 4.05Å; L35-L51 HydrophobicContact CD2-CD1 4.32Å; L35-L71 HydrophobicContact CD2-CD1 4.07Å; L35-C74 HydrophobicContact CD2-CB 3.99Å; L35-C74 HydrophobicContact CG-CB 4.4Å
36E85.8Confident83.7Confident83 Ų8361.1 Ų61.139%0.38831%0.313SS..Hα-helixtrans-64.5-32.1175.6-74.9178.7173.700112.9F32 R34 K70 C74 K76F32-E36 WeakPolarHBondContact O-CG 3.37Å; F32-E36 PolarHBondContact O-N 3.07Å; R34-E36 PolarHBondContact O-N 3.45Å; E36-K70 WeakPolarHBondContact OE1-CE 3.34Å; E36-K70 IonicContact OE1-NZ 3.66Å; E36-K70 PolarHBondContact OE1-NZ 3.16Å; E36-C74 HydrophobicContact CG-CB 3.83Å; E36-C74 VanDerWaalsContact CG-SG 3.55Å; E36-C74 PolarHBondContact OE1-SG 3.4Å; E36-K76 WeakPolarHBondContact O-CE 3.17Å; E36-K76 PolarHBondContact O-NZ 2.81Å
37R87Confident85Confident168 Ų16855.5 Ų55.563%0.63428%0.279SS*.Hα-helixtrans-87.4-8.8178.7-73.3-176.8-70.6156-5.4113.8G33 R34 L35 T39G33-R37 WeakPolarHBondContact O-CB 3.41Å; G33-R37 WeakPolarHBondContact O-CG 3.37Å; G33-R37 PolarHBondContact O-N 3.34Å; G33-R37 PolarHBondContact O-NE 3.15Å; R34-R37 CarbonylContact O-C 3.53Å; R34-R37 PolarHBondContact O-N 3.06Å; R34-R37 VanDerWaalsContact O-N 3.15Å; L35-R37 VanDerWaalsContact C-N 3.29Å; L35-R37 PolarHBondContact O-N 3.33Å; R37-T39 PolarHBondContact O-N 2.9Å
38A86.7Confident85.9Confident3 Ų354.5 Ų54.53%0.02528%0.275CS..  trans-56.7138.4-178.500000111.4R34 L35 E43 K76 L79R34-A38 PolarHBondContact O-N 3.33Å; L35-A38 WeakPolarHBondContact O-CB 3.47Å; L35-A38 PolarHBondContact O-N 3.46Å; A38-E43 WeakPolarHBondContact CA-OE2 3.47Å; A38-E43 HydrophobicContact CB-CB 4.03Å; A38-K76 PolarHBondContact O-NZ 3.46Å; A38-L79 HydrophobicContact CB-CD1 4.28Å; A38-L79 VanDerWaalsContact O-CD1 3.31Å; A38-L79 WeakPolarHBondContact O-CD1 3.43Å
39T86.3Confident86.6Confident110 Ų11057 Ų5768%0.67528%0.282SS*.  trans-116.2-18-178.261.80000112.9R37 E43 L79R37-T39 PolarHBondContact O-N 2.9Å; T39-E43 PolarHBondContact N-OE2 3.29Å; T39-E43 PolarHBondContact OG1-OE2 2.87Å; T39-L79 WeakPolarHBondContact O-CD2 3.3Å
40C87.8Confident86.8Confident45 Ų4555.7 Ų55.730%0.30428%0.278SS..SBendtrans-133.5166.4178.472.50000112.9S42 E43 T44C40-S42 VanDerWaalsContact C-N 3.34Å; C40-S42 PolarHBondContact O-N 3.41Å; C40-S42 PolarHBondContact SG-OG 2.99Å; C40-E43 VanDerWaalsContact SG-CG 3.55Å; C40-T44 PolarHBondContact O-N 3.08Å; C40-T44 PolarHBondContact O-OG1 2.82Å
41S85.8Confident87Confident40 Ų4051.1 Ų51.128%0.2826%0.256SS..Hα-helixtrans-67-31.4-178.650.60000112.9T44 L45S41-T44 WeakPolarHBondContact O-CB 3.2Å; S41-T44 PolarHBondContact O-N 3.25Å; S41-L45 WeakPolarHBondContact O-CB 3.47Å; S41-L45 PolarHBondContact O-N 2.9Å
42S87.5Confident87.2Confident80 Ų8051.5 Ų51.556%0.55926%0.259SS*.Hα-helixtrans-69.4-40.5179.371.70000112.8C40 T44 L45 Q46C40-S42 VanDerWaalsContact C-N 3.34Å; C40-S42 PolarHBondContact O-N 3.41Å; C40-S42 PolarHBondContact SG-OG 2.99Å; S42-T44 VanDerWaalsContact C-N 3.34Å; S42-L45 PolarHBondContact O-N 3.44Å; S42-Q46 PolarHBondContact O-N 2.62Å
43E87.9Confident87.3Confident77 Ų7753.6 Ų53.636%0.3628%0.277SS..Hα-helixtrans-61.5-44.7173.9-75.3171.7173.900110.7A38 T39 C40 L45 Q46 C47A38-E43 WeakPolarHBondContact CA-OE2 3.47Å; A38-E43 HydrophobicContact CB-CB 4.03Å; T39-E43 PolarHBondContact N-OE2 3.29Å; T39-E43 PolarHBondContact OG1-OE2 2.87Å; C40-E43 VanDerWaalsContact SG-CG 3.55Å; E43-L45 PolarHBondContact O-N 3.19Å; E43-Q46 PolarHBondContact O-N 3.49Å; E43-C47 PolarHBondContact O-N 3.34Å; E43-C47 PolarHBondContact O-SG 3.29Å
44T87Confident87.2Confident6 Ų654.4 Ų54.44%0.03728%0.275CS..Hα-helixtrans-57.9-50.5176.3-54.60000110.2L35 C40 S41 S42 Q46 C47 L48 L83L35-T44 HydrophobicContact CD1-CG2 3.87Å; C40-T44 PolarHBondContact O-N 3.08Å; C40-T44 PolarHBondContact O-OG1 2.82Å; S41-T44 WeakPolarHBondContact O-CB 3.2Å; S41-T44 PolarHBondContact O-N 3.25Å; S42-T44 VanDerWaalsContact C-N 3.34Å; T44-Q46 VanDerWaalsContact C-N 3.34Å; T44-Q46 PolarHBondContact O-N 3.46Å; T44-C47 PolarHBondContact O-N 3.25Å; T44-L48 HydrophobicContact CG2-CD1 4.29Å; T44-L48 WeakPolarHBondContact O-CG 3.26Å; T44-L48 PolarHBondContact O-N 3.21Å; T44-L83 HydrophobicContact CG2-CD1 4.35Å
45L88.4Confident87Confident21 Ų2150.5 Ų50.511%0.1126%0.261CS..Hα-helixtrans-60.6-41178.8-176.765.9000112.7S41 S42 E43 L48 K49 L83 E87S41-L45 WeakPolarHBondContact O-CB 3.47Å; S41-L45 PolarHBondContact O-N 2.9Å; S42-L45 PolarHBondContact O-N 3.44Å; E43-L45 PolarHBondContact O-N 3.19Å; L45-L48 PolarHBondContact O-N 3.01Å; L45-K49 HydrophobicContact CG-CD 4.49Å; L45-K49 WeakPolarHBondContact O-CG 3.49Å; L45-K49 PolarHBondContact O-N 2.9Å; L45-L83 HydrophobicContact CB-CD2 4.35Å; L45-E87 HydrophobicContact CD1-CB 3.95Å; L45-E87 HydrophobicContact CD1-CG 3.84Å; L45-E87 HydrophobicContact CD2-CG 3.87Å; L45-E87 WeakPolarHBondContact CD2-OE1 3.45Å; L45-E87 HydrophobicContact CG-CG 4.46Å
46Q90.4Very high86.4Confident105 Ų10555.8 Ų55.849%0.49129%0.285SS..Hα-helixtrans-64.8-42.1179.1-170176.125.700111.6S42 E43 T44 K49 R50S42-Q46 PolarHBondContact O-N 2.62Å; E43-Q46 PolarHBondContact O-N 3.49Å; T44-Q46 VanDerWaalsContact C-N 3.34Å; T44-Q46 PolarHBondContact O-N 3.46Å; Q46-K49 PolarHBondContact O-N 3.29Å; Q46-R50 WeakPolarHBondContact O-CG 3.41Å; Q46-R50 PolarHBondContact O-N 2.88Å; Q46-R50 VanDerWaalsContact O-N 3.15Å
47C88.6Confident85.4Confident8 Ų859.1 Ų59.15%0.05431%0.305CS..Hα-helixtrans-61.6-45.7174.3-62.90000110.7L35 E43 T44 K49 R50 L51L35-C47 HydrophobicContact CB-CB 4.26Å; L35-C47 HydrophobicContact CD1-CB 4.05Å; E43-C47 PolarHBondContact O-N 3.34Å; E43-C47 PolarHBondContact O-SG 3.29Å; T44-C47 PolarHBondContact O-N 3.25Å; C47-K49 PolarHBondContact O-N 3.45Å; C47-R50 PolarHBondContact O-N 3.47Å; C47-L51 WeakPolarHBondContact O-CG 3.43Å; C47-L51 PolarHBondContact O-N 3.47Å
48L89.2Confident84.1Confident2 Ų253.9 Ų53.91%0.0130%0.303CS..Hα-helixtrans-60.6-41.4178.3-67.8177.3000112.7T44 L45 R50 L51 S52 L71 L83 Y91 I94T44-L48 HydrophobicContact CG2-CD1 4.29Å; T44-L48 WeakPolarHBondContact O-CG 3.26Å; T44-L48 PolarHBondContact O-N 3.21Å; L45-L48 PolarHBondContact O-N 3.01Å; L48-R50 VanDerWaalsContact C-N 3.35Å; L48-R50 PolarHBondContact O-N 2.63Å; L48-L51 PolarHBondContact O-N 2.97Å; L48-S52 VanDerWaalsContact O-CB 3.3Å; L48-S52 WeakPolarHBondContact O-CB 2.92Å; L48-S52 PolarHBondContact O-N 2.64Å; L48-L71 HydrophobicContact CD2-CD1 3.87Å; L48-L83 HydrophobicContact CD1-CD1 4.34Å; L48-Y91 HydrophobicContact CD1-CD2 3.85Å; L48-Y91 HydrophobicContact CD1-CG 4.46Å; L48-Y91 HydrophobicContact CD2-CD2 3.52Å; L48-Y91 HydrophobicContact CD2-CE2 4.05Å; L48-Y91 HydrophobicContact CG-CD2 4.34Å; L48-I94 HydrophobicContact CB-CD1 4.43Å; L48-I94 HydrophobicContact CD2-CD1 3.98Å
49K89.5Confident83Confident111 Ų11154.9 Ų54.948%0.48331%0.308SS..Hα-helixtrans-62.4-40.9175.7-75179177.6-1800112.3L45 Q46 C47 S52 A53L45-K49 HydrophobicContact CG-CD 4.49Å; L45-K49 WeakPolarHBondContact O-CG 3.49Å; L45-K49 PolarHBondContact O-N 2.9Å; Q46-K49 PolarHBondContact O-N 3.29Å; C47-K49 PolarHBondContact O-N 3.45Å; K49-S52 WeakPolarHBondContact O-CB 3.32Å; K49-S52 PolarHBondContact O-N 3.04Å; K49-A53 PolarHBondContact O-N 3.4Å; K49-A53 VanDerWaalsContact O-N 3.08Å
50R88.1Confident82Confident94 Ų9452.1 Ų52.136%0.35529%0.292SS..Hα-helixtrans-68.3-44.2177.5-70.4177-177.7171.94.1112E31 Q46 C47 L48 S52 A53 Q54E31-R50 VanDerWaalsContact CD-CD 3.46Å; E31-R50 HydrophobicContact CG-CB 4.37Å; E31-R50 VanDerWaalsContact OE1-CD 3.28Å; E31-R50 WeakPolarHBondContact OE1-CD 3.39Å; E31-R50 IonicContact OE1-CZ 2.7Å; E31-R50 IonicContact OE1-NE 3.94Å; E31-R50 IonicContact OE1-NH1 3.4Å; E31-R50 PolarHBondContact OE1-NH1 3.23Å; E31-R50 WeakPolarHBondContact OE2-CD 3.47Å; E31-R50 IonicContact OE2-NH1 3.14Å; Q46-R50 WeakPolarHBondContact O-CG 3.41Å; Q46-R50 PolarHBondContact O-N 2.88Å; Q46-R50 VanDerWaalsContact O-N 3.15Å; C47-R50 PolarHBondContact O-N 3.47Å; L48-R50 VanDerWaalsContact C-N 3.35Å; L48-R50 PolarHBondContact O-N 2.63Å; R50-S52 VanDerWaalsContact C-N 3.31Å; R50-S52 PolarHBondContact O-N 2.72Å; R50-A53 PolarHBondContact O-N 3.35Å; R50-Q54 WeakPolarHBondContact O-CG 3.36Å; R50-Q54 PolarHBondContact O-N 2.92Å; R50-Q54 VanDerWaalsContact O-N 3.09Å
51L87Confident81Confident3 Ų352.8 Ų52.82%0.01630%0.296CS..Hα-helixtrans-59.9-42.8173.9-70.6171.2000111.1F27 E31 F32 L35 C47 L48 A53 Q54 V55 L71 I94F27-L51 HydrophobicContact CE1-CD2 4.35Å; F27-L51 HydrophobicContact CZ-CD2 3.9Å; E31-L51 HydrophobicContact CB-CD2 3.93Å; E31-L51 HydrophobicContact CB-CG 4.28Å; F32-L51 HydrophobicContact CD1-CD1 4.26Å; F32-L51 HydrophobicContact CD2-CD2 4.39Å; F32-L51 HydrophobicContact CE1-CD1 3.92Å; F32-L51 HydrophobicContact CE1-CD2 4.33Å; F32-L51 HydrophobicContact CE2-CD2 4.14Å; F32-L51 HydrophobicContact CZ-CD1 4.38Å; F32-L51 HydrophobicContact CZ-CD2 4.08Å; L35-L51 HydrophobicContact CD2-CD1 4.32Å; C47-L51 WeakPolarHBondContact O-CG 3.43Å; C47-L51 PolarHBondContact O-N 3.47Å; L48-L51 PolarHBondContact O-N 2.97Å; L51-A53 PolarHBondContact O-N 3.36Å; L51-Q54 PolarHBondContact O-N 3.31Å; L51-V55 WeakPolarHBondContact O-CG2 3.28Å; L51-V55 PolarHBondContact O-N 3.15Å; L51-V55 VanDerWaalsContact O-N 3.12Å; L51-L71 HydrophobicContact CD1-CD1 4.05Å; L51-I94 HydrophobicContact CB-CD1 4.28Å
52S87.9Confident80.3Confident11 Ų1151.8 Ų51.88%0.07729%0.292CS..Hα-helixtrans-57.9-44.7175.9-164.10000112.5L48 K49 R50 Q54 V55 E56 K97L48-S52 VanDerWaalsContact O-CB 3.3Å; L48-S52 WeakPolarHBondContact O-CB 2.92Å; L48-S52 PolarHBondContact O-N 2.64Å; K49-S52 WeakPolarHBondContact O-CB 3.32Å; K49-S52 PolarHBondContact O-N 3.04Å; R50-S52 VanDerWaalsContact C-N 3.31Å; R50-S52 PolarHBondContact O-N 2.72Å; S52-Q54 PolarHBondContact O-N 2.71Å; S52-V55 PolarHBondContact O-N 3.23Å; S52-E56 PolarHBondContact O-N 2.92Å; S52-E56 VanDerWaalsContact O-N 3.14Å; S52-K97 VanDerWaalsContact OG-CD 3.31Å; S52-K97 WeakPolarHBondContact OG-CD 3.35Å; S52-K97 PolarHBondContact OG-NZ 3.07Å
53A85.7Confident79.8Confident47 Ų4753.9 Ų53.939%0.38829%0.287SS..Hα-helixtrans-66.5-3517800000112.9K49 R50 L51 V55 E56 L57K49-A53 PolarHBondContact O-N 3.4Å; K49-A53 VanDerWaalsContact O-N 3.08Å; R50-A53 PolarHBondContact O-N 3.35Å; L51-A53 PolarHBondContact O-N 3.36Å; A53-V55 VanDerWaalsContact C-N 3.34Å; A53-E56 PolarHBondContact O-N 2.91Å; A53-L57 PolarHBondContact O-N 3.38Å
54Q82.4Confident79.7Confident39 Ų3950.2 Ų50.218%0.18227%0.27CS..Hα-helixtrans-68.4-33.8175.5-70.3-177.832.400112.5F27 R50 L51 S52F27-Q54 HydrophobicContact CD2-CB 4.26Å; F27-Q54 HydrophobicContact CE2-CB 3.97Å; R50-Q54 WeakPolarHBondContact O-CG 3.36Å; R50-Q54 PolarHBondContact O-N 2.92Å; R50-Q54 VanDerWaalsContact O-N 3.09Å; L51-Q54 PolarHBondContact O-N 3.31Å; S52-Q54 PolarHBondContact O-N 2.71Å
55V82.7Confident79.5Confident3 Ų352.1 Ų52.12%0.01828%0.28CS..Hα-helixtrans-70-37.6175.7175.40000111.3L51 S52 A53 L57 G58 L59 F64 I94 K97 A98L51-V55 WeakPolarHBondContact O-CG2 3.28Å; L51-V55 PolarHBondContact O-N 3.15Å; L51-V55 VanDerWaalsContact O-N 3.12Å; S52-V55 PolarHBondContact O-N 3.23Å; A53-V55 VanDerWaalsContact C-N 3.34Å; V55-L57 PolarHBondContact O-N 3.36Å; V55-G58 PolarHBondContact O-N 3.39Å; V55-G58 VanDerWaalsContact O-N 3.14Å; V55-L59 HydrophobicContact CB-CD1 4.47Å; V55-L59 HydrophobicContact CG1-CD1 4.38Å; V55-L59 HydrophobicContact CG2-CD1 3.91Å; V55-F64 HydrophobicContact CG2-CD2 4.37Å; V55-F64 HydrophobicContact CG2-CE2 4.26Å; V55-I94 HydrophobicContact CG2-CG2 3.95Å; V55-K97 HydrophobicContact CG1-CB 3.97Å; V55-A98 HydrophobicContact CG1-CB 3.83Å
56E72.7Confident79.3Confident116 Ų11654.7 Ų54.754%0.54230%0.297SS..Hα-helixtrans-59.4-27.5175.6-90.6172174.100114.2S52 A53 G58 K97S52-E56 PolarHBondContact O-N 2.92Å; S52-E56 VanDerWaalsContact O-N 3.14Å; A53-E56 PolarHBondContact O-N 2.91Å; E56-G58 PolarHBondContact O-N 3.34Å; E56-K97 HydrophobicContact CG-CB 4.42Å; E56-K97 HydrophobicContact CG-CD 3.81Å; E56-K97 HydrophobicContact CG-CG 4.12Å; E56-K97 WeakPolarHBondContact OE1-CE 3.44Å; E56-K97 IonicContact OE1-NZ 2.71Å; E56-K97 PolarHBondContact OE1-NZ 3.45Å; E56-K97 IonicContact OE2-NZ 3.72Å
57L65.8Low79.1Confident153 Ų15349.9 Ų49.980%0.80128%0.275SS*.THydrogen-bonded Turntrans-738177.2-67.2171.6000113.6A53 V55A53-L57 PolarHBondContact O-N 3.38Å; V55-L57 PolarHBondContact O-N 3.36Å
58G59.8Low79.1Confident57 Ų5749.5 Ų49.559%0.58827%0.272SS*.THydrogen-bonded Turntrans82.172.7170.100000112.8V55 E56 C60V55-G58 PolarHBondContact O-N 3.39Å; V55-G58 VanDerWaalsContact O-N 3.14Å; E56-G58 PolarHBondContact O-N 3.34Å; G58-C60 PolarHBondContact O-N 3.41Å
59L63.6Low78.9Confident25 Ų2553.8 Ų53.813%0.13129%0.292CS..PPolyproline II helixtrans-55.2129.9168.4-76175.8000110.5F27 V55 R63 F64 V67F27-L59 HydrophobicContact CD2-CD2 3.77Å; F27-L59 HydrophobicContact CE2-CD1 4.46Å; F27-L59 HydrophobicContact CE2-CD2 4.38Å; V55-L59 HydrophobicContact CB-CD1 4.47Å; V55-L59 HydrophobicContact CG1-CD1 4.38Å; V55-L59 HydrophobicContact CG2-CD1 3.91Å; L59-R63 HydrophobicContact CB-CB 4.4Å; L59-R63 HydrophobicContact CD2-CB 4.19Å; L59-F64 HydrophobicContact CD1-CB 4.16Å; L59-F64 HydrophobicContact CD1-CD2 3.95Å; L59-V67 HydrophobicContact CD1-CG2 4.29Å
60C64.7Low78.8Confident52 Ų5252 Ų5235%0.35128%0.284SS..PPolyproline II helixtrans-55.9144.9172-56.50000110.5G58 G62 R63G58-C60 PolarHBondContact O-N 3.41Å; C60-G62 PolarHBondContact O-N 3.43Å; C60-R63 HydrophobicContact CB-CG 4.48Å; C60-R63 WeakPolarHBondContact O-CB 3.33Å; C60-R63 PolarHBondContact O-N 2.85Å; C60-R63 VanDerWaalsContact O-N 3.1Å
61P66.6Low78.8Confident58 Ų5847.6 Ų47.638%0.37727%0.268SS..THydrogen-bonded Turntrans-48.7134.4173.9-25.132.1000112.1
62G70Confident78.9Confident19 Ų1947.6 Ų47.620%0.19627%0.268CS..THydrogen-bonded Turntrans93.9-22.2-176.700000115.1C60 D102C60-G62 PolarHBondContact O-N 3.43Å; G62-D102 VanDerWaalsContact C-OD2 3.32Å; G62-D102 VanDerWaalsContact CA-OD1 3.31Å; G62-D102 WeakPolarHBondContact CA-OD1 3.23Å; G62-D102 VanDerWaalsContact CA-OD2 3.28Å; G62-D102 WeakPolarHBondContact CA-OD2 3.44Å; G62-D102 PolarHBondContact N-OD1 3.21Å; G62-D102 PolarHBondContact N-OD2 3.33Å
63R77.1Confident78.7Confident124 Ų12452 Ų5247%0.46829%0.29SS..Hα-helixtrans-74.9-28.8-176.2-75.7-167.2172.2-173.81.6113.5L59 C60 L65 T66 V67 D102L59-R63 HydrophobicContact CB-CB 4.4Å; L59-R63 HydrophobicContact CD2-CB 4.19Å; C60-R63 HydrophobicContact CB-CG 4.48Å; C60-R63 WeakPolarHBondContact O-CB 3.33Å; C60-R63 PolarHBondContact O-N 2.85Å; C60-R63 VanDerWaalsContact O-N 3.1Å; R63-L65 PolarHBondContact O-N 3.3Å; R63-T66 PolarHBondContact O-N 3.18Å; R63-V67 PolarHBondContact O-N 3.28Å; R63-D102 PolarHBondContact N-OD2 3.16Å
64F86.5Confident78.8Confident0 Ų050 Ų500%027%0.274CS..Hα-helixtrans-71.9-19-176.7-174-101.7000112.6V55 L59 T66 V67 G68 I94 F95 A98 D102 V103 L106V55-F64 HydrophobicContact CG2-CD2 4.37Å; V55-F64 HydrophobicContact CG2-CE2 4.26Å; L59-F64 HydrophobicContact CD1-CB 4.16Å; L59-F64 HydrophobicContact CD1-CD2 3.95Å; F64-T66 VanDerWaalsContact C-N 3.35Å; F64-T66 PolarHBondContact O-N 2.78Å; F64-V67 HydrophobicContact CD2-CB 4.15Å; F64-V67 HydrophobicContact CD2-CG1 4.13Å; F64-V67 HydrophobicContact CE2-CG1 4.19Å; F64-V67 PolarHBondContact O-N 3.49Å; F64-G68 PolarHBondContact O-N 3.29Å; F64-I94 HydrophobicContact CE2-CG2 4.04Å; F64-I94 HydrophobicContact CZ-CG2 4.41Å; F64-F95 AromaticContact CE1-CD1 3.77Å; F64-F95 HydrophobicContact CE1-CD1 3.77Å; F64-F95 HydrophobicContact CE1-CE1 4.23Å; F64-F95 HydrophobicContact CE1-CG 4.45Å; F64-F95 AromaticContact CZ-CD1 3.84Å; F64-F95 HydrophobicContact CZ-CD1 3.84Å; F64-F95 HydrophobicContact CZ-CE1 4.22Å; F64-F95 HydrophobicContact CZ-CG 4.19Å; F64-A98 HydrophobicContact CB-CB 4.09Å; F64-A98 HydrophobicContact CD1-CB 3.55Å; F64-A98 HydrophobicContact CD2-CB 3.38Å; F64-A98 HydrophobicContact CE1-CB 3.73Å; F64-A98 HydrophobicContact CE2-CB 3.56Å; F64-A98 HydrophobicContact CG-CB 3.37Å; F64-A98 HydrophobicContact CZ-CB 3.72Å; F64-D102 HydrophobicContact CB-CB 3.78Å; F64-D102 HydrophobicContact CD1-CB 4.31Å; F64-D102 PolarHBondContact N-OD2 3.31Å; F64-D102 VanDerWaalsContact N-OD2 3.13Å; F64-V103 HydrophobicContact CD1-CG2 3.71Å; F64-V103 HydrophobicContact CE1-CG2 3.59Å; F64-L106 HydrophobicContact CD1-CD2 4.48Å; F64-L106 HydrophobicContact CE1-CD2 4.07Å
65L83.9Confident79Confident46 Ų4648.8 Ų48.824%0.24127%0.269CS..Hα-helixtrans-53.2-52.4172.8-70173.9000111.3R63 E69 D102 L105 L106R63-L65 PolarHBondContact O-N 3.3Å; L65-E69 WeakPolarHBondContact O-CB 3.37Å; L65-E69 VanDerWaalsContact O-CG 3.3Å; L65-E69 WeakPolarHBondContact O-CG 3.15Å; L65-E69 PolarHBondContact O-N 2.69Å; L65-D102 HydrophobicContact CD2-CB 4.5Å; L65-D102 VanDerWaalsContact CD2-O 3.3Å; L65-D102 WeakPolarHBondContact CD2-O 3.29Å; L65-D102 HydrophobicContact CG-CB 4.3Å; L65-L105 HydrophobicContact CD2-CB 3.79Å; L65-L106 HydrophobicContact CD2-CB 3.96Å
66T82.6Confident79.1Confident76 Ų7653.1 Ų53.147%0.46629%0.287SS..Hα-helixtrans-71.7-39-178.1-44.40000112W29 R63 F64 K70W29-T66 HydrophobicContact CH2-CG2 3.68Å; W29-T66 HydrophobicContact CZ2-CG2 4.4Å; W29-T66 HydrophobicContact CZ3-CG2 4.43Å; R63-T66 PolarHBondContact O-N 3.18Å; F64-T66 VanDerWaalsContact C-N 3.35Å; F64-T66 PolarHBondContact O-N 2.78Å; T66-K70 WeakPolarHBondContact O-CB 3.41Å; T66-K70 PolarHBondContact O-N 3.19Å
67V86.6Confident79.8Confident4 Ų451.8 Ų51.82%0.02428%0.281CS..Hα-helixtrans-63.3-46.8177.4174.80000110.5F27 W29 F32 L59 R63 F64 K70 L71F27-V67 HydrophobicContact CD1-CG2 4.16Å; F27-V67 HydrophobicContact CD2-CG2 4.25Å; F27-V67 HydrophobicContact CE1-CG1 4.23Å; F27-V67 HydrophobicContact CE1-CG2 3.87Å; F27-V67 HydrophobicContact CE2-CG1 3.99Å; F27-V67 HydrophobicContact CE2-CG2 3.91Å; F27-V67 HydrophobicContact CG-CG2 4.34Å; F27-V67 HydrophobicContact CZ-CB 4.28Å; F27-V67 HydrophobicContact CZ-CG1 3.51Å; F27-V67 HydrophobicContact CZ-CG2 3.72Å; W29-V67 HydrophobicContact CH2-CG2 4.03Å; W29-V67 HydrophobicContact CZ2-CG2 4.43Å; F32-V67 HydrophobicContact CE2-CG1 4.1Å; F32-V67 HydrophobicContact CZ-CG1 3.8Å; F32-V67 VanDerWaalsContact CZ-O 3.25Å; F32-V67 WeakPolarHBondContact CZ-O 3.23Å; L59-V67 HydrophobicContact CD1-CG2 4.29Å; R63-V67 PolarHBondContact O-N 3.28Å; F64-V67 HydrophobicContact CD2-CB 4.15Å; F64-V67 HydrophobicContact CD2-CG1 4.13Å; F64-V67 HydrophobicContact CE2-CG1 4.19Å; F64-V67 PolarHBondContact O-N 3.49Å; V67-K70 PolarHBondContact O-N 2.94Å; V67-L71 WeakPolarHBondContact O-CB 3.46Å; V67-L71 PolarHBondContact O-N 2.98Å
68G88Confident80.8Confident0 Ų050.5 Ų50.50%028%0.275CS..Hα-helixtrans-70.7-38.5-179.400000113.2F64 K70 L71 L72F64-G68 PolarHBondContact O-N 3.29Å; G68-K70 VanDerWaalsContact C-N 3.31Å; G68-K70 PolarHBondContact O-N 3.44Å; G68-L71 PolarHBondContact O-N 3.15Å; G68-L72 WeakPolarHBondContact O-CG 3.42Å; G68-L72 PolarHBondContact O-N 3.47Å
69E86.7Confident82.1Confident91 Ų9148.5 Ų48.543%0.42525%0.251SS..Hα-helixtrans-58.1-45.6170.4-78.8178.6173.500111.1L65 N73 L106L65-E69 WeakPolarHBondContact O-CB 3.37Å; L65-E69 VanDerWaalsContact O-CG 3.3Å; L65-E69 WeakPolarHBondContact O-CG 3.15Å; L65-E69 PolarHBondContact O-N 2.69Å; E69-N73 WeakPolarHBondContact O-CB 3.42Å; E69-N73 VanDerWaalsContact O-CG 3.28Å; E69-N73 PolarHBondContact O-N 3.05Å; E69-N73 VanDerWaalsContact O-N 3.15Å; E69-N73 PolarHBondContact O-ND2 2.8Å; E69-L106 HydrophobicContact CB-CD1 4.32Å; E69-L106 HydrophobicContact CG-CD1 3.43Å; E69-L106 VanDerWaalsContact CG-CD1 3.43Å
70K85.8Confident83.3Confident75 Ų7547.5 Ų47.533%0.32625%0.245SC..Hα-helixtrans-66.1-41.4178.5-166.961.8175.7161.60111.2W29 F32 E36 T66 V67 G68 L72 N73 C74W29-K70 HydrophobicContact CZ3-CB 4.26Å; W29-K70 HydrophobicContact CZ3-CG 4.34Å; F32-K70 HydrophobicContact CB-CG 4.13Å; F32-K70 HydrophobicContact CD1-CB 4.31Å; F32-K70 HydrophobicContact CD1-CG 3.75Å; F32-K70 HydrophobicContact CD2-CB 4.42Å; F32-K70 HydrophobicContact CD2-CG 3.9Å; F32-K70 HydrophobicContact CE1-CB 4.13Å; F32-K70 HydrophobicContact CE1-CG 4.09Å; F32-K70 HydrophobicContact CE2-CB 4.17Å; F32-K70 HydrophobicContact CE2-CG 4.16Å; F32-K70 HydrophobicContact CG-CB 4.46Å; F32-K70 HydrophobicContact CG-CG 3.66Å; F32-K70 HydrophobicContact CZ-CB 4.04Å; F32-K70 HydrophobicContact CZ-CG 4.27Å; E36-K70 WeakPolarHBondContact OE1-CE 3.34Å; E36-K70 IonicContact OE1-NZ 3.66Å; E36-K70 PolarHBondContact OE1-NZ 3.16Å; T66-K70 WeakPolarHBondContact O-CB 3.41Å; T66-K70 PolarHBondContact O-N 3.19Å; V67-K70 PolarHBondContact O-N 2.94Å; G68-K70 VanDerWaalsContact C-N 3.31Å; G68-K70 PolarHBondContact O-N 3.44Å; K70-L72 PolarHBondContact O-N 3.11Å; K70-N73 PolarHBondContact O-N 3.41Å; K70-C74 VanDerWaalsContact CD-SG 3.54Å; K70-C74 WeakPolarHBondContact CE-SG 3.47Å; K70-C74 WeakPolarHBondContact O-CB 3.43Å; K70-C74 PolarHBondContact O-N 2.84Å; K70-C74 PolarHBondContact O-SG 3.47Å
71L89.5Confident84.4Confident1 Ų148.8 Ų48.81%0.00525%0.249CC..Hα-helixtrans-59.6-46.4177-175.465.2000112.6F32 L35 L48 L51 V67 G68 N73 T75 Y91 I94 F95F32-L71 HydrophobicContact CE1-CB 3.87Å; F32-L71 HydrophobicContact CE1-CD1 4.11Å; F32-L71 HydrophobicContact CZ-CB 4.24Å; L35-L71 HydrophobicContact CD2-CD1 4.07Å; L48-L71 HydrophobicContact CD2-CD1 3.87Å; L51-L71 HydrophobicContact CD1-CD1 4.05Å; V67-L71 WeakPolarHBondContact O-CB 3.46Å; V67-L71 PolarHBondContact O-N 2.98Å; G68-L71 PolarHBondContact O-N 3.15Å; L71-N73 VanDerWaalsContact C-N 3.31Å; L71-N73 PolarHBondContact O-N 3.32Å; L71-T75 PolarHBondContact O-N 3.32Å; L71-T75 PolarHBondContact O-OG1 2.88Å; L71-Y91 HydrophobicContact CD1-CD2 4.46Å; L71-Y91 HydrophobicContact CD1-CE2 3.74Å; L71-Y91 HydrophobicContact CD2-CE2 4.1Å; L71-Y91 HydrophobicContact CG-CE2 3.7Å; L71-Y91 PolarHBondContact O-OH 3.38Å; L71-I94 HydrophobicContact CD2-CB 4.37Å; L71-I94 HydrophobicContact CD2-CD1 4.09Å; L71-I94 HydrophobicContact CD2-CG2 4.12Å; L71-F95 HydrophobicContact CD2-CE2 3.82Å; L71-F95 HydrophobicContact CD2-CZ 4.03Å
72L88Confident85.5Confident3 Ų352.9 Ų52.92%0.01626%0.261CS..Hα-helixtrans-61.8-39.5176.7-72.1169.4000111.9G68 K70 F95 L106 V110 V118 L121 V122G68-L72 WeakPolarHBondContact O-CG 3.42Å; G68-L72 PolarHBondContact O-N 3.47Å; K70-L72 PolarHBondContact O-N 3.11Å; L72-F95 HydrophobicContact CD2-CZ 4.12Å; L72-F95 HydrophobicContact CG-CZ 4.25Å; L72-L106 HydrophobicContact CD1-CD2 4.49Å; L72-V110 HydrophobicContact CD1-CG2 3.99Å; L72-V118 HydrophobicContact CB-CG1 4.45Å; L72-L121 HydrophobicContact CD2-CB 4Å; L72-L121 HydrophobicContact CD2-CD1 4.48Å; L72-V122 HydrophobicContact CD1-CG2 4.07Å; L72-V122 HydrophobicContact CD2-CG2 4.24Å
73N85.3Confident86.4Confident103 Ų10352.2 Ų52.255%0.55125%0.253SS*.Hα-helixtrans-82.1-28-176.6-69.3-34.2000114.4E69 K70 L71E69-N73 WeakPolarHBondContact O-CB 3.42Å; E69-N73 VanDerWaalsContact O-CG 3.28Å; E69-N73 PolarHBondContact O-N 3.05Å; E69-N73 VanDerWaalsContact O-N 3.15Å; E69-N73 PolarHBondContact O-ND2 2.8Å; K70-N73 PolarHBondContact O-N 3.41Å; L71-N73 VanDerWaalsContact C-N 3.31Å; L71-N73 PolarHBondContact O-N 3.32Å
74C87Confident87Confident6 Ų648.4 Ų48.44%0.04125%0.245CC..Hα-helixtrans-84-15.1-178.6-67.10000113.5F32 L35 E36 K70F32-C74 HydrophobicContact CD1-CB 4.49Å; L35-C74 HydrophobicContact CD2-CB 3.99Å; L35-C74 HydrophobicContact CG-CB 4.4Å; E36-C74 HydrophobicContact CG-CB 3.83Å; E36-C74 VanDerWaalsContact CG-SG 3.55Å; E36-C74 PolarHBondContact OE1-SG 3.4Å; K70-C74 VanDerWaalsContact CD-SG 3.54Å; K70-C74 WeakPolarHBondContact CE-SG 3.47Å; K70-C74 WeakPolarHBondContact O-CB 3.43Å; K70-C74 PolarHBondContact O-N 2.84Å; K70-C74 PolarHBondContact O-SG 3.47Å
75T85.8Confident87Confident12 Ų1253 Ų537%0.07428%0.275CS..  trans-79.2124.2-175.7-58.30000110.5L71 F80 Y91 F117 L121L71-T75 PolarHBondContact O-N 3.32Å; L71-T75 PolarHBondContact O-OG1 2.88Å; T75-F80 HydrophobicContact CG2-CB 4.07Å; T75-F80 HydrophobicContact CG2-CD2 3.84Å; T75-F80 HydrophobicContact CG2-CG 4.26Å; T75-Y91 HydrophobicContact CG2-CE2 4.17Å; T75-Y91 VanDerWaalsContact OG1-CE2 3.31Å; T75-Y91 WeakPolarHBondContact OG1-CE2 3.41Å; T75-F117 HydrophobicContact CG2-CE1 4.09Å; T75-F117 HydrophobicContact CG2-CZ 4.17Å; T75-F117 WeakPolarHBondContact O-CE1 3.29Å; T75-L121 HydrophobicContact CG2-CD1 4.24Å
76K85.8Confident87.2Confident95 Ų9558.2 Ų58.241%0.41330%0.298SS..  trans-93.2129.4-179.7-60.2178.1-170.9165.50111.4E36 A38 N78 L79 F80E36-K76 WeakPolarHBondContact O-CE 3.17Å; E36-K76 PolarHBondContact O-NZ 2.81Å; A38-K76 PolarHBondContact O-NZ 3.46Å; K76-N78 PolarHBondContact O-N 3.4Å; K76-L79 HydrophobicContact CB-CB 4.49Å; K76-L79 HydrophobicContact CB-CD1 4.45Å; K76-L79 HydrophobicContact CB-CG 4.45Å; K76-L79 HydrophobicContact CD-CD1 4.13Å; K76-L79 PolarHBondContact O-N 3.03Å; K76-L79 VanDerWaalsContact O-N 3.1Å; K76-F80 PolarHBondContact O-N 3.18Å
77E86.9Confident87.5Confident88 Ų8857 Ų5741%0.41129%0.287SS..Hα-helixtrans-49.9-53.2179.8-176.9167.7-150.400112.8L79 F80 D81 F117E77-L79 PolarHBondContact O-N 3.25Å; E77-L79 VanDerWaalsContact O-N 3.08Å; E77-F80 PolarHBondContact O-N 2.86Å; E77-F80 VanDerWaalsContact O-N 3.14Å; E77-D81 PolarHBondContact O-N 2.88Å; E77-F117 HydrophobicContact CB-CB 4.21Å; E77-F117 HydrophobicContact CB-CD1 3.98Å; E77-F117 HydrophobicContact CB-CD2 3.57Å; E77-F117 HydrophobicContact CB-CE1 4.25Å; E77-F117 HydrophobicContact CB-CE2 3.89Å; E77-F117 HydrophobicContact CB-CG 3.63Å; E77-F117 HydrophobicContact CB-CZ 4.22Å; E77-F117 HydrophobicContact CG-CB 4.39Å; E77-F117 HydrophobicContact CG-CD2 3.45Å; E77-F117 VanDerWaalsContact CG-CD2 3.45Å; E77-F117 HydrophobicContact CG-CE2 3.88Å; E77-F117 HydrophobicContact CG-CG 3.95Å
78N87Confident87.7Confident126 Ų12657.9 Ų57.967%0.67429%0.291SS*.Hα-helixtrans-59.9-24.9-177.6-65.5-22.6000114.8K76 K82K76-N78 PolarHBondContact O-N 3.4Å; N78-K82 WeakPolarHBondContact O-CD 3.17Å; N78-K82 WeakPolarHBondContact O-CE 3.46Å; N78-K82 WeakPolarHBondContact O-CG 3.42Å
79L87.1Confident87.7Confident14 Ų1462.1 Ų62.17%0.07331%0.313CS..Hα-helixtrans-93.8-36.4178.2-65-179.1000111.2A38 T39 K76 E77 K82A38-L79 HydrophobicContact CB-CD1 4.28Å; A38-L79 VanDerWaalsContact O-CD1 3.31Å; A38-L79 WeakPolarHBondContact O-CD1 3.43Å; T39-L79 WeakPolarHBondContact O-CD2 3.3Å; K76-L79 HydrophobicContact CB-CB 4.49Å; K76-L79 HydrophobicContact CB-CD1 4.45Å; K76-L79 HydrophobicContact CB-CG 4.45Å; K76-L79 HydrophobicContact CD-CD1 4.13Å; K76-L79 PolarHBondContact O-N 3.03Å; K76-L79 VanDerWaalsContact O-N 3.1Å; E77-L79 PolarHBondContact O-N 3.25Å; E77-L79 VanDerWaalsContact O-N 3.08Å; L79-K82 PolarHBondContact O-N 3.46Å
80F88.9Confident87.7Confident4 Ų460.5 Ų60.52%0.01831%0.305CS..Hα-helixtrans-64.4-41.5176.9-173.5-93.8000112.1T75 K76 E77 K82 L83 Q88 Y91 F92 F117 L121T75-F80 HydrophobicContact CG2-CB 4.07Å; T75-F80 HydrophobicContact CG2-CD2 3.84Å; T75-F80 HydrophobicContact CG2-CG 4.26Å; K76-F80 PolarHBondContact O-N 3.18Å; E77-F80 PolarHBondContact O-N 2.86Å; E77-F80 VanDerWaalsContact O-N 3.14Å; F80-K82 PolarHBondContact O-N 3.38Å; F80-L83 HydrophobicContact CD2-CD1 4.07Å; F80-L83 VanDerWaalsContact O-CB 3.31Å; F80-L83 WeakPolarHBondContact O-CB 3.48Å; F80-L83 PolarHBondContact O-N 3.24Å; F80-L83 VanDerWaalsContact O-N 3.09Å; F80-Q88 HydrophobicContact CE1-CG 3.95Å; F80-Q88 HydrophobicContact CE2-CG 4.3Å; F80-Q88 HydrophobicContact CZ-CB 4.01Å; F80-Q88 HydrophobicContact CZ-CG 3.83Å; F80-Q88 PolarHBondContact O-NE2 2.98Å; F80-Y91 HydrophobicContact CE2-CD1 4.07Å; F80-Y91 HydrophobicContact CE2-CD2 4.19Å; F80-Y91 AromaticContact CE2-CG 3.82Å; F80-Y91 HydrophobicContact CE2-CG 3.82Å; F80-F92 AromaticContact CZ-CE2 3.94Å; F80-F92 HydrophobicContact CZ-CE2 3.94Å; F80-F92 HydrophobicContact CZ-CZ 4.06Å; F80-F117 HydrophobicContact CB-CE2 4.21Å; F80-F117 HydrophobicContact CB-CZ 3.67Å; F80-F117 AromaticContact CD1-CE2 3.99Å; F80-F117 HydrophobicContact CD1-CE2 3.99Å; F80-F117 AromaticContact CD1-CZ 3.99Å; F80-F117 HydrophobicContact CD1-CZ 3.99Å; F80-F117 HydrophobicContact CG-CE2 4.3Å; F80-F117 AromaticContact CG-CZ 3.85Å; F80-F117 HydrophobicContact CG-CZ 3.85Å; F80-L121 HydrophobicContact CD1-CD2 4.21Å; F80-L121 HydrophobicContact CD2-CD2 4.41Å; F80-L121 HydrophobicContact CE1-CD2 3.8Å; F80-L121 HydrophobicContact CE2-CD2 4.01Å; F80-L121 HydrophobicContact CG-CD2 4.5Å; F80-L121 HydrophobicContact CZ-CD2 3.68Å
81D88Confident88Confident80 Ų8057 Ų5743%0.42829%0.29SS..THydrogen-bonded Turntrans-70.2-16.5178.1-75.8-16.3000112.9E77 K120E77-D81 PolarHBondContact O-N 2.88Å; D81-K120 IonicContact OD1-NZ 3.58Å
82K89.2Confident88.1Confident143 Ų14357 Ų5762%0.62229%0.29SS*.THydrogen-bonded Turntrans-83.5-11.1172.2-70.4178-176.2-178.60113.5N78 L79 F80N78-K82 WeakPolarHBondContact O-CD 3.17Å; N78-K82 WeakPolarHBondContact O-CE 3.46Å; N78-K82 WeakPolarHBondContact O-CG 3.42Å; L79-K82 PolarHBondContact O-N 3.46Å; F80-K82 PolarHBondContact O-N 3.38Å
83L89.3Confident88.2Confident6 Ų659.4 Ų59.43%0.03130%0.302CS..SBendtrans-73.3138.9172.9-63.2172.3000109.4T44 L45 L48 F80 E87 Q88T44-L83 HydrophobicContact CG2-CD1 4.35Å; L45-L83 HydrophobicContact CB-CD2 4.35Å; L48-L83 HydrophobicContact CD1-CD1 4.34Å; F80-L83 HydrophobicContact CD2-CD1 4.07Å; F80-L83 VanDerWaalsContact O-CB 3.31Å; F80-L83 WeakPolarHBondContact O-CB 3.48Å; F80-L83 PolarHBondContact O-N 3.24Å; F80-L83 VanDerWaalsContact O-N 3.09Å; L83-E87 HydrophobicContact CB-CB 3.9Å; L83-E87 HydrophobicContact CD2-CB 4.13Å; L83-E87 HydrophobicContact CG-CB 4.49Å; L83-Q88 HydrophobicContact CB-CG 3.85Å; L83-Q88 PolarHBondContact O-NE2 3.48Å
84S89.8Confident88.4Confident44 Ų4454.5 Ų54.531%0.30828%0.276SS..  trans-60.5158.4170.666.40000111Q86 E87 Q88S84-Q86 PolarHBondContact O-N 3.36Å; S84-Q86 VanDerWaalsContact O-N 3.13Å; S84-E87 WeakPolarHBondContact CB-OE2 3.41Å; S84-E87 PolarHBondContact N-OE2 2.92Å; S84-E87 PolarHBondContact O-N 2.93Å; S84-E87 WeakPolarHBondContact OG-CG 3.47Å; S84-E87 PolarHBondContact OG-N 3.22Å; S84-E87 PolarHBondContact OG-OE2 3.44Å; S84-Q88 PolarHBondContact O-N 2.67Å
85P87Confident88.6Confident97 Ų9754.4 Ų54.463%0.6328%0.275SS*.Hα-helixtrans-54.6-34.8177.9-27.735.3000113.8I89P85-I89 WeakPolarHBondContact O-CG1 3.32Å; P85-I89 PolarHBondContact O-N 3.21Å
86Q87.3Confident88.7Confident155 Ų15556.3 Ų56.372%0.72429%0.285SS*.Hα-helixtrans-69.8-36.1176.4-67.9-178.1-8.900112.6S84 I89 Q90S84-Q86 PolarHBondContact O-N 3.36Å; S84-Q86 VanDerWaalsContact O-N 3.13Å; Q86-I89 PolarHBondContact O-N 3.22Å; Q86-Q90 PolarHBondContact O-N 3.26Å
87E88.1Confident88.7Confident51 Ų5155.7 Ų55.724%0.23828%0.282CS..Hα-helixtrans-73.3-35.2176.4-71164.4155.400111.6L45 L83 S84 I89 Q90 Y91L45-E87 HydrophobicContact CD1-CB 3.95Å; L45-E87 HydrophobicContact CD1-CG 3.84Å; L45-E87 HydrophobicContact CD2-CG 3.87Å; L45-E87 WeakPolarHBondContact CD2-OE1 3.45Å; L45-E87 HydrophobicContact CG-CG 4.46Å; L83-E87 HydrophobicContact CB-CB 3.9Å; L83-E87 HydrophobicContact CD2-CB 4.13Å; L83-E87 HydrophobicContact CG-CB 4.49Å; S84-E87 WeakPolarHBondContact CB-OE2 3.41Å; S84-E87 PolarHBondContact N-OE2 2.92Å; S84-E87 PolarHBondContact O-N 2.93Å; S84-E87 WeakPolarHBondContact OG-CG 3.47Å; S84-E87 PolarHBondContact OG-N 3.22Å; S84-E87 PolarHBondContact OG-OE2 3.44Å; E87-I89 VanDerWaalsContact C-N 3.27Å; E87-I89 PolarHBondContact O-N 3.49Å; E87-Q90 WeakPolarHBondContact O-CB 3.43Å; E87-Q90 PolarHBondContact O-N 3.05Å; E87-Y91 PolarHBondContact O-N 3.44Å
88Q90.4Very high88.7Confident22 Ų2251.9 Ų51.910%0.10327%0.266CS..Hα-helixtrans-63.6-32.6172-68.3-177.42.700112.1F80 L83 S84 Q90 Y91 F92F80-Q88 HydrophobicContact CE1-CG 3.95Å; F80-Q88 HydrophobicContact CE2-CG 4.3Å; F80-Q88 HydrophobicContact CZ-CB 4.01Å; F80-Q88 HydrophobicContact CZ-CG 3.83Å; F80-Q88 PolarHBondContact O-NE2 2.98Å; L83-Q88 HydrophobicContact CB-CG 3.85Å; L83-Q88 PolarHBondContact O-NE2 3.48Å; S84-Q88 PolarHBondContact O-N 2.67Å; Q88-Q90 VanDerWaalsContact C-N 3.33Å; Q88-Y91 WeakPolarHBondContact O-CB 3.27Å; Q88-Y91 PolarHBondContact O-N 3.21Å; Q88-F92 WeakPolarHBondContact O-CD2 3.11Å
89I88.1Confident88.7Confident89 Ų8946.9 Ų46.946%0.45624%0.239SC..Hα-helixtrans-62.5-41.6174.6-69.6164.9000110.6P85 Q86 E87 Y91 F92 D93P85-I89 WeakPolarHBondContact O-CG1 3.32Å; P85-I89 PolarHBondContact O-N 3.21Å; Q86-I89 PolarHBondContact O-N 3.22Å; E87-I89 VanDerWaalsContact C-N 3.27Å; E87-I89 PolarHBondContact O-N 3.49Å; I89-Y91 PolarHBondContact O-N 2.91Å; I89-Y91 VanDerWaalsContact O-N 3.16Å; I89-F92 PolarHBondContact O-N 2.91Å; I89-D93 PolarHBondContact O-N 3.17Å
90Q87.5Confident88.8Confident57 Ų5747 Ų4727%0.26624%0.241SC..Hα-helixtrans-59.7-29.6178.6-67.8173.447.300113Q86 E87 Q88Q86-Q90 PolarHBondContact O-N 3.26Å; E87-Q90 WeakPolarHBondContact O-CB 3.43Å; E87-Q90 PolarHBondContact O-N 3.05Å; Q88-Q90 VanDerWaalsContact C-N 3.33Å
91Y92Very high88.7Confident0 Ų047 Ų470%024%0.241CC..Hα-helixtrans-62.2-48.6171.5178.8-90000111.4L48 L71 T75 F80 E87 Q88 I89 D93 I94 F95 L121L48-Y91 HydrophobicContact CD1-CD2 3.85Å; L48-Y91 HydrophobicContact CD1-CG 4.46Å; L48-Y91 HydrophobicContact CD2-CD2 3.52Å; L48-Y91 HydrophobicContact CD2-CE2 4.05Å; L48-Y91 HydrophobicContact CG-CD2 4.34Å; L71-Y91 HydrophobicContact CD1-CD2 4.46Å; L71-Y91 HydrophobicContact CD1-CE2 3.74Å; L71-Y91 HydrophobicContact CD2-CE2 4.1Å; L71-Y91 HydrophobicContact CG-CE2 3.7Å; L71-Y91 PolarHBondContact O-OH 3.38Å; T75-Y91 HydrophobicContact CG2-CE2 4.17Å; T75-Y91 VanDerWaalsContact OG1-CE2 3.31Å; T75-Y91 WeakPolarHBondContact OG1-CE2 3.41Å; F80-Y91 HydrophobicContact CE2-CD1 4.07Å; F80-Y91 HydrophobicContact CE2-CD2 4.19Å; F80-Y91 AromaticContact CE2-CG 3.82Å; F80-Y91 HydrophobicContact CE2-CG 3.82Å; E87-Y91 PolarHBondContact O-N 3.44Å; Q88-Y91 WeakPolarHBondContact O-CB 3.27Å; Q88-Y91 PolarHBondContact O-N 3.21Å; I89-Y91 PolarHBondContact O-N 2.91Å; I89-Y91 VanDerWaalsContact O-N 3.16Å; Y91-D93 VanDerWaalsContact C-N 3.34Å; Y91-I94 WeakPolarHBondContact O-CB 3.31Å; Y91-I94 PolarHBondContact O-N 3.34Å; Y91-F95 HydrophobicContact CD1-CE2 4.24Å; Y91-F95 AromaticContact CE1-CE2 3.7Å; Y91-F95 HydrophobicContact CE1-CE2 3.7Å; Y91-F95 HydrophobicContact CE1-CZ 4.36Å; Y91-L121 HydrophobicContact CE1-CD2 4.33Å
92F92.6Very high88.8Confident3 Ų343.5 Ų43.51%0.01322%0.222CC..Hα-helixtrans-73.5-25.6-178.5-62.3-69.4000112.8F80 Q88 I89 I94 F95 L121 R124 A125 V128F80-F92 AromaticContact CZ-CE2 3.94Å; F80-F92 HydrophobicContact CZ-CE2 3.94Å; F80-F92 HydrophobicContact CZ-CZ 4.06Å; Q88-F92 WeakPolarHBondContact O-CD2 3.11Å; I89-F92 PolarHBondContact O-N 2.91Å; F92-I94 PolarHBondContact O-N 3.5Å; F92-F95 WeakPolarHBondContact O-CB 3.43Å; F92-F95 PolarHBondContact O-N 3.22Å; F92-L121 HydrophobicContact CZ-CD2 4.07Å; F92-R124 HydrophobicContact CD2-CG 4.29Å; F92-R124 HydrophobicContact CE1-CB 3.9Å; F92-R124 HydrophobicContact CE1-CG 4.04Å; F92-R124 HydrophobicContact CE2-CB 4.31Å; F92-R124 VanDerWaalsContact CE2-CD 3.47Å; F92-R124 HydrophobicContact CE2-CG 3.66Å; F92-R124 HydrophobicContact CZ-CB 3.65Å; F92-R124 HydrophobicContact CZ-CG 3.53Å; F92-A125 HydrophobicContact CD1-CB 3.94Å; F92-A125 HydrophobicContact CE1-CB 4.05Å; F92-V128 HydrophobicContact CB-CB 4.39Å; F92-V128 HydrophobicContact CB-CG1 4.18Å; F92-V128 HydrophobicContact CB-CG2 4.09Å; F92-V128 HydrophobicContact CG-CG2 4.3Å
93D89.2Confident88.9Confident52 Ų5236.7 Ų36.728%0.27819%0.193SC..Hα-helixtrans-60.2-26.9174.4-70.7-20000112.7I89 Y91 F95 L96 K97I89-D93 PolarHBondContact O-N 3.17Å; Y91-D93 VanDerWaalsContact C-N 3.34Å; D93-F95 VanDerWaalsContact C-N 3.25Å; D93-F95 PolarHBondContact O-N 3.25Å; D93-L96 PolarHBondContact O-N 3.22Å; D93-L96 VanDerWaalsContact O-N 3.1Å; D93-K97 WeakPolarHBondContact O-CG 3.29Å; D93-K97 PolarHBondContact O-N 3.41Å
94I90.5Very high89Confident1 Ų136.4 Ų36.41%0.00519%0.191CC..Hα-helixtrans-58.9-40.3174.1-58.4176.2000110.5L48 L51 V55 F64 L71 Y91 F92 L96 K97 A98L48-I94 HydrophobicContact CB-CD1 4.43Å; L48-I94 HydrophobicContact CD2-CD1 3.98Å; L51-I94 HydrophobicContact CB-CD1 4.28Å; V55-I94 HydrophobicContact CG2-CG2 3.95Å; F64-I94 HydrophobicContact CE2-CG2 4.04Å; F64-I94 HydrophobicContact CZ-CG2 4.41Å; L71-I94 HydrophobicContact CD2-CB 4.37Å; L71-I94 HydrophobicContact CD2-CD1 4.09Å; L71-I94 HydrophobicContact CD2-CG2 4.12Å; Y91-I94 WeakPolarHBondContact O-CB 3.31Å; Y91-I94 PolarHBondContact O-N 3.34Å; F92-I94 PolarHBondContact O-N 3.5Å; I94-L96 VanDerWaalsContact C-N 3.32Å; I94-L96 PolarHBondContact O-N 3.05Å; I94-K97 PolarHBondContact O-N 2.93Å; I94-A98 PolarHBondContact O-N 3.09Å
95F90.4Very high89Confident3 Ų336.2 Ų36.21%0.01319%0.186CC..Hα-helixtrans-70.3-28.1177.7-64.1-98.2000112.2F64 L71 L72 Y91 F92 D93 V103 L106 L107F64-F95 AromaticContact CE1-CD1 3.77Å; F64-F95 HydrophobicContact CE1-CD1 3.77Å; F64-F95 HydrophobicContact CE1-CE1 4.23Å; F64-F95 HydrophobicContact CE1-CG 4.45Å; F64-F95 AromaticContact CZ-CD1 3.84Å; F64-F95 HydrophobicContact CZ-CD1 3.84Å; F64-F95 HydrophobicContact CZ-CE1 4.22Å; F64-F95 HydrophobicContact CZ-CG 4.19Å; L71-F95 HydrophobicContact CD2-CE2 3.82Å; L71-F95 HydrophobicContact CD2-CZ 4.03Å; L72-F95 HydrophobicContact CD2-CZ 4.12Å; L72-F95 HydrophobicContact CG-CZ 4.25Å; Y91-F95 HydrophobicContact CD1-CE2 4.24Å; Y91-F95 AromaticContact CE1-CE2 3.7Å; Y91-F95 HydrophobicContact CE1-CE2 3.7Å; Y91-F95 HydrophobicContact CE1-CZ 4.36Å; F92-F95 WeakPolarHBondContact O-CB 3.43Å; F92-F95 PolarHBondContact O-N 3.22Å; D93-F95 VanDerWaalsContact C-N 3.25Å; D93-F95 PolarHBondContact O-N 3.25Å; F95-V103 HydrophobicContact CB-CG1 4.25Å; F95-V103 HydrophobicContact CD1-CG1 4.29Å; F95-V103 WeakPolarHBondContact O-CG2 3.33Å; F95-L106 HydrophobicContact CD1-CD2 4.47Å; F95-L106 HydrophobicContact CE1-CD2 3.9Å; F95-L107 HydrophobicContact CD1-CD2 4.49Å; F95-L107 HydrophobicContact CE1-CD2 4.2Å
96L87.4Confident89.2Confident52 Ų5231.6 Ų31.627%0.27216%0.156SC..Hα-helixtrans-78-27.8177.3-64.5-178.8000113.1D93 I94 V128 N132D93-L96 PolarHBondContact O-N 3.22Å; D93-L96 VanDerWaalsContact O-N 3.1Å; I94-L96 VanDerWaalsContact C-N 3.32Å; I94-L96 PolarHBondContact O-N 3.05Å; L96-V128 HydrophobicContact CD1-CG1 3.74Å; L96-V128 HydrophobicContact CD2-CG1 4.05Å; L96-V128 HydrophobicContact CG-CG1 3.95Å; L96-N132 HydrophobicContact CD1-CB 3.9Å; L96-N132 HydrophobicContact CD2-CB 3.78Å
97K86.2Confident89.3Confident82 Ų8224.2 Ų24.236%0.35712%0.122SC..Hα-helixtrans-80.1-21.1177-69.9162.7174.8-158.40113.1S52 V55 E56 D93 I94S52-K97 VanDerWaalsContact OG-CD 3.31Å; S52-K97 WeakPolarHBondContact OG-CD 3.35Å; S52-K97 PolarHBondContact OG-NZ 3.07Å; V55-K97 HydrophobicContact CG1-CB 3.97Å; E56-K97 HydrophobicContact CG-CB 4.42Å; E56-K97 HydrophobicContact CG-CD 3.81Å; E56-K97 HydrophobicContact CG-CG 4.12Å; E56-K97 WeakPolarHBondContact OE1-CE 3.44Å; E56-K97 IonicContact OE1-NZ 2.71Å; E56-K97 PolarHBondContact OE1-NZ 3.45Å; E56-K97 IonicContact OE2-NZ 3.72Å; D93-K97 WeakPolarHBondContact O-CG 3.29Å; D93-K97 PolarHBondContact O-N 3.41Å; I94-K97 PolarHBondContact O-N 2.93Å
98A86.7Confident89.4Confident9 Ų921.9 Ų21.97%0.07411%0.112CC..SBendtrans-75.4168.5-179.300000113.1V55 F64 I94 P100 V103V55-A98 HydrophobicContact CG1-CB 3.83Å; F64-A98 HydrophobicContact CB-CB 4.09Å; F64-A98 HydrophobicContact CD1-CB 3.55Å; F64-A98 HydrophobicContact CD2-CB 3.38Å; F64-A98 HydrophobicContact CE1-CB 3.73Å; F64-A98 HydrophobicContact CE2-CB 3.56Å; F64-A98 HydrophobicContact CG-CB 3.37Å; F64-A98 HydrophobicContact CZ-CB 3.72Å; I94-A98 PolarHBondContact O-N 3.09Å; A98-P100 WeakPolarHBondContact O-CD 3.39Å; A98-P100 VanDerWaalsContact O-N 3.17Å; A98-V103 HydrophobicContact CB-CG2 3.76Å
99N86.3Confident89.1Confident21 Ų2122.6 Ų22.611%0.11212%0.119CC..  trans-58.8120.1170.6-178.8-43.9000109.4T101 D102 V103 I148N99-T101 PolarHBondContact O-N 2.98Å; N99-T101 VanDerWaalsContact OD1-CB 3.28Å; N99-T101 WeakPolarHBondContact OD1-CB 3.47Å; N99-T101 PolarHBondContact OD1-N 3.28Å; N99-D102 HydrophobicContact CB-CB 4.35Å; N99-D102 WeakPolarHBondContact O-CB 3.44Å; N99-D102 PolarHBondContact O-N 2.81Å; N99-D102 VanDerWaalsContact O-N 3.12Å; N99-V103 WeakPolarHBondContact O-CG2 3.43Å; N99-V103 PolarHBondContact O-N 3.19Å; N99-V103 VanDerWaalsContact O-N 3.12Å; N99-I148 PolarHBondContact ND2-O 3.14Å; N99-I148 VanDerWaalsContact OD1-CG2 3.3Å; N99-I148 WeakPolarHBondContact OD1-CG2 3.34Å
100P89.3Confident88.4Confident16 Ų1619.9 Ų19.910%0.10411%0.106CC..Hα-helixtrans-68.9-21.6-172.427.7-35.9000113.4A98 M104 F129 L137 I148A98-P100 WeakPolarHBondContact O-CD 3.39Å; A98-P100 VanDerWaalsContact O-N 3.17Å; P100-M104 WeakPolarHBondContact O-CB 3.47Å; P100-M104 PolarHBondContact O-N 2.93Å; P100-F129 HydrophobicContact CB-CE2 3.91Å; P100-F129 HydrophobicContact CB-CZ 4.07Å; P100-F129 WeakPolarHBondContact O-CZ 3.15Å; P100-L137 HydrophobicContact CB-CB 3.97Å; P100-L137 HydrophobicContact CB-CD1 4.19Å; P100-L137 HydrophobicContact CG-CB 4.28Å; P100-L137 HydrophobicContact CG-CD1 4.08Å; P100-I148 HydrophobicContact CG-CD1 4.34Å; P100-I148 HydrophobicContact CG-CG2 4.46Å
101T88.6Confident87.3Confident5 Ų519.6 Ų19.63%0.03111%0.111CC..Hα-helixtrans-67.5-46.2172.4-62.90000110.5N99 V103 M104 L105 L137 I148 C149 L157N99-T101 PolarHBondContact O-N 2.98Å; N99-T101 VanDerWaalsContact OD1-CB 3.28Å; N99-T101 WeakPolarHBondContact OD1-CB 3.47Å; N99-T101 PolarHBondContact OD1-N 3.28Å; T101-V103 VanDerWaalsContact C-N 3.3Å; T101-V103 PolarHBondContact O-N 3.33Å; T101-M104 PolarHBondContact O-N 3.32Å; T101-L105 HydrophobicContact CG2-CD1 3.99Å; T101-L105 HydrophobicContact CG2-CG 4.43Å; T101-L105 WeakPolarHBondContact O-CB 3.32Å; T101-L105 WeakPolarHBondContact O-CG 3.39Å; T101-L105 PolarHBondContact O-N 2.86Å; T101-L137 VanDerWaalsContact OG1-CD1 3.27Å; T101-L137 WeakPolarHBondContact OG1-CD1 3.34Å; T101-I148 VanDerWaalsContact OG1-CG2 3.32Å; T101-I148 WeakPolarHBondContact OG1-CG2 3.37Å; T101-C149 HydrophobicContact CG2-CB 4.03Å; T101-L157 HydrophobicContact CG2-CD1 4.23Å; T101-L157 HydrophobicContact CG2-CD2 4.22Å
102D88.4Confident85.6Confident6 Ų622.6 Ų22.63%0.03213%0.13CC..Hα-helixtrans-62.2-41.7177.6-69-2.7000110.7G62 R63 F64 L65 N99 M104 L105 L106G62-D102 VanDerWaalsContact C-OD2 3.32Å; G62-D102 VanDerWaalsContact CA-OD1 3.31Å; G62-D102 WeakPolarHBondContact CA-OD1 3.23Å; G62-D102 VanDerWaalsContact CA-OD2 3.28Å; G62-D102 WeakPolarHBondContact CA-OD2 3.44Å; G62-D102 PolarHBondContact N-OD1 3.21Å; G62-D102 PolarHBondContact N-OD2 3.33Å; R63-D102 PolarHBondContact N-OD2 3.16Å; F64-D102 HydrophobicContact CB-CB 3.78Å; F64-D102 HydrophobicContact CD1-CB 4.31Å; F64-D102 PolarHBondContact N-OD2 3.31Å; F64-D102 VanDerWaalsContact N-OD2 3.13Å; L65-D102 HydrophobicContact CD2-CB 4.5Å; L65-D102 VanDerWaalsContact CD2-O 3.3Å; L65-D102 WeakPolarHBondContact CD2-O 3.29Å; L65-D102 HydrophobicContact CG-CB 4.3Å; N99-D102 HydrophobicContact CB-CB 4.35Å; N99-D102 WeakPolarHBondContact O-CB 3.44Å; N99-D102 PolarHBondContact O-N 2.81Å; N99-D102 VanDerWaalsContact O-N 3.12Å; D102-M104 PolarHBondContact O-N 3.34Å; D102-L105 PolarHBondContact O-N 3.13Å; D102-L106 WeakPolarHBondContact O-CB 3.26Å; D102-L106 PolarHBondContact O-N 3.04Å
103V91.6Very high83.8Confident0 Ų027.3 Ų27.30%016%0.163CC..Hα-helixtrans-60.5-46.1177.2177.40000110.8F64 F95 A98 N99 T101 L106 L107 F129F64-V103 HydrophobicContact CD1-CG2 3.71Å; F64-V103 HydrophobicContact CE1-CG2 3.59Å; F95-V103 HydrophobicContact CB-CG1 4.25Å; F95-V103 HydrophobicContact CD1-CG1 4.29Å; F95-V103 WeakPolarHBondContact O-CG2 3.33Å; A98-V103 HydrophobicContact CB-CG2 3.76Å; N99-V103 WeakPolarHBondContact O-CG2 3.43Å; N99-V103 PolarHBondContact O-N 3.19Å; N99-V103 VanDerWaalsContact O-N 3.12Å; T101-V103 VanDerWaalsContact C-N 3.3Å; T101-V103 PolarHBondContact O-N 3.33Å; V103-L106 PolarHBondContact O-N 3.44Å; V103-L107 HydrophobicContact CG1-CD1 3.78Å; V103-L107 HydrophobicContact CG1-CG 4.29Å; V103-L107 WeakPolarHBondContact O-CB 3.43Å; V103-L107 VanDerWaalsContact O-CG 3.32Å; V103-L107 WeakPolarHBondContact O-CG 3.43Å; V103-L107 PolarHBondContact O-N 3.22Å; V103-F129 HydrophobicContact CB-CD2 4.22Å; V103-F129 HydrophobicContact CB-CE2 3.9Å; V103-F129 HydrophobicContact CB-CZ 4.43Å; V103-F129 HydrophobicContact CG1-CD2 3.47Å; V103-F129 VanDerWaalsContact CG1-CD2 3.47Å; V103-F129 HydrophobicContact CG1-CE2 3.67Å; V103-F129 HydrophobicContact CG1-CG 3.99Å; V103-F129 HydrophobicContact CG1-CZ 4.33Å
104M91.7Very high82.4Confident0 Ų027.5 Ų27.50%017%0.167CC..Hα-helixtrans-63.8-44.6178.8-173.261.7179.500112.1P100 T101 D102 S108 F129 L137 L157 A160 F161 I164P100-M104 WeakPolarHBondContact O-CB 3.47Å; P100-M104 PolarHBondContact O-N 2.93Å; T101-M104 PolarHBondContact O-N 3.32Å; D102-M104 PolarHBondContact O-N 3.34Å; M104-S108 WeakPolarHBondContact O-CB 3.47Å; M104-S108 PolarHBondContact O-N 2.84Å; M104-S108 VanDerWaalsContact O-N 3.13Å; M104-S108 PolarHBondContact O-OG 3.22Å; M104-F129 HydrophobicContact CB-CE1 4.14Å; M104-F129 HydrophobicContact CB-CZ 4.28Å; M104-F129 HydrophobicContact SD-CD1 4.44Å; M104-F129 HydrophobicContact SD-CE1 3.9Å; M104-L137 HydrophobicContact CB-CD2 4.04Å; M104-L137 HydrophobicContact CG-CD2 4.3Å; M104-L157 HydrophobicContact CB-CD1 4.03Å; M104-L157 HydrophobicContact CG-CD1 3.82Å; M104-A160 HydrophobicContact CG-CB 4.25Å; M104-F161 VanDerWaalsContact CE-CA 3.49Å; M104-F161 HydrophobicContact CE-CB 4.09Å; M104-F161 HydrophobicContact CE-CD1 3.67Å; M104-F161 HydrophobicContact CE-CD2 3.77Å; M104-F161 HydrophobicContact CE-CE1 4.04Å; M104-F161 HydrophobicContact CE-CE2 4.07Å; M104-F161 HydrophobicContact CE-CG 3.55Å; M104-F161 HydrophobicContact CE-CZ 4.2Å; M104-F161 HydrophobicContact CG-CD2 4.42Å; M104-F161 HydrophobicContact CG-CE2 4.17Å; M104-I164 HydrophobicContact CE-CD1 4.29Å; M104-I164 HydrophobicContact CE-CG1 3.55Å; M104-I164 HydrophobicContact SD-CG1 4.4Å
105L90.7Very high81.7Confident39 Ų3931.6 Ų31.620%0.20419%0.188CC..Hα-helixtrans-62.9-45177-72.2174.4000111.2L65 T101 D102 S108 S109 A156 A160L65-L105 HydrophobicContact CD2-CB 3.79Å; T101-L105 HydrophobicContact CG2-CD1 3.99Å; T101-L105 HydrophobicContact CG2-CG 4.43Å; T101-L105 WeakPolarHBondContact O-CB 3.32Å; T101-L105 WeakPolarHBondContact O-CG 3.39Å; T101-L105 PolarHBondContact O-N 2.86Å; D102-L105 PolarHBondContact O-N 3.13Å; L105-S108 PolarHBondContact O-OG 3.24Å; L105-S109 WeakPolarHBondContact O-CB 3.2Å; L105-S109 PolarHBondContact O-N 3.18Å; L105-S109 PolarHBondContact O-OG 2.68Å; L105-S109 VanDerWaalsContact O-OG 3.04Å; L105-A156 HydrophobicContact CD2-CB 4.34Å; L105-A160 HydrophobicContact CD2-CB 4.07Å
106L90.5Very high81.2Confident0 Ų036.9 Ų36.90%022%0.223CC..Hα-helixtrans-56.8-61175.817564.6000111F64 L65 E69 L72 F95 D102 V103 S108 S109 V110F64-L106 HydrophobicContact CD1-CD2 4.48Å; F64-L106 HydrophobicContact CE1-CD2 4.07Å; L65-L106 HydrophobicContact CD2-CB 3.96Å; E69-L106 HydrophobicContact CB-CD1 4.32Å; E69-L106 HydrophobicContact CG-CD1 3.43Å; E69-L106 VanDerWaalsContact CG-CD1 3.43Å; L72-L106 HydrophobicContact CD1-CD2 4.49Å; F95-L106 HydrophobicContact CD1-CD2 4.47Å; F95-L106 HydrophobicContact CE1-CD2 3.9Å; D102-L106 WeakPolarHBondContact O-CB 3.26Å; D102-L106 PolarHBondContact O-N 3.04Å; V103-L106 PolarHBondContact O-N 3.44Å; L106-S108 PolarHBondContact O-N 3.45Å; L106-S108 VanDerWaalsContact O-N 3.14Å; L106-S109 PolarHBondContact O-N 3.4Å; L106-S109 PolarHBondContact O-OG 3.25Å; L106-V110 HydrophobicContact CD1-CG2 4.4Å; L106-V110 WeakPolarHBondContact O-CG2 3.47Å; L106-V110 PolarHBondContact O-N 2.96Å
107L90.3Very high81.2Confident0 Ų034.6 Ų34.60%021%0.211CC..Hα-helixtrans-66.1-22.3-172.1-62.2177.6000112.9F95 V103 V122 A125 L126 F129F95-L107 HydrophobicContact CD1-CD2 4.49Å; F95-L107 HydrophobicContact CE1-CD2 4.2Å; V103-L107 HydrophobicContact CG1-CD1 3.78Å; V103-L107 HydrophobicContact CG1-CG 4.29Å; V103-L107 WeakPolarHBondContact O-CB 3.43Å; V103-L107 VanDerWaalsContact O-CG 3.32Å; V103-L107 WeakPolarHBondContact O-CG 3.43Å; V103-L107 PolarHBondContact O-N 3.22Å; L107-V122 HydrophobicContact CD2-CG1 4.39Å; L107-A125 HydrophobicContact CD1-CB 4.01Å; L107-A125 HydrophobicContact CD2-CB 3.8Å; L107-L126 HydrophobicContact CB-CD2 3.52Å; L107-L126 HydrophobicContact CB-CG 4.11Å; L107-L126 HydrophobicContact CD1-CD2 3.84Å; L107-L126 HydrophobicContact CD1-CG 4.23Å; L107-L126 HydrophobicContact CG-CD2 4.31Å; L107-F129 HydrophobicContact CD1-CB 4.34Å
108S88.8Confident81.1Confident3 Ų330.9 Ų30.92%0.02120%0.195CC..Hα-helixtrans-78.3-24.6172.577.70000114.3M104 L105 L106 A160 R167M104-S108 WeakPolarHBondContact O-CB 3.47Å; M104-S108 PolarHBondContact O-N 2.84Å; M104-S108 VanDerWaalsContact O-N 3.13Å; M104-S108 PolarHBondContact O-OG 3.22Å; L105-S108 PolarHBondContact O-OG 3.24Å; L106-S108 PolarHBondContact O-N 3.45Å; L106-S108 VanDerWaalsContact O-N 3.14Å; S108-A160 WeakPolarHBondContact OG-CB 3.4Å; S108-R167 PolarHBondContact O-NE 3.04Å; S108-R167 VanDerWaalsContact O-NE 3.15Å
109S84Confident80.9Confident37 Ų3731.4 Ų31.426%0.25920%0.199SC..Hα-helixtrans-95.5-24.2-169.162.90000114.2L105 L106 S111 R167L105-S109 WeakPolarHBondContact O-CB 3.2Å; L105-S109 PolarHBondContact O-N 3.18Å; L105-S109 PolarHBondContact O-OG 2.68Å; L105-S109 VanDerWaalsContact O-OG 3.04Å; L106-S109 PolarHBondContact O-N 3.4Å; L106-S109 PolarHBondContact O-OG 3.25Å; S109-S111 PolarHBondContact O-N 2.95Å; S109-R167 PolarHBondContact O-NH2 3.31Å
110V72.9Confident80.9Confident31 Ų3135.3 Ų35.319%0.18822%0.215CC..  trans-56.8124.8178.6-171.90000110.8L72 L106 V118 V122 R167L72-V110 HydrophobicContact CD1-CG2 3.99Å; L106-V110 HydrophobicContact CD1-CG2 4.4Å; L106-V110 WeakPolarHBondContact O-CG2 3.47Å; L106-V110 PolarHBondContact O-N 2.96Å; V110-V118 HydrophobicContact CG1-CG1 4.25Å; V110-V122 HydrophobicContact CB-CG2 4.14Å; V110-V122 HydrophobicContact CG1-CG2 4.02Å; V110-V122 HydrophobicContact CG2-CG2 4.17Å; V110-R167 PolarHBondContact O-NE 3.34Å; V110-R167 PolarHBondContact O-NH2 3.42Å
111S64.8Low80.8Confident52 Ų5234.7 Ų34.736%0.36421%0.211SC..  trans-77.7134.7-178.1-175.10000111S109 S113 V114S109-S111 PolarHBondContact O-N 2.95Å; S111-S113 PolarHBondContact O-N 3.06Å; S111-S113 VanDerWaalsContact O-N 3.09Å; S111-S113 PolarHBondContact OG-N 3.02Å; S111-S113 PolarHBondContact OG-OG 3.46Å; S111-V114 PolarHBondContact O-N 3.39Å
112P57.6Low80.8Confident62 Ų6234.9 Ų34.940%0.40321%0.212SC..THydrogen-bonded Turntrans-66.7-8.6176.627.3-35.2000113.2V114 A170P112-V114 PolarHBondContact O-N 3.47Å; P112-A170 HydrophobicContact CB-CB 4.1Å; P112-A170 HydrophobicContact CG-CB 4.18Å
113S54.7Low80.7Confident102 Ų10235 Ų3571%0.71321%0.214SC*.THydrogen-bonded Turntrans-74.23.7173.665.20000113.9S111S111-S113 PolarHBondContact O-N 3.06Å; S111-S113 VanDerWaalsContact O-N 3.09Å; S111-S113 PolarHBondContact OG-N 3.02Å; S111-S113 PolarHBondContact OG-OG 3.46Å
114V59Low80.6Confident57 Ų5739.3 Ų39.335%0.34523%0.23SC..SBendtrans-115.9105.7-174.3-174.60000107.5S111 P112S111-V114 PolarHBondContact O-N 3.39Å; P112-V114 PolarHBondContact O-N 3.47Å
115D76.4Confident80.5Confident86 Ų8639.3 Ų39.346%0.4623%0.23SC..  trans45.3116.4165.4-169.7-6.9000117.3F117 V118 A119D115-F117 PolarHBondContact O-N 2.92Å; D115-F117 WeakPolarHBondContact OD1-CB 3.37Å; D115-F117 PolarHBondContact OD1-N 3.36Å; D115-V118 HydrophobicContact CB-CB 4.17Å; D115-V118 HydrophobicContact CB-CG2 3.88Å; D115-V118 PolarHBondContact O-N 3.24Å; D115-A119 PolarHBondContact O-N 3.01Å
116P80.3Confident80.5Confident115 Ų11537.6 Ų37.675%0.74722%0.221SC*.Hα-helixtrans-47.2-34173.9-27.534.6000114.7K120P116-K120 PolarHBondContact O-N 3.47Å
117F86Confident80.5Confident3 Ų340.1 Ų40.11%0.01324%0.235CC..Hα-helixtrans-68.5-44.3176.7176.8-110.4000112.5T75 E77 F80 D115 A119 K120 L121T75-F117 HydrophobicContact CG2-CE1 4.09Å; T75-F117 HydrophobicContact CG2-CZ 4.17Å; T75-F117 WeakPolarHBondContact O-CE1 3.29Å; E77-F117 HydrophobicContact CB-CB 4.21Å; E77-F117 HydrophobicContact CB-CD1 3.98Å; E77-F117 HydrophobicContact CB-CD2 3.57Å; E77-F117 HydrophobicContact CB-CE1 4.25Å; E77-F117 HydrophobicContact CB-CE2 3.89Å; E77-F117 HydrophobicContact CB-CG 3.63Å; E77-F117 HydrophobicContact CB-CZ 4.22Å; E77-F117 HydrophobicContact CG-CB 4.39Å; E77-F117 HydrophobicContact CG-CD2 3.45Å; E77-F117 VanDerWaalsContact CG-CD2 3.45Å; E77-F117 HydrophobicContact CG-CE2 3.88Å; E77-F117 HydrophobicContact CG-CG 3.95Å; F80-F117 HydrophobicContact CB-CE2 4.21Å; F80-F117 HydrophobicContact CB-CZ 3.67Å; F80-F117 AromaticContact CD1-CE2 3.99Å; F80-F117 HydrophobicContact CD1-CE2 3.99Å; F80-F117 AromaticContact CD1-CZ 3.99Å; F80-F117 HydrophobicContact CD1-CZ 3.99Å; F80-F117 HydrophobicContact CG-CE2 4.3Å; F80-F117 AromaticContact CG-CZ 3.85Å; F80-F117 HydrophobicContact CG-CZ 3.85Å; D115-F117 PolarHBondContact O-N 2.92Å; D115-F117 WeakPolarHBondContact OD1-CB 3.37Å; D115-F117 PolarHBondContact OD1-N 3.36Å; F117-A119 VanDerWaalsContact C-N 3.3Å; F117-A119 PolarHBondContact O-N 3.19Å; F117-K120 WeakPolarHBondContact O-CB 3.44Å; F117-K120 PolarHBondContact O-N 3.19Å; F117-L121 HydrophobicContact CD1-CD1 4.13Å; F117-L121 HydrophobicContact CE1-CD1 3.46Å; F117-L121 VanDerWaalsContact CE1-CD1 3.46Å; F117-L121 HydrophobicContact CE1-CG 4.03Å; F117-L121 HydrophobicContact CE2-CD2 4.32Å; F117-L121 HydrophobicContact CE2-CG 4.25Å; F117-L121 HydrophobicContact CZ-CD1 3.67Å; F117-L121 HydrophobicContact CZ-CD2 3.99Å; F117-L121 HydrophobicContact CZ-CG 3.86Å; F117-L121 PolarHBondContact O-N 3.44Å
118V85Confident80.5Confident5 Ų541.7 Ų41.73%0.0324%0.244CC..Hα-helixtrans-63.3-39.6176.2175.90000110.3L72 V110 D115 K120 L121 V122L72-V118 HydrophobicContact CB-CG1 4.45Å; V110-V118 HydrophobicContact CG1-CG1 4.25Å; D115-V118 HydrophobicContact CB-CB 4.17Å; D115-V118 HydrophobicContact CB-CG2 3.88Å; D115-V118 PolarHBondContact O-N 3.24Å; V118-K120 PolarHBondContact O-N 3.18Å; V118-L121 PolarHBondContact O-N 3.44Å; V118-V122 HydrophobicContact CG1-CG2 4.3Å; V118-V122 WeakPolarHBondContact O-CG2 3.39Å; V118-V122 PolarHBondContact O-N 3.38Å
119A82.6Confident80.7Confident19 Ų1941.6 Ų41.616%0.15724%0.243CC..Hα-helixtrans-59.6-44.3174.300000111.8D115 F117 L121 V122 S123 V171D115-A119 PolarHBondContact O-N 3.01Å; F117-A119 VanDerWaalsContact C-N 3.3Å; F117-A119 PolarHBondContact O-N 3.19Å; A119-L121 PolarHBondContact O-N 2.98Å; A119-V122 PolarHBondContact O-N 2.85Å; A119-S123 PolarHBondContact O-N 3.37Å; A119-V171 HydrophobicContact CB-CG1 3.81Å; A119-V171 HydrophobicContact CB-CG2 4.17Å; A119-V171 VanDerWaalsContact O-CG1 3.24Å; A119-V171 WeakPolarHBondContact O-CG1 3.29Å
120K85Confident81.1Confident104 Ų10440.4 Ų40.445%0.45223%0.234SC..Hα-helixtrans-59.2-43.6173.8-177.6-173.6177.4-169.30111.8D81 P116 F117 V118 R124D81-K120 IonicContact OD1-NZ 3.58Å; P116-K120 PolarHBondContact O-N 3.47Å; F117-K120 WeakPolarHBondContact O-CB 3.44Å; F117-K120 PolarHBondContact O-N 3.19Å; V118-K120 PolarHBondContact O-N 3.18Å; K120-R124 PolarHBondContact O-N 3.06Å; K120-R124 VanDerWaalsContact O-N 3.11Å
121L88.8Confident81.8Confident2 Ų248.5 Ų48.51%0.0126%0.261CS..Hα-helixtrans-63.5-47176-70.2-178.5000112L72 T75 F80 Y91 F92 F117 V118 A119 S123 R124 A125L72-L121 HydrophobicContact CD2-CB 4Å; L72-L121 HydrophobicContact CD2-CD1 4.48Å; T75-L121 HydrophobicContact CG2-CD1 4.24Å; F80-L121 HydrophobicContact CD1-CD2 4.21Å; F80-L121 HydrophobicContact CD2-CD2 4.41Å; F80-L121 HydrophobicContact CE1-CD2 3.8Å; F80-L121 HydrophobicContact CE2-CD2 4.01Å; F80-L121 HydrophobicContact CG-CD2 4.5Å; F80-L121 HydrophobicContact CZ-CD2 3.68Å; Y91-L121 HydrophobicContact CE1-CD2 4.33Å; F92-L121 HydrophobicContact CZ-CD2 4.07Å; F117-L121 HydrophobicContact CD1-CD1 4.13Å; F117-L121 HydrophobicContact CE1-CD1 3.46Å; F117-L121 VanDerWaalsContact CE1-CD1 3.46Å; F117-L121 HydrophobicContact CE1-CG 4.03Å; F117-L121 HydrophobicContact CE2-CD2 4.32Å; F117-L121 HydrophobicContact CE2-CG 4.25Å; F117-L121 HydrophobicContact CZ-CD1 3.67Å; F117-L121 HydrophobicContact CZ-CD2 3.99Å; F117-L121 HydrophobicContact CZ-CG 3.86Å; F117-L121 PolarHBondContact O-N 3.44Å; V118-L121 PolarHBondContact O-N 3.44Å; A119-L121 PolarHBondContact O-N 2.98Å; L121-S123 VanDerWaalsContact C-N 3.34Å; L121-S123 PolarHBondContact O-N 3.2Å; L121-R124 PolarHBondContact O-N 2.95Å; L121-A125 WeakPolarHBondContact O-CB 3.46Å; L121-A125 PolarHBondContact O-N 3.41Å
122V88.6Confident82.9Confident10 Ų1050.3 Ų50.36%0.06127%0.266CS..Hα-helixtrans-60.2-44.6178.4170.80000110.7L72 L107 V110 V118 A119 R124 A125 L126L72-V122 HydrophobicContact CD1-CG2 4.07Å; L72-V122 HydrophobicContact CD2-CG2 4.24Å; L107-V122 HydrophobicContact CD2-CG1 4.39Å; V110-V122 HydrophobicContact CB-CG2 4.14Å; V110-V122 HydrophobicContact CG1-CG2 4.02Å; V110-V122 HydrophobicContact CG2-CG2 4.17Å; V118-V122 HydrophobicContact CG1-CG2 4.3Å; V118-V122 WeakPolarHBondContact O-CG2 3.39Å; V118-V122 PolarHBondContact O-N 3.38Å; A119-V122 PolarHBondContact O-N 2.85Å; V122-R124 VanDerWaalsContact C-N 3.34Å; V122-R124 PolarHBondContact O-N 3.16Å; V122-A125 PolarHBondContact O-N 3Å; V122-L126 HydrophobicContact CG1-CD1 4.16Å; V122-L126 HydrophobicContact CG1-CG 4.45Å; V122-L126 WeakPolarHBondContact O-CB 3.48Å; V122-L126 WeakPolarHBondContact O-CG 3.43Å; V122-L126 PolarHBondContact O-N 3.03Å
123S86.6Confident84.3Confident9 Ų947.5 Ų47.56%0.06325%0.249CC..Hα-helixtrans-59.2-45.3176.7-1790000111.9A119 L121 L126 D127 K180A119-S123 PolarHBondContact O-N 3.37Å; L121-S123 VanDerWaalsContact C-N 3.34Å; L121-S123 PolarHBondContact O-N 3.2Å; S123-L126 PolarHBondContact O-N 3.44Å; S123-D127 PolarHBondContact O-N 3.4Å; S123-K180 PolarHBondContact OG-NZ 3.26Å
124R87.8Confident86.2Confident89 Ų8942.7 Ų42.734%0.33622%0.215SC..Hα-helixtrans-71.3-34-179-170.1165174.7-174.5-5.1111.8F92 K120 L121 V122 D127 V128F92-R124 HydrophobicContact CD2-CG 4.29Å; F92-R124 HydrophobicContact CE1-CB 3.9Å; F92-R124 HydrophobicContact CE1-CG 4.04Å; F92-R124 HydrophobicContact CE2-CB 4.31Å; F92-R124 VanDerWaalsContact CE2-CD 3.47Å; F92-R124 HydrophobicContact CE2-CG 3.66Å; F92-R124 HydrophobicContact CZ-CB 3.65Å; F92-R124 HydrophobicContact CZ-CG 3.53Å; K120-R124 PolarHBondContact O-N 3.06Å; K120-R124 VanDerWaalsContact O-N 3.11Å; L121-R124 PolarHBondContact O-N 2.95Å; V122-R124 VanDerWaalsContact C-N 3.34Å; V122-R124 PolarHBondContact O-N 3.16Å; R124-D127 PolarHBondContact O-N 3.02Å; R124-V128 WeakPolarHBondContact O-CG2 3.3Å; R124-V128 PolarHBondContact O-N 2.71Å
125A90.6Very high87.8Confident1 Ų140.6 Ų40.61%0.00820%0.203CC..Hα-helixtrans-64.2-41.4172.400000111.6F92 L107 L121 V122 V128 F129F92-A125 HydrophobicContact CD1-CB 3.94Å; F92-A125 HydrophobicContact CE1-CB 4.05Å; L107-A125 HydrophobicContact CD1-CB 4.01Å; L107-A125 HydrophobicContact CD2-CB 3.8Å; L121-A125 WeakPolarHBondContact O-CB 3.46Å; L121-A125 PolarHBondContact O-N 3.41Å; V122-A125 PolarHBondContact O-N 3Å; A125-V128 PolarHBondContact O-N 3.46Å; A125-F129 VanDerWaalsContact O-CB 3.23Å; A125-F129 WeakPolarHBondContact O-CB 3.35Å; A125-F129 PolarHBondContact O-N 3.06Å
126L91.1Very high88.4Confident3 Ų341 Ų412%0.01620%0.204CC..Hα-helixtrans-61.1-46172.9-75172.9000111.4L107 V122 S123 V128 F129 F130 I164 L168L107-L126 HydrophobicContact CB-CD2 3.52Å; L107-L126 HydrophobicContact CB-CG 4.11Å; L107-L126 HydrophobicContact CD1-CD2 3.84Å; L107-L126 HydrophobicContact CD1-CG 4.23Å; L107-L126 HydrophobicContact CG-CD2 4.31Å; V122-L126 HydrophobicContact CG1-CD1 4.16Å; V122-L126 HydrophobicContact CG1-CG 4.45Å; V122-L126 WeakPolarHBondContact O-CB 3.48Å; V122-L126 WeakPolarHBondContact O-CG 3.43Å; V122-L126 PolarHBondContact O-N 3.03Å; S123-L126 PolarHBondContact O-N 3.44Å; L126-V128 VanDerWaalsContact C-N 3.34Å; L126-V128 PolarHBondContact O-N 3.33Å; L126-F129 PolarHBondContact O-N 2.72Å; L126-F130 HydrophobicContact CB-CE2 3.92Å; L126-F130 HydrophobicContact CB-CZ 3.87Å; L126-F130 HydrophobicContact CD2-CE1 3.95Å; L126-F130 HydrophobicContact CD2-CZ 3.69Å; L126-F130 HydrophobicContact CG-CZ 4.24Å; L126-F130 WeakPolarHBondContact O-CB 3.39Å; L126-F130 WeakPolarHBondContact O-CD1 3.45Å; L126-F130 VanDerWaalsContact O-CD2 3.3Å; L126-F130 WeakPolarHBondContact O-CD2 3.4Å; L126-F130 WeakPolarHBondContact O-CG 3.25Å; L126-F130 PolarHBondContact O-N 3.31Å; L126-I164 HydrophobicContact CD1-CD1 4.39Å; L126-I164 HydrophobicContact CD2-CD1 3.68Å; L126-L168 HydrophobicContact CD1-CD2 4.02Å
127D89.2Confident89Confident53 Ų5335.5 Ų35.528%0.28317%0.168SC..Hα-helixtrans-59.8-43.1178.3-69.4-31.4000112.1S123 R124 R131S123-D127 PolarHBondContact O-N 3.4Å; R124-D127 PolarHBondContact O-N 3.02Å; D127-R131 VanDerWaalsContact O-CG 3.3Å; D127-R131 WeakPolarHBondContact O-CG 3.46Å; D127-R131 PolarHBondContact O-N 3.32Å
128V91.3Very high89.4Confident32 Ų3235.3 Ų35.319%0.19417%0.168CC..Hα-helixtrans-67.2-43.5176.4172.50000111F92 L96 R124 A125 L126 R131 N132F92-V128 HydrophobicContact CB-CB 4.39Å; F92-V128 HydrophobicContact CB-CG1 4.18Å; F92-V128 HydrophobicContact CB-CG2 4.09Å; F92-V128 HydrophobicContact CG-CG2 4.3Å; L96-V128 HydrophobicContact CD1-CG1 3.74Å; L96-V128 HydrophobicContact CD2-CG1 4.05Å; L96-V128 HydrophobicContact CG-CG1 3.95Å; R124-V128 WeakPolarHBondContact O-CG2 3.3Å; R124-V128 PolarHBondContact O-N 2.71Å; A125-V128 PolarHBondContact O-N 3.46Å; L126-V128 VanDerWaalsContact C-N 3.34Å; L126-V128 PolarHBondContact O-N 3.33Å; V128-R131 PolarHBondContact O-N 2.86Å; V128-N132 PolarHBondContact O-N 3.4Å; V128-N132 VanDerWaalsContact O-N 3.08Å
129F92.5Very high89.7Confident1 Ų136.9 Ų36.90%0.00418%0.177CC..Iπ-helixtrans-64.9-41.5179.2-174.1-105.9000112P100 V103 M104 L107 A125 L126 R131 N132 G133 L134 L137P100-F129 HydrophobicContact CB-CE2 3.91Å; P100-F129 HydrophobicContact CB-CZ 4.07Å; P100-F129 WeakPolarHBondContact O-CZ 3.15Å; V103-F129 HydrophobicContact CB-CD2 4.22Å; V103-F129 HydrophobicContact CB-CE2 3.9Å; V103-F129 HydrophobicContact CB-CZ 4.43Å; V103-F129 HydrophobicContact CG1-CD2 3.47Å; V103-F129 VanDerWaalsContact CG1-CD2 3.47Å; V103-F129 HydrophobicContact CG1-CE2 3.67Å; V103-F129 HydrophobicContact CG1-CG 3.99Å; V103-F129 HydrophobicContact CG1-CZ 4.33Å; M104-F129 HydrophobicContact CB-CE1 4.14Å; M104-F129 HydrophobicContact CB-CZ 4.28Å; M104-F129 HydrophobicContact SD-CD1 4.44Å; M104-F129 HydrophobicContact SD-CE1 3.9Å; L107-F129 HydrophobicContact CD1-CB 4.34Å; A125-F129 VanDerWaalsContact O-CB 3.23Å; A125-F129 WeakPolarHBondContact O-CB 3.35Å; A125-F129 PolarHBondContact O-N 3.06Å; L126-F129 PolarHBondContact O-N 2.72Å; F129-R131 VanDerWaalsContact C-N 3.3Å; F129-R131 PolarHBondContact O-N 3.44Å; F129-N132 PolarHBondContact O-N 2.9Å; F129-G133 CarbonylContact O-C 3.52Å; F129-G133 WeakPolarHBondContact O-CA 3.42Å; F129-G133 PolarHBondContact O-N 2.99Å; F129-L134 HydrophobicContact CE1-CB 4.38Å; F129-L134 HydrophobicContact CE1-CD1 4.1Å; F129-L134 PolarHBondContact O-N 2.95Å; F129-L137 HydrophobicContact CZ-CD2 4.27Å
130F92.1Very high90.1Very high13 Ų1336.7 Ų36.76%0.05717%0.174CC..Iπ-helixtrans-63.9-35.1177-62.8-21.2000112.8L126 L134 I164 L168 Y184 A187L126-F130 HydrophobicContact CB-CE2 3.92Å; L126-F130 HydrophobicContact CB-CZ 3.87Å; L126-F130 HydrophobicContact CD2-CE1 3.95Å; L126-F130 HydrophobicContact CD2-CZ 3.69Å; L126-F130 HydrophobicContact CG-CZ 4.24Å; L126-F130 WeakPolarHBondContact O-CB 3.39Å; L126-F130 WeakPolarHBondContact O-CD1 3.45Å; L126-F130 VanDerWaalsContact O-CD2 3.3Å; L126-F130 WeakPolarHBondContact O-CD2 3.4Å; L126-F130 WeakPolarHBondContact O-CG 3.25Å; L126-F130 PolarHBondContact O-N 3.31Å; F130-L134 HydrophobicContact CD1-CD2 4.15Å; F130-I164 HydrophobicContact CE1-CG2 4.29Å; F130-I164 HydrophobicContact CE2-CG2 4.23Å; F130-I164 HydrophobicContact CZ-CG2 3.46Å; F130-I164 VanDerWaalsContact CZ-CG2 3.46Å; F130-L168 HydrophobicContact CE2-CD1 4.22Å; F130-L168 HydrophobicContact CE2-CD2 4.45Å; F130-Y184 HydrophobicContact CD1-CD2 4.16Å; F130-Y184 HydrophobicContact CD2-CD2 4.18Å; F130-Y184 AromaticContact CE1-CD2 3.72Å; F130-Y184 HydrophobicContact CE1-CD2 3.72Å; F130-Y184 AromaticContact CE1-CE2 3.95Å; F130-Y184 HydrophobicContact CE1-CE2 3.95Å; F130-Y184 AromaticContact CE2-CD2 3.73Å; F130-Y184 HydrophobicContact CE2-CD2 3.73Å; F130-Y184 HydrophobicContact CE2-CG 4.32Å; F130-Y184 HydrophobicContact CG-CD2 4.4Å; F130-Y184 AromaticContact CZ-CD2 3.5Å; F130-Y184 HydrophobicContact CZ-CD2 3.5Å; F130-Y184 VanDerWaalsContact CZ-CD2 3.5Å; F130-Y184 HydrophobicContact CZ-CE2 4.03Å; F130-Y184 HydrophobicContact CZ-CG 4.4Å; F130-A187 HydrophobicContact CB-CB 3.85Å
131R88.6Confident90.3Very high201 Ų20132.6 Ų32.676%0.75816%0.157SC*.Iπ-helixtrans-71.5-42.4177.9-71.6173.9-175.6-121.21.9112.4D127 V128 F129D127-R131 VanDerWaalsContact O-CG 3.3Å; D127-R131 WeakPolarHBondContact O-CG 3.46Å; D127-R131 PolarHBondContact O-N 3.32Å; V128-R131 PolarHBondContact O-N 2.86Å; F129-R131 VanDerWaalsContact C-N 3.3Å; F129-R131 PolarHBondContact O-N 3.44Å
132N87.7Confident90.3Very high89 Ų8932.5 Ų32.548%0.47616%0.157SC..Iπ-helixtrans-119.9-38.5-165.6-60.2-35.5000114.4L96 V128 F129 I136L96-N132 HydrophobicContact CD1-CB 3.9Å; L96-N132 HydrophobicContact CD2-CB 3.78Å; V128-N132 PolarHBondContact O-N 3.4Å; V128-N132 VanDerWaalsContact O-N 3.08Å; F129-N132 PolarHBondContact O-N 2.9Å; N132-I136 WeakPolarHBondContact O-CD1 3.49Å
133G87.5Confident90.1Very high4 Ų433 Ų334%0.04116%0.159CC..Iπ-helixtrans-92.5-31.3-172.300000115F129 S135 I136 L137F129-G133 CarbonylContact O-C 3.52Å; F129-G133 WeakPolarHBondContact O-CA 3.42Å; F129-G133 PolarHBondContact O-N 2.99Å; G133-S135 PolarHBondContact O-N 3.03Å; G133-I136 WeakPolarHBondContact O-CB 3.31Å; G133-I136 PolarHBondContact O-N 3.37Å; G133-I136 VanDerWaalsContact O-N 3.14Å; G133-L137 PolarHBondContact O-N 2.91Å
134L93.4Very high89.5Confident0 Ų036.3 Ų36.30%018%0.179CC..Hα-helixtrans-65.1-39.6-173.4-174.361.9000113F129 F130 I136 L137 L138 F161 A187 I188 A191F129-L134 HydrophobicContact CE1-CB 4.38Å; F129-L134 HydrophobicContact CE1-CD1 4.1Å; F129-L134 PolarHBondContact O-N 2.95Å; F130-L134 HydrophobicContact CD1-CD2 4.15Å; L134-I136 VanDerWaalsContact C-N 3.34Å; L134-L137 WeakPolarHBondContact O-CB 3.42Å; L134-L137 PolarHBondContact O-N 3.44Å; L134-L138 PolarHBondContact O-N 3.32Å; L134-L138 VanDerWaalsContact O-N 3.12Å; L134-F161 HydrophobicContact CD1-CE1 3.63Å; L134-F161 HydrophobicContact CD1-CZ 3.73Å; L134-A187 HydrophobicContact CD2-CB 4.12Å; L134-I188 HydrophobicContact CD2-CB 4.22Å; L134-A191 HydrophobicContact CD2-CB 4.39Å; L134-A191 HydrophobicContact CG-CB 4.01Å
135S92.3Very high88.5Confident14 Ų1439 Ų3910%0.09820%0.195CC..Hα-helixtrans-62.9-42.3174.2-65.70000111.2G133 L137 L138 V139 K194G133-S135 PolarHBondContact O-N 3.03Å; S135-L137 VanDerWaalsContact C-N 3.34Å; S135-L137 PolarHBondContact O-N 2.66Å; S135-L138 PolarHBondContact O-N 2.92Å; S135-V139 VanDerWaalsContact O-CB 3.23Å; S135-V139 WeakPolarHBondContact O-CB 2.97Å; S135-V139 WeakPolarHBondContact O-CG2 3.37Å; S135-V139 PolarHBondContact O-N 3.14Å; S135-K194 PolarHBondContact OG-NZ 3.49Å
136I90.4Very high87.3Confident93 Ų9343.8 Ų43.848%0.47722%0.217SC..Hα-helixtrans-61.3-46.6178.5-59.4172000109.5N132 G133 L134 L138 V139 T140N132-I136 WeakPolarHBondContact O-CD1 3.49Å; G133-I136 WeakPolarHBondContact O-CB 3.31Å; G133-I136 PolarHBondContact O-N 3.37Å; G133-I136 VanDerWaalsContact O-N 3.14Å; L134-I136 VanDerWaalsContact C-N 3.34Å; I136-L138 PolarHBondContact O-N 2.99Å; I136-V139 PolarHBondContact O-N 3.47Å; I136-T140 WeakPolarHBondContact O-CB 3.4Å; I136-T140 PolarHBondContact O-N 3.49Å; I136-T140 PolarHBondContact O-OG1 3.39Å; I136-T140 VanDerWaalsContact O-OG1 3.09Å
137L92.2Very high85.9Confident0 Ų053.8 Ų53.80%026%0.255CS..Hα-helixtrans-53.2-57176.6-178.854.3000111.9P100 T101 M104 F129 G133 L134 S135 V139 T140 L141 L157 F161P100-L137 HydrophobicContact CB-CB 3.97Å; P100-L137 HydrophobicContact CB-CD1 4.19Å; P100-L137 HydrophobicContact CG-CB 4.28Å; P100-L137 HydrophobicContact CG-CD1 4.08Å; T101-L137 VanDerWaalsContact OG1-CD1 3.27Å; T101-L137 WeakPolarHBondContact OG1-CD1 3.34Å; M104-L137 HydrophobicContact CB-CD2 4.04Å; M104-L137 HydrophobicContact CG-CD2 4.3Å; F129-L137 HydrophobicContact CZ-CD2 4.27Å; G133-L137 PolarHBondContact O-N 2.91Å; L134-L137 WeakPolarHBondContact O-CB 3.42Å; L134-L137 PolarHBondContact O-N 3.44Å; S135-L137 VanDerWaalsContact C-N 3.34Å; S135-L137 PolarHBondContact O-N 2.66Å; L137-V139 PolarHBondContact O-N 2.94Å; L137-T140 PolarHBondContact O-N 3.39Å; L137-L141 HydrophobicContact CD1-CD1 4Å; L137-L141 HydrophobicContact CD1-CG 4.37Å; L137-L141 HydrophobicContact CG-CD1 4.18Å; L137-L141 VanDerWaalsContact O-CG 3.26Å; L137-L141 WeakPolarHBondContact O-CG 3.33Å; L137-L141 PolarHBondContact O-N 3.29Å; L137-L141 VanDerWaalsContact O-N 3.16Å; L137-L157 HydrophobicContact CD2-CD1 4.44Å; L137-F161 HydrophobicContact CD2-CE2 4.15Å; L137-F161 HydrophobicContact CD2-CZ 4.03Å
138L93.7Very high84.8Confident0 Ų052.7 Ų52.70%025%0.248CC..Hα-helixtrans-70.3-32.2-174.2-69.5-177.9000112.7L134 S135 I136 L141 F161 I188 A191 L192 A195 F213 H214 L217L134-L138 PolarHBondContact O-N 3.32Å; L134-L138 VanDerWaalsContact O-N 3.12Å; S135-L138 PolarHBondContact O-N 2.92Å; I136-L138 PolarHBondContact O-N 2.99Å; L138-L141 HydrophobicContact CD2-CD1 4.44Å; L138-F161 HydrophobicContact CD2-CZ 3.93Å; L138-F161 HydrophobicContact CG-CZ 4.39Å; L138-I188 HydrophobicContact CD1-CG1 4.43Å; L138-A191 HydrophobicContact CB-CB 4.38Å; L138-A191 HydrophobicContact CD1-CB 3.55Å; L138-A191 HydrophobicContact CG-CB 4.33Å; L138-L192 HydrophobicContact CD1-CD2 3.93Å; L138-L192 HydrophobicContact CD1-CG 3.95Å; L138-A195 HydrophobicContact CB-CB 4.23Å; L138-A195 VanDerWaalsContact O-CB 3.32Å; L138-A195 WeakPolarHBondContact O-CB 3.2Å; L138-F213 HydrophobicContact CD2-CD1 4.06Å; L138-F213 HydrophobicContact CD2-CE1 3.55Å; L138-H214 PolarHBondContact O-CE1 2.86Å; L138-H214 PolarHBondContact O-NE2 2.58Å; L138-L217 HydrophobicContact CD2-CD2 4.01Å
139V92.7Very high83.8Confident37 Ų3752.4 Ų52.422%0.22425%0.248CC..Hα-helixtrans-68.7-45.3175.61690000110.4S135 I136 L137 L141 V142 K194 A195 E198S135-V139 VanDerWaalsContact O-CB 3.23Å; S135-V139 WeakPolarHBondContact O-CB 2.97Å; S135-V139 WeakPolarHBondContact O-CG2 3.37Å; S135-V139 PolarHBondContact O-N 3.14Å; I136-V139 PolarHBondContact O-N 3.47Å; L137-V139 PolarHBondContact O-N 2.94Å; V139-L141 VanDerWaalsContact C-N 3.29Å; V139-L141 PolarHBondContact O-N 3.21Å; V139-V142 WeakPolarHBondContact O-CB 3.49Å; V139-V142 WeakPolarHBondContact O-CG2 3.49Å; V139-V142 PolarHBondContact O-N 3.02Å; V139-V142 VanDerWaalsContact O-N 3.13Å; V139-K194 HydrophobicContact CG2-CB 3.9Å; V139-A195 HydrophobicContact CG2-CB 4.38Å; V139-E198 HydrophobicContact CG1-CB 3.97Å; V139-E198 HydrophobicContact CG1-CG 3.81Å
140T89.8Confident82.8Confident16 Ų1657.4 Ų57.410%0.09827%0.271CS..Hα-helixtrans-67.1-30.7179.8-58.30000113I136 L137 V142 D143 Q146 I148I136-T140 WeakPolarHBondContact O-CB 3.4Å; I136-T140 PolarHBondContact O-N 3.49Å; I136-T140 PolarHBondContact O-OG1 3.39Å; I136-T140 VanDerWaalsContact O-OG1 3.09Å; L137-T140 PolarHBondContact O-N 3.39Å; T140-V142 PolarHBondContact O-N 3.42Å; T140-V142 VanDerWaalsContact O-N 3.07Å; T140-D143 WeakPolarHBondContact O-CB 2.8Å; T140-D143 PolarHBondContact O-N 3.46Å; T140-Q146 HydrophobicContact CG2-CB 3.73Å; T140-Q146 HydrophobicContact CG2-CG 4.45Å; T140-I148 HydrophobicContact CG2-CB 4.3Å; T140-I148 HydrophobicContact CG2-CD1 3.13Å; T140-I148 HydrophobicContact CG2-CG1 3.46Å; T140-I148 VanDerWaalsContact CG2-CG1 3.46Å
141L89.7Confident81.8Confident18 Ų1860.7 Ų60.79%0.09430%0.296CS..THydrogen-bonded Turntrans-65.8-9.6176.3-69.4171.9000114L137 L138 V139 D143 C149 F154 L157 F213L137-L141 HydrophobicContact CD1-CD1 4Å; L137-L141 HydrophobicContact CD1-CG 4.37Å; L137-L141 HydrophobicContact CG-CD1 4.18Å; L137-L141 VanDerWaalsContact O-CG 3.26Å; L137-L141 WeakPolarHBondContact O-CG 3.33Å; L137-L141 PolarHBondContact O-N 3.29Å; L137-L141 VanDerWaalsContact O-N 3.16Å; L138-L141 HydrophobicContact CD2-CD1 4.44Å; V139-L141 VanDerWaalsContact C-N 3.29Å; V139-L141 PolarHBondContact O-N 3.21Å; L141-D143 VanDerWaalsContact C-N 3.34Å; L141-C149 WeakPolarHBondContact CD2-SG 3.45Å; L141-F154 HydrophobicContact CD2-CE1 4.37Å; L141-L157 HydrophobicContact CD1-CD2 3.94Å; L141-F213 HydrophobicContact CB-CD1 4.42Å; L141-F213 HydrophobicContact CD1-CD1 3.42Å; L141-F213 VanDerWaalsContact CD1-CD1 3.42Å; L141-F213 HydrophobicContact CD1-CD2 4.49Å; L141-F213 HydrophobicContact CD1-CE1 3.58Å; L141-F213 HydrophobicContact CD1-CG 3.91Å; L141-F213 HydrophobicContact CD1-CZ 4.21Å
142V89.2Confident81.2Confident0 Ų055.7 Ų55.70%029%0.292CS..THydrogen-bonded Turntrans-73.4-31.1169.9179.70000111.2V139 T140 T144 A195 T199 S209 S210 L211V139-V142 WeakPolarHBondContact O-CB 3.49Å; V139-V142 WeakPolarHBondContact O-CG2 3.49Å; V139-V142 PolarHBondContact O-N 3.02Å; V139-V142 VanDerWaalsContact O-N 3.13Å; T140-V142 PolarHBondContact O-N 3.42Å; T140-V142 VanDerWaalsContact O-N 3.07Å; V142-T144 PolarHBondContact O-N 3.41Å; V142-A195 HydrophobicContact CG2-CB 3.81Å; V142-A195 WeakPolarHBondContact CG2-O 3.44Å; V142-T199 HydrophobicContact CG1-CG2 4.29Å; V142-T199 WeakPolarHBondContact CG1-OG1 3.22Å; V142-S209 CarbonylContact O-C 3.59Å; V142-S209 VanDerWaalsContact O-CA 3.25Å; V142-S209 WeakPolarHBondContact O-CA 3.32Å; V142-S210 WeakPolarHBondContact CA-O 3.21Å; V142-S210 PolarHBondContact O-N 2.61Å; V142-L211 HydrophobicContact CG2-CD2 4.47Å
143D83.5Confident80.9Confident21 Ų2152.7 Ų52.711%0.11228%0.278CS..BIsolated β-bridgetrans-80.2115-175.8-169.3-15.6000111.3T140 L141 E145 Q146 R202T140-D143 WeakPolarHBondContact O-CB 2.8Å; T140-D143 PolarHBondContact O-N 3.46Å; L141-D143 VanDerWaalsContact C-N 3.34Å; D143-E145 PolarHBondContact O-N 3.41Å; D143-E145 WeakPolarHBondContact OD1-CA 3.29Å; D143-E145 VanDerWaalsContact OD1-CB 3.28Å; D143-E145 WeakPolarHBondContact OD1-CB 3.43Å; D143-E145 PolarHBondContact OD1-N 2.86Å; D143-Q146 HydrophobicContact CB-CB 4.05Å; D143-Q146 HydrophobicContact CB-CG 4.32Å; D143-Q146 PolarHBondContact OD1-N 2.79Å; D143-Q146 WeakPolarHBondContact OD2-CG 3.45Å; D143-R202 VanDerWaalsContact CB-NH1 3.34Å; D143-R202 IonicContact OD1-CZ 2.84Å; D143-R202 IonicContact OD1-NH1 3.8Å; D143-R202 PolarHBondContact OD1-NH1 2.81Å; D143-R202 IonicContact OD1-NH2 3.97Å; D143-R202 PolarHBondContact OD1-NH2 3.48Å; D143-R202 IonicContact OD2-CZ 3.14Å; D143-R202 IonicContact OD2-NH1 3.65Å; D143-R202 PolarHBondContact OD2-NH1 2.77Å; D143-R202 IonicContact OD2-NH2 3.91Å
144T74.1Confident80.9Confident77 Ų7753.5 Ų53.547%0.47228%0.28SS..SBendtrans-72.5-17.9176.947.90000113.4V142V142-T144 PolarHBondContact O-N 3.41Å
145E66.7Low80.6Confident145 Ų14555.8 Ų55.868%0.67830%0.303SS*.SBendtrans-87.6-33-179.5-55.3-177.5175.100111.6D143 R147D143-E145 PolarHBondContact O-N 3.41Å; D143-E145 WeakPolarHBondContact OD1-CA 3.29Å; D143-E145 VanDerWaalsContact OD1-CB 3.28Å; D143-E145 WeakPolarHBondContact OD1-CB 3.43Å; D143-E145 PolarHBondContact OD1-N 2.86Å; E145-R147 PolarHBondContact O-N 3.13Å
146Q65.9Low80.4Confident102 Ų10257.9 Ų57.948%0.47732%0.322SS..  trans-81.3103.1178.1-71.9-175.414.200111.6T140 D143 I148T140-Q146 HydrophobicContact CG2-CB 3.73Å; T140-Q146 HydrophobicContact CG2-CG 4.45Å; D143-Q146 HydrophobicContact CB-CB 4.05Å; D143-Q146 HydrophobicContact CB-CG 4.32Å; D143-Q146 PolarHBondContact OD1-N 2.79Å; D143-Q146 WeakPolarHBondContact OD2-CG 3.45Å; Q146-I148 PolarHBondContact O-N 3.39Å
147R62.4Low80.4Confident214 Ų21453.5 Ų53.581%0.80830%0.3SS*.  trans-77.761.9176.4-64.4-172.8-178.3-179.51.5112.8E145 C149E145-R147 PolarHBondContact O-N 3.13Å; R147-C149 VanDerWaalsContact C-N 3.31Å
148I65.1Low80.4Confident29 Ų2953.7 Ų53.715%0.14930%0.301CS..SBendtrans-69-34.4170-65-158.5000110.6N99 P100 T101 T140 Q146N99-I148 PolarHBondContact ND2-O 3.14Å; N99-I148 VanDerWaalsContact OD1-CG2 3.3Å; N99-I148 WeakPolarHBondContact OD1-CG2 3.34Å; P100-I148 HydrophobicContact CG-CD1 4.34Å; P100-I148 HydrophobicContact CG-CG2 4.46Å; T101-I148 VanDerWaalsContact OG1-CG2 3.32Å; T101-I148 WeakPolarHBondContact OG1-CG2 3.37Å; T140-I148 HydrophobicContact CG2-CB 4.3Å; T140-I148 HydrophobicContact CG2-CD1 3.13Å; T140-I148 HydrophobicContact CG2-CG1 3.46Å; T140-I148 VanDerWaalsContact CG2-CG1 3.46Å; Q146-I148 PolarHBondContact O-N 3.39Å
149C70.5Confident80.2Confident27 Ų2756.3 Ų56.318%0.18231%0.313CS..SBendtrans-152.7163172.1760000111.6T101 L141 R147 S153 F154T101-C149 HydrophobicContact CG2-CB 4.03Å; L141-C149 WeakPolarHBondContact CD2-SG 3.45Å; R147-C149 VanDerWaalsContact C-N 3.31Å; C149-S153 WeakPolarHBondContact CB-OG 3.29Å; C149-F154 VanDerWaalsContact SG-CE1 3.6Å
150Q70.4Confident80.2Confident105 Ų10554.6 Ų54.649%0.49130%0.303SS..  trans-92.6152.1176.5-66.1-178.6-2.100110.2S152 S153Q150-S152 WeakPolarHBondContact CB-OG 3.44Å; Q150-S152 PolarHBondContact O-N 3.07Å; Q150-S152 VanDerWaalsContact O-N 3.11Å; Q150-S152 PolarHBondContact OE1-OG 3.41Å; Q150-S153 PolarHBondContact N-OG 2.91Å; Q150-S153 WeakPolarHBondContact O-CB 3.2Å; Q150-S153 PolarHBondContact O-N 3.36Å; Q150-S153 PolarHBondContact O-OG 2.85Å
151S72Confident80.5Confident82 Ų8253.8 Ų53.857%0.57330%0.298SS*.G310 helixtrans-54.6-32.2176.455.40000113.1S153 F154S151-S153 PolarHBondContact O-N 3.29Å; S151-S153 VanDerWaalsContact O-N 3.17Å; S151-F154 WeakPolarHBondContact O-CB 3.4Å; S151-F154 WeakPolarHBondContact O-CG 3.36Å; S151-F154 PolarHBondContact O-N 3.39Å; S151-F154 VanDerWaalsContact O-N 3.13Å
152S75.6Confident80.5Confident96 Ų9653.5 Ų53.567%0.67130%0.297SS*.G310 helixtrans-58.9-24.1173.156.90000114.2Q150Q150-S152 WeakPolarHBondContact CB-OG 3.44Å; Q150-S152 PolarHBondContact O-N 3.07Å; Q150-S152 VanDerWaalsContact O-N 3.11Å; Q150-S152 PolarHBondContact OE1-OG 3.41Å
153S81.3Confident80.5Confident26 Ų2657.9 Ų57.918%0.18231%0.313CS..G310 helixtrans-91.2-9.4179.670.70000114.1C149 Q150 S151 G155 A156 L157C149-S153 WeakPolarHBondContact CB-OG 3.29Å; Q150-S153 PolarHBondContact N-OG 2.91Å; Q150-S153 WeakPolarHBondContact O-CB 3.2Å; Q150-S153 PolarHBondContact O-N 3.36Å; Q150-S153 PolarHBondContact O-OG 2.85Å; S151-S153 PolarHBondContact O-N 3.29Å; S151-S153 VanDerWaalsContact O-N 3.17Å; S153-G155 PolarHBondContact O-N 2.92Å; S153-A156 PolarHBondContact O-N 3.2Å; S153-A156 VanDerWaalsContact O-N 3.11Å; S153-L157 PolarHBondContact O-N 2.85Å
154F88.6Confident80.8Confident21 Ų2156.9 Ų56.99%0.09231%0.308CS..Hα-helixtrans-58.3-35.3-177.1-73.5-1.8000113L141 C149 S151 L157 C158 E212 F213 L216L141-F154 HydrophobicContact CD2-CE1 4.37Å; C149-F154 VanDerWaalsContact SG-CE1 3.6Å; S151-F154 WeakPolarHBondContact O-CB 3.4Å; S151-F154 WeakPolarHBondContact O-CG 3.36Å; S151-F154 PolarHBondContact O-N 3.39Å; S151-F154 VanDerWaalsContact O-N 3.13Å; F154-L157 PolarHBondContact O-N 3.33Å; F154-C158 WeakPolarHBondContact O-CB 3.31Å; F154-C158 PolarHBondContact O-N 3.19Å; F154-C158 PolarHBondContact O-SG 2.6Å; F154-E212 HydrophobicContact CE2-CB 4.39Å; F154-E212 HydrophobicContact CE2-CG 4.25Å; F154-F213 HydrophobicContact CB-CD2 3.92Å; F154-F213 HydrophobicContact CB-CE2 4.45Å; F154-F213 HydrophobicContact CD1-CB 4.41Å; F154-F213 AromaticContact CD1-CD2 3.73Å; F154-F213 HydrophobicContact CD1-CD2 3.73Å; F154-F213 HydrophobicContact CD1-CG 4.42Å; F154-F213 HydrophobicContact CD2-CB 4.03Å; F154-F213 HydrophobicContact CD2-CD2 4.14Å; F154-F213 HydrophobicContact CE1-CB 4.16Å; F154-F213 HydrophobicContact CE1-CD2 4.23Å; F154-F213 HydrophobicContact CE1-CG 4.49Å; F154-F213 HydrophobicContact CE2-CB 3.77Å; F154-F213 HydrophobicContact CG-CB 4.35Å; F154-F213 AromaticContact CG-CD2 3.68Å; F154-F213 HydrophobicContact CG-CD2 3.68Å; F154-F213 HydrophobicContact CG-CG 4.48Å; F154-F213 HydrophobicContact CZ-CB 3.84Å; F154-L216 HydrophobicContact CB-CD2 3.71Å
155G86Confident81.5Confident48 Ų4853.2 Ų53.250%0.49529%0.286SS..Hα-helixtrans-63.3-44.7176.800000112.9S153 Q159S153-G155 PolarHBondContact O-N 2.92Å; G155-Q159 WeakPolarHBondContact O-CB 3.24Å; G155-Q159 PolarHBondContact O-N 3.33Å
156A87.6Confident82.2Confident59 Ų5950.9 Ų50.949%0.48828%0.278SS..Hα-helixtrans-66-41.317700000111.2L105 S153 Q159 A160L105-A156 HydrophobicContact CD2-CB 4.34Å; S153-A156 PolarHBondContact O-N 3.2Å; S153-A156 VanDerWaalsContact O-N 3.11Å; A156-Q159 PolarHBondContact O-N 3.43Å; A156-A160 PolarHBondContact O-N 3.4Å
157L91.9Very high82.9Confident1 Ų148.8 Ų48.81%0.00527%0.266CS..Hα-helixtrans-65.4-47177.4-174.557.3000111.6T101 M104 L137 L141 S153 F154 Q159 A160 F161 F213T101-L157 HydrophobicContact CG2-CD1 4.23Å; T101-L157 HydrophobicContact CG2-CD2 4.22Å; M104-L157 HydrophobicContact CB-CD1 4.03Å; M104-L157 HydrophobicContact CG-CD1 3.82Å; L137-L157 HydrophobicContact CD2-CD1 4.44Å; L141-L157 HydrophobicContact CD1-CD2 3.94Å; S153-L157 PolarHBondContact O-N 2.85Å; F154-L157 PolarHBondContact O-N 3.33Å; L157-Q159 PolarHBondContact O-N 3.48Å; L157-A160 WeakPolarHBondContact O-CA 3.22Å; L157-A160 VanDerWaalsContact O-CB 3.26Å; L157-A160 WeakPolarHBondContact O-CB 3.12Å; L157-A160 PolarHBondContact O-N 3.26Å; L157-F161 HydrophobicContact CD1-CD2 4.29Å; L157-F161 HydrophobicContact CD1-CE2 3.97Å; L157-F161 HydrophobicContact CG-CD2 4.24Å; L157-F161 HydrophobicContact CG-CE2 3.97Å; L157-F161 WeakPolarHBondContact O-CD2 3.33Å; L157-F161 PolarHBondContact O-N 2.6Å; L157-F161 VanDerWaalsContact O-N 3.11Å; L157-F213 HydrophobicContact CB-CE2 3.93Å; L157-F213 HydrophobicContact CB-CZ 4.31Å; L157-F213 HydrophobicContact CD2-CD2 4.4Å; L157-F213 HydrophobicContact CD2-CE1 4.28Å; L157-F213 HydrophobicContact CD2-CE2 3.6Å; L157-F213 HydrophobicContact CD2-CZ 3.54Å; L157-F213 HydrophobicContact CG-CE2 3.76Å; L157-F213 HydrophobicContact CG-CZ 3.65Å
158C91.5Very high83.9Confident3 Ų338.8 Ų38.82%0.0223%0.228CC..Hα-helixtrans-57.3-39174.1-72.90000111.9F154 A160 F161 V162 F213 K220F154-C158 WeakPolarHBondContact O-CB 3.31Å; F154-C158 PolarHBondContact O-N 3.19Å; F154-C158 PolarHBondContact O-SG 2.6Å; C158-A160 VanDerWaalsContact C-N 3.3Å; C158-A160 PolarHBondContact O-N 3.29Å; C158-F161 PolarHBondContact O-N 3.47Å; C158-V162 WeakPolarHBondContact O-CG2 3.46Å; C158-V162 PolarHBondContact O-N 3.26Å; C158-V162 VanDerWaalsContact O-N 3.14Å; C158-F213 VanDerWaalsContact SG-CE2 3.54Å; C158-K220 HydrophobicContact CB-CB 4.36Å; C158-K220 HydrophobicContact CB-CG 4.2Å
159Q90.7Very high84.7Confident55 Ų5541 Ų4126%0.25724%0.243SC..Hα-helixtrans-66.3-32.9176-169.259.343.900112.4G155 A156 L157 V162 R163G155-Q159 WeakPolarHBondContact O-CB 3.24Å; G155-Q159 PolarHBondContact O-N 3.33Å; A156-Q159 PolarHBondContact O-N 3.43Å; L157-Q159 PolarHBondContact O-N 3.48Å; Q159-V162 PolarHBondContact O-N 2.86Å; Q159-R163 VanDerWaalsContact O-CG 3.32Å; Q159-R163 WeakPolarHBondContact O-CG 3.5Å; Q159-R163 PolarHBondContact O-N 3.01Å; Q159-R163 VanDerWaalsContact O-N 3.12Å
160A92.5Very high85.1Confident1 Ų142.5 Ų42.51%0.00826%0.257CS..Hα-helixtrans-62.7-47.2172.500000111.5M104 L105 S108 A156 L157 C158 V162 R163 I164M104-A160 HydrophobicContact CG-CB 4.25Å; L105-A160 HydrophobicContact CD2-CB 4.07Å; S108-A160 WeakPolarHBondContact OG-CB 3.4Å; A156-A160 PolarHBondContact O-N 3.4Å; L157-A160 WeakPolarHBondContact O-CA 3.22Å; L157-A160 VanDerWaalsContact O-CB 3.26Å; L157-A160 WeakPolarHBondContact O-CB 3.12Å; L157-A160 PolarHBondContact O-N 3.26Å; C158-A160 VanDerWaalsContact C-N 3.3Å; C158-A160 PolarHBondContact O-N 3.29Å; A160-V162 VanDerWaalsContact C-N 3.31Å; A160-V162 PolarHBondContact O-N 3.29Å; A160-R163 PolarHBondContact O-N 2.77Å; A160-R163 VanDerWaalsContact O-N 3.12Å; A160-I164 WeakPolarHBondContact O-CG1 3.47Å; A160-I164 PolarHBondContact O-N 3.33Å
161F94.4Very high85.2Confident0 Ų039.6 Ų39.60%025%0.247CC..Hα-helixtrans-56.1-42.5175.3-83.8-93.2000113M104 L134 L137 L138 L157 C158 R163 Y184 I188 F213 L217M104-F161 VanDerWaalsContact CE-CA 3.49Å; M104-F161 HydrophobicContact CE-CB 4.09Å; M104-F161 HydrophobicContact CE-CD1 3.67Å; M104-F161 HydrophobicContact CE-CD2 3.77Å; M104-F161 HydrophobicContact CE-CE1 4.04Å; M104-F161 HydrophobicContact CE-CE2 4.07Å; M104-F161 HydrophobicContact CE-CG 3.55Å; M104-F161 HydrophobicContact CE-CZ 4.2Å; M104-F161 HydrophobicContact CG-CD2 4.42Å; M104-F161 HydrophobicContact CG-CE2 4.17Å; L134-F161 HydrophobicContact CD1-CE1 3.63Å; L134-F161 HydrophobicContact CD1-CZ 3.73Å; L137-F161 HydrophobicContact CD2-CE2 4.15Å; L137-F161 HydrophobicContact CD2-CZ 4.03Å; L138-F161 HydrophobicContact CD2-CZ 3.93Å; L138-F161 HydrophobicContact CG-CZ 4.39Å; L157-F161 HydrophobicContact CD1-CD2 4.29Å; L157-F161 HydrophobicContact CD1-CE2 3.97Å; L157-F161 HydrophobicContact CG-CD2 4.24Å; L157-F161 HydrophobicContact CG-CE2 3.97Å; L157-F161 WeakPolarHBondContact O-CD2 3.33Å; L157-F161 PolarHBondContact O-N 2.6Å; L157-F161 VanDerWaalsContact O-N 3.11Å; C158-F161 PolarHBondContact O-N 3.47Å; F161-R163 VanDerWaalsContact C-N 3.34Å; F161-R163 PolarHBondContact O-N 2.87Å; F161-Y184 PolarHBondContact O-OH 2.92Å; F161-I188 HydrophobicContact CD1-CD1 3.55Å; F161-I188 HydrophobicContact CD1-CG1 4.29Å; F161-I188 HydrophobicContact CE1-CD1 3.88Å; F161-I188 HydrophobicContact CE1-CG1 4.12Å; F161-F213 HydrophobicContact CD2-CZ 4.2Å; F161-F213 HydrophobicContact CE2-CE1 4.24Å; F161-F213 AromaticContact CE2-CZ 3.87Å; F161-F213 HydrophobicContact CE2-CZ 3.87Å; F161-L217 HydrophobicContact CB-CD1 3.5Å; F161-L217 HydrophobicContact CD1-CD1 3.95Å; F161-L217 HydrophobicContact CD1-CD2 4.01Å; F161-L217 HydrophobicContact CD2-CD1 3.99Å; F161-L217 HydrophobicContact CD2-CD2 4.39Å; F161-L217 HydrophobicContact CE1-CD2 3.9Å; F161-L217 HydrophobicContact CE2-CD2 4.36Å; F161-L217 HydrophobicContact CG-CD1 3.56Å; F161-L217 HydrophobicContact CG-CD2 4.24Å; F161-L217 HydrophobicContact CZ-CD2 4.12Å
162V90.3Very high85.3Confident12 Ų1236.8 Ų36.87%0.07323%0.227CC..Hα-helixtrans-69-31178.3172.30000112.6C158 Q159 A160 P165 K220 L221 T224C158-V162 WeakPolarHBondContact O-CG2 3.46Å; C158-V162 PolarHBondContact O-N 3.26Å; C158-V162 VanDerWaalsContact O-N 3.14Å; Q159-V162 PolarHBondContact O-N 2.86Å; A160-V162 VanDerWaalsContact C-N 3.31Å; A160-V162 PolarHBondContact O-N 3.29Å; V162-P165 WeakPolarHBondContact O-CD 3.41Å; V162-K220 HydrophobicContact CG2-CG 3.64Å; V162-L221 HydrophobicContact CG2-CD2 4.36Å; V162-T224 HydrophobicContact CG1-CG2 3.6Å; V162-T224 HydrophobicContact CG2-CG2 4.05Å
163R89.8Confident85.2Confident91 Ų9135.9 Ų35.934%0.34322%0.221SC..Hα-helixtrans-75.9-23.1-178.5-77.9175.7177167.61113.5Q159 A160 F161 D166 R167Q159-R163 VanDerWaalsContact O-CG 3.32Å; Q159-R163 WeakPolarHBondContact O-CG 3.5Å; Q159-R163 PolarHBondContact O-N 3.01Å; Q159-R163 VanDerWaalsContact O-N 3.12Å; A160-R163 PolarHBondContact O-N 2.77Å; A160-R163 VanDerWaalsContact O-N 3.12Å; F161-R163 VanDerWaalsContact C-N 3.34Å; F161-R163 PolarHBondContact O-N 2.87Å; R163-D166 PolarHBondContact O-N 3.28Å; R163-R167 WeakPolarHBondContact O-CG 3.45Å; R163-R167 PolarHBondContact O-N 3.5Å; R163-R167 VanDerWaalsContact O-N 3.14Å
164I90.6Very high84.5Confident0 Ų043 Ų430%025%0.25CS..Hα-helixtrans-56.5-48.3-175.8-70.7-49000113.1M104 L126 F130 A160 D166 R167 L168 Y184M104-I164 HydrophobicContact CE-CD1 4.29Å; M104-I164 HydrophobicContact CE-CG1 3.55Å; M104-I164 HydrophobicContact SD-CG1 4.4Å; L126-I164 HydrophobicContact CD1-CD1 4.39Å; L126-I164 HydrophobicContact CD2-CD1 3.68Å; F130-I164 HydrophobicContact CE1-CG2 4.29Å; F130-I164 HydrophobicContact CE2-CG2 4.23Å; F130-I164 HydrophobicContact CZ-CG2 3.46Å; F130-I164 VanDerWaalsContact CZ-CG2 3.46Å; A160-I164 WeakPolarHBondContact O-CG1 3.47Å; A160-I164 PolarHBondContact O-N 3.33Å; I164-D166 PolarHBondContact O-N 3.47Å; I164-R167 WeakPolarHBondContact O-CA 3.27Å; I164-R167 WeakPolarHBondContact O-CB 3.47Å; I164-R167 PolarHBondContact O-N 3.46Å; I164-L168 HydrophobicContact CG2-CD1 3.85Å; I164-L168 HydrophobicContact CG2-CG 4.11Å; I164-L168 WeakPolarHBondContact O-CG 3.3Å; I164-L168 PolarHBondContact O-N 3.43Å; I164-Y184 HydrophobicContact CB-CE1 4.47Å; I164-Y184 HydrophobicContact CB-CE2 4.14Å; I164-Y184 HydrophobicContact CG2-CD1 4.29Å; I164-Y184 HydrophobicContact CG2-CD2 3.72Å; I164-Y184 HydrophobicContact CG2-CE1 4.23Å; I164-Y184 HydrophobicContact CG2-CE2 3.68Å; I164-Y184 HydrophobicContact CG2-CG 4.03Å
165P87Confident83.5Confident1 Ų151 Ų511%0.00629%0.285CS..Hα-helixtrans-50.1-50.9175.4-33.137.8000113.9V162 R167 L168 V169 L181 Y184 F185 Y226V162-P165 WeakPolarHBondContact O-CD 3.41Å; P165-R167 PolarHBondContact O-N 3.11Å; P165-L168 PolarHBondContact O-N 3.09Å; P165-L168 VanDerWaalsContact O-N 3.14Å; P165-V169 WeakPolarHBondContact O-CG2 3.23Å; P165-V169 PolarHBondContact O-N 2.95Å; P165-V169 VanDerWaalsContact O-N 3.07Å; P165-L181 HydrophobicContact CB-CD2 3.61Å; P165-L181 HydrophobicContact CG-CD2 4.35Å; P165-Y184 HydrophobicContact CG-CD1 4.09Å; P165-Y184 HydrophobicContact CG-CE1 3.77Å; P165-F185 HydrophobicContact CG-CE1 4.37Å; P165-F185 HydrophobicContact CG-CZ 4.05Å; P165-Y226 HydrophobicContact CB-CE1 4.27Å; P165-Y226 HydrophobicContact CB-CE2 4.07Å; P165-Y226 WeakPolarHBondContact CB-OH 3.4Å; P165-Y226 HydrophobicContact CG-CD2 4.28Å; P165-Y226 HydrophobicContact CG-CE1 4.42Å; P165-Y226 HydrophobicContact CG-CE2 3.79Å
166D83Confident83Confident96 Ų9651.8 Ų51.851%0.51328%0.28SS..Hα-helixtrans-59.2-37178-62.1-24.9000111.7R163 I164 A170R163-D166 PolarHBondContact O-N 3.28Å; I164-D166 PolarHBondContact O-N 3.47Å; D166-A170 VanDerWaalsContact O-CB 3.31Å; D166-A170 WeakPolarHBondContact O-CB 3.38Å; D166-A170 PolarHBondContact O-N 3.17Å
167R80.6Confident82.6Confident58 Ų5849.2 Ų49.222%0.21926%0.259CS..Hα-helixtrans-67.8-43.9176.3-64.7-57-171.6-157.112.5112.4S108 S109 V110 R163 I164 P165 V169 A170 V171S108-R167 PolarHBondContact O-NE 3.04Å; S108-R167 VanDerWaalsContact O-NE 3.15Å; S109-R167 PolarHBondContact O-NH2 3.31Å; V110-R167 PolarHBondContact O-NE 3.34Å; V110-R167 PolarHBondContact O-NH2 3.42Å; R163-R167 WeakPolarHBondContact O-CG 3.45Å; R163-R167 PolarHBondContact O-N 3.5Å; R163-R167 VanDerWaalsContact O-N 3.14Å; I164-R167 WeakPolarHBondContact O-CA 3.27Å; I164-R167 WeakPolarHBondContact O-CB 3.47Å; I164-R167 PolarHBondContact O-N 3.46Å; P165-R167 PolarHBondContact O-N 3.11Å; R167-V169 PolarHBondContact O-N 3.17Å; R167-A170 PolarHBondContact O-N 2.82Å; R167-V171 WeakPolarHBondContact O-CB 3.4Å; R167-V171 WeakPolarHBondContact O-CG2 3.47Å; R167-V171 PolarHBondContact O-N 2.75Å
168L83.2Confident82.1Confident3 Ų352.7 Ų52.72%0.01628%0.283CS..Hα-helixtrans-62.3-37.3179.3-68.8173.6000111.3L126 F130 I164 P165 S172 K180 L181 Y184L126-L168 HydrophobicContact CD1-CD2 4.02Å; F130-L168 HydrophobicContact CE2-CD1 4.22Å; F130-L168 HydrophobicContact CE2-CD2 4.45Å; I164-L168 HydrophobicContact CG2-CD1 3.85Å; I164-L168 HydrophobicContact CG2-CG 4.11Å; I164-L168 WeakPolarHBondContact O-CG 3.3Å; I164-L168 PolarHBondContact O-N 3.43Å; P165-L168 PolarHBondContact O-N 3.09Å; P165-L168 VanDerWaalsContact O-N 3.14Å; L168-S172 WeakPolarHBondContact O-CB 3.48Å; L168-S172 PolarHBondContact O-N 3.42Å; L168-S172 PolarHBondContact O-OG 2.92Å; L168-K180 HydrophobicContact CB-CB 4.5Å; L168-K180 HydrophobicContact CD1-CB 4.38Å; L168-K180 HydrophobicContact CD2-CB 4.36Å; L168-K180 HydrophobicContact CD2-CD 4.29Å; L168-L181 HydrophobicContact CB-CD2 4.37Å; L168-L181 HydrophobicContact CD1-CD2 4.31Å; L168-Y184 HydrophobicContact CD1-CG 4.32Å
169V82.1Confident81.8Confident76 Ų7656.5 Ų56.546%0.46131%0.31SS..Hα-helixtrans-68.4-47.5173.8177.40000110.9P165 R167 V171 S172 A177 L181P165-V169 WeakPolarHBondContact O-CG2 3.23Å; P165-V169 PolarHBondContact O-N 2.95Å; P165-V169 VanDerWaalsContact O-N 3.07Å; R167-V169 PolarHBondContact O-N 3.17Å; V169-V171 PolarHBondContact O-N 3.01Å; V169-S172 PolarHBondContact O-N 3.5Å; V169-S172 VanDerWaalsContact O-O 3.09Å; V169-A177 HydrophobicContact CG2-CB 4.28Å; V169-L181 HydrophobicContact CG2-CD1 3.88Å; V169-L181 HydrophobicContact CG2-CG 4.45Å
170A78.6Confident81.6Confident59 Ų5955.6 Ų55.649%0.48831%0.305SS..Hα-helixtrans-62.3-28.8-17800000114P112 D166 R167P112-A170 HydrophobicContact CB-CB 4.1Å; P112-A170 HydrophobicContact CG-CB 4.18Å; D166-A170 VanDerWaalsContact O-CB 3.31Å; D166-A170 WeakPolarHBondContact O-CB 3.38Å; D166-A170 PolarHBondContact O-N 3.17Å; R167-A170 PolarHBondContact O-N 2.82Å
171V72.3Confident81.4Confident44 Ų4457.4 Ų57.427%0.26732%0.315SS..THydrogen-bonded Turntrans-98.5-3.6-174.9177.10000112.7A119 R167 V169A119-V171 HydrophobicContact CB-CG1 3.81Å; A119-V171 HydrophobicContact CB-CG2 4.17Å; A119-V171 VanDerWaalsContact O-CG1 3.24Å; A119-V171 WeakPolarHBondContact O-CG1 3.29Å; R167-V171 WeakPolarHBondContact O-CB 3.4Å; R167-V171 WeakPolarHBondContact O-CG2 3.47Å; R167-V171 PolarHBondContact O-N 2.75Å; V169-V171 PolarHBondContact O-N 3.01Å
172S74.4Confident81Confident22 Ų2261 Ų6115%0.15434%0.337CS..SBendtrans-127.7153-173.2-50.60000112.6L168 V169 K180L168-S172 WeakPolarHBondContact O-CB 3.48Å; L168-S172 PolarHBondContact O-N 3.42Å; L168-S172 PolarHBondContact O-OG 2.92Å; V169-S172 PolarHBondContact O-N 3.5Å; V169-S172 VanDerWaalsContact O-O 3.09Å; S172-K180 WeakPolarHBondContact OG-CD 3.45Å; S172-K180 PolarHBondContact OG-NZ 3.49Å
173S72.2Confident81Confident78 Ų7862.6 Ų62.655%0.54535%0.351SS..  trans-66.8154.8165.765.90000110.5K175 V176 A177S173-K175 VanDerWaalsContact C-N 3.3Å; S173-K175 PolarHBondContact O-N 2.97Å; S173-K175 VanDerWaalsContact O-N 3.14Å; S173-V176 PolarHBondContact O-N 2.92Å; S173-V176 WeakPolarHBondContact OG-CG2 3.31Å; S173-A177 PolarHBondContact O-N 3.27Å
174H66.7Low81.1Confident175 Ų17558.2 Ų58.281%0.8133%0.334SS*.Hα-helixtrans-50.6-43.9-172.2-169.8-85.5000114.1A177 S178H174-A177 PolarHBondContact O-N 3.3Å; H174-S178 PolarHBondContact O-N 3.05Å
175K68Low81.2Confident189 Ų18959.3 Ų59.382%0.82234%0.339SS*.Hα-helixtrans-65.6-39.3178.2-68.4-171.9176.7-172.10112.9S173S173-K175 VanDerWaalsContact C-N 3.3Å; S173-K175 PolarHBondContact O-N 2.97Å; S173-K175 VanDerWaalsContact O-N 3.14Å
176V75.9Confident81.5Confident64 Ų6465.7 Ų65.739%0.38836%0.363SS..Hα-helixtrans-75-33.9-179.8177.20000111S173 S179 K180S173-V176 PolarHBondContact O-N 2.92Å; S173-V176 WeakPolarHBondContact OG-CG2 3.31Å; V176-S179 PolarHBondContact O-N 3.11Å; V176-K180 HydrophobicContact CG1-CD 4.03Å; V176-K180 HydrophobicContact CG1-CG 4.31Å; V176-K180 WeakPolarHBondContact O-CG 3.43Å; V176-K180 PolarHBondContact O-N 3.3Å
177A78.8Confident82Confident6 Ų662 Ų625%0.0535%0.346CS..Hα-helixtrans-60.3-46.3179.200000112.1V169 S173 H174 S179 K180 L181V169-A177 HydrophobicContact CG2-CB 4.28Å; S173-A177 PolarHBondContact O-N 3.27Å; H174-A177 PolarHBondContact O-N 3.3Å; A177-S179 PolarHBondContact O-N 2.88Å; A177-K180 PolarHBondContact O-N 3.4Å; A177-L181 WeakPolarHBondContact O-CB 3.48Å; A177-L181 VanDerWaalsContact O-CG 3.3Å; A177-L181 WeakPolarHBondContact O-CG 3.42Å; A177-L181 PolarHBondContact O-N 2.91Å
178S82Confident82.7Confident73 Ų7359.2 Ų59.251%0.5134%0.335SS..Hα-helixtrans-57.9-47.9178.31770000112.1H174 K180 L181 T182H174-S178 PolarHBondContact O-N 3.05Å; S178-K180 PolarHBondContact O-N 3Å; S178-L181 PolarHBondContact O-N 3.45Å; S178-T182 PolarHBondContact O-N 3.34Å; S178-T182 PolarHBondContact O-OG1 2.98Å; S178-T182 VanDerWaalsContact O-OG1 3.14Å
179S85.3Confident83.3Confident83 Ų8359.1 Ų59.158%0.5834%0.335SS*.Hα-helixtrans-60.5-43177.4-178.10000112.4V176 A177 T182 A183V176-S179 PolarHBondContact O-N 3.11Å; A177-S179 PolarHBondContact O-N 2.88Å; S179-T182 PolarHBondContact O-N 2.97Å; S179-A183 PolarHBondContact O-N 2.87Å
180K85.9Confident83.9Confident37 Ų3758.5 Ų58.516%0.16133%0.331CS..Hα-helixtrans-66.9-39177.8-74.1-178.2-179.8172.80113S123 L168 S172 V176 A177 S178 A183 Y184S123-K180 PolarHBondContact OG-NZ 3.26Å; L168-K180 HydrophobicContact CB-CB 4.5Å; L168-K180 HydrophobicContact CD1-CB 4.38Å; L168-K180 HydrophobicContact CD2-CB 4.36Å; L168-K180 HydrophobicContact CD2-CD 4.29Å; S172-K180 WeakPolarHBondContact OG-CD 3.45Å; S172-K180 PolarHBondContact OG-NZ 3.49Å; V176-K180 HydrophobicContact CG1-CD 4.03Å; V176-K180 HydrophobicContact CG1-CG 4.31Å; V176-K180 WeakPolarHBondContact O-CG 3.43Å; V176-K180 PolarHBondContact O-N 3.3Å; A177-K180 PolarHBondContact O-N 3.4Å; S178-K180 PolarHBondContact O-N 3Å; K180-A183 PolarHBondContact O-N 3.49Å; K180-Y184 WeakPolarHBondContact O-CB 3.23Å; K180-Y184 PolarHBondContact O-N 2.94Å
181L87.7Confident84.7Confident39 Ų3955.7 Ų55.720%0.20431%0.308CS..Hα-helixtrans-62-46.7175.3-73.4172.8000111P165 L168 V169 A177 S178 A183 Y184 F185P165-L181 HydrophobicContact CB-CD2 3.61Å; P165-L181 HydrophobicContact CG-CD2 4.35Å; L168-L181 HydrophobicContact CB-CD2 4.37Å; L168-L181 HydrophobicContact CD1-CD2 4.31Å; V169-L181 HydrophobicContact CG2-CD1 3.88Å; V169-L181 HydrophobicContact CG2-CG 4.45Å; A177-L181 WeakPolarHBondContact O-CB 3.48Å; A177-L181 VanDerWaalsContact O-CG 3.3Å; A177-L181 WeakPolarHBondContact O-CG 3.42Å; A177-L181 PolarHBondContact O-N 2.91Å; S178-L181 PolarHBondContact O-N 3.45Å; L181-A183 VanDerWaalsContact C-N 3.31Å; L181-A183 PolarHBondContact O-N 3.47Å; L181-Y184 WeakPolarHBondContact O-CB 3.41Å; L181-Y184 PolarHBondContact O-N 3.36Å; L181-Y184 VanDerWaalsContact O-N 3.16Å; L181-F185 HydrophobicContact CB-CE2 4.25Å; L181-F185 HydrophobicContact CD2-CE2 4.47Å; L181-F185 WeakPolarHBondContact O-CD2 3Å; L181-F185 PolarHBondContact O-N 3.03Å
182T87.3Confident85.9Confident76 Ų7653.6 Ų53.647%0.46630%0.295SS..Hα-helixtrans-59.3-42.9175.2-580000111.6S178 S179 Y184 F185 R186S178-T182 PolarHBondContact O-N 3.34Å; S178-T182 PolarHBondContact O-OG1 2.98Å; S178-T182 VanDerWaalsContact O-OG1 3.14Å; S179-T182 PolarHBondContact O-N 2.97Å; T182-Y184 VanDerWaalsContact C-N 3.35Å; T182-Y184 PolarHBondContact O-N 3.45Å; T182-F185 PolarHBondContact O-N 2.89Å; T182-R186 WeakPolarHBondContact O-CB 3.04Å; T182-R186 PolarHBondContact O-N 2.79Å
183A89.1Confident86.9Confident44 Ų4453.6 Ų53.636%0.36429%0.293SS..Hα-helixtrans-62.7-40.317600000112.3S179 K180 L181 R186 A187S179-A183 PolarHBondContact O-N 2.87Å; K180-A183 PolarHBondContact O-N 3.49Å; L181-A183 VanDerWaalsContact C-N 3.31Å; L181-A183 PolarHBondContact O-N 3.47Å; A183-R186 PolarHBondContact O-N 2.84Å; A183-A187 WeakPolarHBondContact O-CB 3.41Å; A183-A187 PolarHBondContact O-N 2.93Å
184Y92.7Very high88Confident0 Ų054.8 Ų54.80%029%0.289CS..Hα-helixtrans-63.4-51.4175.9170.1-111.6000112.2F130 F161 I164 P165 L168 K180 L181 T182 R186 A187 I188F130-Y184 HydrophobicContact CD1-CD2 4.16Å; F130-Y184 HydrophobicContact CD2-CD2 4.18Å; F130-Y184 AromaticContact CE1-CD2 3.72Å; F130-Y184 HydrophobicContact CE1-CD2 3.72Å; F130-Y184 AromaticContact CE1-CE2 3.95Å; F130-Y184 HydrophobicContact CE1-CE2 3.95Å; F130-Y184 AromaticContact CE2-CD2 3.73Å; F130-Y184 HydrophobicContact CE2-CD2 3.73Å; F130-Y184 HydrophobicContact CE2-CG 4.32Å; F130-Y184 HydrophobicContact CG-CD2 4.4Å; F130-Y184 AromaticContact CZ-CD2 3.5Å; F130-Y184 HydrophobicContact CZ-CD2 3.5Å; F130-Y184 VanDerWaalsContact CZ-CD2 3.5Å; F130-Y184 HydrophobicContact CZ-CE2 4.03Å; F130-Y184 HydrophobicContact CZ-CG 4.4Å; F161-Y184 PolarHBondContact O-OH 2.92Å; I164-Y184 HydrophobicContact CB-CE1 4.47Å; I164-Y184 HydrophobicContact CB-CE2 4.14Å; I164-Y184 HydrophobicContact CG2-CD1 4.29Å; I164-Y184 HydrophobicContact CG2-CD2 3.72Å; I164-Y184 HydrophobicContact CG2-CE1 4.23Å; I164-Y184 HydrophobicContact CG2-CE2 3.68Å; I164-Y184 HydrophobicContact CG2-CG 4.03Å; P165-Y184 HydrophobicContact CG-CD1 4.09Å; P165-Y184 HydrophobicContact CG-CE1 3.77Å; L168-Y184 HydrophobicContact CD1-CG 4.32Å; K180-Y184 WeakPolarHBondContact O-CB 3.23Å; K180-Y184 PolarHBondContact O-N 2.94Å; L181-Y184 WeakPolarHBondContact O-CB 3.41Å; L181-Y184 PolarHBondContact O-N 3.36Å; L181-Y184 VanDerWaalsContact O-N 3.16Å; T182-Y184 VanDerWaalsContact C-N 3.35Å; T182-Y184 PolarHBondContact O-N 3.45Å; Y184-R186 PolarHBondContact O-N 3.34Å; Y184-A187 PolarHBondContact O-N 2.96Å; Y184-A187 VanDerWaalsContact O-N 3.08Å; Y184-I188 WeakPolarHBondContact O-CG2 3.29Å; Y184-I188 PolarHBondContact O-N 3.14Å
185F93.1Very high89.3Confident23 Ų2346.5 Ų46.510%0.10125%0.25CS..Hα-helixtrans-63.6-31.7179.5-66.7-55.1000112.5P165 L181 T182 I188 S189 Y226 D229 V230P165-F185 HydrophobicContact CG-CE1 4.37Å; P165-F185 HydrophobicContact CG-CZ 4.05Å; L181-F185 HydrophobicContact CB-CE2 4.25Å; L181-F185 HydrophobicContact CD2-CE2 4.47Å; L181-F185 WeakPolarHBondContact O-CD2 3Å; L181-F185 PolarHBondContact O-N 3.03Å; T182-F185 PolarHBondContact O-N 2.89Å; F185-I188 VanDerWaalsContact O-CG2 3.25Å; F185-I188 WeakPolarHBondContact O-CG2 3.27Å; F185-S189 WeakPolarHBondContact O-CB 3.49Å; F185-S189 PolarHBondContact O-N 3.36Å; F185-S189 PolarHBondContact O-OG 2.97Å; F185-Y226 AromaticContact CE1-CD1 3.96Å; F185-Y226 HydrophobicContact CE1-CD1 3.96Å; F185-Y226 AromaticContact CE1-CG 3.84Å; F185-Y226 HydrophobicContact CE1-CG 3.84Å; F185-Y226 HydrophobicContact CE2-CD1 4.38Å; F185-Y226 AromaticContact CZ-CD1 3.42Å; F185-Y226 HydrophobicContact CZ-CD1 3.42Å; F185-Y226 VanDerWaalsContact CZ-CD1 3.42Å; F185-Y226 AromaticContact CZ-CE1 3.95Å; F185-Y226 HydrophobicContact CZ-CE1 3.95Å; F185-Y226 AromaticContact CZ-CG 3.79Å; F185-Y226 HydrophobicContact CZ-CG 3.79Å; F185-D229 HydrophobicContact CB-CB 4.23Å; F185-D229 HydrophobicContact CD1-CB 4.13Å; F185-D229 HydrophobicContact CD2-CB 4.11Å; F185-D229 HydrophobicContact CG-CB 3.9Å; F185-V230 HydrophobicContact CD1-CG2 4.2Å
186R92Very high90.7Very high135 Ų13537.5 Ų37.551%0.50921%0.211SC..Hα-helixtrans-66.4-48.3170-172.8179.5-65.3156.7-1.3111.7T182 A183 Y184 I188 S189 V190T182-R186 WeakPolarHBondContact O-CB 3.04Å; T182-R186 PolarHBondContact O-N 2.79Å; A183-R186 PolarHBondContact O-N 2.84Å; Y184-R186 PolarHBondContact O-N 3.34Å; R186-I188 PolarHBondContact O-N 2.91Å; R186-S189 PolarHBondContact O-N 2.87Å; R186-V190 WeakPolarHBondContact O-CG2 3.25Å; R186-V190 PolarHBondContact O-N 3.24Å
187A93.2Very high91.5Very high18 Ų1836.2 Ų36.215%0.14921%0.207CC..Hα-helixtrans-62-44.7-177.800000112.4F130 L134 A183 Y184 V190 A191F130-A187 HydrophobicContact CB-CB 3.85Å; L134-A187 HydrophobicContact CD2-CB 4.12Å; A183-A187 WeakPolarHBondContact O-CB 3.41Å; A183-A187 PolarHBondContact O-N 2.93Å; Y184-A187 PolarHBondContact O-N 2.96Å; Y184-A187 VanDerWaalsContact O-N 3.08Å; A187-V190 PolarHBondContact O-N 3.35Å; A187-A191 VanDerWaalsContact O-CB 3.28Å; A187-A191 WeakPolarHBondContact O-CB 3.46Å; A187-A191 PolarHBondContact O-N 3.42Å
188I95.7Very high92.3Very high0 Ų039.1 Ų39.10%022%0.22CC..Hα-helixtrans-64.4-40.7176.9-166.5176.9000111.6L134 L138 F161 Y184 F185 R186 A191 L192 L217 L221 V230L134-I188 HydrophobicContact CD2-CB 4.22Å; L138-I188 HydrophobicContact CD1-CG1 4.43Å; F161-I188 HydrophobicContact CD1-CD1 3.55Å; F161-I188 HydrophobicContact CD1-CG1 4.29Å; F161-I188 HydrophobicContact CE1-CD1 3.88Å; F161-I188 HydrophobicContact CE1-CG1 4.12Å; Y184-I188 WeakPolarHBondContact O-CG2 3.29Å; Y184-I188 PolarHBondContact O-N 3.14Å; F185-I188 VanDerWaalsContact O-CG2 3.25Å; F185-I188 WeakPolarHBondContact O-CG2 3.27Å; R186-I188 PolarHBondContact O-N 2.91Å; I188-A191 PolarHBondContact O-N 3.13Å; I188-L192 HydrophobicContact CG1-CD1 4.31Å; I188-L192 HydrophobicContact CG1-CG 4.5Å; I188-L192 WeakPolarHBondContact O-CB 3.33Å; I188-L192 VanDerWaalsContact O-CG 3.3Å; I188-L192 WeakPolarHBondContact O-CG 3.19Å; I188-L192 PolarHBondContact O-N 3.16Å; I188-L217 HydrophobicContact CD1-CD2 4.26Å; I188-L221 HydrophobicContact CD1-CD1 3.58Å; I188-V230 HydrophobicContact CG2-CG2 3.81Å
189S95.5Very high92.8Very high0 Ų035.7 Ų35.70%020%0.196CC..Hα-helixtrans-62.8-45.1178.1-60.40000111.7F185 R186 L192 I193F185-S189 WeakPolarHBondContact O-CB 3.49Å; F185-S189 PolarHBondContact O-N 3.36Å; F185-S189 PolarHBondContact O-OG 2.97Å; R186-S189 PolarHBondContact O-N 2.87Å; S189-L192 PolarHBondContact O-N 3.42Å; S189-I193 WeakPolarHBondContact O-CG1 3.22Å; S189-I193 PolarHBondContact O-N 2.82Å
190V95Very high93.1Very high63 Ų6332 Ų3238%0.38217%0.169SC..Hα-helixtrans-63.6-42.4175.8171.70000111.3R186 A187 I193 K194R186-V190 WeakPolarHBondContact O-CG2 3.25Å; R186-V190 PolarHBondContact O-N 3.24Å; A187-V190 PolarHBondContact O-N 3.35Å; V190-I193 PolarHBondContact O-N 2.9Å; V190-K194 HydrophobicContact CG1-CD 4.36Å; V190-K194 WeakPolarHBondContact O-CG 3.41Å; V190-K194 PolarHBondContact O-N 3.31Å
191A95.6Very high93.4Very high0 Ų032.4 Ų32.40%018%0.177CC..Hα-helixtrans-64.7-40178.500000112.3L134 L138 A187 I188 K194 A195L134-A191 HydrophobicContact CD2-CB 4.39Å; L134-A191 HydrophobicContact CG-CB 4.01Å; L138-A191 HydrophobicContact CB-CB 4.38Å; L138-A191 HydrophobicContact CD1-CB 3.55Å; L138-A191 HydrophobicContact CG-CB 4.33Å; A187-A191 VanDerWaalsContact O-CB 3.28Å; A187-A191 WeakPolarHBondContact O-CB 3.46Å; A187-A191 PolarHBondContact O-N 3.42Å; I188-A191 PolarHBondContact O-N 3.13Å; A191-K194 PolarHBondContact O-N 3.25Å; A191-A195 PolarHBondContact O-N 3.27Å
192L96.9Very high93.6Very high0 Ų031.2 Ų31.20%017%0.17CC..Hα-helixtrans-61.8-47.3172.7-74.2169.6000111.4L138 I188 S189 K194 A195 F196 H214 L217 I218 V230 V234L138-L192 HydrophobicContact CD1-CD2 3.93Å; L138-L192 HydrophobicContact CD1-CG 3.95Å; I188-L192 HydrophobicContact CG1-CD1 4.31Å; I188-L192 HydrophobicContact CG1-CG 4.5Å; I188-L192 WeakPolarHBondContact O-CB 3.33Å; I188-L192 VanDerWaalsContact O-CG 3.3Å; I188-L192 WeakPolarHBondContact O-CG 3.19Å; I188-L192 PolarHBondContact O-N 3.16Å; S189-L192 PolarHBondContact O-N 3.42Å; L192-K194 VanDerWaalsContact C-N 3.31Å; L192-K194 PolarHBondContact O-N 3.2Å; L192-A195 WeakPolarHBondContact O-CB 3.38Å; L192-A195 PolarHBondContact O-N 2.97Å; L192-A195 VanDerWaalsContact O-N 3.12Å; L192-F196 HydrophobicContact CB-CE2 4.15Å; L192-F196 HydrophobicContact CB-CZ 3.97Å; L192-F196 HydrophobicContact CD2-CE1 4.46Å; L192-F196 HydrophobicContact CD2-CZ 4.22Å; L192-F196 VanDerWaalsContact O-CD1 3.3Å; L192-F196 WeakPolarHBondContact O-CD1 3.42Å; L192-F196 WeakPolarHBondContact O-CD2 3.35Å; L192-F196 WeakPolarHBondContact O-CG 3.5Å; L192-F196 PolarHBondContact O-N 2.98Å; L192-H214 HydrophobicContact CD2-CB 4.27Å; L192-L217 HydrophobicContact CD2-CD2 4.38Å; L192-I218 HydrophobicContact CD1-CD1 4.15Å; L192-I218 HydrophobicContact CD1-CG1 4.09Å; L192-I218 HydrophobicContact CD2-CD1 4.45Å; L192-V230 HydrophobicContact CD1-CG1 3.57Å; L192-V234 HydrophobicContact CD1-CG2 4.45Å
193I96Very high93.6Very high22 Ų2231.3 Ų31.311%0.11316%0.164CC..Hα-helixtrans-58.8-42.8178-73.8166.9000111.5S189 V190 F196 A197 T233 Y237S189-I193 WeakPolarHBondContact O-CG1 3.22Å; S189-I193 PolarHBondContact O-N 2.82Å; V190-I193 PolarHBondContact O-N 2.9Å; I193-F196 PolarHBondContact O-N 3.38Å; I193-A197 PolarHBondContact O-N 2.77Å; I193-T233 HydrophobicContact CD1-CG2 4.22Å; I193-Y237 HydrophobicContact CB-CD1 4.46Å; I193-Y237 HydrophobicContact CB-CE1 4.43Å; I193-Y237 HydrophobicContact CD1-CD1 4.17Å; I193-Y237 HydrophobicContact CD1-CD2 4.14Å; I193-Y237 HydrophobicContact CD1-CG 3.8Å; I193-Y237 HydrophobicContact CG1-CD1 3.91Å; I193-Y237 HydrophobicContact CG1-CE1 4.36Å; I193-Y237 HydrophobicContact CG1-CG 4.08Å; I193-Y237 HydrophobicContact CG2-CD1 3.83Å; I193-Y237 HydrophobicContact CG2-CD2 4.19Å; I193-Y237 HydrophobicContact CG2-CE1 3.42Å; I193-Y237 VanDerWaalsContact CG2-CE1 3.42Å; I193-Y237 HydrophobicContact CG2-CE2 3.81Å; I193-Y237 HydrophobicContact CG2-CG 4.2Å
194K95.2Very high93.6Very high104 Ų10433.9 Ų33.945%0.45217%0.167SC..Hα-helixtrans-62.7-42.2175.3-74.3177.6-179.2178.40112S135 V139 V190 A191 L192 F196 A197 E198S135-K194 PolarHBondContact OG-NZ 3.49Å; V139-K194 HydrophobicContact CG2-CB 3.9Å; V190-K194 HydrophobicContact CG1-CD 4.36Å; V190-K194 WeakPolarHBondContact O-CG 3.41Å; V190-K194 PolarHBondContact O-N 3.31Å; A191-K194 PolarHBondContact O-N 3.25Å; L192-K194 VanDerWaalsContact C-N 3.31Å; L192-K194 PolarHBondContact O-N 3.2Å; K194-F196 VanDerWaalsContact C-N 3.3Å; K194-F196 PolarHBondContact O-N 3.28Å; K194-A197 PolarHBondContact O-N 3.08Å; K194-E198 PolarHBondContact O-N 3.33Å
195A95.2Very high93.4Very high0 Ų038.6 Ų38.60%019%0.192CC..Hα-helixtrans-62.6-38175.800000112.2L138 V139 V142 A191 L192 E198 T199 H214L138-A195 HydrophobicContact CB-CB 4.23Å; L138-A195 VanDerWaalsContact O-CB 3.32Å; L138-A195 WeakPolarHBondContact O-CB 3.2Å; V139-A195 HydrophobicContact CG2-CB 4.38Å; V142-A195 HydrophobicContact CG2-CB 3.81Å; V142-A195 WeakPolarHBondContact CG2-O 3.44Å; A191-A195 PolarHBondContact O-N 3.27Å; L192-A195 WeakPolarHBondContact O-CB 3.38Å; L192-A195 PolarHBondContact O-N 2.97Å; L192-A195 VanDerWaalsContact O-N 3.12Å; A195-E198 PolarHBondContact O-N 3.13Å; A195-T199 PolarHBondContact O-N 2.97Å; A195-T199 PolarHBondContact O-OG1 3.14Å; A195-H214 VanDerWaalsContact CB-NE2 3.31Å; A195-H214 WeakPolarHBondContact CB-NE2 3.4Å
196F96Very high93.1Very high0 Ų046.1 Ų46.10%023%0.227CC..Hα-helixtrans-66.2-40.5175.6-58.3-17.8000112.1L192 I193 K194 E198 T199 L200 L211 H214 I218 V234 L238 W250 V253 I257L192-F196 HydrophobicContact CB-CE2 4.15Å; L192-F196 HydrophobicContact CB-CZ 3.97Å; L192-F196 HydrophobicContact CD2-CE1 4.46Å; L192-F196 HydrophobicContact CD2-CZ 4.22Å; L192-F196 VanDerWaalsContact O-CD1 3.3Å; L192-F196 WeakPolarHBondContact O-CD1 3.42Å; L192-F196 WeakPolarHBondContact O-CD2 3.35Å; L192-F196 WeakPolarHBondContact O-CG 3.5Å; L192-F196 PolarHBondContact O-N 2.98Å; I193-F196 PolarHBondContact O-N 3.38Å; K194-F196 VanDerWaalsContact C-N 3.3Å; K194-F196 PolarHBondContact O-N 3.28Å; F196-E198 VanDerWaalsContact C-N 3.35Å; F196-T199 WeakPolarHBondContact O-CB 3.3Å; F196-T199 PolarHBondContact O-N 3.19Å; F196-L200 PolarHBondContact O-N 3.29Å; F196-L211 HydrophobicContact CD1-CD2 3.9Å; F196-L211 HydrophobicContact CE1-CD2 4.18Å; F196-H214 HydrophobicContact CE1-CB 3.99Å; F196-I218 HydrophobicContact CZ-CD1 4.06Å; F196-V234 HydrophobicContact CE2-CG1 3.8Å; F196-L238 HydrophobicContact CD2-CD2 4.23Å; F196-W250 HydrophobicContact CB-CH2 4.4Å; F196-W250 HydrophobicContact CB-CZ3 3.86Å; F196-V253 HydrophobicContact CB-CG1 3.9Å; F196-V253 HydrophobicContact CD1-CG1 4.3Å; F196-V253 HydrophobicContact CG-CG1 4.02Å; F196-I257 HydrophobicContact CD1-CD1 4.21Å; F196-I257 HydrophobicContact CD1-CG1 4.2Å; F196-I257 HydrophobicContact CE1-CD1 3.34Å; F196-I257 HydrophobicContact CE1-CG1 3.6Å; F196-I257 HydrophobicContact CE2-CG1 4.31Å; F196-I257 HydrophobicContact CE2-CG2 4.41Å; F196-I257 HydrophobicContact CZ-CB 4.41Å; F196-I257 HydrophobicContact CZ-CD1 3.66Å; F196-I257 HydrophobicContact CZ-CG1 3.65Å; F196-I257 HydrophobicContact CZ-CG2 3.95Å
197A94.2Very high92.9Very high38 Ų3843.4 Ų43.431%0.31422%0.22SC..Hα-helixtrans-64.5-38.6173.500000112.2I193 K194 L200 S201 W250I193-A197 PolarHBondContact O-N 2.77Å; K194-A197 PolarHBondContact O-N 3.08Å; A197-L200 WeakPolarHBondContact O-CB 3.45Å; A197-L200 PolarHBondContact O-N 2.89Å; A197-S201 PolarHBondContact O-N 3.43Å; A197-W250 HydrophobicContact CB-CH2 4.12Å
198E93.9Very high92.5Very high67 Ų6748.2 Ų48.231%0.31324%0.244SC..Hα-helixtrans-64.3-42.8174.9-178.259.4-154.400111.8V139 K194 A195 F196 L200 S201 R202V139-E198 HydrophobicContact CG1-CB 3.97Å; V139-E198 HydrophobicContact CG1-CG 3.81Å; K194-E198 PolarHBondContact O-N 3.33Å; A195-E198 PolarHBondContact O-N 3.13Å; F196-E198 VanDerWaalsContact C-N 3.35Å; E198-L200 PolarHBondContact O-N 2.74Å; E198-S201 WeakPolarHBondContact O-CB 3.12Å; E198-S201 PolarHBondContact O-N 3.49Å; E198-R202 HydrophobicContact CG-CG 4.4Å; E198-R202 WeakPolarHBondContact O-CG 3.42Å; E198-R202 PolarHBondContact O-N 3.47Å; E198-R202 WeakPolarHBondContact OE1-CG 3.18Å
199T93.2Very high92.2Very high0 Ų049.4 Ų49.40%025%0.252CS..Hα-helixtrans-53.8-42.5175.4-52.60000110.7V142 A195 F196 R202 F203 S209 L211 V253V142-T199 HydrophobicContact CG1-CG2 4.29Å; V142-T199 WeakPolarHBondContact CG1-OG1 3.22Å; A195-T199 PolarHBondContact O-N 2.97Å; A195-T199 PolarHBondContact O-OG1 3.14Å; F196-T199 WeakPolarHBondContact O-CB 3.3Å; F196-T199 PolarHBondContact O-N 3.19Å; T199-R202 PolarHBondContact O-N 3.35Å; T199-F203 HydrophobicContact CG2-CD2 4.19Å; T199-F203 HydrophobicContact CG2-CE2 3.65Å; T199-F203 HydrophobicContact CG2-CZ 3.91Å; T199-F203 WeakPolarHBondContact O-CD2 3.45Å; T199-F203 WeakPolarHBondContact O-CG 3.3Å; T199-F203 PolarHBondContact O-N 3.06Å; T199-S209 WeakPolarHBondContact CG2-OG 3.21Å; T199-L211 HydrophobicContact CG2-CD1 4.05Å; T199-L211 HydrophobicContact CG2-CD2 4.35Å; T199-L211 HydrophobicContact CG2-CG 4.05Å; T199-L211 WeakPolarHBondContact OG1-CD2 3.47Å; T199-V253 HydrophobicContact CG2-CG2 4.47Å
200L92Very high92Very high5 Ų551 Ų513%0.02626%0.263CS..Hα-helixtrans-67.4-42.2177.9-17464.9000112.8F196 A197 E198 R202 F203 K204 E246 L249 W250F196-L200 PolarHBondContact O-N 3.29Å; A197-L200 WeakPolarHBondContact O-CB 3.45Å; A197-L200 PolarHBondContact O-N 2.89Å; E198-L200 PolarHBondContact O-N 2.74Å; L200-R202 VanDerWaalsContact C-N 3.33Å; L200-R202 PolarHBondContact O-N 3.34Å; L200-F203 PolarHBondContact O-N 3.39Å; L200-K204 WeakPolarHBondContact O-CG 3.37Å; L200-K204 PolarHBondContact O-N 3.05Å; L200-K204 VanDerWaalsContact O-N 3.13Å; L200-E246 HydrophobicContact CD2-CB 4.44Å; L200-E246 WeakPolarHBondContact CD2-OE2 3.45Å; L200-L249 HydrophobicContact CD1-CB 3.23Å; L200-L249 HydrophobicContact CD1-CD1 3.5Å; L200-L249 VanDerWaalsContact CD1-CD1 3.5Å; L200-L249 HydrophobicContact CD1-CG 3.97Å; L200-W250 HydrophobicContact CD2-CD2 4.17Å; L200-W250 HydrophobicContact CD2-CG 4.46Å; L200-W250 HydrophobicContact CD2-CZ2 3.61Å
201S91.6Very high91.9Very high47 Ų4748.5 Ų48.533%0.32925%0.247SC..Hα-helixtrans-57.2-47.2173.9-176.20000111.2A197 E198 F203 K204 N205A197-S201 PolarHBondContact O-N 3.43Å; E198-S201 WeakPolarHBondContact O-CB 3.12Å; E198-S201 PolarHBondContact O-N 3.49Å; S201-F203 PolarHBondContact O-N 2.85Å; S201-K204 WeakPolarHBondContact O-CB 3.42Å; S201-K204 PolarHBondContact O-N 3.46Å; S201-N205 PolarHBondContact O-N 2.89Å; S201-N205 VanDerWaalsContact O-N 3.15Å; S201-N205 PolarHBondContact O-ND2 2.92Å
202R91.5Very high91.7Very high13 Ų1352.9 Ų52.95%0.04927%0.268CS..Hα-helixtrans-63.1-42178.1-68.5-178.171.9103.3-4.5112.7D143 E198 T199 L200 K204 N205 H206 Q207 D208D143-R202 VanDerWaalsContact CB-NH1 3.34Å; D143-R202 IonicContact OD1-CZ 2.84Å; D143-R202 IonicContact OD1-NH1 3.8Å; D143-R202 PolarHBondContact OD1-NH1 2.81Å; D143-R202 IonicContact OD1-NH2 3.97Å; D143-R202 PolarHBondContact OD1-NH2 3.48Å; D143-R202 IonicContact OD2-CZ 3.14Å; D143-R202 IonicContact OD2-NH1 3.65Å; D143-R202 PolarHBondContact OD2-NH1 2.77Å; D143-R202 IonicContact OD2-NH2 3.91Å; E198-R202 HydrophobicContact CG-CG 4.4Å; E198-R202 WeakPolarHBondContact O-CG 3.42Å; E198-R202 PolarHBondContact O-N 3.47Å; E198-R202 WeakPolarHBondContact OE1-CG 3.18Å; T199-R202 PolarHBondContact O-N 3.35Å; L200-R202 VanDerWaalsContact C-N 3.33Å; L200-R202 PolarHBondContact O-N 3.34Å; R202-K204 VanDerWaalsContact C-N 3.3Å; R202-K204 PolarHBondContact O-N 3.08Å; R202-N205 CarbonylContact O-C 3.4Å; R202-N205 WeakPolarHBondContact O-CA 3.14Å; R202-N205 PolarHBondContact O-N 3.19Å; R202-H206 PolarHBondContact O-N 2.71Å; R202-Q207 HydrophobicContact CB-CB 4.06Å; R202-Q207 PolarHBondContact O-N 3.29Å; R202-D208 PolarHBondContact NE-O 2.72Å; R202-D208 PolarHBondContact NH2-O 2.82Å
203F87.8Confident91.5Very high79 Ų7952.9 Ų52.935%0.34627%0.268SS..Hα-helixtrans-60.3-38.7175.2-74.2-29.8000113T199 L200 S201 N205 H206 S209T199-F203 HydrophobicContact CG2-CD2 4.19Å; T199-F203 HydrophobicContact CG2-CE2 3.65Å; T199-F203 HydrophobicContact CG2-CZ 3.91Å; T199-F203 WeakPolarHBondContact O-CD2 3.45Å; T199-F203 WeakPolarHBondContact O-CG 3.3Å; T199-F203 PolarHBondContact O-N 3.06Å; L200-F203 PolarHBondContact O-N 3.39Å; S201-F203 PolarHBondContact O-N 2.85Å; F203-N205 PolarHBondContact O-N 3.17Å; F203-H206 PolarHBondContact O-N 2.92Å; F203-S209 WeakPolarHBondContact CE1-OG 3.5Å; F203-S209 WeakPolarHBondContact CZ-OG 3.23Å
204K88.3Confident91.5Very high98 Ų9851.9 Ų51.943%0.42626%0.263SS..Hα-helixtrans-64.7-32.7174.4-67.9174.9-169.2170.50112.3L200 S201 R202 H206 E246L200-K204 WeakPolarHBondContact O-CG 3.37Å; L200-K204 PolarHBondContact O-N 3.05Å; L200-K204 VanDerWaalsContact O-N 3.13Å; S201-K204 WeakPolarHBondContact O-CB 3.42Å; S201-K204 PolarHBondContact O-N 3.46Å; R202-K204 VanDerWaalsContact C-N 3.3Å; R202-K204 PolarHBondContact O-N 3.08Å; K204-H206 PolarHBondContact O-N 2.83Å; K204-E246 VanDerWaalsContact CE-OE1 3.27Å; K204-E246 WeakPolarHBondContact CE-OE1 3.42Å; K204-E246 VanDerWaalsContact CE-OE2 3.28Å; K204-E246 WeakPolarHBondContact CE-OE2 3.09Å; K204-E246 IonicContact NZ-OE1 3.56Å; K204-E246 PolarHBondContact NZ-OE1 3.24Å; K204-E246 IonicContact NZ-OE2 3.5Å; K204-E246 PolarHBondContact NZ-OE2 2.86Å
205N88.7Confident91.5Very high98 Ų9847.1 Ų47.152%0.52424%0.243SC..THydrogen-bonded Turntrans-85.310177.5-61.9-28.3000113.3S201 R202 F203 Q207S201-N205 PolarHBondContact O-N 2.89Å; S201-N205 VanDerWaalsContact O-N 3.15Å; S201-N205 PolarHBondContact O-ND2 2.92Å; R202-N205 CarbonylContact O-C 3.4Å; R202-N205 WeakPolarHBondContact O-CA 3.14Å; R202-N205 PolarHBondContact O-N 3.19Å; F203-N205 PolarHBondContact O-N 3.17Å; N205-Q207 HydrophobicContact CB-CG 4.19Å; N205-Q207 PolarHBondContact O-N 3.04Å
206H87.2Confident91.4Very high181 Ų18149.5 Ų49.584%0.83826%0.255SS*.THydrogen-bonded Turntrans54.631.8-175.8-56.9-71.1000113.9R202 F203 K204R202-H206 PolarHBondContact O-N 2.71Å; F203-H206 PolarHBondContact O-N 2.92Å; K204-H206 PolarHBondContact O-N 2.83Å
207Q87.3Confident91.4Very high78 Ų7849.5 Ų49.536%0.36426%0.255SS..  trans-98.1144.3176.6-68.9175.6-19.800110.8R202 N205R202-Q207 HydrophobicContact CB-CB 4.06Å; R202-Q207 PolarHBondContact O-N 3.29Å; N205-Q207 HydrophobicContact CB-CG 4.19Å; N205-Q207 PolarHBondContact O-N 3.04Å
208D85.2Confident91.5Very high120 Ų12047.9 Ų47.964%0.64224%0.241SC*.  trans-67.9142.7174-73.5-22.2000110.7R202R202-D208 PolarHBondContact NE-O 2.72Å; R202-D208 PolarHBondContact NH2-O 2.82Å
209S90.6Very high91.5Very high24 Ų2444.7 Ų44.717%0.16823%0.226CC..BIsolated β-bridgetrans-146.8148.617657.90000111.1V142 T199 F203V142-S209 CarbonylContact O-C 3.59Å; V142-S209 VanDerWaalsContact O-CA 3.25Å; V142-S209 WeakPolarHBondContact O-CA 3.32Å; T199-S209 WeakPolarHBondContact CG2-OG 3.21Å; F203-S209 WeakPolarHBondContact CE1-OG 3.5Å; F203-S209 WeakPolarHBondContact CZ-OG 3.23Å
210S90.4Very high91.5Very high33 Ų3347.7 Ų47.723%0.23124%0.239CC..  trans-125.1134.4177.6-175.30000111.4V142 E212V142-S210 WeakPolarHBondContact CA-O 3.21Å; V142-S210 PolarHBondContact O-N 2.61Å; S210-E212 WeakPolarHBondContact OG-CB 3.4Å; S210-E212 PolarHBondContact OG-N 3.19Å
211L93.1Very high91.6Very high11 Ų1147.5 Ų47.56%0.05824%0.238CC..  trans-107.516.8171.3-70.8177.1000112.3V142 F196 T199 H214 S215 V253 R256 I257V142-L211 HydrophobicContact CG2-CD2 4.47Å; F196-L211 HydrophobicContact CD1-CD2 3.9Å; F196-L211 HydrophobicContact CE1-CD2 4.18Å; T199-L211 HydrophobicContact CG2-CD1 4.05Å; T199-L211 HydrophobicContact CG2-CD2 4.35Å; T199-L211 HydrophobicContact CG2-CG 4.05Å; T199-L211 WeakPolarHBondContact OG1-CD2 3.47Å; L211-H214 HydrophobicContact CD2-CB 4.32Å; L211-H214 PolarHBondContact O-N 3.43Å; L211-S215 PolarHBondContact O-N 3.13Å; L211-S215 PolarHBondContact O-OG 3.08Å; L211-V253 HydrophobicContact CD1-CB 4.43Å; L211-V253 HydrophobicContact CD1-CG1 3.87Å; L211-V253 HydrophobicContact CD1-CG2 4.4Å; L211-R256 HydrophobicContact CB-CG 3.89Å; L211-R256 HydrophobicContact CD1-CB 4.39Å; L211-R256 HydrophobicContact CD1-CG 4.32Å; L211-I257 HydrophobicContact CB-CD1 4.02Å; L211-I257 HydrophobicContact CD1-CD1 4.11Å; L211-I257 HydrophobicContact CD1-CG1 4.14Å; L211-I257 HydrophobicContact CD2-CD1 4.29Å; L211-I257 HydrophobicContact CG-CD1 4.39Å
212E91.7Very high91.6Very high92 Ų9245.4 Ų45.443%0.4322%0.223SC..Hα-helixtrans-60.8-45.9-177.9-177.7-176.417500112.4F154 S210 H214 S215 L216F154-E212 HydrophobicContact CE2-CB 4.39Å; F154-E212 HydrophobicContact CE2-CG 4.25Å; S210-E212 WeakPolarHBondContact OG-CB 3.4Å; S210-E212 PolarHBondContact OG-N 3.19Å; E212-H214 VanDerWaalsContact C-N 3.34Å; E212-H214 PolarHBondContact O-N 3.48Å; E212-S215 PolarHBondContact O-OG 3.25Å; E212-S215 VanDerWaalsContact O-OG 3.13Å; E212-L216 WeakPolarHBondContact O-CB 3.47Å; E212-L216 PolarHBondContact O-N 3.34Å
213F92.9Very high91.4Very high1 Ų148.9 Ų48.90%0.00424%0.242CC..Hα-helixtrans-64.3-41.8177.4177.3-99.2000111.5L138 L141 F154 L157 C158 F161 L216 L217L138-F213 HydrophobicContact CD2-CD1 4.06Å; L138-F213 HydrophobicContact CD2-CE1 3.55Å; L141-F213 HydrophobicContact CB-CD1 4.42Å; L141-F213 HydrophobicContact CD1-CD1 3.42Å; L141-F213 VanDerWaalsContact CD1-CD1 3.42Å; L141-F213 HydrophobicContact CD1-CD2 4.49Å; L141-F213 HydrophobicContact CD1-CE1 3.58Å; L141-F213 HydrophobicContact CD1-CG 3.91Å; L141-F213 HydrophobicContact CD1-CZ 4.21Å; F154-F213 HydrophobicContact CB-CD2 3.92Å; F154-F213 HydrophobicContact CB-CE2 4.45Å; F154-F213 HydrophobicContact CD1-CB 4.41Å; F154-F213 AromaticContact CD1-CD2 3.73Å; F154-F213 HydrophobicContact CD1-CD2 3.73Å; F154-F213 HydrophobicContact CD1-CG 4.42Å; F154-F213 HydrophobicContact CD2-CB 4.03Å; F154-F213 HydrophobicContact CD2-CD2 4.14Å; F154-F213 HydrophobicContact CE1-CB 4.16Å; F154-F213 HydrophobicContact CE1-CD2 4.23Å; F154-F213 HydrophobicContact CE1-CG 4.49Å; F154-F213 HydrophobicContact CE2-CB 3.77Å; F154-F213 HydrophobicContact CG-CB 4.35Å; F154-F213 AromaticContact CG-CD2 3.68Å; F154-F213 HydrophobicContact CG-CD2 3.68Å; F154-F213 HydrophobicContact CG-CG 4.48Å; F154-F213 HydrophobicContact CZ-CB 3.84Å; L157-F213 HydrophobicContact CB-CE2 3.93Å; L157-F213 HydrophobicContact CB-CZ 4.31Å; L157-F213 HydrophobicContact CD2-CD2 4.4Å; L157-F213 HydrophobicContact CD2-CE1 4.28Å; L157-F213 HydrophobicContact CD2-CE2 3.6Å; L157-F213 HydrophobicContact CD2-CZ 3.54Å; L157-F213 HydrophobicContact CG-CE2 3.76Å; L157-F213 HydrophobicContact CG-CZ 3.65Å; C158-F213 VanDerWaalsContact SG-CE2 3.54Å; F161-F213 HydrophobicContact CD2-CZ 4.2Å; F161-F213 HydrophobicContact CE2-CE1 4.24Å; F161-F213 AromaticContact CE2-CZ 3.87Å; F161-F213 HydrophobicContact CE2-CZ 3.87Å; F213-L216 WeakPolarHBondContact O-CB 3.5Å; F213-L216 PolarHBondContact O-N 3.39Å; F213-L217 HydrophobicContact CE1-CB 4.24Å; F213-L217 HydrophobicContact CE1-CD2 3.85Å; F213-L217 HydrophobicContact CZ-CB 4.37Å; F213-L217 HydrophobicContact CZ-CD2 4.26Å; F213-L217 VanDerWaalsContact O-CB 3.31Å; F213-L217 WeakPolarHBondContact O-CB 3.34Å; F213-L217 PolarHBondContact O-N 3.33Å
214H95.2Very high91.3Very high0 Ų047.5 Ų47.50%024%0.24CC..Hα-helixtrans-66.4-40.7-177.3-52.271.6000111.8L138 L192 A195 F196 L211 E212 L217 I218 I257L138-H214 PolarHBondContact O-CE1 2.86Å; L138-H214 PolarHBondContact O-NE2 2.58Å; L192-H214 HydrophobicContact CD2-CB 4.27Å; A195-H214 VanDerWaalsContact CB-NE2 3.31Å; A195-H214 WeakPolarHBondContact CB-NE2 3.4Å; F196-H214 HydrophobicContact CE1-CB 3.99Å; L211-H214 HydrophobicContact CD2-CB 4.32Å; L211-H214 PolarHBondContact O-N 3.43Å; E212-H214 VanDerWaalsContact C-N 3.34Å; E212-H214 PolarHBondContact O-N 3.48Å; H214-L217 PolarHBondContact O-N 3.3Å; H214-I218 WeakPolarHBondContact O-CG1 3.3Å; H214-I218 PolarHBondContact O-N 2.89Å; H214-I257 HydrophobicContact CB-CD1 3.65Å
215S94.6Very high91.1Very high5 Ų544.9 Ų44.94%0.03524%0.241CC..Hα-helixtrans-68.1-38.9174.372.40000111.6L211 E212 G219 G260 V261L211-S215 PolarHBondContact O-N 3.13Å; L211-S215 PolarHBondContact O-OG 3.08Å; E212-S215 PolarHBondContact O-OG 3.25Å; E212-S215 VanDerWaalsContact O-OG 3.13Å; S215-G219 PolarHBondContact O-N 3.01Å; S215-G260 VanDerWaalsContact CB-O 3.24Å; S215-G260 WeakPolarHBondContact CB-O 3.37Å; S215-G260 PolarHBondContact OG-O 3.28Å; S215-V261 WeakPolarHBondContact O-CG1 3.16Å
216L94.5Very high91.1Very high50 Ų5042.7 Ų42.726%0.26223%0.226SC..Hα-helixtrans-61.2-44.4173.1-176.868.2000111.8F154 E212 F213 G219 K220 P262F154-L216 HydrophobicContact CB-CD2 3.71Å; E212-L216 WeakPolarHBondContact O-CB 3.47Å; E212-L216 PolarHBondContact O-N 3.34Å; F213-L216 WeakPolarHBondContact O-CB 3.5Å; F213-L216 PolarHBondContact O-N 3.39Å; L216-G219 PolarHBondContact O-N 2.92Å; L216-K220 VanDerWaalsContact O-CB 3.3Å; L216-K220 WeakPolarHBondContact O-CB 3.38Å; L216-K220 PolarHBondContact O-N 3.15Å; L216-P262 HydrophobicContact CD1-CG 3.51Å
217L95.4Very high91.1Very high0 Ų034.1 Ų34.10%019%0.186CC..Hα-helixtrans-64.3-49.2179.9175.958.3000111.3L138 F161 I188 L192 F213 H214 G219 K220 L221L138-L217 HydrophobicContact CD2-CD2 4.01Å; F161-L217 HydrophobicContact CB-CD1 3.5Å; F161-L217 HydrophobicContact CD1-CD1 3.95Å; F161-L217 HydrophobicContact CD1-CD2 4.01Å; F161-L217 HydrophobicContact CD2-CD1 3.99Å; F161-L217 HydrophobicContact CD2-CD2 4.39Å; F161-L217 HydrophobicContact CE1-CD2 3.9Å; F161-L217 HydrophobicContact CE2-CD2 4.36Å; F161-L217 HydrophobicContact CG-CD1 3.56Å; F161-L217 HydrophobicContact CG-CD2 4.24Å; F161-L217 HydrophobicContact CZ-CD2 4.12Å; I188-L217 HydrophobicContact CD1-CD2 4.26Å; L192-L217 HydrophobicContact CD2-CD2 4.38Å; F213-L217 HydrophobicContact CE1-CB 4.24Å; F213-L217 HydrophobicContact CE1-CD2 3.85Å; F213-L217 HydrophobicContact CZ-CB 4.37Å; F213-L217 HydrophobicContact CZ-CD2 4.26Å; F213-L217 VanDerWaalsContact O-CB 3.31Å; F213-L217 WeakPolarHBondContact O-CB 3.34Å; F213-L217 PolarHBondContact O-N 3.33Å; H214-L217 PolarHBondContact O-N 3.3Å; L217-G219 VanDerWaalsContact C-N 3.31Å; L217-G219 PolarHBondContact O-N 3.2Å; L217-K220 PolarHBondContact O-N 3.48Å; L217-L221 HydrophobicContact CD1-CD1 3.84Å; L217-L221 HydrophobicContact CD1-CG 4.02Å; L217-L221 HydrophobicContact CG-CD1 3.89Å; L217-L221 HydrophobicContact CG-CG 4.5Å; L217-L221 WeakPolarHBondContact O-CB 3.45Å; L217-L221 VanDerWaalsContact O-CG 3.29Å; L217-L221 WeakPolarHBondContact O-CG 3.39Å; L217-L221 PolarHBondContact O-N 3.34Å
218I96.4Very high91.2Very high3 Ų333.2 Ų33.22%0.01518%0.181CC..Hα-helixtrans-61.4-42.7177.2-73.9166.6000110.7L192 F196 H214 K220 L221 S222 L231 I257 V269L192-I218 HydrophobicContact CD1-CD1 4.15Å; L192-I218 HydrophobicContact CD1-CG1 4.09Å; L192-I218 HydrophobicContact CD2-CD1 4.45Å; F196-I218 HydrophobicContact CZ-CD1 4.06Å; H214-I218 WeakPolarHBondContact O-CG1 3.3Å; H214-I218 PolarHBondContact O-N 2.89Å; I218-K220 PolarHBondContact O-N 2.97Å; I218-L221 PolarHBondContact O-N 3.14Å; I218-S222 WeakPolarHBondContact O-CB 3.41Å; I218-S222 PolarHBondContact O-N 3Å; I218-S222 PolarHBondContact O-OG 2.98Å; I218-L231 HydrophobicContact CG2-CD2 4.12Å; I218-I257 HydrophobicContact CD1-CG2 3.29Å; I218-V269 HydrophobicContact CG2-CG1 4.49Å; I218-V269 HydrophobicContact CG2-CG2 4.27Å
219G94.2Very high91.4Very high0 Ų030.1 Ų30.10%017%0.165CC..Hα-helixtrans-60-44.5174.900000112.6S215 L216 L217 S222 I223 S265S215-G219 PolarHBondContact O-N 3.01Å; L216-G219 PolarHBondContact O-N 2.92Å; L217-G219 VanDerWaalsContact C-N 3.31Å; L217-G219 PolarHBondContact O-N 3.2Å; G219-S222 PolarHBondContact O-N 3.33Å; G219-I223 WeakPolarHBondContact O-CG1 3.24Å; G219-I223 PolarHBondContact O-N 2.96Å; G219-S265 WeakPolarHBondContact CA-OG 3.24Å; G219-S265 VanDerWaalsContact O-CB 3.27Å; G219-S265 WeakPolarHBondContact O-CB 3.45Å
220K93.4Very high91.6Very high64 Ų6429.1 Ų29.128%0.27816%0.158SC..Hα-helixtrans-67.3-42.3179.4-173.169.9178.1-176.70112.5C158 V162 L216 L217 I218 S222 I223 T224C158-K220 HydrophobicContact CB-CB 4.36Å; C158-K220 HydrophobicContact CB-CG 4.2Å; V162-K220 HydrophobicContact CG2-CG 3.64Å; L216-K220 VanDerWaalsContact O-CB 3.3Å; L216-K220 WeakPolarHBondContact O-CB 3.38Å; L216-K220 PolarHBondContact O-N 3.15Å; L217-K220 PolarHBondContact O-N 3.48Å; I218-K220 PolarHBondContact O-N 2.97Å; K220-S222 VanDerWaalsContact C-N 3.27Å; K220-S222 PolarHBondContact O-N 2.87Å; K220-I223 PolarHBondContact O-N 3.44Å; K220-T224 WeakPolarHBondContact O-CG2 3.31Å; K220-T224 PolarHBondContact O-N 2.86Å; K220-T224 PolarHBondContact O-OG1 3.27Å
221L93.5Very high91.8Very high1 Ų127.7 Ų27.71%0.00515%0.147CC..Hα-helixtrans-62.3-37.6174.7-70.6167.2000111.2V162 I188 L217 I218 T224 G225 Y226 G227 V230V162-L221 HydrophobicContact CG2-CD2 4.36Å; I188-L221 HydrophobicContact CD1-CD1 3.58Å; L217-L221 HydrophobicContact CD1-CD1 3.84Å; L217-L221 HydrophobicContact CD1-CG 4.02Å; L217-L221 HydrophobicContact CG-CD1 3.89Å; L217-L221 HydrophobicContact CG-CG 4.5Å; L217-L221 WeakPolarHBondContact O-CB 3.45Å; L217-L221 VanDerWaalsContact O-CG 3.29Å; L217-L221 WeakPolarHBondContact O-CG 3.39Å; L217-L221 PolarHBondContact O-N 3.34Å; I218-L221 PolarHBondContact O-N 3.14Å; L221-T224 WeakPolarHBondContact CA-OG1 3.43Å; L221-T224 PolarHBondContact O-N 3.19Å; L221-T224 PolarHBondContact O-OG1 3.36Å; L221-G225 PolarHBondContact O-N 3.36Å; L221-Y226 HydrophobicContact CD2-CD2 4.38Å; L221-Y226 CarbonylContact O-C 3.56Å; L221-Y226 WeakPolarHBondContact O-CA 3.49Å; L221-Y226 PolarHBondContact O-N 3.33Å; L221-G227 PolarHBondContact O-N 2.65Å; L221-G227 VanDerWaalsContact O-N 3.11Å; L221-V230 HydrophobicContact CD1-CG2 4.21Å
222S91.5Very high91.8Very high2 Ų232.8 Ų32.81%0.01417%0.166CC..Hα-helixtrans-66.7-48178.7-57.40000112.4I218 G219 K220 T224 G225 G227 R268 V269I218-S222 WeakPolarHBondContact O-CB 3.41Å; I218-S222 PolarHBondContact O-N 3Å; I218-S222 PolarHBondContact O-OG 2.98Å; G219-S222 PolarHBondContact O-N 3.33Å; K220-S222 VanDerWaalsContact C-N 3.27Å; K220-S222 PolarHBondContact O-N 2.87Å; S222-T224 PolarHBondContact O-N 3.49Å; S222-G225 PolarHBondContact O-N 3.48Å; S222-G225 VanDerWaalsContact O-N 3.16Å; S222-G227 WeakPolarHBondContact OG-CA 3.48Å; S222-R268 WeakPolarHBondContact O-CG 3.11Å; S222-V269 VanDerWaalsContact OG-CG2 3.31Å; S222-V269 WeakPolarHBondContact OG-CG2 3.14Å
223I87.9Confident91.9Very high87 Ų8731.5 Ų31.545%0.44616%0.164SC..Hα-helixtrans-60.7-31.4176.7-67.3165.4000111.9G219 K220 G225 I264G219-I223 WeakPolarHBondContact O-CG1 3.24Å; G219-I223 PolarHBondContact O-N 2.96Å; K220-I223 PolarHBondContact O-N 3.44Å; I223-G225 VanDerWaalsContact C-N 3.31Å; I223-I264 HydrophobicContact CD1-CB 4.27Å; I223-I264 HydrophobicContact CD1-CG2 3.71Å
224T86.4Confident92Very high50 Ų5031.5 Ų31.531%0.30716%0.164SC..THydrogen-bonded Turntrans-86.4-0.9-177.251.40000113.7V162 K220 L221 S222V162-T224 HydrophobicContact CG1-CG2 3.6Å; V162-T224 HydrophobicContact CG2-CG2 4.05Å; K220-T224 WeakPolarHBondContact O-CG2 3.31Å; K220-T224 PolarHBondContact O-N 2.86Å; K220-T224 PolarHBondContact O-OG1 3.27Å; L221-T224 WeakPolarHBondContact CA-OG1 3.43Å; L221-T224 PolarHBondContact O-N 3.19Å; L221-T224 PolarHBondContact O-OG1 3.36Å; S222-T224 PolarHBondContact O-N 3.49Å
225G82.8Confident92.1Very high43 Ų4331.5 Ų31.544%0.44316%0.164SC..THydrogen-bonded Turntrans98.2-5.3175.600000115.1L221 S222 I223L221-G225 PolarHBondContact O-N 3.36Å; S222-G225 PolarHBondContact O-N 3.48Å; S222-G225 VanDerWaalsContact O-N 3.16Å; I223-G225 VanDerWaalsContact C-N 3.31Å
226Y89.2Confident92.1Very high51 Ų5134.3 Ų34.320%0.218%0.183CC..  trans-95.81.5-178.3-55-50.9000114.2P165 F185 L221 K228 D229P165-Y226 HydrophobicContact CB-CE1 4.27Å; P165-Y226 HydrophobicContact CB-CE2 4.07Å; P165-Y226 WeakPolarHBondContact CB-OH 3.4Å; P165-Y226 HydrophobicContact CG-CD2 4.28Å; P165-Y226 HydrophobicContact CG-CE1 4.42Å; P165-Y226 HydrophobicContact CG-CE2 3.79Å; F185-Y226 AromaticContact CE1-CD1 3.96Å; F185-Y226 HydrophobicContact CE1-CD1 3.96Å; F185-Y226 AromaticContact CE1-CG 3.84Å; F185-Y226 HydrophobicContact CE1-CG 3.84Å; F185-Y226 HydrophobicContact CE2-CD1 4.38Å; F185-Y226 AromaticContact CZ-CD1 3.42Å; F185-Y226 HydrophobicContact CZ-CD1 3.42Å; F185-Y226 VanDerWaalsContact CZ-CD1 3.42Å; F185-Y226 AromaticContact CZ-CE1 3.95Å; F185-Y226 HydrophobicContact CZ-CE1 3.95Å; F185-Y226 AromaticContact CZ-CG 3.79Å; F185-Y226 HydrophobicContact CZ-CG 3.79Å; L221-Y226 HydrophobicContact CD2-CD2 4.38Å; L221-Y226 CarbonylContact O-C 3.56Å; L221-Y226 WeakPolarHBondContact O-CA 3.49Å; L221-Y226 PolarHBondContact O-N 3.33Å; Y226-K228 VanDerWaalsContact C-N 3.34Å; Y226-K228 PolarHBondContact O-N 3Å; Y226-D229 PolarHBondContact O-N 3.32Å
227G87.2Confident92.2Very high1 Ų134.8 Ų34.81%0.0118%0.181CC..Hα-helixtrans-57.4-45.8-177.500000112.6L221 S222 D229 V230 L231L221-G227 PolarHBondContact O-N 2.65Å; L221-G227 VanDerWaalsContact O-N 3.11Å; S222-G227 WeakPolarHBondContact OG-CA 3.48Å; G227-D229 VanDerWaalsContact C-N 3.34Å; G227-D229 PolarHBondContact O-N 3.42Å; G227-V230 PolarHBondContact O-N 3.16Å; G227-L231 VanDerWaalsContact O-CB 3.31Å; G227-L231 WeakPolarHBondContact O-CB 3.47Å; G227-L231 VanDerWaalsContact O-CG 3.31Å; G227-L231 WeakPolarHBondContact O-CG 3.3Å; G227-L231 PolarHBondContact O-N 3.1Å
228K88.9Confident92.2Very high60 Ų6034.8 Ų34.826%0.26118%0.181SC..Hα-helixtrans-61.3-39.3-178.1-163.2173.2-177.3165.30112.6Y226 V230 R232 E275Y226-K228 VanDerWaalsContact C-N 3.34Å; Y226-K228 PolarHBondContact O-N 3Å; K228-V230 VanDerWaalsContact C-N 3.31Å; K228-V230 PolarHBondContact O-N 3.26Å; K228-R232 HydrophobicContact CG-CG 4.32Å; K228-R232 VanDerWaalsContact O-CB 3.25Å; K228-R232 WeakPolarHBondContact O-CB 3.44Å; K228-R232 WeakPolarHBondContact O-CD 3.32Å; K228-R232 WeakPolarHBondContact O-CG 3.46Å; K228-R232 PolarHBondContact O-N 3.19Å; K228-E275 VanDerWaalsContact CE-OE2 3.26Å; K228-E275 WeakPolarHBondContact CE-OE2 3.26Å; K228-E275 IonicContact NZ-OE2 3.36Å; K228-E275 PolarHBondContact NZ-OE2 3.11Å
229D90.2Very high92.1Very high55 Ų5535.3 Ų35.329%0.29418%0.184SC..Hα-helixtrans-65.7-35.2-179.3-59.4-54.8000112.6F185 Y226 G227 R232F185-D229 HydrophobicContact CB-CB 4.23Å; F185-D229 HydrophobicContact CD1-CB 4.13Å; F185-D229 HydrophobicContact CD2-CB 4.11Å; F185-D229 HydrophobicContact CG-CB 3.9Å; Y226-D229 PolarHBondContact O-N 3.32Å; G227-D229 VanDerWaalsContact C-N 3.34Å; G227-D229 PolarHBondContact O-N 3.42Å; D229-R232 IonicContact OD1-NH1 3.11Å; D229-R232 PolarHBondContact OD1-NH1 3.37Å
230V93.9Very high92.1Very high3 Ų337.6 Ų37.62%0.01820%0.203CC..Hα-helixtrans-81.1-47.3176.5179.60000111.3F185 I188 L192 L221 G227 K228 R232 T233 V234F185-V230 HydrophobicContact CD1-CG2 4.2Å; I188-V230 HydrophobicContact CG2-CG2 3.81Å; L192-V230 HydrophobicContact CD1-CG1 3.57Å; L221-V230 HydrophobicContact CD1-CG2 4.21Å; G227-V230 PolarHBondContact O-N 3.16Å; K228-V230 VanDerWaalsContact C-N 3.31Å; K228-V230 PolarHBondContact O-N 3.26Å; V230-R232 VanDerWaalsContact C-N 3.3Å; V230-R232 PolarHBondContact O-N 3.17Å; V230-T233 PolarHBondContact O-N 2.98Å; V230-T233 VanDerWaalsContact O-N 3.08Å; V230-V234 HydrophobicContact CG1-CG2 4Å; V230-V234 WeakPolarHBondContact O-CG2 3.47Å; V230-V234 PolarHBondContact O-N 2.8Å
231L94.9Very high92.1Very high2 Ų239.7 Ų39.71%0.0121%0.209CC..Hα-helixtrans-66.2-30.5-176.4-70.2174.1000112.7I218 G227 T233 V234 V235 V269 D272 L276I218-L231 HydrophobicContact CG2-CD2 4.12Å; G227-L231 VanDerWaalsContact O-CB 3.31Å; G227-L231 WeakPolarHBondContact O-CB 3.47Å; G227-L231 VanDerWaalsContact O-CG 3.31Å; G227-L231 WeakPolarHBondContact O-CG 3.3Å; G227-L231 PolarHBondContact O-N 3.1Å; L231-T233 PolarHBondContact O-N 3.32Å; L231-T233 VanDerWaalsContact O-N 3.13Å; L231-V234 PolarHBondContact O-N 3.38Å; L231-V235 HydrophobicContact CB-CG2 4.08Å; L231-V235 HydrophobicContact CD2-CG2 3.97Å; L231-V235 WeakPolarHBondContact O-CB 3.15Å; L231-V235 WeakPolarHBondContact O-CG2 3.48Å; L231-V235 PolarHBondContact O-N 2.73Å; L231-V269 HydrophobicContact CD1-CG1 4.33Å; L231-D272 HydrophobicContact CD1-CB 3.63Å; L231-L276 VanDerWaalsContact C-CD1 3.45Å; L231-L276 HydrophobicContact CB-CD1 4.02Å; L231-L276 WeakPolarHBondContact O-CD1 3.35Å
232R93.3Very high92.1Very high119 Ų11940.2 Ų40.245%0.44921%0.212SC..Hα-helixtrans-53.9-29.9171.5-85.6170.3-178.8142.4-8113.4K228 D229 V230 P236 L276K228-R232 HydrophobicContact CG-CG 4.32Å; K228-R232 VanDerWaalsContact O-CB 3.25Å; K228-R232 WeakPolarHBondContact O-CB 3.44Å; K228-R232 WeakPolarHBondContact O-CD 3.32Å; K228-R232 WeakPolarHBondContact O-CG 3.46Å; K228-R232 PolarHBondContact O-N 3.19Å; D229-R232 IonicContact OD1-NH1 3.11Å; D229-R232 PolarHBondContact OD1-NH1 3.37Å; V230-R232 VanDerWaalsContact C-N 3.3Å; V230-R232 PolarHBondContact O-N 3.17Å; R232-P236 VanDerWaalsContact O-CD 3.27Å; R232-P236 WeakPolarHBondContact O-CD 3.42Å; R232-P236 VanDerWaalsContact O-CG 3.31Å; R232-P236 WeakPolarHBondContact O-CG 3.4Å; R232-L276 HydrophobicContact CG-CD1 4.46Å; R232-L276 HydrophobicContact CG-CD2 3.8Å
233T93.5Very high92.1Very high65 Ų6544.5 Ų44.540%0.39923%0.228SC..Hα-helixtrans-94.2-42.5176.8-530000111.2I193 V230 L231I193-T233 HydrophobicContact CD1-CG2 4.22Å; V230-T233 PolarHBondContact O-N 2.98Å; V230-T233 VanDerWaalsContact O-N 3.08Å; L231-T233 PolarHBondContact O-N 3.32Å; L231-T233 VanDerWaalsContact O-N 3.13Å
234V96Very high92.3Very high0 Ų042.6 Ų42.60%022%0.222CC..Hα-helixtrans-71.8-44.2-173.3171.20000112.7L192 F196 V230 L231 Y237 L238L192-V234 HydrophobicContact CD1-CG2 4.45Å; F196-V234 HydrophobicContact CE2-CG1 3.8Å; V230-V234 HydrophobicContact CG1-CG2 4Å; V230-V234 WeakPolarHBondContact O-CG2 3.47Å; V230-V234 PolarHBondContact O-N 2.8Å; L231-V234 PolarHBondContact O-N 3.38Å; V234-Y237 PolarHBondContact O-N 3.03Å; V234-L238 HydrophobicContact CG1-CD1 3.76Å; V234-L238 HydrophobicContact CG1-CG 4.24Å; V234-L238 WeakPolarHBondContact O-CG 3.37Å; V234-L238 PolarHBondContact O-N 3.49Å
235V96.2Very high92.4Very high1 Ų150 Ų501%0.00625%0.253CS..Hα-helixtrans-65.4-49.5-174.51720000111.9L231 Y237 L238 L239 T273 L276 V277 L286L231-V235 HydrophobicContact CB-CG2 4.08Å; L231-V235 HydrophobicContact CD2-CG2 3.97Å; L231-V235 WeakPolarHBondContact O-CB 3.15Å; L231-V235 WeakPolarHBondContact O-CG2 3.48Å; L231-V235 PolarHBondContact O-N 2.73Å; V235-Y237 VanDerWaalsContact C-N 3.29Å; V235-Y237 PolarHBondContact O-N 3.45Å; V235-L238 PolarHBondContact O-N 3.24Å; V235-L239 HydrophobicContact CG1-CD1 4.13Å; V235-L239 HydrophobicContact CG1-CG 4.49Å; V235-L239 WeakPolarHBondContact O-CG 3.48Å; V235-L239 PolarHBondContact O-N 3.1Å; V235-T273 HydrophobicContact CG1-CG2 4.41Å; V235-T273 HydrophobicContact CG2-CG2 4.39Å; V235-L276 HydrophobicContact CB-CD1 4.04Å; V235-L276 HydrophobicContact CG1-CB 4.18Å; V235-L276 HydrophobicContact CG2-CD1 4.16Å; V235-V277 HydrophobicContact CG1-CG2 4.13Å; V235-L286 HydrophobicContact CG1-CD1 3.92Å
236P95.1Very high92.7Very high64 Ų6451.2 Ų51.242%0.41625%0.248SC..Hα-helixtrans-60-39.1175.8-2637.1000112.8R232 L239 A240R232-P236 VanDerWaalsContact O-CD 3.27Å; R232-P236 WeakPolarHBondContact O-CD 3.42Å; R232-P236 VanDerWaalsContact O-CG 3.31Å; R232-P236 WeakPolarHBondContact O-CG 3.4Å; P236-L239 PolarHBondContact O-N 3.35Å; P236-A240 PolarHBondContact O-N 3.37Å
237Y95.3Very high92.7Very high59 Ų5949.2 Ų49.223%0.23124%0.242CC..Hα-helixtrans-60.8-48.1176.2-179.1-89.1000112I193 V234 V235 L239 A240 R241 W250I193-Y237 HydrophobicContact CB-CD1 4.46Å; I193-Y237 HydrophobicContact CB-CE1 4.43Å; I193-Y237 HydrophobicContact CD1-CD1 4.17Å; I193-Y237 HydrophobicContact CD1-CD2 4.14Å; I193-Y237 HydrophobicContact CD1-CG 3.8Å; I193-Y237 HydrophobicContact CG1-CD1 3.91Å; I193-Y237 HydrophobicContact CG1-CE1 4.36Å; I193-Y237 HydrophobicContact CG1-CG 4.08Å; I193-Y237 HydrophobicContact CG2-CD1 3.83Å; I193-Y237 HydrophobicContact CG2-CD2 4.19Å; I193-Y237 HydrophobicContact CG2-CE1 3.42Å; I193-Y237 VanDerWaalsContact CG2-CE1 3.42Å; I193-Y237 HydrophobicContact CG2-CE2 3.81Å; I193-Y237 HydrophobicContact CG2-CG 4.2Å; V234-Y237 PolarHBondContact O-N 3.03Å; V235-Y237 VanDerWaalsContact C-N 3.29Å; V235-Y237 PolarHBondContact O-N 3.45Å; Y237-L239 VanDerWaalsContact C-N 3.33Å; Y237-L239 PolarHBondContact O-N 2.82Å; Y237-A240 PolarHBondContact O-N 3.49Å; Y237-R241 HydrophobicContact CD1-CG 4.09Å; Y237-R241 HydrophobicContact CE1-CG 3.61Å; Y237-R241 HydrophobicContact CE2-CG 4.41Å; Y237-R241 WeakPolarHBondContact O-CG 3.42Å; Y237-R241 PolarHBondContact O-N 3.09Å; Y237-R241 PolarHBondContact OH-NE 3.45Å; Y237-R241 PolarHBondContact OH-NH2 3.12Å; Y237-W250 AromaticContact CE1-CH2 3.95Å; Y237-W250 HydrophobicContact CE1-CH2 3.95Å; Y237-W250 HydrophobicContact CE1-CZ3 4.08Å
238L96Very high93Very high0 Ų055.8 Ų55.80%028%0.276CS..Hα-helixtrans-61.4-42.8177.1-70.6173.1000111F196 V234 V235 A240 R241 T242 W250 A254 L286F196-L238 HydrophobicContact CD2-CD2 4.23Å; V234-L238 HydrophobicContact CG1-CD1 3.76Å; V234-L238 HydrophobicContact CG1-CG 4.24Å; V234-L238 WeakPolarHBondContact O-CG 3.37Å; V234-L238 PolarHBondContact O-N 3.49Å; V235-L238 PolarHBondContact O-N 3.24Å; L238-A240 PolarHBondContact O-N 2.86Å; L238-R241 PolarHBondContact O-N 3.21Å; L238-T242 VanDerWaalsContact O-CG2 3.29Å; L238-T242 WeakPolarHBondContact O-CG2 3.27Å; L238-T242 PolarHBondContact O-N 3.02Å; L238-W250 HydrophobicContact CD2-CE3 3.84Å; L238-W250 HydrophobicContact CD2-CZ3 4.05Å; L238-A254 HydrophobicContact CB-CB 4.45Å; L238-A254 HydrophobicContact CD1-CB 4.06Å; L238-A254 HydrophobicContact CD2-CB 4.5Å; L238-L286 HydrophobicContact CB-CD2 3.9Å
239L94.8Very high93.1Very high15 Ų1555.3 Ų55.38%0.07928%0.276CS..Hα-helixtrans-60.2-44.1177.1-76.4173.8000112.7V235 P236 Y237 R241 T242 V277 S282 R285 L286V235-L239 HydrophobicContact CG1-CD1 4.13Å; V235-L239 HydrophobicContact CG1-CG 4.49Å; V235-L239 WeakPolarHBondContact O-CG 3.48Å; V235-L239 PolarHBondContact O-N 3.1Å; P236-L239 PolarHBondContact O-N 3.35Å; Y237-L239 VanDerWaalsContact C-N 3.33Å; Y237-L239 PolarHBondContact O-N 2.82Å; L239-R241 VanDerWaalsContact C-N 3.34Å; L239-R241 PolarHBondContact O-N 3.12Å; L239-T242 PolarHBondContact O-N 3.14Å; L239-T242 PolarHBondContact O-OG1 2.99Å; L239-V277 HydrophobicContact CD1-CG2 4.32Å; L239-S282 WeakPolarHBondContact CD2-O 3.37Å; L239-R285 PolarHBondContact O-NH1 3.49Å; L239-L286 HydrophobicContact CD1-CD1 4.46Å; L239-L286 HydrophobicContact CD2-CD1 3.78Å; L239-L286 HydrophobicContact CD2-CD2 3.93Å; L239-L286 HydrophobicContact CD2-CG 3.63Å; L239-L286 HydrophobicContact CG-CD1 4.03Å; L239-L286 HydrophobicContact CG-CD2 4.12Å; L239-L286 HydrophobicContact CG-CG 4.2Å
240A94Very high93.4Very high47 Ų4753.2 Ų53.239%0.38826%0.264SS..Hα-helixtrans-60.9-45.517500000110.9P236 Y237 L238 T242 R243P236-A240 PolarHBondContact O-N 3.37Å; Y237-A240 PolarHBondContact O-N 3.49Å; L238-A240 PolarHBondContact O-N 2.86Å; A240-T242 PolarHBondContact O-N 3.22Å; A240-R243 PolarHBondContact O-N 3.19Å; A240-R243 VanDerWaalsContact O-N 3.15Å
241R94.3Very high93.4Very high109 Ų10954.6 Ų54.641%0.41127%0.273SS..Hα-helixtrans-68.4-29.5-179.2-66.8-59.1-175.7-174.8-0.8114.3Y237 L238 L239 R243 S244 W250Y237-R241 HydrophobicContact CD1-CG 4.09Å; Y237-R241 HydrophobicContact CE1-CG 3.61Å; Y237-R241 HydrophobicContact CE2-CG 4.41Å; Y237-R241 WeakPolarHBondContact O-CG 3.42Å; Y237-R241 PolarHBondContact O-N 3.09Å; Y237-R241 PolarHBondContact OH-NE 3.45Å; Y237-R241 PolarHBondContact OH-NH2 3.12Å; L238-R241 PolarHBondContact O-N 3.21Å; L239-R241 VanDerWaalsContact C-N 3.34Å; L239-R241 PolarHBondContact O-N 3.12Å; R241-R243 PolarHBondContact O-N 3.37Å; R241-R243 VanDerWaalsContact O-N 3.17Å; R241-S244 WeakPolarHBondContact O-CB 3.38Å; R241-S244 PolarHBondContact O-N 3.25Å; R241-S244 PolarHBondContact O-OG 3.26Å; R241-W250 HydrophobicContact CB-CB 4.22Å; R241-W250 HydrophobicContact CB-CD2 3.56Å; R241-W250 HydrophobicContact CB-CE3 4.08Å; R241-W250 HydrophobicContact CB-CG 3.61Å; R241-W250 HydrophobicContact CB-CZ2 4.44Å; R241-W250 HydrophobicContact CG-CD2 4.15Å; R241-W250 HydrophobicContact CG-CE3 4.48Å; R241-W250 HydrophobicContact CG-CZ2 4.16Å
242T93.2Very high93.3Very high12 Ų1262.4 Ų62.47%0.07430%0.303CS..THydrogen-bonded Turntrans-65.4-13.717459.20000113.7L238 L239 A240 G247 W250 S251 R285L238-T242 VanDerWaalsContact O-CG2 3.29Å; L238-T242 WeakPolarHBondContact O-CG2 3.27Å; L238-T242 PolarHBondContact O-N 3.02Å; L239-T242 PolarHBondContact O-N 3.14Å; L239-T242 PolarHBondContact O-OG1 2.99Å; A240-T242 PolarHBondContact O-N 3.22Å; T242-G247 VanDerWaalsContact O-CA 3.3Å; T242-G247 WeakPolarHBondContact O-CA 3.21Å; T242-W250 HydrophobicContact CG2-CB 4.14Å; T242-S251 WeakPolarHBondContact CG2-OG 3.36Å; T242-R285 HydrophobicContact CG2-CB 4.38Å; T242-R285 PolarHBondContact OG1-NH1 3.48Å
243R91.3Very high93.4Very high92 Ų9256.9 Ų56.935%0.34728%0.282SS..THydrogen-bonded Turntrans-89.2-11.7172.1-56.8-170.8-179.9160.87113.9A240 R241 D458A240-R243 PolarHBondContact O-N 3.19Å; A240-R243 VanDerWaalsContact O-N 3.15Å; R241-R243 PolarHBondContact O-N 3.37Å; R241-R243 VanDerWaalsContact O-N 3.17Å; R243-D458 IonicContact CZ-OD2 3.59Å; R243-D458 VanDerWaalsContact CZ-OD2 3.23Å; R243-D458 VanDerWaalsContact NH1-CB 3.3Å; R243-D458 IonicContact NH1-OD2 2.62Å; R243-D458 PolarHBondContact NH1-OD2 3.49Å; R243-D458 IonicContact NH2-OD2 3.91Å; R243-D458 PolarHBondContact NH2-OD2 2.99Å
244S91.9Very high93.6Very high46 Ų4653.8 Ų53.832%0.32226%0.263SS..SBendtrans-70.3170.3177.771.40000112R241 E246 G247R241-S244 WeakPolarHBondContact O-CB 3.38Å; R241-S244 PolarHBondContact O-N 3.25Å; R241-S244 PolarHBondContact O-OG 3.26Å; S244-E246 PolarHBondContact O-N 3.43Å; S244-E246 PolarHBondContact OG-N 3.11Å; S244-G247 WeakPolarHBondContact O-CA 3.4Å; S244-G247 PolarHBondContact O-N 3.11Å
245E87.8Confident93.5Very high206 Ų20657.7 Ų57.796%0.96328%0.278SS*.THydrogen-bonded Turntrans-52.9-28.7173.9-62.5-178176.500112.4G247E245-G247 VanDerWaalsContact C-N 3.28Å; E245-G247 PolarHBondContact O-N 3.14Å
246E88.8Confident93.5Very high69 Ų6963.3 Ų63.332%0.32230%0.299SS..THydrogen-bonded Turntrans-93.818.3179.6-63170.2-17100112.6L200 K204 S244 I248 L249 W250L200-E246 HydrophobicContact CD2-CB 4.44Å; L200-E246 WeakPolarHBondContact CD2-OE2 3.45Å; K204-E246 VanDerWaalsContact CE-OE1 3.27Å; K204-E246 WeakPolarHBondContact CE-OE1 3.42Å; K204-E246 VanDerWaalsContact CE-OE2 3.28Å; K204-E246 WeakPolarHBondContact CE-OE2 3.09Å; K204-E246 IonicContact NZ-OE1 3.56Å; K204-E246 PolarHBondContact NZ-OE1 3.24Å; K204-E246 IonicContact NZ-OE2 3.5Å; K204-E246 PolarHBondContact NZ-OE2 2.86Å; S244-E246 PolarHBondContact O-N 3.43Å; S244-E246 PolarHBondContact OG-N 3.11Å; E246-I248 VanDerWaalsContact C-N 3.28Å; E246-I248 PolarHBondContact O-N 3.02Å; E246-I248 VanDerWaalsContact O-N 3.17Å; E246-L249 PolarHBondContact O-N 2.71Å; E246-W250 PolarHBondContact O-N 3.41Å; E246-W250 VanDerWaalsContact O-N 3.11Å
247G91.1Very high93.5Very high8 Ų860.3 Ų60.38%0.08228%0.279CS..Hα-helixtrans-53.6-40.6-170.500000114T242 S244 E245 L249 W250 S251T242-G247 VanDerWaalsContact O-CA 3.3Å; T242-G247 WeakPolarHBondContact O-CA 3.21Å; S244-G247 WeakPolarHBondContact O-CA 3.4Å; S244-G247 PolarHBondContact O-N 3.11Å; E245-G247 VanDerWaalsContact C-N 3.28Å; E245-G247 PolarHBondContact O-N 3.14Å; G247-L249 VanDerWaalsContact C-N 3.34Å; G247-L249 PolarHBondContact O-N 3.1Å; G247-W250 PolarHBondContact O-N 3.3Å; G247-S251 PolarHBondContact O-N 3.16Å; G247-S251 PolarHBondContact O-OG 3.47Å
248I91.8Very high93.5Very high139 Ų13957.7 Ų57.771%0.71327%0.269SS*.Hα-helixtrans-60.5-42.9179-60.8173.5000111.5E246 S251 R252E246-I248 VanDerWaalsContact C-N 3.28Å; E246-I248 PolarHBondContact O-N 3.02Å; E246-I248 VanDerWaalsContact O-N 3.17Å; I248-S251 PolarHBondContact O-N 3.47Å; I248-R252 WeakPolarHBondContact O-CG 3.48Å; I248-R252 PolarHBondContact O-N 2.98Å; I248-R252 VanDerWaalsContact O-N 3.11Å
249L92.5Very high93.4Very high50 Ų5058.3 Ų58.326%0.26227%0.273SS..Hα-helixtrans-71.7-39.6179.9-62.5176.5000110.7L200 E246 G247 S251 R252 V253L200-L249 HydrophobicContact CD1-CB 3.23Å; L200-L249 HydrophobicContact CD1-CD1 3.5Å; L200-L249 VanDerWaalsContact CD1-CD1 3.5Å; L200-L249 HydrophobicContact CD1-CG 3.97Å; E246-L249 PolarHBondContact O-N 2.71Å; G247-L249 VanDerWaalsContact C-N 3.34Å; G247-L249 PolarHBondContact O-N 3.1Å; L249-S251 VanDerWaalsContact C-N 3.32Å; L249-S251 PolarHBondContact O-N 3.31Å; L249-R252 WeakPolarHBondContact O-CB 3.48Å; L249-R252 PolarHBondContact O-N 3.1Å; L249-R252 VanDerWaalsContact O-N 3.15Å; L249-V253 WeakPolarHBondContact O-CG2 3.41Å; L249-V253 PolarHBondContact O-N 2.79Å
250W95.6Very high93.2Very high11 Ų1158.7 Ų58.74%0.04228%0.28CS..Hα-helixtrans-61.7-37.6172-78.4108.8000112.7F196 A197 L200 Y237 L238 R241 T242 E246 G247 R252 V253 A254F196-W250 HydrophobicContact CB-CH2 4.4Å; F196-W250 HydrophobicContact CB-CZ3 3.86Å; A197-W250 HydrophobicContact CB-CH2 4.12Å; L200-W250 HydrophobicContact CD2-CD2 4.17Å; L200-W250 HydrophobicContact CD2-CG 4.46Å; L200-W250 HydrophobicContact CD2-CZ2 3.61Å; Y237-W250 AromaticContact CE1-CH2 3.95Å; Y237-W250 HydrophobicContact CE1-CH2 3.95Å; Y237-W250 HydrophobicContact CE1-CZ3 4.08Å; L238-W250 HydrophobicContact CD2-CE3 3.84Å; L238-W250 HydrophobicContact CD2-CZ3 4.05Å; R241-W250 HydrophobicContact CB-CB 4.22Å; R241-W250 HydrophobicContact CB-CD2 3.56Å; R241-W250 HydrophobicContact CB-CE3 4.08Å; R241-W250 HydrophobicContact CB-CG 3.61Å; R241-W250 HydrophobicContact CB-CZ2 4.44Å; R241-W250 HydrophobicContact CG-CD2 4.15Å; R241-W250 HydrophobicContact CG-CE3 4.48Å; R241-W250 HydrophobicContact CG-CZ2 4.16Å; T242-W250 HydrophobicContact CG2-CB 4.14Å; E246-W250 PolarHBondContact O-N 3.41Å; E246-W250 VanDerWaalsContact O-N 3.11Å; G247-W250 PolarHBondContact O-N 3.3Å; W250-R252 VanDerWaalsContact C-N 3.33Å; W250-R252 PolarHBondContact O-N 3.49Å; W250-V253 PolarHBondContact O-N 2.86Å; W250-A254 WeakPolarHBondContact O-CB 3.28Å; W250-A254 PolarHBondContact O-N 3.04Å
251S94.7Very high93.3Very high32 Ų3256.7 Ų56.722%0.22426%0.263CS..Hα-helixtrans-62.9-38.4172.7-69.30000112T242 G247 I248 L249 A254 R255 R285T242-S251 WeakPolarHBondContact CG2-OG 3.36Å; G247-S251 PolarHBondContact O-N 3.16Å; G247-S251 PolarHBondContact O-OG 3.47Å; I248-S251 PolarHBondContact O-N 3.47Å; L249-S251 VanDerWaalsContact C-N 3.32Å; L249-S251 PolarHBondContact O-N 3.31Å; S251-A254 PolarHBondContact O-N 3.13Å; S251-R255 WeakPolarHBondContact O-CB 3.33Å; S251-R255 PolarHBondContact O-N 3.24Å; S251-R285 WeakPolarHBondContact CB-O 3.13Å; S251-R285 PolarHBondContact OG-O 3.29Å
252R93.1Very high93.1Very high167 Ų16753.9 Ų53.963%0.6326%0.259SS*.Hα-helixtrans-65-42.4175.3-69.5178.273.7-176.22.3111.8I248 L249 W250 R256I248-R252 WeakPolarHBondContact O-CG 3.48Å; I248-R252 PolarHBondContact O-N 2.98Å; I248-R252 VanDerWaalsContact O-N 3.11Å; L249-R252 WeakPolarHBondContact O-CB 3.48Å; L249-R252 PolarHBondContact O-N 3.1Å; L249-R252 VanDerWaalsContact O-N 3.15Å; W250-R252 VanDerWaalsContact C-N 3.33Å; W250-R252 PolarHBondContact O-N 3.49Å; R252-R256 PolarHBondContact O-N 3.14Å
253V95.3Very high93Very high2 Ų259.9 Ų59.91%0.01229%0.286CS..Hα-helixtrans-62.2-49.3174.7171.30000110.4F196 T199 L211 L249 W250 R255 R256 I257F196-V253 HydrophobicContact CB-CG1 3.9Å; F196-V253 HydrophobicContact CD1-CG1 4.3Å; F196-V253 HydrophobicContact CG-CG1 4.02Å; T199-V253 HydrophobicContact CG2-CG2 4.47Å; L211-V253 HydrophobicContact CD1-CB 4.43Å; L211-V253 HydrophobicContact CD1-CG1 3.87Å; L211-V253 HydrophobicContact CD1-CG2 4.4Å; L249-V253 WeakPolarHBondContact O-CG2 3.41Å; L249-V253 PolarHBondContact O-N 2.79Å; W250-V253 PolarHBondContact O-N 2.86Å; V253-R255 PolarHBondContact O-N 3.48Å; V253-R256 PolarHBondContact O-N 3.46Å; V253-I257 HydrophobicContact CG1-CG1 4.47Å; V253-I257 WeakPolarHBondContact O-CG1 3.5Å; V253-I257 PolarHBondContact O-N 3.11Å
254A96.3Very high92.9Very high0 Ų062.7 Ų62.70%031%0.306CS..Hα-helixtrans-57.1-46.9177.600000112L238 W250 S251 R256 I257 I258 L286L238-A254 HydrophobicContact CB-CB 4.45Å; L238-A254 HydrophobicContact CD1-CB 4.06Å; L238-A254 HydrophobicContact CD2-CB 4.5Å; W250-A254 WeakPolarHBondContact O-CB 3.28Å; W250-A254 PolarHBondContact O-N 3.04Å; S251-A254 PolarHBondContact O-N 3.13Å; A254-R256 VanDerWaalsContact C-N 3.32Å; A254-R256 PolarHBondContact O-N 3.36Å; A254-I257 PolarHBondContact O-N 3.47Å; A254-I257 VanDerWaalsContact O-N 3.16Å; A254-I258 WeakPolarHBondContact O-CB 3.05Å; A254-I258 WeakPolarHBondContact O-CG1 3Å; A254-I258 PolarHBondContact O-N 2.89Å; A254-L286 CarbonylContact C-O 3.56Å; A254-L286 HydrophobicContact CB-CD2 3.76Å
255R95.4Very high92.9Very high82 Ų8260.5 Ų60.531%0.30929%0.291SS..Hα-helixtrans-59.5-43.3177.9-175.9178.1-176.5-92.31111.2S251 V253 I257 I259 G260 L286 I287 T293S251-R255 WeakPolarHBondContact O-CB 3.33Å; S251-R255 PolarHBondContact O-N 3.24Å; V253-R255 PolarHBondContact O-N 3.48Å; R255-I257 VanDerWaalsContact C-N 3.33Å; R255-I257 PolarHBondContact O-N 3.49Å; R255-I259 WeakPolarHBondContact O-CB 3.29Å; R255-I259 PolarHBondContact O-N 3.03Å; R255-G260 PolarHBondContact O-N 2.95Å; R255-L286 WeakPolarHBondContact CA-O 3.27Å; R255-L286 PolarHBondContact N-O 2.71Å; R255-I287 WeakPolarHBondContact CD-O 3.37Å; R255-I287 PolarHBondContact NE-O 3.14Å; R255-T293 PolarHBondContact NH2-OG1 3.29Å; R255-T293 VanDerWaalsContact NH2-OG1 3.09Å
256R94.5Very high93.2Very high120 Ų12051.8 Ų51.845%0.45325%0.25SS..Hα-helixtrans-65.5-36.3178.6-174.357.1175.4169.20.6112.3L211 R252 V253 A254 G260L211-R256 HydrophobicContact CB-CG 3.89Å; L211-R256 HydrophobicContact CD1-CB 4.39Å; L211-R256 HydrophobicContact CD1-CG 4.32Å; R252-R256 PolarHBondContact O-N 3.14Å; V253-R256 PolarHBondContact O-N 3.46Å; A254-R256 VanDerWaalsContact C-N 3.32Å; A254-R256 PolarHBondContact O-N 3.36Å; R256-G260 WeakPolarHBondContact O-CA 3.43Å; R256-G260 PolarHBondContact O-N 3.21Å
257I95.4Very high93.3Very high1 Ų149.6 Ų49.61%0.00524%0.24CC..Hα-helixtrans-79-37.4-178.4-69.2-59.8000113.1F196 L211 H214 I218 V253 A254 R255 V261F196-I257 HydrophobicContact CD1-CD1 4.21Å; F196-I257 HydrophobicContact CD1-CG1 4.2Å; F196-I257 HydrophobicContact CE1-CD1 3.34Å; F196-I257 HydrophobicContact CE1-CG1 3.6Å; F196-I257 HydrophobicContact CE2-CG1 4.31Å; F196-I257 HydrophobicContact CE2-CG2 4.41Å; F196-I257 HydrophobicContact CZ-CB 4.41Å; F196-I257 HydrophobicContact CZ-CD1 3.66Å; F196-I257 HydrophobicContact CZ-CG1 3.65Å; F196-I257 HydrophobicContact CZ-CG2 3.95Å; L211-I257 HydrophobicContact CB-CD1 4.02Å; L211-I257 HydrophobicContact CD1-CD1 4.11Å; L211-I257 HydrophobicContact CD1-CG1 4.14Å; L211-I257 HydrophobicContact CD2-CD1 4.29Å; L211-I257 HydrophobicContact CG-CD1 4.39Å; H214-I257 HydrophobicContact CB-CD1 3.65Å; I218-I257 HydrophobicContact CD1-CG2 3.29Å; V253-I257 HydrophobicContact CG1-CG1 4.47Å; V253-I257 WeakPolarHBondContact O-CG1 3.5Å; V253-I257 PolarHBondContact O-N 3.11Å; A254-I257 PolarHBondContact O-N 3.47Å; A254-I257 VanDerWaalsContact O-N 3.16Å; R255-I257 VanDerWaalsContact C-N 3.33Å; R255-I257 PolarHBondContact O-N 3.49Å; I257-V261 WeakPolarHBondContact O-CG1 3.34Å
258I95.1Very high93.3Very high4 Ų453.9 Ų53.92%0.02125%0.254CS..Hα-helixtrans-85.8-44.6-176.3-64.5166.8000110.8A254 V269 T273 L286 I287A254-I258 WeakPolarHBondContact O-CB 3.05Å; A254-I258 WeakPolarHBondContact O-CG1 3Å; A254-I258 PolarHBondContact O-N 2.89Å; I258-V269 HydrophobicContact CG2-CG1 4.24Å; I258-T273 HydrophobicContact CD1-CG2 4.32Å; I258-L286 HydrophobicContact CD1-CB 3.8Å; I258-L286 HydrophobicContact CD1-CD1 4.03Å; I258-L286 HydrophobicContact CD1-CD2 4.03Å; I258-L286 HydrophobicContact CD1-CG 4.16Å; I258-I287 HydrophobicContact CB-CG2 4.32Å; I258-I287 HydrophobicContact CG2-CG2 3.85Å
259I94.1Very high93.4Very high13 Ų1347.3 Ų47.37%0.06722%0.22CC..THydrogen-bonded Turntrans-95.7-32.4-176.1-56.6-54.4000112.3R255 V261 Q266 I287 A290 E294 L297R255-I259 WeakPolarHBondContact O-CB 3.29Å; R255-I259 PolarHBondContact O-N 3.03Å; I259-V261 PolarHBondContact O-N 3.29Å; I259-Q266 PolarHBondContact O-NE2 2.95Å; I259-Q266 VanDerWaalsContact O-NE2 3.08Å; I259-I287 HydrophobicContact CD1-CB 4.24Å; I259-I287 HydrophobicContact CD1-CG2 3.76Å; I259-I287 HydrophobicContact CG1-CB 3.97Å; I259-I287 HydrophobicContact CG1-CG2 3.73Å; I259-A290 HydrophobicContact CG1-CB 4.12Å; I259-A290 HydrophobicContact CG2-CB 4.34Å; I259-E294 HydrophobicContact CG2-CG 4.21Å; I259-L297 HydrophobicContact CD1-CD1 3.86Å; I259-L297 HydrophobicContact CD1-CD2 3.63Å; I259-L297 HydrophobicContact CD1-CG 4.36Å; I259-L297 HydrophobicContact CG1-CD2 4.14Å; I259-L297 HydrophobicContact CG2-CD2 4.34Å
260G92Very high93.5Very high22 Ų2245.1 Ų45.123%0.22721%0.208CC..SBendtrans-74.313.4-179.600000115S215 R255 R256S215-G260 VanDerWaalsContact CB-O 3.24Å; S215-G260 WeakPolarHBondContact CB-O 3.37Å; S215-G260 PolarHBondContact OG-O 3.28Å; R255-G260 PolarHBondContact O-N 2.95Å; R256-G260 WeakPolarHBondContact O-CA 3.43Å; R256-G260 PolarHBondContact O-N 3.21Å
261V94.7Very high93.3Very high5 Ų545.4 Ų45.43%0.0321%0.211CC..SBendtrans-75.6157.6171.2-530000110.5S215 I257 I259 Q266 V269S215-V261 WeakPolarHBondContact O-CG1 3.16Å; I257-V261 WeakPolarHBondContact O-CG1 3.34Å; I259-V261 PolarHBondContact O-N 3.29Å; V261-Q266 HydrophobicContact CG2-CB 4.21Å; V261-Q266 HydrophobicContact CG2-CG 3.55Å; V261-V269 HydrophobicContact CG1-CG1 4.41Å; V261-V269 HydrophobicContact CG1-CG2 4.19Å; V261-V269 HydrophobicContact CG2-CB 4.32Å; V261-V269 HydrophobicContact CG2-CG2 4.09Å
262P91.3Very high93.1Very high51 Ų5143.9 Ų43.933%0.33120%0.2SC..  trans-53.4144.7174.7-24.330.5000112.9L216 I264 S265 Q266L216-P262 HydrophobicContact CD1-CG 3.51Å; P262-I264 PolarHBondContact O-N 3.48Å; P262-I264 VanDerWaalsContact O-N 3.09Å; P262-S265 WeakPolarHBondContact CD-OG 3.19Å; P262-S265 WeakPolarHBondContact O-CA 3.25Å; P262-S265 PolarHBondContact O-N 2.88Å; P262-S265 PolarHBondContact O-OG 3.42Å; P262-Q266 PolarHBondContact O-N 3.37Å; P262-Q266 VanDerWaalsContact O-N 3.12Å
263E90.3Very high93.2Very high138 Ų13835.9 Ų35.965%0.64517%0.17SC*.Hα-helixtrans-54.4-35.7-175.8-65.5-172.8169.600113.9S265 Q266E263-S265 PolarHBondContact O-N 2.71Å; E263-Q266 PolarHBondContact O-N 3.33Å
264I88.4Confident93Very high151 Ų15136 Ų3677%0.77417%0.17SC*.Hα-helixtrans-63.3-31.3177.7-63.7172.9000111.3I223 P262I223-I264 HydrophobicContact CD1-CB 4.27Å; I223-I264 HydrophobicContact CD1-CG2 3.71Å; P262-I264 PolarHBondContact O-N 3.48Å; P262-I264 VanDerWaalsContact O-N 3.09Å
265S92.6Very high92.6Very high0 Ų040.6 Ų40.60%019%0.192CC..Hα-helixtrans-92.3-17.6179.245.20000114.6G219 P262 E263 E267 R268 V269G219-S265 WeakPolarHBondContact CA-OG 3.24Å; G219-S265 VanDerWaalsContact O-CB 3.27Å; G219-S265 WeakPolarHBondContact O-CB 3.45Å; P262-S265 WeakPolarHBondContact CD-OG 3.19Å; P262-S265 WeakPolarHBondContact O-CA 3.25Å; P262-S265 PolarHBondContact O-N 2.88Å; P262-S265 PolarHBondContact O-OG 3.42Å; E263-S265 PolarHBondContact O-N 2.71Å; S265-E267 VanDerWaalsContact C-N 3.32Å; S265-E267 PolarHBondContact O-N 3.46Å; S265-R268 PolarHBondContact O-N 2.98Å; S265-V269 WeakPolarHBondContact O-CG2 3.15Å; S265-V269 PolarHBondContact O-N 3.41Å
266Q93.3Very high92.3Very high23 Ų2339 Ų3911%0.10719%0.189CC..Hα-helixtrans-55.1-44.2-172.4-79.6-179.5-15.800113I259 V261 P262 E263 R268 L270 L300I259-Q266 PolarHBondContact O-NE2 2.95Å; I259-Q266 VanDerWaalsContact O-NE2 3.08Å; V261-Q266 HydrophobicContact CG2-CB 4.21Å; V261-Q266 HydrophobicContact CG2-CG 3.55Å; P262-Q266 PolarHBondContact O-N 3.37Å; P262-Q266 VanDerWaalsContact O-N 3.12Å; E263-Q266 PolarHBondContact O-N 3.33Å; Q266-R268 VanDerWaalsContact C-N 3.34Å; Q266-R268 PolarHBondContact O-N 2.99Å; Q266-L270 WeakPolarHBondContact O-CB 3.32Å; Q266-L270 PolarHBondContact O-N 3.11Å; Q266-L300 HydrophobicContact CB-CD1 4.34Å
267E91.5Very high92.2Very high23 Ų2333.5 Ų33.511%0.10717%0.169CC..Hα-helixtrans-60.6-44.5178.4179.1179165.200111.8S265 L270 L271 L300 K304 R309S265-E267 VanDerWaalsContact C-N 3.32Å; S265-E267 PolarHBondContact O-N 3.46Å; E267-L270 PolarHBondContact O-N 3.14Å; E267-L271 HydrophobicContact CG-CD1 4.09Å; E267-L271 WeakPolarHBondContact O-CB 3.12Å; E267-L271 VanDerWaalsContact O-CG 3.27Å; E267-L271 WeakPolarHBondContact O-CG 3.44Å; E267-L271 PolarHBondContact O-N 3.49Å; E267-L300 HydrophobicContact CB-CD1 4.25Å; E267-L300 HydrophobicContact CB-CD2 3.95Å; E267-L300 HydrophobicContact CG-CD2 4.06Å; E267-K304 VanDerWaalsContact CD-NZ 3.26Å; E267-K304 WeakPolarHBondContact OE1-CE 3.36Å; E267-K304 IonicContact OE1-NZ 3.63Å; E267-K304 PolarHBondContact OE1-NZ 3.43Å; E267-K304 VanDerWaalsContact OE1-NZ 3.13Å; E267-K304 WeakPolarHBondContact OE2-CE 3.16Å; E267-K304 IonicContact OE2-NZ 3.66Å; E267-K304 PolarHBondContact OE2-NZ 3.05Å; E267-R309 IonicContact OE1-CZ 3.58Å; E267-R309 IonicContact OE1-NE 2.87Å; E267-R309 PolarHBondContact OE1-NE 2.91Å; E267-R309 IonicContact OE1-NH2 2.77Å; E267-R309 PolarHBondContact OE1-NH2 3.47Å
268R90.8Very high91.6Very high98 Ų9839 Ų3937%0.3720%0.202SC..Hα-helixtrans-69.3-44.6-177-178.463.5-160.7-162.79.5111.7S222 S265 Q266 L270 L271 D272S222-R268 WeakPolarHBondContact O-CG 3.11Å; S265-R268 PolarHBondContact O-N 2.98Å; Q266-R268 VanDerWaalsContact C-N 3.34Å; Q266-R268 PolarHBondContact O-N 2.99Å; R268-L270 VanDerWaalsContact C-N 3.29Å; R268-L270 PolarHBondContact O-N 2.91Å; R268-L271 PolarHBondContact O-N 3.05Å; R268-D272 IonicContact CZ-OD1 2.75Å; R268-D272 VanDerWaalsContact CZ-OD1 3.31Å; R268-D272 IonicContact CZ-OD2 3.83Å; R268-D272 IonicContact NE-OD1 2.63Å; R268-D272 PolarHBondContact NE-OD1 3.22Å; R268-D272 IonicContact NE-OD2 3.02Å; R268-D272 PolarHBondContact NE-OD2 3.08Å; R268-D272 IonicContact NH2-OD1 3.34Å; R268-D272 PolarHBondContact NH2-OD1 2.87Å; R268-D272 IonicContact NH2-OD2 3.91Å; R268-D272 PolarHBondContact O-N 3.1Å
269V95.2Very high91.4Very high0 Ų041.2 Ų41.20%022%0.217CC..Hα-helixtrans-60.8-41.5176.3173.90000110.7I218 S222 L231 I258 V261 S265 T273I218-V269 HydrophobicContact CG2-CG1 4.49Å; I218-V269 HydrophobicContact CG2-CG2 4.27Å; S222-V269 VanDerWaalsContact OG-CG2 3.31Å; S222-V269 WeakPolarHBondContact OG-CG2 3.14Å; L231-V269 HydrophobicContact CD1-CG1 4.33Å; I258-V269 HydrophobicContact CG2-CG1 4.24Å; V261-V269 HydrophobicContact CG1-CG1 4.41Å; V261-V269 HydrophobicContact CG1-CG2 4.19Å; V261-V269 HydrophobicContact CG2-CB 4.32Å; V261-V269 HydrophobicContact CG2-CG2 4.09Å; S265-V269 WeakPolarHBondContact O-CG2 3.15Å; S265-V269 PolarHBondContact O-N 3.41Å; V269-T273 WeakPolarHBondContact O-CB 3.35Å; V269-T273 PolarHBondContact O-N 3.5Å; V269-T273 PolarHBondContact O-OG1 3.29Å
270L94.1Very high91.3Very high4 Ų440.7 Ų40.72%0.02121%0.214CC..Hα-helixtrans-65.9-42.4177.7-176.863000112.2Q266 E267 R268 T273 L274 L297 L300 L301 L305Q266-L270 WeakPolarHBondContact O-CB 3.32Å; Q266-L270 PolarHBondContact O-N 3.11Å; E267-L270 PolarHBondContact O-N 3.14Å; R268-L270 VanDerWaalsContact C-N 3.29Å; R268-L270 PolarHBondContact O-N 2.91Å; L270-T273 PolarHBondContact O-N 3.16Å; L270-L274 HydrophobicContact CD1-CD1 4.27Å; L270-L274 HydrophobicContact CD1-CG 4.36Å; L270-L274 HydrophobicContact CG-CD1 3.97Å; L270-L274 HydrophobicContact CG-CG 4.49Å; L270-L274 WeakPolarHBondContact O-CB 3.31Å; L270-L274 WeakPolarHBondContact O-CG 3.4Å; L270-L274 PolarHBondContact O-N 3.31Å; L270-L297 HydrophobicContact CD1-CD1 4.38Å; L270-L297 HydrophobicContact CD2-CD1 3.73Å; L270-L300 HydrophobicContact CD2-CB 4.06Å; L270-L300 HydrophobicContact CD2-CD1 4.26Å; L270-L301 HydrophobicContact CD1-CD2 4.35Å; L270-L301 HydrophobicContact CD2-CD2 3.87Å; L270-L301 HydrophobicContact CD2-CG 4.12Å; L270-L301 HydrophobicContact CG-CD2 4.49Å; L270-L305 HydrophobicContact CD2-CD1 3.93Å; L270-L305 HydrophobicContact CG-CD1 4.33Å
271L91Very high91.4Very high17 Ų1743 Ų439%0.08922%0.221CC..Hα-helixtrans-59.9-52.2175-76.4170.8000111.5E267 R268 T273 L274 E275 L305 F311E267-L271 HydrophobicContact CG-CD1 4.09Å; E267-L271 WeakPolarHBondContact O-CB 3.12Å; E267-L271 VanDerWaalsContact O-CG 3.27Å; E267-L271 WeakPolarHBondContact O-CG 3.44Å; E267-L271 PolarHBondContact O-N 3.49Å; R268-L271 PolarHBondContact O-N 3.05Å; L271-T273 PolarHBondContact O-N 3.38Å; L271-L274 PolarHBondContact O-N 2.81Å; L271-L274 VanDerWaalsContact O-N 3.16Å; L271-E275 PolarHBondContact O-N 2.98Å; L271-L305 HydrophobicContact CD2-CD2 3.52Å; L271-L305 HydrophobicContact CG-CD2 4.19Å; L271-F311 HydrophobicContact CD2-CE1 3.75Å; L271-F311 HydrophobicContact CD2-CZ 3.52Å
272D90.5Very high91.4Very high0 Ų043 Ų430%022%0.222CC..Hα-helixtrans-61.1-32178.8-70-35.4000111.2L231 R268 L276L231-D272 HydrophobicContact CD1-CB 3.63Å; R268-D272 IonicContact CZ-OD1 2.75Å; R268-D272 VanDerWaalsContact CZ-OD1 3.31Å; R268-D272 IonicContact CZ-OD2 3.83Å; R268-D272 IonicContact NE-OD1 2.63Å; R268-D272 PolarHBondContact NE-OD1 3.22Å; R268-D272 IonicContact NE-OD2 3.02Å; R268-D272 PolarHBondContact NE-OD2 3.08Å; R268-D272 IonicContact NH2-OD1 3.34Å; R268-D272 PolarHBondContact NH2-OD1 2.87Å; R268-D272 IonicContact NH2-OD2 3.91Å; R268-D272 PolarHBondContact O-N 3.1Å; D272-L276 WeakPolarHBondContact O-CD1 3.33Å; D272-L276 VanDerWaalsContact O-CG 3.3Å; D272-L276 WeakPolarHBondContact O-CG 3.42Å
273T94.5Very high91.6Very high0 Ų040.6 Ų40.60%021%0.206CC..Hα-helixtrans-71.7-44.6174.6-56.50000112V235 I258 V269 L270 L271 E275 L276 V277 L286V235-T273 HydrophobicContact CG1-CG2 4.41Å; V235-T273 HydrophobicContact CG2-CG2 4.39Å; I258-T273 HydrophobicContact CD1-CG2 4.32Å; V269-T273 WeakPolarHBondContact O-CB 3.35Å; V269-T273 PolarHBondContact O-N 3.5Å; V269-T273 PolarHBondContact O-OG1 3.29Å; L270-T273 PolarHBondContact O-N 3.16Å; L271-T273 PolarHBondContact O-N 3.38Å; T273-E275 VanDerWaalsContact C-N 3.29Å; T273-E275 PolarHBondContact O-N 3.32Å; T273-L276 PolarHBondContact O-N 3.27Å; T273-V277 HydrophobicContact CG2-CG2 4Å; T273-V277 VanDerWaalsContact O-CG2 3.26Å; T273-V277 WeakPolarHBondContact O-CG2 3.01Å; T273-V277 PolarHBondContact O-N 3.46Å; T273-L286 HydrophobicContact CG2-CD1 4.05Å
274L92.1Very high91.9Very high4 Ų438.4 Ų38.42%0.02119%0.192CC..Hα-helixtrans-65.4-31.1-179.7-77.2166.8000112.7L270 L271 L276 L283 L301 L305 V316 T319 I320L270-L274 HydrophobicContact CD1-CD1 4.27Å; L270-L274 HydrophobicContact CD1-CG 4.36Å; L270-L274 HydrophobicContact CG-CD1 3.97Å; L270-L274 HydrophobicContact CG-CG 4.49Å; L270-L274 WeakPolarHBondContact O-CB 3.31Å; L270-L274 WeakPolarHBondContact O-CG 3.4Å; L270-L274 PolarHBondContact O-N 3.31Å; L271-L274 PolarHBondContact O-N 2.81Å; L271-L274 VanDerWaalsContact O-N 3.16Å; L274-L276 PolarHBondContact O-N 3.3Å; L274-L283 HydrophobicContact CD2-CD1 4.39Å; L274-L283 HydrophobicContact CD2-CD2 3.79Å; L274-L301 HydrophobicContact CD1-CD2 4.5Å; L274-L305 HydrophobicContact CD1-CD1 3.47Å; L274-L305 VanDerWaalsContact CD1-CD1 3.47Å; L274-V316 HydrophobicContact CB-CG1 4.33Å; L274-V316 HydrophobicContact CD1-CG1 4.13Å; L274-T319 HydrophobicContact CD2-CG2 3.93Å; L274-I320 HydrophobicContact CD1-CD1 4.29Å; L274-I320 HydrophobicContact CD1-CG1 4.45Å; L274-I320 HydrophobicContact CD2-CG1 4.22Å
275E87.8Confident92.2Very high97 Ų9733.4 Ų33.445%0.45316%0.164SC..Hα-helixtrans-67.3-24172.4-73.1-177.9-165.200113K228 L271 T273K228-E275 VanDerWaalsContact CE-OE2 3.26Å; K228-E275 WeakPolarHBondContact CE-OE2 3.26Å; K228-E275 IonicContact NZ-OE2 3.36Å; K228-E275 PolarHBondContact NZ-OE2 3.11Å; L271-E275 PolarHBondContact O-N 2.98Å; T273-E275 VanDerWaalsContact C-N 3.29Å; T273-E275 PolarHBondContact O-N 3.32Å
276L90Very high92.4Very high48 Ų4833.4 Ų33.425%0.25116%0.164SC..Hα-helixtrans-96.4-16.1-179.4-63170.8000113L231 R232 V235 D272 T273 L274L231-L276 VanDerWaalsContact C-CD1 3.45Å; L231-L276 HydrophobicContact CB-CD1 4.02Å; L231-L276 WeakPolarHBondContact O-CD1 3.35Å; R232-L276 HydrophobicContact CG-CD1 4.46Å; R232-L276 HydrophobicContact CG-CD2 3.8Å; V235-L276 HydrophobicContact CB-CD1 4.04Å; V235-L276 HydrophobicContact CG1-CB 4.18Å; V235-L276 HydrophobicContact CG2-CD1 4.16Å; D272-L276 WeakPolarHBondContact O-CD1 3.33Å; D272-L276 VanDerWaalsContact O-CG 3.3Å; D272-L276 WeakPolarHBondContact O-CG 3.42Å; T273-L276 PolarHBondContact O-N 3.27Å; L274-L276 PolarHBondContact O-N 3.3Å
277V91.6Very high92.5Very high5 Ų532.3 Ų32.33%0.0316%0.159CC..  trans-102.5120.4-176175.70000110.3V235 L239 T273 T279 L283 L286 T319V235-V277 HydrophobicContact CG1-CG2 4.13Å; L239-V277 HydrophobicContact CD1-CG2 4.32Å; T273-V277 HydrophobicContact CG2-CG2 4Å; T273-V277 VanDerWaalsContact O-CG2 3.26Å; T273-V277 WeakPolarHBondContact O-CG2 3.01Å; T273-V277 PolarHBondContact O-N 3.46Å; V277-T279 WeakPolarHBondContact CG1-O 3.12Å; V277-L283 HydrophobicContact CG1-CB 4.15Å; V277-L286 HydrophobicContact CG2-CD1 3.81Å; V277-T319 HydrophobicContact CG1-CG2 4.1Å
278T82.2Confident92.6Very high115 Ų11532 Ų3271%0.70616%0.162SC*.  trans-89.2-17.7-176.353.70000114.5
279T90.9Very high92.7Very high52 Ų5231.2 Ų31.232%0.31917%0.165SC..SBendtrans-138.4150-174.9660000113.1V277 D281 S282 L283V277-T279 WeakPolarHBondContact CG1-O 3.12Å; T279-D281 VanDerWaalsContact C-N 3.28Å; T279-D281 PolarHBondContact O-N 3.18Å; T279-S282 WeakPolarHBondContact O-CB 3.18Å; T279-S282 PolarHBondContact O-N 3.02Å; T279-S282 VanDerWaalsContact O-N 3.16Å; T279-S282 WeakPolarHBondContact OG1-CB 3.45Å; T279-S282 PolarHBondContact OG1-N 3.06Å; T279-S282 PolarHBondContact OG1-OG 3.29Å; T279-L283 PolarHBondContact O-N 2.9Å; T279-L283 VanDerWaalsContact O-N 3.17Å
280G92.6Very high92.7Very high2 Ų231.2 Ų31.22%0.02117%0.165CC..Hα-helixtrans-62.5-31.4176.700000113.8S282 L283 Y284 T319G280-S282 VanDerWaalsContact C-N 3.32Å; G280-S282 PolarHBondContact O-N 3.19Å; G280-L283 PolarHBondContact O-N 3.38Å; G280-Y284 PolarHBondContact O-N 3.45Å; G280-T319 WeakPolarHBondContact CA-O 3.26Å
281D93.8Very high92.7Very high69 Ų6931 Ų3137%0.36916%0.164SC..Hα-helixtrans-63.8-38.4174.4-57.8-90.8000112.1T279 Y284 R285 K322 M326T279-D281 VanDerWaalsContact C-N 3.28Å; T279-D281 PolarHBondContact O-N 3.18Å; D281-Y284 PolarHBondContact O-N 3.41Å; D281-R285 WeakPolarHBondContact O-CG 3.32Å; D281-R285 PolarHBondContact O-N 2.83Å; D281-K322 VanDerWaalsContact OD2-CE 3.23Å; D281-K322 WeakPolarHBondContact OD2-CE 3.34Å; D281-M326 HydrophobicContact CB-CE 4.25Å; D281-M326 HydrophobicContact CB-SD 4.35Å; D281-M326 WeakPolarHBondContact OD1-CE 3.48Å
282S95.2Very high92.8Very high6 Ų632.4 Ų32.44%0.04217%0.173CC..Hα-helixtrans-67.8-39.2175.3-65.40000111.1L239 T279 G280 R285 L286L239-S282 WeakPolarHBondContact CD2-O 3.37Å; T279-S282 WeakPolarHBondContact O-CB 3.18Å; T279-S282 PolarHBondContact O-N 3.02Å; T279-S282 VanDerWaalsContact O-N 3.16Å; T279-S282 WeakPolarHBondContact OG1-CB 3.45Å; T279-S282 PolarHBondContact OG1-N 3.06Å; T279-S282 PolarHBondContact OG1-OG 3.29Å; G280-S282 VanDerWaalsContact C-N 3.32Å; G280-S282 PolarHBondContact O-N 3.19Å; S282-R285 PolarHBondContact O-N 3.45Å; S282-R285 PolarHBondContact OG-NH2 3.3Å; S282-L286 WeakPolarHBondContact O-CG 3.03Å; S282-L286 PolarHBondContact O-N 3.42Å
283L96.3Very high92.7Very high0 Ų036.1 Ų36.10%020%0.196CC..Hα-helixtrans-63.3-45.3172.2-174.460.3000110.9L274 V277 T279 G280 R285 L286 I287 T319 Y323L274-L283 HydrophobicContact CD2-CD1 4.39Å; L274-L283 HydrophobicContact CD2-CD2 3.79Å; V277-L283 HydrophobicContact CG1-CB 4.15Å; T279-L283 PolarHBondContact O-N 2.9Å; T279-L283 VanDerWaalsContact O-N 3.17Å; G280-L283 PolarHBondContact O-N 3.38Å; L283-R285 VanDerWaalsContact C-N 3.33Å; L283-R285 PolarHBondContact O-N 3.39Å; L283-L286 PolarHBondContact O-N 3.35Å; L283-I287 HydrophobicContact CD1-CD1 3.79Å; L283-I287 HydrophobicContact CD1-CG1 4Å; L283-I287 HydrophobicContact CD1-CG2 4.41Å; L283-I287 HydrophobicContact CD2-CD1 4.3Å; L283-I287 HydrophobicContact CG-CD1 3.83Å; L283-I287 HydrophobicContact CG-CG1 4.04Å; L283-I287 VanDerWaalsContact O-CG1 3.32Å; L283-I287 WeakPolarHBondContact O-CG1 3.4Å; L283-I287 PolarHBondContact O-N 3.14Å; L283-T319 HydrophobicContact CB-CG2 4.03Å; L283-T319 HydrophobicContact CD2-CG2 4.02Å; L283-Y323 HydrophobicContact CB-CD2 4.28Å; L283-Y323 HydrophobicContact CB-CG 4.48Å; L283-Y323 HydrophobicContact CD2-CD1 4.07Å; L283-Y323 HydrophobicContact CD2-CD2 4.19Å; L283-Y323 HydrophobicContact CD2-CG 3.74Å; L283-Y323 HydrophobicContact CG-CD2 3.98Å; L283-Y323 HydrophobicContact CG-CG 4.06Å
284Y95.6Very high92.6Very high92 Ų9240 Ų4036%0.36121%0.214SC..Hα-helixtrans-57.8-42.8177.5-176-96.4000112.4G280 D281 L286 G288 Y323 M326G280-Y284 PolarHBondContact O-N 3.45Å; D281-Y284 PolarHBondContact O-N 3.41Å; Y284-L286 PolarHBondContact O-N 3.34Å; Y284-G288 WeakPolarHBondContact O-CA 3.22Å; Y284-G288 PolarHBondContact O-N 2.93Å; Y284-Y323 HydrophobicContact CD2-CD2 4.27Å; Y284-Y323 HydrophobicContact CD2-CE2 4.05Å; Y284-M326 HydrophobicContact CD1-CE 3.97Å; Y284-M326 HydrophobicContact CD2-CB 4.16Å; Y284-M326 HydrophobicContact CG-CE 3.89Å; Y284-M326 HydrophobicContact CG-SD 4.39Å
285R94.8Very high92.6Very high46 Ų4648.9 Ų48.917%0.17425%0.253CS..Hα-helixtrans-62.6-28.4176.4-74-175.4-64.8143.7-5.8113.7L239 T242 S251 D281 S282 L283L239-R285 PolarHBondContact O-NH1 3.49Å; T242-R285 HydrophobicContact CG2-CB 4.38Å; T242-R285 PolarHBondContact OG1-NH1 3.48Å; S251-R285 WeakPolarHBondContact CB-O 3.13Å; S251-R285 PolarHBondContact OG-O 3.29Å; D281-R285 WeakPolarHBondContact O-CG 3.32Å; D281-R285 PolarHBondContact O-N 2.83Å; S282-R285 PolarHBondContact O-N 3.45Å; S282-R285 PolarHBondContact OG-NH2 3.3Å; L283-R285 VanDerWaalsContact C-N 3.33Å; L283-R285 PolarHBondContact O-N 3.39Å
286L96.4Very high92.8Very high0 Ų048.1 Ų48.10%025%0.246CC..Hα-helixtrans-85.6-42.5-179.7-69.9176.2000113.2V235 L238 L239 A254 R255 I258 T273 V277 S282 L283 Y284V235-L286 HydrophobicContact CG1-CD1 3.92Å; L238-L286 HydrophobicContact CB-CD2 3.9Å; L239-L286 HydrophobicContact CD1-CD1 4.46Å; L239-L286 HydrophobicContact CD2-CD1 3.78Å; L239-L286 HydrophobicContact CD2-CD2 3.93Å; L239-L286 HydrophobicContact CD2-CG 3.63Å; L239-L286 HydrophobicContact CG-CD1 4.03Å; L239-L286 HydrophobicContact CG-CD2 4.12Å; L239-L286 HydrophobicContact CG-CG 4.2Å; A254-L286 CarbonylContact C-O 3.56Å; A254-L286 HydrophobicContact CB-CD2 3.76Å; R255-L286 WeakPolarHBondContact CA-O 3.27Å; R255-L286 PolarHBondContact N-O 2.71Å; I258-L286 HydrophobicContact CD1-CB 3.8Å; I258-L286 HydrophobicContact CD1-CD1 4.03Å; I258-L286 HydrophobicContact CD1-CD2 4.03Å; I258-L286 HydrophobicContact CD1-CG 4.16Å; T273-L286 HydrophobicContact CG2-CD1 4.05Å; V277-L286 HydrophobicContact CG2-CD1 3.81Å; S282-L286 WeakPolarHBondContact O-CG 3.03Å; S282-L286 PolarHBondContact O-N 3.42Å; L283-L286 PolarHBondContact O-N 3.35Å; Y284-L286 PolarHBondContact O-N 3.34Å
287I95.9Very high93Very high0 Ų046 Ų460%024%0.235CC..Hα-helixtrans-115-10.3-171.565.8166.9000114.3R255 I258 I259 L283 A290 L297 L301 Y323R255-I287 WeakPolarHBondContact CD-O 3.37Å; R255-I287 PolarHBondContact NE-O 3.14Å; I258-I287 HydrophobicContact CB-CG2 4.32Å; I258-I287 HydrophobicContact CG2-CG2 3.85Å; I259-I287 HydrophobicContact CD1-CB 4.24Å; I259-I287 HydrophobicContact CD1-CG2 3.76Å; I259-I287 HydrophobicContact CG1-CB 3.97Å; I259-I287 HydrophobicContact CG1-CG2 3.73Å; L283-I287 HydrophobicContact CD1-CD1 3.79Å; L283-I287 HydrophobicContact CD1-CG1 4Å; L283-I287 HydrophobicContact CD1-CG2 4.41Å; L283-I287 HydrophobicContact CD2-CD1 4.3Å; L283-I287 HydrophobicContact CG-CD1 3.83Å; L283-I287 HydrophobicContact CG-CG1 4.04Å; L283-I287 VanDerWaalsContact O-CG1 3.32Å; L283-I287 WeakPolarHBondContact O-CG1 3.4Å; L283-I287 PolarHBondContact O-N 3.14Å; I287-A290 HydrophobicContact CB-CB 4.48Å; I287-A290 WeakPolarHBondContact O-CB 3.49Å; I287-A290 PolarHBondContact O-N 3.06Å; I287-L297 HydrophobicContact CD1-CD2 4.36Å; I287-L301 HydrophobicContact CD1-CD1 4.26Å; I287-Y323 HydrophobicContact CD1-CD2 4.49Å; I287-Y323 HydrophobicContact CD1-CE1 3.91Å; I287-Y323 HydrophobicContact CD1-CE2 3.78Å; I287-Y323 VanDerWaalsContact CD1-CZ 3.45Å; I287-Y323 WeakPolarHBondContact CD1-OH 3.43Å; I287-Y323 HydrophobicContact CG1-CD2 4.47Å; I287-Y323 HydrophobicContact CG1-CE2 3.65Å
288G93.8Very high93.1Very high18 Ų1850.2 Ų50.219%0.18625%0.252CS..THydrogen-bonded Turntrans57.2-136.6178.600000113Y284 A290 Y323 Q327Y284-G288 WeakPolarHBondContact O-CA 3.22Å; Y284-G288 PolarHBondContact O-N 2.93Å; G288-A290 PolarHBondContact O-N 3.41Å; G288-Y323 WeakPolarHBondContact O-CE2 3.5Å; G288-Y323 PolarHBondContact O-OH 3.45Å; G288-Q327 PolarHBondContact O-NE2 3.4Å
289D93.5Very high93.7Very high81 Ų8148.4 Ų48.443%0.43324%0.238SC..THydrogen-bonded Turntrans-86.318.6177.668.6-19000113.7V291 V292 T293D289-V291 PolarHBondContact O-N 3.05Å; D289-V291 VanDerWaalsContact O-N 3.07Å; D289-V292 WeakPolarHBondContact O-CB 3.3Å; D289-V292 PolarHBondContact O-N 3.43Å; D289-T293 PolarHBondContact O-N 3.01Å; D289-T293 PolarHBondContact O-OG1 3.38Å
290A93.4Very high93.8Very high0 Ų046 Ų460%022%0.223CC..Hα-helixtrans-55.2-31.6-177.500000113I259 I287 G288 V292 T293 E294 L297I259-A290 HydrophobicContact CG1-CB 4.12Å; I259-A290 HydrophobicContact CG2-CB 4.34Å; I287-A290 HydrophobicContact CB-CB 4.48Å; I287-A290 WeakPolarHBondContact O-CB 3.49Å; I287-A290 PolarHBondContact O-N 3.06Å; G288-A290 PolarHBondContact O-N 3.41Å; A290-V292 PolarHBondContact O-N 3.41Å; A290-T293 WeakPolarHBondContact CA-OG1 3.37Å; A290-T293 PolarHBondContact O-N 3.31Å; A290-T293 PolarHBondContact O-OG1 2.97Å; A290-E294 VanDerWaalsContact O-CB 3.29Å; A290-E294 WeakPolarHBondContact O-CB 3.18Å; A290-E294 PolarHBondContact O-N 3.4Å; A290-L297 HydrophobicContact CB-CD2 3.41Å; A290-L297 VanDerWaalsContact CB-CD2 3.41Å
291V94.7Very high93.9Very high0 Ų045.9 Ų45.90%022%0.222CC..Hα-helixtrans-64-26.8179.370.80000113.4D289 K298 L301 Y323 L324 Q327 M335D289-V291 PolarHBondContact O-N 3.05Å; D289-V291 VanDerWaalsContact O-N 3.07Å; V291-K298 HydrophobicContact CG2-CB 4.39Å; V291-K298 WeakPolarHBondContact O-CB 3.49Å; V291-L301 HydrophobicContact CB-CD1 4.17Å; V291-L301 HydrophobicContact CG2-CB 4.43Å; V291-L301 HydrophobicContact CG2-CD1 3.87Å; V291-Y323 HydrophobicContact CB-CE1 3.75Å; V291-Y323 WeakPolarHBondContact CB-OH 3.47Å; V291-Y323 HydrophobicContact CG1-CE1 3.62Å; V291-Y323 VanDerWaalsContact CG1-OH 3.3Å; V291-Y323 WeakPolarHBondContact CG1-OH 3.3Å; V291-Y323 HydrophobicContact CG2-CE1 4.31Å; V291-Y323 PolarHBondContact N-OH 2.97Å; V291-L324 HydrophobicContact CG1-CD2 4.4Å; V291-L324 HydrophobicContact CG2-CD2 4.03Å; V291-Q327 HydrophobicContact CG1-CG 3.7Å; V291-M335 HydrophobicContact CG1-CE 4.04Å; V291-M335 HydrophobicContact CG2-SD 3.99Å
292V92.7Very high93.9Very high45 Ų4543.3 Ų43.327%0.27321%0.209SC..Hα-helixtrans-78-42.3177.3172.30000110.5D289 A290 E331 M335D289-V292 WeakPolarHBondContact O-CB 3.3Å; D289-V292 PolarHBondContact O-N 3.43Å; A290-V292 PolarHBondContact O-N 3.41Å; V292-E331 WeakPolarHBondContact CG1-OE2 3.29Å; V292-E331 VanDerWaalsContact CG2-OE2 3.28Å; V292-E331 WeakPolarHBondContact CG2-OE2 3.24Å; V292-M335 HydrophobicContact CG2-CE 4.44Å
293T90.1Very high93.7Very high78 Ų7846.9 Ų46.948%0.47922%0.224SC..Hα-helixtrans-84.9-36-171.645.30000112.9R255 D289 A290R255-T293 PolarHBondContact NH2-OG1 3.29Å; R255-T293 VanDerWaalsContact NH2-OG1 3.09Å; D289-T293 PolarHBondContact O-N 3.01Å; D289-T293 PolarHBondContact O-OG1 3.38Å; A290-T293 WeakPolarHBondContact CA-OG1 3.37Å; A290-T293 PolarHBondContact O-N 3.31Å; A290-T293 PolarHBondContact O-OG1 2.97Å
294E91.2Very high93.3Very high83 Ų8349.8 Ų49.839%0.38824%0.237SC..  trans-101.3108.5-173.6-65.7-67.3165.600112.1I259 A290 R296 L297 K298I259-E294 HydrophobicContact CG2-CG 4.21Å; A290-E294 VanDerWaalsContact O-CB 3.29Å; A290-E294 WeakPolarHBondContact O-CB 3.18Å; A290-E294 PolarHBondContact O-N 3.4Å; E294-R296 VanDerWaalsContact C-N 3.29Å; E294-R296 PolarHBondContact O-N 2.84Å; E294-L297 HydrophobicContact CB-CB 3.89Å; E294-L297 PolarHBondContact O-N 3.22Å; E294-K298 PolarHBondContact O-N 3.1Å
295K92.3Very high93.1Very high190 Ų19045.5 Ų45.583%0.82622%0.22SC*.Hα-helixtrans-56.4-40.1-178.2-66.8-177.9-178.3178.20113.3K298 L299K295-K298 WeakPolarHBondContact O-CB 3.33Å; K295-L299 PolarHBondContact O-N 3.49Å; K295-L299 VanDerWaalsContact O-N 3.11Å
296R91.8Very high93Very high80 Ų8043.3 Ų43.330%0.30221%0.211SC..Hα-helixtrans-67.7-44.2-178.8-179.660.3176.4158.33.6111.3E294 K298 L299 L300E294-R296 VanDerWaalsContact C-N 3.29Å; E294-R296 PolarHBondContact O-N 2.84Å; R296-K298 VanDerWaalsContact C-N 3.34Å; R296-L299 PolarHBondContact O-N 3.4Å; R296-L300 HydrophobicContact CG-CD1 4.48Å; R296-L300 WeakPolarHBondContact O-CG 3.48Å; R296-L300 PolarHBondContact O-N 3.23Å
297L93.9Very high92.6Very high4 Ų444.8 Ų44.82%0.02122%0.218CC..Hα-helixtrans-63.8-41.7177.5-177.760.8000111.3I259 L270 I287 A290 E294 L299 L300 L301I259-L297 HydrophobicContact CD1-CD1 3.86Å; I259-L297 HydrophobicContact CD1-CD2 3.63Å; I259-L297 HydrophobicContact CD1-CG 4.36Å; I259-L297 HydrophobicContact CG1-CD2 4.14Å; I259-L297 HydrophobicContact CG2-CD2 4.34Å; L270-L297 HydrophobicContact CD1-CD1 4.38Å; L270-L297 HydrophobicContact CD2-CD1 3.73Å; I287-L297 HydrophobicContact CD1-CD2 4.36Å; A290-L297 HydrophobicContact CB-CD2 3.41Å; A290-L297 VanDerWaalsContact CB-CD2 3.41Å; E294-L297 HydrophobicContact CB-CB 3.89Å; E294-L297 PolarHBondContact O-N 3.22Å; L297-L299 PolarHBondContact O-N 3.17Å; L297-L300 PolarHBondContact O-N 3.38Å; L297-L301 HydrophobicContact CD1-CD1 3.83Å; L297-L301 HydrophobicContact CD1-CG 4.05Å; L297-L301 HydrophobicContact CG-CD1 3.91Å; L297-L301 HydrophobicContact CG-CG 4.46Å; L297-L301 PolarHBondContact O-N 3.45Å
298K94.8Very high92Very high93 Ų9349.6 Ų49.640%0.40425%0.247SC..Hα-helixtrans-52.8-52.7171.9-169.2170.9179.1168.80111.3V291 E294 K295 R296 L300 L301 T302 M335V291-K298 HydrophobicContact CG2-CB 4.39Å; V291-K298 WeakPolarHBondContact O-CB 3.49Å; E294-K298 PolarHBondContact O-N 3.1Å; K295-K298 WeakPolarHBondContact O-CB 3.33Å; R296-K298 VanDerWaalsContact C-N 3.34Å; K298-L300 VanDerWaalsContact C-N 3.31Å; K298-L300 PolarHBondContact O-N 3.01Å; K298-L301 PolarHBondContact O-N 3.47Å; K298-T302 HydrophobicContact CG-CG2 4.34Å; K298-T302 WeakPolarHBondContact O-CB 3.31Å; K298-T302 WeakPolarHBondContact O-CG2 3.41Å; K298-T302 PolarHBondContact O-N 3.49Å; K298-T302 PolarHBondContact O-OG1 3.07Å; K298-M335 HydrophobicContact CD-SD 4.19Å; K298-M335 HydrophobicContact CG-SD 4.07Å
299L93.2Very high91.5Very high78 Ų7853.9 Ų53.941%0.40826%0.258SS..Hα-helixtrans-59.5-39.3178.5-175.173000113K295 R296 L297 K303 K304K295-L299 PolarHBondContact O-N 3.49Å; K295-L299 VanDerWaalsContact O-N 3.11Å; R296-L299 PolarHBondContact O-N 3.4Å; L297-L299 PolarHBondContact O-N 3.17Å; L299-K303 HydrophobicContact CD1-CB 4.2Å; L299-K303 HydrophobicContact CD1-CD 3.74Å; L299-K303 HydrophobicContact CD1-CG 4.12Å; L299-K303 WeakPolarHBondContact O-CB 3.47Å; L299-K303 PolarHBondContact O-N 3.18Å; L299-K303 VanDerWaalsContact O-N 3.1Å; L299-K304 PolarHBondContact O-N 3.4Å
300L93.8Very high91Very high0 Ų053.1 Ų53.10%026%0.258CS..Iπ-helixtrans-64.6-53.4178.5-70.2173.7000111Q266 E267 L270 R296 L297 K298 K304 L305Q266-L300 HydrophobicContact CB-CD1 4.34Å; E267-L300 HydrophobicContact CB-CD1 4.25Å; E267-L300 HydrophobicContact CB-CD2 3.95Å; E267-L300 HydrophobicContact CG-CD2 4.06Å; L270-L300 HydrophobicContact CD2-CB 4.06Å; L270-L300 HydrophobicContact CD2-CD1 4.26Å; R296-L300 HydrophobicContact CG-CD1 4.48Å; R296-L300 WeakPolarHBondContact O-CG 3.48Å; R296-L300 PolarHBondContact O-N 3.23Å; L297-L300 PolarHBondContact O-N 3.38Å; K298-L300 VanDerWaalsContact C-N 3.31Å; K298-L300 PolarHBondContact O-N 3.01Å; L300-K304 HydrophobicContact CD2-CB 4.21Å; L300-K304 HydrophobicContact CD2-CD 3.93Å; L300-K304 PolarHBondContact O-N 3.29Å; L300-L305 WeakPolarHBondContact O-CB 3.38Å; L300-L305 VanDerWaalsContact O-CG 3.31Å; L300-L305 WeakPolarHBondContact O-CG 3.41Å; L300-L305 PolarHBondContact O-N 3.42Å
301L95Very high90.6Very high0 Ų054.8 Ų54.80%027%0.265CS..Iπ-helixtrans-72.9-33.1-174.6-70.6174.4000113.6L270 L274 I287 V291 L297 K298 L305 L306 I320 Y323L270-L301 HydrophobicContact CD1-CD2 4.35Å; L270-L301 HydrophobicContact CD2-CD2 3.87Å; L270-L301 HydrophobicContact CD2-CG 4.12Å; L270-L301 HydrophobicContact CG-CD2 4.49Å; L274-L301 HydrophobicContact CD1-CD2 4.5Å; I287-L301 HydrophobicContact CD1-CD1 4.26Å; V291-L301 HydrophobicContact CB-CD1 4.17Å; V291-L301 HydrophobicContact CG2-CB 4.43Å; V291-L301 HydrophobicContact CG2-CD1 3.87Å; L297-L301 HydrophobicContact CD1-CD1 3.83Å; L297-L301 HydrophobicContact CD1-CG 4.05Å; L297-L301 HydrophobicContact CG-CD1 3.91Å; L297-L301 HydrophobicContact CG-CG 4.46Å; L297-L301 PolarHBondContact O-N 3.45Å; K298-L301 PolarHBondContact O-N 3.47Å; L301-L305 HydrophobicContact CD2-CD1 4.2Å; L301-L306 WeakPolarHBondContact O-CD1 3.46Å; L301-L306 WeakPolarHBondContact O-CG 3.29Å; L301-I320 HydrophobicContact CB-CG2 4.48Å; L301-I320 HydrophobicContact CD2-CD1 4.3Å; L301-I320 HydrophobicContact CD2-CG1 4.04Å; L301-I320 HydrophobicContact CD2-CG2 4.5Å; L301-I320 WeakPolarHBondContact O-CG2 3.4Å; L301-Y323 HydrophobicContact CD1-CD1 4.17Å; L301-Y323 HydrophobicContact CD1-CE1 3.68Å
302T94.1Very high89.7Confident16 Ų1664.8 Ų64.810%0.09831%0.312CS..Iπ-helixtrans-100.6-9.5-175.5740000114K298 F307 L324 M335K298-T302 HydrophobicContact CG-CG2 4.34Å; K298-T302 WeakPolarHBondContact O-CB 3.31Å; K298-T302 WeakPolarHBondContact O-CG2 3.41Å; K298-T302 PolarHBondContact O-N 3.49Å; K298-T302 PolarHBondContact O-OG1 3.07Å; T302-F307 WeakPolarHBondContact O-CE2 3.35Å; T302-L324 HydrophobicContact CG2-CD1 4.3Å; T302-L324 HydrophobicContact CG2-CD2 4.3Å; T302-M335 HydrophobicContact CG2-CB 4.11Å; T302-M335 HydrophobicContact CG2-CG 4.22Å; T302-M335 HydrophobicContact CG2-SD 4.06Å
303K90.1Very high89.2Confident80 Ų8065.4 Ų65.435%0.34832%0.318SS..Iπ-helixtrans-132.4-65.3178.5-57.9-158.8177.4-130.20113.6L299 L305 L306 F307 E342L299-K303 HydrophobicContact CD1-CB 4.2Å; L299-K303 HydrophobicContact CD1-CD 3.74Å; L299-K303 HydrophobicContact CD1-CG 4.12Å; L299-K303 WeakPolarHBondContact O-CB 3.47Å; L299-K303 PolarHBondContact O-N 3.18Å; L299-K303 VanDerWaalsContact O-N 3.1Å; K303-L305 PolarHBondContact O-N 3.14Å; K303-L306 PolarHBondContact O-N 3.31Å; K303-L306 VanDerWaalsContact O-N 3.17Å; K303-F307 HydrophobicContact CB-CD2 4.26Å; K303-F307 WeakPolarHBondContact O-CD2 3.35Å; K303-F307 PolarHBondContact O-N 2.97Å; K303-E342 VanDerWaalsContact CE-OE2 3.3Å; K303-E342 WeakPolarHBondContact CE-OE2 3.5Å; K303-E342 IonicContact NZ-OE1 2.56Å; K303-E342 PolarHBondContact NZ-OE1 2.96Å; K303-E342 IonicContact NZ-OE2 2.74Å; K303-E342 PolarHBondContact NZ-OE2 3.1Å
304K89.2Confident89.1Confident62 Ų6262.4 Ų62.427%0.2730%0.3SS..Iπ-helixtrans-63.1-44.5-167.4-167.8172.1-177.1175.10112.1E267 L299 L300 L306 V308 R309E267-K304 VanDerWaalsContact CD-NZ 3.26Å; E267-K304 WeakPolarHBondContact OE1-CE 3.36Å; E267-K304 IonicContact OE1-NZ 3.63Å; E267-K304 PolarHBondContact OE1-NZ 3.43Å; E267-K304 VanDerWaalsContact OE1-NZ 3.13Å; E267-K304 WeakPolarHBondContact OE2-CE 3.16Å; E267-K304 IonicContact OE2-NZ 3.66Å; E267-K304 PolarHBondContact OE2-NZ 3.05Å; L299-K304 PolarHBondContact O-N 3.4Å; L300-K304 HydrophobicContact CD2-CB 4.21Å; L300-K304 HydrophobicContact CD2-CD 3.93Å; L300-K304 PolarHBondContact O-N 3.29Å; K304-L306 VanDerWaalsContact C-N 3.33Å; K304-V308 HydrophobicContact CG-CB 4.07Å; K304-V308 HydrophobicContact CG-CG2 4.38Å; K304-V308 WeakPolarHBondContact O-CA 3.37Å; K304-V308 WeakPolarHBondContact O-CB 3.34Å; K304-V308 PolarHBondContact O-N 3.41Å; K304-V308 VanDerWaalsContact O-N 3.11Å; K304-R309 PolarHBondContact O-N 3.17Å
305L91.3Very high89.1Confident1 Ų161.7 Ų61.71%0.00530%0.302CS..Iπ-helixtrans-74.4-23179.9-61.9-174.4000113.2L270 L271 L274 L300 L301 K303 R309 F311 I320 Y363L270-L305 HydrophobicContact CD2-CD1 3.93Å; L270-L305 HydrophobicContact CG-CD1 4.33Å; L271-L305 HydrophobicContact CD2-CD2 3.52Å; L271-L305 HydrophobicContact CG-CD2 4.19Å; L274-L305 HydrophobicContact CD1-CD1 3.47Å; L274-L305 VanDerWaalsContact CD1-CD1 3.47Å; L300-L305 WeakPolarHBondContact O-CB 3.38Å; L300-L305 VanDerWaalsContact O-CG 3.31Å; L300-L305 WeakPolarHBondContact O-CG 3.41Å; L300-L305 PolarHBondContact O-N 3.42Å; L301-L305 HydrophobicContact CD2-CD1 4.2Å; K303-L305 PolarHBondContact O-N 3.14Å; L305-R309 HydrophobicContact CD2-CG 4.07Å; L305-F311 HydrophobicContact CB-CE2 4.44Å; L305-F311 HydrophobicContact CD2-CZ 4.19Å; L305-F311 WeakPolarHBondContact O-CE2 3.38Å; L305-I320 HydrophobicContact CB-CD1 4.03Å; L305-I320 HydrophobicContact CD1-CD1 4.13Å; L305-Y363 PolarHBondContact O-OH 3Å
306L91.7Very high89Confident0 Ų053 Ų530%027%0.265CS..Iπ-helixtrans-94-27.8-177.7-61-179.4000113.9L301 K303 K304 P317 I320 F321 A339 Y363 V367L301-L306 WeakPolarHBondContact O-CD1 3.46Å; L301-L306 WeakPolarHBondContact O-CG 3.29Å; K303-L306 PolarHBondContact O-N 3.31Å; K303-L306 VanDerWaalsContact O-N 3.17Å; K304-L306 VanDerWaalsContact C-N 3.33Å; L306-P317 HydrophobicContact CD2-CB 4.27Å; L306-I320 HydrophobicContact CD2-CD1 4.14Å; L306-I320 HydrophobicContact CD2-CG2 4.32Å; L306-F321 HydrophobicContact CD1-CE1 4.36Å; L306-F321 HydrophobicContact CD1-CZ 3.93Å; L306-F321 HydrophobicContact CD2-CE2 4.22Å; L306-F321 HydrophobicContact CD2-CZ 4.43Å; L306-A339 HydrophobicContact CD1-CB 4.1Å; L306-Y363 VanDerWaalsContact O-CE1 3.31Å; L306-Y363 WeakPolarHBondContact O-CE1 3.48Å; L306-V367 HydrophobicContact CB-CG1 4.23Å; L306-V367 HydrophobicContact CD2-CG1 4.48Å; L306-V367 HydrophobicContact CD2-CG2 4.26Å
307F88.2Confident89.1Confident32 Ų3249.2 Ų49.214%0.1425%0.25CS..Iπ-helixtrans-122.1-27.7-172.5-52.6-49.7000114.2T302 K303 A339 E342 L364 V367T302-F307 WeakPolarHBondContact O-CE2 3.35Å; K303-F307 HydrophobicContact CB-CD2 4.26Å; K303-F307 WeakPolarHBondContact O-CD2 3.35Å; K303-F307 PolarHBondContact O-N 2.97Å; F307-A339 HydrophobicContact CZ-CB 4.27Å; F307-A339 WeakPolarHBondContact CZ-O 2.96Å; F307-E342 HydrophobicContact CD2-CG 4.39Å; F307-E342 HydrophobicContact CE2-CB 4.21Å; F307-E342 HydrophobicContact CE2-CG 3.96Å; F307-E342 HydrophobicContact CZ-CB 4.25Å; F307-E342 HydrophobicContact CZ-CG 4.38Å; F307-L364 HydrophobicContact CD1-CD1 3.76Å; F307-L364 HydrophobicContact CE1-CD1 4Å; F307-V367 HydrophobicContact CE1-CG1 4.04Å
308V82.8Confident89.1Confident100 Ų10050.6 Ų50.661%0.60626%0.256SS*.Iπ-helixtrans-100.5-36.4-176-175.50000111.6K304K304-V308 HydrophobicContact CG-CB 4.07Å; K304-V308 HydrophobicContact CG-CG2 4.38Å; K304-V308 WeakPolarHBondContact O-CA 3.37Å; K304-V308 WeakPolarHBondContact O-CB 3.34Å; K304-V308 PolarHBondContact O-N 3.41Å; K304-V308 VanDerWaalsContact O-N 3.11Å
309R83.3Confident89.2Confident109 Ų10946.3 Ų46.341%0.41124%0.238SC..  trans-91.6143.8173.7-63.9-67.1-170.3166.10.1109.8E267 K304 L305 F311 Y363E267-R309 IonicContact OE1-CZ 3.58Å; E267-R309 IonicContact OE1-NE 2.87Å; E267-R309 PolarHBondContact OE1-NE 2.91Å; E267-R309 IonicContact OE1-NH2 2.77Å; E267-R309 PolarHBondContact OE1-NH2 3.47Å; K304-R309 PolarHBondContact O-N 3.17Å; L305-R309 HydrophobicContact CD2-CG 4.07Å; R309-F311 HydrophobicContact CB-CE2 3.84Å; R309-F311 HydrophobicContact CB-CZ 4.15Å; R309-Y363 VanDerWaalsContact O-CE1 3.27Å; R309-Y363 WeakPolarHBondContact O-CE1 3.29Å
310C83.5Confident89.3Confident64 Ų6442.6 Ų42.643%0.43222%0.218SC..  trans-114.1127.5169.9-175.60000108.1
311F84.5Confident89.4Confident35 Ų3542.6 Ų42.615%0.15422%0.218CC..  trans-110.8138.9174.9-60.4-90.4000108.9L271 L305 R309 S313 V316 Y363L271-F311 HydrophobicContact CD2-CE1 3.75Å; L271-F311 HydrophobicContact CD2-CZ 3.52Å; L305-F311 HydrophobicContact CB-CE2 4.44Å; L305-F311 HydrophobicContact CD2-CZ 4.19Å; L305-F311 WeakPolarHBondContact O-CE2 3.38Å; R309-F311 HydrophobicContact CB-CE2 3.84Å; R309-F311 HydrophobicContact CB-CZ 4.15Å; F311-S313 VanDerWaalsContact C-N 3.25Å; F311-S313 PolarHBondContact O-N 2.83Å; F311-V316 HydrophobicContact CD1-CB 4.32Å; F311-V316 HydrophobicContact CD1-CG1 4.43Å; F311-V316 HydrophobicContact CD1-CG2 3.96Å; F311-V316 HydrophobicContact CD2-CB 4.26Å; F311-V316 HydrophobicContact CD2-CG1 4.1Å; F311-V316 HydrophobicContact CE1-CG1 4.19Å; F311-V316 HydrophobicContact CE1-CG2 4.21Å; F311-V316 HydrophobicContact CE2-CB 4.47Å; F311-V316 HydrophobicContact CE2-CG1 3.83Å; F311-V316 HydrophobicContact CG-CB 4.16Å; F311-V316 HydrophobicContact CG-CG1 4.38Å; F311-V316 HydrophobicContact CG-CG2 4.24Å; F311-V316 HydrophobicContact CZ-CG1 3.87Å; F311-Y363 HydrophobicContact CB-CD2 4.45Å; F311-Y363 HydrophobicContact CB-CE2 3.94Å; F311-Y363 AromaticContact CD2-CE2 3.82Å; F311-Y363 HydrophobicContact CD2-CE2 3.82Å; F311-Y363 AromaticContact CD2-CZ 3.72Å; F311-Y363 WeakPolarHBondContact CD2-OH 3.49Å; F311-Y363 HydrophobicContact CG-CE2 4.39Å; F311-Y363 WeakPolarHBondContact O-CD2 3.28Å
312E76.6Confident89.4Confident211 Ų21145.9 Ų45.999%0.98623%0.233SC*.SBendtrans-65.4-33.4176.7-64.2179.4173.400111.7
313S82.5Confident89.5Confident58 Ų5845.1 Ų45.141%0.40623%0.228SC..SBendtrans-97.8140.6-179.5-178.10000112.8F311 T315F311-S313 VanDerWaalsContact C-N 3.25Å; F311-S313 PolarHBondContact O-N 2.83Å; S313-T315 PolarHBondContact O-N 2.98Å; S313-T315 VanDerWaalsContact OG-CG2 3.32Å; S313-T315 WeakPolarHBondContact OG-CG2 3.41Å; S313-T315 PolarHBondContact OG-N 3.28Å; S313-T315 PolarHBondContact OG-OG1 3.48Å
314S87.6Confident89.8Confident15 Ų1541.3 Ų41.311%0.10521%0.211CC..THydrogen-bonded Turntrans-71.5-6.5172.268.20000113.8V316 P317 K318S314-V316 PolarHBondContact O-N 3.29Å; S314-P317 WeakPolarHBondContact O-CD 3.44Å; S314-P317 WeakPolarHBondContact O-CG 3.46Å; S314-K318 VanDerWaalsContact O-CB 3.32Å; S314-K318 WeakPolarHBondContact O-CB 3.46Å; S314-K318 WeakPolarHBondContact O-CD 3.18Å; S314-K318 WeakPolarHBondContact O-CG 3.46Å; S314-K318 PolarHBondContact O-N 3.3Å; S314-K318 VanDerWaalsContact O-N 3.11Å; S314-K318 WeakPolarHBondContact OG-CE 3.46Å; S314-K318 PolarHBondContact OG-NZ 3.31Å
315T90.2Very high90Very high68 Ų6840.2 Ų40.242%0.41721%0.211SC..Hα-helixtrans-61.9-43.2-177.752.60000112.9S313 K318 T319S313-T315 PolarHBondContact O-N 2.98Å; S313-T315 VanDerWaalsContact OG-CG2 3.32Å; S313-T315 WeakPolarHBondContact OG-CG2 3.41Å; S313-T315 PolarHBondContact OG-N 3.28Å; S313-T315 PolarHBondContact OG-OG1 3.48Å; T315-K318 PolarHBondContact O-N 2.85Å; T315-T319 WeakPolarHBondContact O-CB 3.14Å; T315-T319 PolarHBondContact O-N 3.39Å; T315-T319 PolarHBondContact O-OG1 2.97Å; T315-T319 VanDerWaalsContact O-OG1 3.08Å
316V92Very high90.1Very high7 Ų742.9 Ų42.94%0.04223%0.225CC..Hα-helixtrans-62.8-55.6-178.3177.30000111.9L274 F311 S314 K318 T319 I320L274-V316 HydrophobicContact CB-CG1 4.33Å; L274-V316 HydrophobicContact CD1-CG1 4.13Å; F311-V316 HydrophobicContact CD1-CB 4.32Å; F311-V316 HydrophobicContact CD1-CG1 4.43Å; F311-V316 HydrophobicContact CD1-CG2 3.96Å; F311-V316 HydrophobicContact CD2-CB 4.26Å; F311-V316 HydrophobicContact CD2-CG1 4.1Å; F311-V316 HydrophobicContact CE1-CG1 4.19Å; F311-V316 HydrophobicContact CE1-CG2 4.21Å; F311-V316 HydrophobicContact CE2-CB 4.47Å; F311-V316 HydrophobicContact CE2-CG1 3.83Å; F311-V316 HydrophobicContact CG-CB 4.16Å; F311-V316 HydrophobicContact CG-CG1 4.38Å; F311-V316 HydrophobicContact CG-CG2 4.24Å; F311-V316 HydrophobicContact CZ-CG1 3.87Å; S314-V316 PolarHBondContact O-N 3.29Å; V316-K318 VanDerWaalsContact C-N 3.3Å; V316-K318 PolarHBondContact O-N 3Å; V316-T319 PolarHBondContact O-N 3Å; V316-I320 HydrophobicContact CG1-CD1 3.92Å; V316-I320 VanDerWaalsContact O-CG1 3.32Å; V316-I320 WeakPolarHBondContact O-CG1 3.46Å; V316-I320 PolarHBondContact O-N 3.47Å
317P93.5Very high90.2Very high0 Ų043.5 Ų43.50%023%0.227CC..Hα-helixtrans-63.6-34.2177.725.1-34000112.3L306 S314 I320 F321 Y363 I366 V367 L370L306-P317 HydrophobicContact CD2-CB 4.27Å; S314-P317 WeakPolarHBondContact O-CD 3.44Å; S314-P317 WeakPolarHBondContact O-CG 3.46Å; P317-I320 PolarHBondContact O-N 3.4Å; P317-F321 WeakPolarHBondContact O-CD2 3.37Å; P317-F321 PolarHBondContact O-N 2.92Å; P317-Y363 HydrophobicContact CB-CE2 4.49Å; P317-Y363 HydrophobicContact CG-CE2 3.82Å; P317-I366 HydrophobicContact CG-CG2 4.19Å; P317-V367 HydrophobicContact CB-CG2 4.23Å; P317-L370 HydrophobicContact CB-CD1 3.77Å; P317-L370 HydrophobicContact CG-CD1 3.88Å
318K94.3Very high90.1Very high34 Ų3447 Ų4715%0.14825%0.248CC..Hα-helixtrans-58-51.2172.9-79.7172.7-179.3178.60111.4S314 T315 V316 I320 F321 K322 L370S314-K318 VanDerWaalsContact O-CB 3.32Å; S314-K318 WeakPolarHBondContact O-CB 3.46Å; S314-K318 WeakPolarHBondContact O-CD 3.18Å; S314-K318 WeakPolarHBondContact O-CG 3.46Å; S314-K318 PolarHBondContact O-N 3.3Å; S314-K318 VanDerWaalsContact O-N 3.11Å; S314-K318 WeakPolarHBondContact OG-CE 3.46Å; S314-K318 PolarHBondContact OG-NZ 3.31Å; T315-K318 PolarHBondContact O-N 2.85Å; V316-K318 VanDerWaalsContact C-N 3.3Å; V316-K318 PolarHBondContact O-N 3Å; K318-I320 VanDerWaalsContact C-N 3.32Å; K318-I320 PolarHBondContact O-N 2.62Å; K318-F321 PolarHBondContact O-N 3.44Å; K318-K322 WeakPolarHBondContact O-CB 3.45Å; K318-K322 PolarHBondContact O-N 3.48Å; K318-L370 HydrophobicContact CB-CD1 4.45Å; K318-L370 HydrophobicContact CD-CD2 4.4Å; K318-L370 HydrophobicContact CG-CD1 3.7Å; K318-L370 HydrophobicContact CG-CD2 3.44Å; K318-L370 VanDerWaalsContact CG-CD2 3.44Å; K318-L370 HydrophobicContact CG-CG 4.23Å
319T95.1Very high90Very high2 Ų248.6 Ų48.61%0.01225%0.246CC..Hα-helixtrans-58.4-43.7177.4-68.30000111.5L274 V277 G280 L283 T315 V316 Y323L274-T319 HydrophobicContact CD2-CG2 3.93Å; V277-T319 HydrophobicContact CG1-CG2 4.1Å; G280-T319 WeakPolarHBondContact CA-O 3.26Å; L283-T319 HydrophobicContact CB-CG2 4.03Å; L283-T319 HydrophobicContact CD2-CG2 4.02Å; T315-T319 WeakPolarHBondContact O-CB 3.14Å; T315-T319 PolarHBondContact O-N 3.39Å; T315-T319 PolarHBondContact O-OG1 2.97Å; T315-T319 VanDerWaalsContact O-OG1 3.08Å; V316-T319 PolarHBondContact O-N 3Å; T319-Y323 VanDerWaalsContact O-CB 3.24Å; T319-Y323 WeakPolarHBondContact O-CB 3.43Å; T319-Y323 PolarHBondContact O-N 3.17Å
320I95.7Very high90.3Very high0 Ų049.1 Ų49.10%026%0.257CS..Hα-helixtrans-62.6-52.2178.3-67.1171000110.7L274 L301 L305 L306 V316 P317 K318 K322 Y323 L324L274-I320 HydrophobicContact CD1-CD1 4.29Å; L274-I320 HydrophobicContact CD1-CG1 4.45Å; L274-I320 HydrophobicContact CD2-CG1 4.22Å; L301-I320 HydrophobicContact CB-CG2 4.48Å; L301-I320 HydrophobicContact CD2-CD1 4.3Å; L301-I320 HydrophobicContact CD2-CG1 4.04Å; L301-I320 HydrophobicContact CD2-CG2 4.5Å; L301-I320 WeakPolarHBondContact O-CG2 3.4Å; L305-I320 HydrophobicContact CB-CD1 4.03Å; L305-I320 HydrophobicContact CD1-CD1 4.13Å; L306-I320 HydrophobicContact CD2-CD1 4.14Å; L306-I320 HydrophobicContact CD2-CG2 4.32Å; V316-I320 HydrophobicContact CG1-CD1 3.92Å; V316-I320 VanDerWaalsContact O-CG1 3.32Å; V316-I320 WeakPolarHBondContact O-CG1 3.46Å; V316-I320 PolarHBondContact O-N 3.47Å; P317-I320 PolarHBondContact O-N 3.4Å; K318-I320 VanDerWaalsContact C-N 3.32Å; K318-I320 PolarHBondContact O-N 2.62Å; I320-K322 PolarHBondContact O-N 3.29Å; I320-Y323 WeakPolarHBondContact O-CB 3.31Å; I320-Y323 PolarHBondContact O-N 3.34Å; I320-L324 HydrophobicContact CG2-CD1 3.99Å; I320-L324 HydrophobicContact CG2-CG 4.31Å; I320-L324 WeakPolarHBondContact O-CG 3.34Å; I320-L324 PolarHBondContact O-N 3.27Å
321F95.9Very high90.7Very high0 Ų050.3 Ų50.30%026%0.257CS..Hα-helixtrans-66.9-38.6-177.5-77-64.4000112.8L306 P317 K318 Y323 L324 S325 I336 A339 V367 L370 Y374L306-F321 HydrophobicContact CD1-CE1 4.36Å; L306-F321 HydrophobicContact CD1-CZ 3.93Å; L306-F321 HydrophobicContact CD2-CE2 4.22Å; L306-F321 HydrophobicContact CD2-CZ 4.43Å; P317-F321 WeakPolarHBondContact O-CD2 3.37Å; P317-F321 PolarHBondContact O-N 2.92Å; K318-F321 PolarHBondContact O-N 3.44Å; F321-Y323 VanDerWaalsContact C-N 3.34Å; F321-Y323 PolarHBondContact O-N 3.01Å; F321-L324 HydrophobicContact CD1-CD1 4.31Å; F321-L324 PolarHBondContact O-N 2.79Å; F321-S325 WeakPolarHBondContact O-CB 3.47Å; F321-S325 PolarHBondContact O-N 3.02Å; F321-I336 HydrophobicContact CD1-CG1 4.2Å; F321-I336 HydrophobicContact CD1-CG2 4.31Å; F321-I336 HydrophobicContact CE1-CG2 4.4Å; F321-A339 HydrophobicContact CE1-CB 4.18Å; F321-A339 HydrophobicContact CZ-CB 4.43Å; F321-V367 HydrophobicContact CE2-CB 4.47Å; F321-V367 HydrophobicContact CE2-CG1 3.96Å; F321-V367 WeakPolarHBondContact CE2-O 3.36Å; F321-V367 HydrophobicContact CZ-CG1 3.87Å; F321-L370 HydrophobicContact CD2-CB 3.53Å; F321-L370 HydrophobicContact CD2-CD1 4.43Å; F321-L370 HydrophobicContact CE2-CB 3.91Å; F321-L370 HydrophobicContact CG-CB 4.37Å; F321-Y374 HydrophobicContact CB-CD2 3.3Å; F321-Y374 HydrophobicContact CB-CE2 3.83Å; F321-Y374 HydrophobicContact CB-CG 3.88Å; F321-Y374 HydrophobicContact CG-CD2 4.31Å
322K95.2Very high91.1Very high70 Ų7048.7 Ų48.730%0.30425%0.25SC..Hα-helixtrans-58.8-46.6170.917866.4-178.3-176.10110.8D281 K318 I320 L324 S325 M326 Y374D281-K322 VanDerWaalsContact OD2-CE 3.23Å; D281-K322 WeakPolarHBondContact OD2-CE 3.34Å; K318-K322 WeakPolarHBondContact O-CB 3.45Å; K318-K322 PolarHBondContact O-N 3.48Å; I320-K322 PolarHBondContact O-N 3.29Å; K322-L324 PolarHBondContact O-N 2.8Å; K322-S325 PolarHBondContact O-N 3.49Å; K322-S325 PolarHBondContact O-OG 3.5Å; K322-M326 WeakPolarHBondContact O-CG 3.02Å; K322-M326 PolarHBondContact O-N 2.89Å; K322-Y374 HydrophobicContact CB-CD1 4.48Å; K322-Y374 HydrophobicContact CB-CE1 3.75Å; K322-Y374 HydrophobicContact CD-CD1 4.46Å; K322-Y374 HydrophobicContact CD-CE1 3.71Å; K322-Y374 HydrophobicContact CG-CE1 4.32Å
323Y96.2Very high92Very high0 Ų039.5 Ų39.50%021%0.207CC..Hα-helixtrans-60.7-42.8176.6165.4-101.4000113.2L283 Y284 I287 G288 V291 L301 T319 I320 F321 S325 M326 Q327L283-Y323 HydrophobicContact CB-CD2 4.28Å; L283-Y323 HydrophobicContact CB-CG 4.48Å; L283-Y323 HydrophobicContact CD2-CD1 4.07Å; L283-Y323 HydrophobicContact CD2-CD2 4.19Å; L283-Y323 HydrophobicContact CD2-CG 3.74Å; L283-Y323 HydrophobicContact CG-CD2 3.98Å; L283-Y323 HydrophobicContact CG-CG 4.06Å; Y284-Y323 HydrophobicContact CD2-CD2 4.27Å; Y284-Y323 HydrophobicContact CD2-CE2 4.05Å; I287-Y323 HydrophobicContact CD1-CD2 4.49Å; I287-Y323 HydrophobicContact CD1-CE1 3.91Å; I287-Y323 HydrophobicContact CD1-CE2 3.78Å; I287-Y323 VanDerWaalsContact CD1-CZ 3.45Å; I287-Y323 WeakPolarHBondContact CD1-OH 3.43Å; I287-Y323 HydrophobicContact CG1-CD2 4.47Å; I287-Y323 HydrophobicContact CG1-CE2 3.65Å; G288-Y323 WeakPolarHBondContact O-CE2 3.5Å; G288-Y323 PolarHBondContact O-OH 3.45Å; V291-Y323 HydrophobicContact CB-CE1 3.75Å; V291-Y323 WeakPolarHBondContact CB-OH 3.47Å; V291-Y323 HydrophobicContact CG1-CE1 3.62Å; V291-Y323 VanDerWaalsContact CG1-OH 3.3Å; V291-Y323 WeakPolarHBondContact CG1-OH 3.3Å; V291-Y323 HydrophobicContact CG2-CE1 4.31Å; V291-Y323 PolarHBondContact N-OH 2.97Å; L301-Y323 HydrophobicContact CD1-CD1 4.17Å; L301-Y323 HydrophobicContact CD1-CE1 3.68Å; T319-Y323 VanDerWaalsContact O-CB 3.24Å; T319-Y323 WeakPolarHBondContact O-CB 3.43Å; T319-Y323 PolarHBondContact O-N 3.17Å; I320-Y323 WeakPolarHBondContact O-CB 3.31Å; I320-Y323 PolarHBondContact O-N 3.34Å; F321-Y323 VanDerWaalsContact C-N 3.34Å; F321-Y323 PolarHBondContact O-N 3.01Å; Y323-S325 VanDerWaalsContact C-N 3.3Å; Y323-S325 PolarHBondContact O-N 3.32Å; Y323-M326 PolarHBondContact O-N 2.92Å; Y323-Q327 PolarHBondContact O-NE2 2.88Å; Y323-Q327 PolarHBondContact OH-NE2 3.5Å
324L96.3Very high92.6Very high0 Ų041.7 Ų41.70%021%0.21CC..Hα-helixtrans-63.8-36.7176.2-67.9176.4000111.6V291 T302 I320 F321 K322 M326 Q327 G332 M335 I336V291-L324 HydrophobicContact CG1-CD2 4.4Å; V291-L324 HydrophobicContact CG2-CD2 4.03Å; T302-L324 HydrophobicContact CG2-CD1 4.3Å; T302-L324 HydrophobicContact CG2-CD2 4.3Å; I320-L324 HydrophobicContact CG2-CD1 3.99Å; I320-L324 HydrophobicContact CG2-CG 4.31Å; I320-L324 WeakPolarHBondContact O-CG 3.34Å; I320-L324 PolarHBondContact O-N 3.27Å; F321-L324 HydrophobicContact CD1-CD1 4.31Å; F321-L324 PolarHBondContact O-N 2.79Å; K322-L324 PolarHBondContact O-N 2.8Å; L324-M326 PolarHBondContact O-N 2.83Å; L324-Q327 WeakPolarHBondContact O-CB 3.49Å; L324-Q327 WeakPolarHBondContact O-CG 3.29Å; L324-Q327 PolarHBondContact O-N 3.34Å; L324-G332 WeakPolarHBondContact O-CA 3.41Å; L324-M335 HydrophobicContact CD2-CB 4.42Å; L324-M335 HydrophobicContact CD2-CE 4.06Å; L324-M335 HydrophobicContact CD2-SD 4.12Å; L324-I336 HydrophobicContact CB-CD1 4.13Å; L324-I336 HydrophobicContact CB-CG1 3.87Å; L324-I336 HydrophobicContact CD1-CG1 4.36Å
325S94.3Very high92.9Very high38 Ų3841.3 Ų41.327%0.26621%0.207SC..Hα-helixtrans-66.2-20.7178.278.70000113.6F321 K322 Y323F321-S325 WeakPolarHBondContact O-CB 3.47Å; F321-S325 PolarHBondContact O-N 3.02Å; K322-S325 PolarHBondContact O-N 3.49Å; K322-S325 PolarHBondContact O-OG 3.5Å; Y323-S325 VanDerWaalsContact C-N 3.3Å; Y323-S325 PolarHBondContact O-N 3.32Å
326M93.5Very high93.2Very high58 Ų5838.1 Ų38.129%0.28619%0.187SC..THydrogen-bonded Turntrans-88.2-8.6178.7-63.3173.975.100113.9D281 Y284 K322 Y323 L324D281-M326 HydrophobicContact CB-CE 4.25Å; D281-M326 HydrophobicContact CB-SD 4.35Å; D281-M326 WeakPolarHBondContact OD1-CE 3.48Å; Y284-M326 HydrophobicContact CD1-CE 3.97Å; Y284-M326 HydrophobicContact CD2-CB 4.16Å; Y284-M326 HydrophobicContact CG-CE 3.89Å; Y284-M326 HydrophobicContact CG-SD 4.39Å; K322-M326 WeakPolarHBondContact O-CG 3.02Å; K322-M326 PolarHBondContact O-N 2.89Å; Y323-M326 PolarHBondContact O-N 2.92Å; L324-M326 PolarHBondContact O-N 2.83Å
327Q92.5Very high93.4Very high13 Ų1340 Ų406%0.06120%0.195CC..SBendtrans-68.9173.1175.2-56.8-54.8-47.700110.6G288 V291 Y323 L324 K329 M335G288-Q327 PolarHBondContact O-NE2 3.4Å; V291-Q327 HydrophobicContact CG1-CG 3.7Å; Y323-Q327 PolarHBondContact O-NE2 2.88Å; Y323-Q327 PolarHBondContact OH-NE2 3.5Å; L324-Q327 WeakPolarHBondContact O-CB 3.49Å; L324-Q327 WeakPolarHBondContact O-CG 3.29Å; L324-Q327 PolarHBondContact O-N 3.34Å; Q327-K329 PolarHBondContact O-N 3.46Å; Q327-K329 VanDerWaalsContact O-N 3.15Å; Q327-M335 HydrophobicContact CB-CE 4.43Å; Q327-M335 HydrophobicContact CG-CE 4.24Å
328N86.4Confident93.4Very high106 Ų10642.4 Ų42.457%0.56722%0.215SC*.  trans-47128.1173.1-174.5-18.8000109.8N330 E331 G332N328-N330 PolarHBondContact O-N 3.09Å; N328-E331 PolarHBondContact O-N 3.23Å; N328-G332 PolarHBondContact O-N 3.41Å
329K81.1Confident93.4Very high133 Ų13340.9 Ų40.958%0.57821%0.209SC*.Hα-helixtrans-45.8-41.8-166.5-170-178177.8-170.10112.4Q327 Q333Q327-K329 PolarHBondContact O-N 3.46Å; Q327-K329 VanDerWaalsContact O-N 3.15Å; K329-Q333 VanDerWaalsContact O-CB 3.26Å; K329-Q333 WeakPolarHBondContact O-CB 3.47Å; K329-Q333 WeakPolarHBondContact O-CG 3.47Å; K329-Q333 PolarHBondContact O-N 2.98Å
330N88.8Confident93.5Very high120 Ų12040.8 Ų40.864%0.64221%0.209SC*.Hα-helixtrans-73.6-50.9-179.1-65.8-13.1000112.4N328 Q333 E334N328-N330 PolarHBondContact O-N 3.09Å; N330-Q333 PolarHBondContact O-N 2.87Å; N330-E334 WeakPolarHBondContact O-CB 3.44Å; N330-E334 WeakPolarHBondContact O-CG 3.48Å; N330-E334 PolarHBondContact O-N 3.46Å
331E91.7Very high93.4Very high89 Ų8942.2 Ų42.242%0.41622%0.216SC..Hα-helixtrans-70.3-40.3-175-65.8178.1150.800112.6V292 N328 E334 M335V292-E331 WeakPolarHBondContact CG1-OE2 3.29Å; V292-E331 VanDerWaalsContact CG2-OE2 3.28Å; V292-E331 WeakPolarHBondContact CG2-OE2 3.24Å; N328-E331 PolarHBondContact O-N 3.23Å; E331-E334 PolarHBondContact O-N 3.23Å; E331-M335 WeakPolarHBondContact O-CE 3.44Å; E331-M335 WeakPolarHBondContact O-CG 3.46Å; E331-M335 PolarHBondContact O-N 3.37Å
332G93.7Very high93.3Very high1 Ų145.1 Ų45.11%0.0123%0.23CC..Hα-helixtrans-58.7-48.7175.400000111.6L324 N328 M335 I336L324-G332 WeakPolarHBondContact O-CA 3.41Å; N328-G332 PolarHBondContact O-N 3.41Å; G332-M335 PolarHBondContact O-N 2.88Å; G332-I336 WeakPolarHBondContact O-CG1 3.34Å; G332-I336 PolarHBondContact O-N 3.02Å
333Q95.2Very high93.2Very high18 Ų1841.8 Ų41.88%0.08422%0.215CC..Hα-helixtrans-68-36.6179.4-68.1-62-41.500112.7K329 N330 M335 I336 K337 Y374 A376 T379K329-Q333 VanDerWaalsContact O-CB 3.26Å; K329-Q333 WeakPolarHBondContact O-CB 3.47Å; K329-Q333 WeakPolarHBondContact O-CG 3.47Å; K329-Q333 PolarHBondContact O-N 2.98Å; N330-Q333 PolarHBondContact O-N 2.87Å; Q333-M335 VanDerWaalsContact C-N 3.33Å; Q333-M335 PolarHBondContact O-N 3.44Å; Q333-I336 PolarHBondContact O-N 3.01Å; Q333-K337 WeakPolarHBondContact O-CB 3.4Å; Q333-K337 PolarHBondContact O-N 3.33Å; Q333-Y374 PolarHBondContact NE2-O 3.27Å; Q333-A376 HydrophobicContact CG-CB 4.16Å; Q333-T379 HydrophobicContact CB-CG2 4.33Å
334E94.4Very high93.1Very high103 Ų10341.9 Ų41.948%0.48122%0.215SC..Hα-helixtrans-64.4-36173-74.4-59.1125.900112.3N330 E331 K337 A338N330-E334 WeakPolarHBondContact O-CB 3.44Å; N330-E334 WeakPolarHBondContact O-CG 3.48Å; N330-E334 PolarHBondContact O-N 3.46Å; E331-E334 PolarHBondContact O-N 3.23Å; E334-K337 IonicContact OE1-NZ 2.93Å; E334-A338 VanDerWaalsContact O-CB 3.3Å; E334-A338 WeakPolarHBondContact O-CB 3.4Å; E334-A338 PolarHBondContact O-N 3.14Å
335M95.4Very high92.9Very high8 Ų845.5 Ų45.54%0.03924%0.235CC..Hα-helixtrans-67-42.7174-73-175.9-73.200112.4V291 V292 K298 T302 L324 Q327 E331 G332 Q333 A338 A339V291-M335 HydrophobicContact CG1-CE 4.04Å; V291-M335 HydrophobicContact CG2-SD 3.99Å; V292-M335 HydrophobicContact CG2-CE 4.44Å; K298-M335 HydrophobicContact CD-SD 4.19Å; K298-M335 HydrophobicContact CG-SD 4.07Å; T302-M335 HydrophobicContact CG2-CB 4.11Å; T302-M335 HydrophobicContact CG2-CG 4.22Å; T302-M335 HydrophobicContact CG2-SD 4.06Å; L324-M335 HydrophobicContact CD2-CB 4.42Å; L324-M335 HydrophobicContact CD2-CE 4.06Å; L324-M335 HydrophobicContact CD2-SD 4.12Å; Q327-M335 HydrophobicContact CB-CE 4.43Å; Q327-M335 HydrophobicContact CG-CE 4.24Å; E331-M335 WeakPolarHBondContact O-CE 3.44Å; E331-M335 WeakPolarHBondContact O-CG 3.46Å; E331-M335 PolarHBondContact O-N 3.37Å; G332-M335 PolarHBondContact O-N 2.88Å; Q333-M335 VanDerWaalsContact C-N 3.33Å; Q333-M335 PolarHBondContact O-N 3.44Å; M335-A338 PolarHBondContact O-N 3.14Å; M335-A339 WeakPolarHBondContact O-CB 3.37Å; M335-A339 PolarHBondContact O-N 3.39Å
336I96.4Very high92.7Very high0 Ų046.7 Ų46.70%024%0.24CC..Hα-helixtrans-65.1-44.9176.7-63.9170.8000110.3F321 L324 G332 Q333 A339 F340 S371 M375F321-I336 HydrophobicContact CD1-CG1 4.2Å; F321-I336 HydrophobicContact CD1-CG2 4.31Å; F321-I336 HydrophobicContact CE1-CG2 4.4Å; L324-I336 HydrophobicContact CB-CD1 4.13Å; L324-I336 HydrophobicContact CB-CG1 3.87Å; L324-I336 HydrophobicContact CD1-CG1 4.36Å; G332-I336 WeakPolarHBondContact O-CG1 3.34Å; G332-I336 PolarHBondContact O-N 3.02Å; Q333-I336 PolarHBondContact O-N 3.01Å; I336-A339 PolarHBondContact O-N 3.27Å; I336-F340 WeakPolarHBondContact O-CB 3.31Å; I336-F340 PolarHBondContact O-N 2.96Å; I336-S371 VanDerWaalsContact CG2-O 3.25Å; I336-S371 WeakPolarHBondContact CG2-O 3.47Å; I336-M375 HydrophobicContact CG2-CB 4.36Å; I336-M375 HydrophobicContact CG2-CE 4.14Å
337K95.3Very high92.6Very high46 Ų4644.2 Ų44.220%0.223%0.228CC..Hα-helixtrans-57.2-49.2175.3173.2175.2171.3179.90112.1Q333 E334 A339 F340 L341 M375 T379 S382 V383Q333-K337 WeakPolarHBondContact O-CB 3.4Å; Q333-K337 PolarHBondContact O-N 3.33Å; E334-K337 IonicContact OE1-NZ 2.93Å; K337-A339 PolarHBondContact O-N 3.41Å; K337-F340 PolarHBondContact O-N 3.27Å; K337-L341 HydrophobicContact CG-CD1 4.21Å; K337-L341 WeakPolarHBondContact O-CG 3.26Å; K337-L341 PolarHBondContact O-N 3.06Å; K337-M375 HydrophobicContact CB-CE 4.48Å; K337-T379 HydrophobicContact CB-CG2 3.92Å; K337-T379 HydrophobicContact CD-CG2 4Å; K337-T379 HydrophobicContact CG-CG2 4.39Å; K337-S382 PolarHBondContact NZ-OG 3.46Å; K337-V383 HydrophobicContact CD-CG1 3.81Å; K337-V383 HydrophobicContact CG-CG1 3.73Å
338A94.3Very high92.6Very high52 Ų5243.9 Ų43.943%0.4323%0.227SC..Hα-helixtrans-62-43.8178.700000111.6E334 M335 F340 L341 E342E334-A338 VanDerWaalsContact O-CB 3.3Å; E334-A338 WeakPolarHBondContact O-CB 3.4Å; E334-A338 PolarHBondContact O-N 3.14Å; M335-A338 PolarHBondContact O-N 3.14Å; A338-F340 PolarHBondContact O-N 2.75Å; A338-L341 PolarHBondContact O-N 3.18Å; A338-E342 VanDerWaalsContact O-CB 3.27Å; A338-E342 WeakPolarHBondContact O-CB 3.4Å; A338-E342 PolarHBondContact O-N 2.92Å
339A94.9Very high92.8Very high2 Ų240.4 Ų40.42%0.01721%0.211CC..Hα-helixtrans-62.5-41.5176.400000111.9L306 F307 F321 M335 I336 K337 S343L306-A339 HydrophobicContact CD1-CB 4.1Å; F307-A339 HydrophobicContact CZ-CB 4.27Å; F307-A339 WeakPolarHBondContact CZ-O 2.96Å; F321-A339 HydrophobicContact CE1-CB 4.18Å; F321-A339 HydrophobicContact CZ-CB 4.43Å; M335-A339 WeakPolarHBondContact O-CB 3.37Å; M335-A339 PolarHBondContact O-N 3.39Å; I336-A339 PolarHBondContact O-N 3.27Å; K337-A339 PolarHBondContact O-N 3.41Å; A339-S343 VanDerWaalsContact O-CB 3.22Å; A339-S343 WeakPolarHBondContact O-CB 3.33Å; A339-S343 PolarHBondContact O-N 3.37Å; A339-S343 PolarHBondContact O-OG 3.11Å
340F95.9Very high93.1Very high0 Ų035 Ų350%019%0.189CC..Hα-helixtrans-61.7-50.4176.5176.9-124.1000112I336 K337 A338 S343 L344 S371 L372 M375 V383 A387I336-F340 WeakPolarHBondContact O-CB 3.31Å; I336-F340 PolarHBondContact O-N 2.96Å; K337-F340 PolarHBondContact O-N 3.27Å; A338-F340 PolarHBondContact O-N 2.75Å; F340-S343 PolarHBondContact O-N 3.41Å; F340-S343 PolarHBondContact O-OG 2.67Å; F340-L344 HydrophobicContact CD1-CD1 4.29Å; F340-L344 HydrophobicContact CD2-CD1 4.42Å; F340-L344 HydrophobicContact CD2-CG 4.45Å; F340-L344 HydrophobicContact CE1-CD1 3.74Å; F340-L344 HydrophobicContact CE2-CD1 3.88Å; F340-L344 HydrophobicContact CE2-CD2 4.47Å; F340-L344 HydrophobicContact CE2-CG 4.05Å; F340-L344 HydrophobicContact CZ-CD1 3.51Å; F340-L344 HydrophobicContact CZ-CG 4.19Å; F340-L344 PolarHBondContact O-N 2.89Å; F340-S371 WeakPolarHBondContact CB-OG 3.43Å; F340-S371 WeakPolarHBondContact CD2-OG 3.35Å; F340-L372 HydrophobicContact CD2-CD2 4.47Å; F340-L372 HydrophobicContact CD2-CG 4.14Å; F340-L372 HydrophobicContact CE1-CD2 3.93Å; F340-L372 HydrophobicContact CE2-CD1 3.87Å; F340-L372 HydrophobicContact CE2-CD2 3.87Å; F340-L372 HydrophobicContact CE2-CG 3.61Å; F340-L372 HydrophobicContact CZ-CD1 4.09Å; F340-L372 HydrophobicContact CZ-CD2 3.56Å; F340-L372 HydrophobicContact CZ-CG 3.84Å; F340-M375 HydrophobicContact CB-CE 3.82Å; F340-M375 HydrophobicContact CD1-CE 3.9Å; F340-M375 HydrophobicContact CG-CE 4.07Å; F340-V383 HydrophobicContact CD1-CG2 4.45Å; F340-V383 HydrophobicContact CE1-CG2 4.36Å; F340-A387 HydrophobicContact CE1-CB 3.56Å; F340-A387 HydrophobicContact CZ-CB 4.01Å
341L94.1Very high92.8Very high30 Ų3029.9 Ų29.916%0.15716%0.163CC..Hα-helixtrans-66-42-178.6-66.4175.5000112.3K337 A338 S343 L344 D345 V383K337-L341 HydrophobicContact CG-CD1 4.21Å; K337-L341 WeakPolarHBondContact O-CG 3.26Å; K337-L341 PolarHBondContact O-N 3.06Å; A338-L341 PolarHBondContact O-N 3.18Å; L341-S343 VanDerWaalsContact C-N 3.3Å; L341-S343 PolarHBondContact O-N 3.02Å; L341-L344 WeakPolarHBondContact O-CB 3.49Å; L341-L344 PolarHBondContact O-N 3.22Å; L341-D345 PolarHBondContact O-N 3.3Å; L341-V383 HydrophobicContact CD1-CG1 4.16Å; L341-V383 HydrophobicContact CD2-CB 4.45Å; L341-V383 HydrophobicContact CD2-CG1 4.4Å; L341-V383 HydrophobicContact CG-CG1 4.48Å
342E93.3Very high92.6Very high61 Ų6126.9 Ų26.929%0.28515%0.153SC..Hα-helixtrans-63-38.5175.7-172167-177.500111K303 F307 A338 L344 D345 V346K303-E342 VanDerWaalsContact CE-OE2 3.3Å; K303-E342 WeakPolarHBondContact CE-OE2 3.5Å; K303-E342 IonicContact NZ-OE1 2.56Å; K303-E342 PolarHBondContact NZ-OE1 2.96Å; K303-E342 IonicContact NZ-OE2 2.74Å; K303-E342 PolarHBondContact NZ-OE2 3.1Å; F307-E342 HydrophobicContact CD2-CG 4.39Å; F307-E342 HydrophobicContact CE2-CB 4.21Å; F307-E342 HydrophobicContact CE2-CG 3.96Å; F307-E342 HydrophobicContact CZ-CB 4.25Å; F307-E342 HydrophobicContact CZ-CG 4.38Å; A338-E342 VanDerWaalsContact O-CB 3.27Å; A338-E342 WeakPolarHBondContact O-CB 3.4Å; A338-E342 PolarHBondContact O-N 2.92Å; E342-L344 VanDerWaalsContact C-N 3.34Å; E342-L344 PolarHBondContact O-N 2.91Å; E342-D345 PolarHBondContact O-N 2.94Å; E342-V346 WeakPolarHBondContact O-CG2 3.44Å; E342-V346 PolarHBondContact O-N 3.49Å; E342-V346 VanDerWaalsContact O-N 3.14Å
343S93.6Very high92.3Very high0 Ų026.8 Ų26.80%015%0.153CC..Hα-helixtrans-64.9-36.5174.778.20000112.7A339 F340 L341 W347 Q368A339-S343 VanDerWaalsContact O-CB 3.22Å; A339-S343 WeakPolarHBondContact O-CB 3.33Å; A339-S343 PolarHBondContact O-N 3.37Å; A339-S343 PolarHBondContact O-OG 3.11Å; F340-S343 PolarHBondContact O-N 3.41Å; F340-S343 PolarHBondContact O-OG 2.67Å; L341-S343 VanDerWaalsContact C-N 3.3Å; L341-S343 PolarHBondContact O-N 3.02Å; S343-W347 WeakPolarHBondContact O-CB 3.44Å; S343-W347 PolarHBondContact O-N 3.44Å; S343-Q368 PolarHBondContact O-NE2 3.45Å; S343-Q368 WeakPolarHBondContact OG-CG 3.43Å
344L93.7Very high91.6Very high1 Ų126.6 Ų26.61%0.00515%0.153CC..Hα-helixtrans-68.4-39.1175.7-79.8173.9000111.7F340 L341 E342 W347 S348 A387 K390F340-L344 HydrophobicContact CD1-CD1 4.29Å; F340-L344 HydrophobicContact CD2-CD1 4.42Å; F340-L344 HydrophobicContact CD2-CG 4.45Å; F340-L344 HydrophobicContact CE1-CD1 3.74Å; F340-L344 HydrophobicContact CE2-CD1 3.88Å; F340-L344 HydrophobicContact CE2-CD2 4.47Å; F340-L344 HydrophobicContact CE2-CG 4.05Å; F340-L344 HydrophobicContact CZ-CD1 3.51Å; F340-L344 HydrophobicContact CZ-CG 4.19Å; F340-L344 PolarHBondContact O-N 2.89Å; L341-L344 WeakPolarHBondContact O-CB 3.49Å; L341-L344 PolarHBondContact O-N 3.22Å; E342-L344 VanDerWaalsContact C-N 3.34Å; E342-L344 PolarHBondContact O-N 2.91Å; L344-W347 PolarHBondContact O-N 2.93Å; L344-S348 VanDerWaalsContact O-CB 3.29Å; L344-S348 WeakPolarHBondContact O-CB 3.25Å; L344-S348 PolarHBondContact O-N 3.17Å; L344-S348 PolarHBondContact O-OG 2.98Å; L344-A387 HydrophobicContact CD1-CB 3.96Å; L344-K390 HydrophobicContact CB-CB 4.23Å; L344-K390 HydrophobicContact CB-CD 4.29Å; L344-K390 HydrophobicContact CD1-CB 4.3Å
345D91.8Very high91.1Very high76 Ų7622.9 Ų22.941%0.40614%0.137SC..Hα-helixtrans-60.6-50.4177.2-76.2-37.7000111.1L341 E342 W347 S348 S349 K390L341-D345 PolarHBondContact O-N 3.3Å; E342-D345 PolarHBondContact O-N 2.94Å; D345-W347 PolarHBondContact O-N 3.46Å; D345-S348 PolarHBondContact O-N 2.87Å; D345-S348 PolarHBondContact O-OG 3.34Å; D345-S349 PolarHBondContact O-N 2.66Å; D345-K390 WeakPolarHBondContact OD1-CE 3.49Å; D345-K390 IonicContact OD1-NZ 3.86Å; D345-K390 PolarHBondContact OD1-NZ 3.39Å; D345-K390 IonicContact OD2-NZ 3.04Å; D345-K390 PolarHBondContact OD2-NZ 2.9Å
346V90.2Very high90.5Very high63 Ų6323.7 Ų23.738%0.38214%0.143SC..Hα-helixtrans-62.9-42.8176.5179.60000111.1E342 S348 S349 A352 L364E342-V346 WeakPolarHBondContact O-CG2 3.44Å; E342-V346 PolarHBondContact O-N 3.49Å; E342-V346 VanDerWaalsContact O-N 3.14Å; V346-S348 VanDerWaalsContact C-N 3.26Å; V346-S348 PolarHBondContact O-N 3.34Å; V346-S349 PolarHBondContact O-N 2.92Å; V346-A352 HydrophobicContact CG1-CB 4.19Å; V346-A352 WeakPolarHBondContact O-CB 3.45Å; V346-L364 HydrophobicContact CB-CD2 4.07Å; V346-L364 HydrophobicContact CG1-CD2 3.72Å
347W92.2Very high89.9Confident6 Ų626.6 Ų26.62%0.02316%0.162CC..Hα-helixtrans-64.3-30.2179.7-173-110.3000113.7S343 L344 D345 R361 L364 A394 H398 L409 V413S343-W347 WeakPolarHBondContact O-CB 3.44Å; S343-W347 PolarHBondContact O-N 3.44Å; L344-W347 PolarHBondContact O-N 2.93Å; D345-W347 PolarHBondContact O-N 3.46Å; W347-R361 VanDerWaalsContact CE3-NH2 3.35Å; W347-R361 HydrophobicContact CH2-CB 4.45Å; W347-R361 HydrophobicContact CZ3-CB 4.02Å; W347-R361 WeakPolarHBondContact CZ3-O 3.41Å; W347-R361 PolarHBondContact O-NH2 3.2Å; W347-L364 HydrophobicContact CB-CD2 4.3Å; W347-L364 HydrophobicContact CE3-CB 4.11Å; W347-L364 HydrophobicContact CE3-CD2 3.87Å; W347-L364 HydrophobicContact CE3-CG 3.94Å; W347-L364 HydrophobicContact CZ3-CB 4.21Å; W347-A394 HydrophobicContact CG-CB 4.48Å; W347-H398 AromaticContact CD1-CE1 3.57Å; W347-H398 AromaticContact CD2-CE1 3.69Å; W347-H398 AromaticContact CD2-NE2 3.71Å; W347-H398 AromaticContact CE2-CE1 3.29Å; W347-H398 AromaticContact CE2-NE2 3.18Å; W347-H398 AromaticContact CG-CE1 3.85Å; W347-H398 AromaticContact CH2-NE2 3.75Å; W347-H398 AromaticContact CZ2-CE1 3.82Å; W347-H398 AromaticContact CZ2-NE2 3.22Å; W347-H398 WeakPolarHBondContact CZ2-NE2 3.41Å; W347-H398 AromaticContact NE1-CE1 3.17Å; W347-H398 PolarHBondContact NE1-CE1 2.97Å; W347-H398 AromaticContact NE1-NE2 3.56Å; W347-H398 PolarHBondContact O-CE1 3.19Å; W347-H398 VanDerWaalsContact O-CE1 3.24Å; W347-L409 HydrophobicContact CH2-CB 4.22Å; W347-L409 HydrophobicContact CZ2-CB 4.45Å; W347-V413 HydrophobicContact CH2-CG2 4.29Å; W347-V413 HydrophobicContact CZ2-CB 4.01Å; W347-V413 HydrophobicContact CZ2-CG1 4.24Å; W347-V413 HydrophobicContact CZ2-CG2 3.79Å
348S92.6Very high89.5Confident7 Ų727.1 Ų27.15%0.04917%0.166CC..Hα-helixtrans-82.1-16179.278.30000113.8L344 D345 V346 P350 N397L344-S348 VanDerWaalsContact O-CB 3.29Å; L344-S348 WeakPolarHBondContact O-CB 3.25Å; L344-S348 PolarHBondContact O-N 3.17Å; L344-S348 PolarHBondContact O-OG 2.98Å; D345-S348 PolarHBondContact O-N 2.87Å; D345-S348 PolarHBondContact O-OG 3.34Å; V346-S348 VanDerWaalsContact C-N 3.26Å; V346-S348 PolarHBondContact O-N 3.34Å; S348-P350 WeakPolarHBondContact O-CD 3.47Å; S348-N397 PolarHBondContact O-ND2 2.87Å
349S90.6Very high89.1Confident33 Ų3327.5 Ų27.523%0.23117%0.169CC..  trans-77.2119.5-174.7-177.40000112.1D345 V346 S351 A352 I353D345-S349 PolarHBondContact O-N 2.66Å; V346-S349 PolarHBondContact O-N 2.92Å; S349-S351 VanDerWaalsContact C-N 3.33Å; S349-S351 PolarHBondContact O-N 3.45Å; S349-S351 PolarHBondContact OG-OG 2.92Å; S349-A352 WeakPolarHBondContact O-CB 3.34Å; S349-A352 PolarHBondContact O-N 2.82Å; S349-A352 VanDerWaalsContact O-N 3.08Å; S349-I353 WeakPolarHBondContact O-CG1 3.43Å; S349-I353 PolarHBondContact O-N 3.36Å
350P86.3Confident88.8Confident18 Ų1830.8 Ų30.812%0.11718%0.184CC..Hα-helixtrans-57.7-38.7-179.4-2130.3000114.5S348 I353 C354 D508 W511S348-P350 WeakPolarHBondContact O-CD 3.47Å; P350-I353 WeakPolarHBondContact O-CB 3.37Å; P350-I353 PolarHBondContact O-N 3.49Å; P350-C354 WeakPolarHBondContact O-CB 3.38Å; P350-C354 PolarHBondContact O-N 2.87Å; P350-D508 WeakPolarHBondContact CB-OD1 3.42Å; P350-D508 WeakPolarHBondContact CD-OD1 3.46Å; P350-W511 HydrophobicContact CB-CB 3.62Å; P350-W511 HydrophobicContact CB-CD2 4.07Å; P350-W511 HydrophobicContact CB-CG 3.54Å; P350-W511 HydrophobicContact CG-CB 4.5Å; P350-W511 HydrophobicContact CG-CG 4.47Å
351S83.3Confident88.5Confident13 Ų1331 Ų319%0.09119%0.185CC..Hα-helixtrans-62.2-43.9174.247.90000111.3S349 I353 C354 L355 D508S349-S351 VanDerWaalsContact C-N 3.33Å; S349-S351 PolarHBondContact O-N 3.45Å; S349-S351 PolarHBondContact OG-OG 2.92Å; S351-I353 VanDerWaalsContact C-N 3.33Å; S351-I353 PolarHBondContact O-N 3.22Å; S351-C354 PolarHBondContact O-N 2.8Å; S351-L355 WeakPolarHBondContact O-CB 3.06Å; S351-L355 VanDerWaalsContact O-CG 3.3Å; S351-L355 WeakPolarHBondContact O-CG 3.26Å; S351-L355 PolarHBondContact O-N 3.33Å; S351-D508 WeakPolarHBondContact CA-OD1 3.5Å; S351-D508 WeakPolarHBondContact CB-OD1 3.5Å; S351-D508 PolarHBondContact N-OD1 3.05Å; S351-D508 PolarHBondContact OG-OD1 3.27Å; S351-D508 PolarHBondContact OG-OD2 3.39Å
352A86.2Confident88.4Confident26 Ų2630.9 Ų30.922%0.21519%0.185CC..Hα-helixtrans-65.5-37.6173.800000111.5V346 S349 C354 S356V346-A352 HydrophobicContact CG1-CB 4.19Å; V346-A352 WeakPolarHBondContact O-CB 3.45Å; S349-A352 WeakPolarHBondContact O-CB 3.34Å; S349-A352 PolarHBondContact O-N 2.82Å; S349-A352 VanDerWaalsContact O-N 3.08Å; A352-C354 VanDerWaalsContact C-N 3.33Å; A352-C354 PolarHBondContact O-N 3.5Å; A352-S356 VanDerWaalsContact O-CB 3.22Å; A352-S356 WeakPolarHBondContact O-CB 3.49Å; A352-S356 PolarHBondContact O-N 3.29Å; A352-S356 VanDerWaalsContact O-N 3.13Å; A352-S356 PolarHBondContact O-OG 3.43Å
353I89.1Confident88.4Confident0 Ų028.3 Ų28.30%017%0.172CC..Hα-helixtrans-57.8-47.7174.8-61.7-150.9000111.2S349 P350 S351 N397 H398 I406 W511S349-I353 WeakPolarHBondContact O-CG1 3.43Å; S349-I353 PolarHBondContact O-N 3.36Å; P350-I353 WeakPolarHBondContact O-CB 3.37Å; P350-I353 PolarHBondContact O-N 3.49Å; S351-I353 VanDerWaalsContact C-N 3.33Å; S351-I353 PolarHBondContact O-N 3.22Å; I353-N397 HydrophobicContact CD1-CB 3.75Å; I353-H398 WeakPolarHBondContact CD1-ND1 3.41Å; I353-I406 HydrophobicContact CG2-CD1 4.37Å; I353-I406 HydrophobicContact CG2-CG2 3.76Å; I353-W511 HydrophobicContact CB-CH2 4.39Å; I353-W511 HydrophobicContact CB-CZ2 4.28Å; I353-W511 HydrophobicContact CG2-CH2 3.38Å; I353-W511 HydrophobicContact CG2-CZ2 3.32Å; I353-W511 HydrophobicContact CG2-CZ3 4.24Å
354C80.8Confident88.4Confident14 Ų1429.1 Ų29.110%0.09518%0.177CC..Hα-helixtrans-74.2-43-174.6-174.10000112.7P350 S351 A352 I507 W511 E543P350-C354 WeakPolarHBondContact O-CB 3.38Å; P350-C354 PolarHBondContact O-N 2.87Å; S351-C354 PolarHBondContact O-N 2.8Å; A352-C354 VanDerWaalsContact C-N 3.33Å; A352-C354 PolarHBondContact O-N 3.5Å; C354-I507 HydrophobicContact CB-CG2 3.48Å; C354-I507 VanDerWaalsContact CB-CG2 3.48Å; C354-W511 HydrophobicContact CB-CE3 3.91Å; C354-W511 HydrophobicContact CB-CH2 4.41Å; C354-W511 HydrophobicContact CB-CZ3 3.49Å; C354-W511 VanDerWaalsContact CB-CZ3 3.49Å; C354-E543 WeakPolarHBondContact O-CB 3.33Å
355L83.1Confident88.4Confident24 Ų2429.1 Ų29.113%0.12618%0.177CC..Hα-helixtrans-91.8-8.9-169.2-65.3177.2000113.9S351 E504 I507 L540 E543 V544S351-L355 WeakPolarHBondContact O-CB 3.06Å; S351-L355 VanDerWaalsContact O-CG 3.3Å; S351-L355 WeakPolarHBondContact O-CG 3.26Å; S351-L355 PolarHBondContact O-N 3.33Å; L355-E504 HydrophobicContact CD1-CG 3.9Å; L355-I507 HydrophobicContact CD1-CD1 3.71Å; L355-I507 HydrophobicContact CD2-CD1 3.32Å; L355-I507 HydrophobicContact CG-CD1 3.49Å; L355-I507 VanDerWaalsContact CG-CD1 3.49Å; L355-L540 HydrophobicContact CB-CD2 4.18Å; L355-L540 HydrophobicContact CD1-CD2 4.04Å; L355-L540 HydrophobicContact CD2-CB 4.31Å; L355-L540 HydrophobicContact CD2-CD2 3.8Å; L355-L540 HydrophobicContact CG-CD2 4.21Å; L355-E543 HydrophobicContact CD2-CB 3.97Å; L355-V544 HydrophobicContact CD2-CG2 3.92Å
356S83Confident88.5Confident25 Ų2526 Ų2618%0.17516%0.16CC..SBendtrans-89.6132.617756.60000111.1A352 R361A352-S356 VanDerWaalsContact O-CB 3.22Å; A352-S356 WeakPolarHBondContact O-CB 3.49Å; A352-S356 PolarHBondContact O-N 3.29Å; A352-S356 VanDerWaalsContact O-N 3.13Å; A352-S356 PolarHBondContact O-OG 3.43Å; S356-R361 WeakPolarHBondContact OG-CD 3.39Å; S356-R361 WeakPolarHBondContact OG-CG 2.97Å
357P83.4Confident88.7Confident61 Ų6123 Ų2340%0.39614%0.142SC..  trans-56.2148.2170-25.934.6000111.4A359 Q360 R361P357-A359 PolarHBondContact O-N 3.43Å; P357-A359 VanDerWaalsContact O-N 3.12Å; P357-Q360 WeakPolarHBondContact O-CB 3.28Å; P357-Q360 PolarHBondContact O-N 3.11Å; P357-R361 PolarHBondContact O-N 3.24Å; P357-R361 VanDerWaalsContact O-N 3.08Å
358I86.7Confident88.8Confident58 Ų5822.8 Ų22.830%0.29714%0.141SC..Hα-helixtrans-56.6-35-177.2-165.366.1000112.7R361 L362 D405 I406 L409 L437I358-R361 PolarHBondContact O-N 3.18Å; I358-L362 PolarHBondContact O-N 3.03Å; I358-D405 HydrophobicContact CD1-CB 4.19Å; I358-I406 HydrophobicContact CD1-CG1 4.25Å; I358-L409 HydrophobicContact CD1-CD1 3.46Å; I358-L409 VanDerWaalsContact CD1-CD1 3.46Å; I358-L409 HydrophobicContact CG1-CD1 4.31Å; I358-L437 HydrophobicContact CD1-CD1 4.31Å; I358-L437 HydrophobicContact CG1-CD1 4.11Å; I358-L437 HydrophobicContact CG1-CD2 4.33Å
359A86.8Confident88.9Confident59 Ų5922.4 Ų22.449%0.48814%0.139SC..Hα-helixtrans-63-42175.900000112.2P357 R361 L362 Y363P357-A359 PolarHBondContact O-N 3.43Å; P357-A359 VanDerWaalsContact O-N 3.12Å; A359-R361 VanDerWaalsContact C-N 3.34Å; A359-L362 PolarHBondContact O-N 3.44Å; A359-Y363 WeakPolarHBondContact O-CB 3.32Å; A359-Y363 PolarHBondContact O-N 3.39Å
360Q87.9Confident89.1Confident72 Ų7220.9 Ų20.934%0.33613%0.128SC..Hα-helixtrans-67.5-36.7176.7-173.5178.44.900111.2P357 Y363 L364P357-Q360 WeakPolarHBondContact O-CB 3.28Å; P357-Q360 PolarHBondContact O-N 3.11Å; Q360-Y363 PolarHBondContact O-N 3.36Å; Q360-L364 PolarHBondContact O-N 3.3Å
361R90.5Very high89.6Confident3 Ų320 Ų201%0.01112%0.122CC..Hα-helixtrans-64.4-48.7173.5-67.5-140.775.7164.215.1112.1W347 S356 P357 I358 A359 Y363 L364 G365 H398 L409W347-R361 VanDerWaalsContact CE3-NH2 3.35Å; W347-R361 HydrophobicContact CH2-CB 4.45Å; W347-R361 HydrophobicContact CZ3-CB 4.02Å; W347-R361 WeakPolarHBondContact CZ3-O 3.41Å; W347-R361 PolarHBondContact O-NH2 3.2Å; S356-R361 WeakPolarHBondContact OG-CD 3.39Å; S356-R361 WeakPolarHBondContact OG-CG 2.97Å; P357-R361 PolarHBondContact O-N 3.24Å; P357-R361 VanDerWaalsContact O-N 3.08Å; I358-R361 PolarHBondContact O-N 3.18Å; A359-R361 VanDerWaalsContact C-N 3.34Å; R361-Y363 PolarHBondContact O-N 3.03Å; R361-L364 PolarHBondContact O-N 3.48Å; R361-L364 VanDerWaalsContact O-N 3.11Å; R361-G365 PolarHBondContact O-N 3.3Å; R361-H398 PolarHBondContact NH1-CD2 2.85Å; R361-H398 PolarHBondContact NH1-NE2 3.13Å; R361-H398 PolarHBondContact NH2-CE1 3.37Å; R361-H398 PolarHBondContact NH2-NE2 3.03Å; R361-L409 HydrophobicContact CB-CD1 3.91Å
362L92.1Very high90Very high29 Ų2919.9 Ų19.915%0.15212%0.12CC..Hα-helixtrans-53.5-46.5175.1176.562.8000110.5I358 A359 L364 G365 I366 L409 L437 A440 L441I358-L362 PolarHBondContact O-N 3.03Å; A359-L362 PolarHBondContact O-N 3.44Å; L362-L364 PolarHBondContact O-N 3.12Å; L362-G365 PolarHBondContact O-N 2.94Å; L362-I366 HydrophobicContact CD1-CD1 4.44Å; L362-I366 HydrophobicContact CG-CD1 4.17Å; L362-I366 WeakPolarHBondContact O-CG1 3.32Å; L362-I366 PolarHBondContact O-N 3.11Å; L362-L409 HydrophobicContact CD1-CD2 4Å; L362-L437 HydrophobicContact CB-CD2 4.42Å; L362-L437 HydrophobicContact CD2-CD2 3.95Å; L362-A440 HydrophobicContact CD1-CB 4.16Å; L362-A440 HydrophobicContact CD2-CB 4.1Å; L362-L441 HydrophobicContact CD1-CD1 4.39Å; L362-L441 HydrophobicContact CD1-CD2 3.98Å; L362-L441 HydrophobicContact CD1-CG 3.81Å
363Y92.6Very high90.3Very high6 Ų622.3 Ų22.32%0.02412%0.124CC..Hα-helixtrans-59.1-44.7176.8-176.3-99.9000112.9L305 L306 R309 F311 P317 A359 Q360 R361 G365 I366 V367L305-Y363 PolarHBondContact O-OH 3Å; L306-Y363 VanDerWaalsContact O-CE1 3.31Å; L306-Y363 WeakPolarHBondContact O-CE1 3.48Å; R309-Y363 VanDerWaalsContact O-CE1 3.27Å; R309-Y363 WeakPolarHBondContact O-CE1 3.29Å; F311-Y363 HydrophobicContact CB-CD2 4.45Å; F311-Y363 HydrophobicContact CB-CE2 3.94Å; F311-Y363 AromaticContact CD2-CE2 3.82Å; F311-Y363 HydrophobicContact CD2-CE2 3.82Å; F311-Y363 AromaticContact CD2-CZ 3.72Å; F311-Y363 WeakPolarHBondContact CD2-OH 3.49Å; F311-Y363 HydrophobicContact CG-CE2 4.39Å; F311-Y363 WeakPolarHBondContact O-CD2 3.28Å; P317-Y363 HydrophobicContact CB-CE2 4.49Å; P317-Y363 HydrophobicContact CG-CE2 3.82Å; A359-Y363 WeakPolarHBondContact O-CB 3.32Å; A359-Y363 PolarHBondContact O-N 3.39Å; Q360-Y363 PolarHBondContact O-N 3.36Å; R361-Y363 PolarHBondContact O-N 3.03Å; Y363-G365 VanDerWaalsContact C-N 3.33Å; Y363-G365 PolarHBondContact O-N 3.08Å; Y363-I366 WeakPolarHBondContact O-CB 3.28Å; Y363-I366 PolarHBondContact O-N 2.93Å; Y363-I366 VanDerWaalsContact O-N 3.16Å; Y363-V367 HydrophobicContact CD1-CG2 4.17Å; Y363-V367 HydrophobicContact CE1-CG2 3.72Å; Y363-V367 WeakPolarHBondContact O-CG2 3.35Å; Y363-V367 PolarHBondContact O-N 3.44Å
364L92.8Very high90.5Very high18 Ų1824.1 Ų24.19%0.09413%0.131CC..Hα-helixtrans-64.6-37.1177.3-172.958000112.3F307 V346 W347 Q360 R361 L362 V367 Q368F307-L364 HydrophobicContact CD1-CD1 3.76Å; F307-L364 HydrophobicContact CE1-CD1 4Å; V346-L364 HydrophobicContact CB-CD2 4.07Å; V346-L364 HydrophobicContact CG1-CD2 3.72Å; W347-L364 HydrophobicContact CB-CD2 4.3Å; W347-L364 HydrophobicContact CE3-CB 4.11Å; W347-L364 HydrophobicContact CE3-CD2 3.87Å; W347-L364 HydrophobicContact CE3-CG 3.94Å; W347-L364 HydrophobicContact CZ3-CB 4.21Å; Q360-L364 PolarHBondContact O-N 3.3Å; R361-L364 PolarHBondContact O-N 3.48Å; R361-L364 VanDerWaalsContact O-N 3.11Å; L362-L364 PolarHBondContact O-N 3.12Å; L364-V367 PolarHBondContact O-N 3.38Å; L364-Q368 PolarHBondContact O-N 3.16Å
365G93.7Very high91.1Very high0 Ų024.2 Ų24.20%013%0.13CC..Hα-helixtrans-61.6-43.217100000112.1R361 L362 Y363 V367 Q368 L369R361-G365 PolarHBondContact O-N 3.3Å; L362-G365 PolarHBondContact O-N 2.94Å; Y363-G365 VanDerWaalsContact C-N 3.33Å; Y363-G365 PolarHBondContact O-N 3.08Å; G365-V367 PolarHBondContact O-N 2.91Å; G365-Q368 WeakPolarHBondContact O-CB 3.33Å; G365-Q368 PolarHBondContact O-N 3.42Å; G365-L369 WeakPolarHBondContact O-CG 3.37Å; G365-L369 PolarHBondContact O-N 3.29Å
366I94.4Very high91.6Very high12 Ų1224.2 Ų24.26%0.06213%0.134CC..Hα-helixtrans-60.2-44.8174-68.8170.2000110.9P317 L362 Y363 Q368 L369 L370 L441 V444P317-I366 HydrophobicContact CG-CG2 4.19Å; L362-I366 HydrophobicContact CD1-CD1 4.44Å; L362-I366 HydrophobicContact CG-CD1 4.17Å; L362-I366 WeakPolarHBondContact O-CG1 3.32Å; L362-I366 PolarHBondContact O-N 3.11Å; Y363-I366 WeakPolarHBondContact O-CB 3.28Å; Y363-I366 PolarHBondContact O-N 2.93Å; Y363-I366 VanDerWaalsContact O-N 3.16Å; I366-Q368 VanDerWaalsContact C-N 3.33Å; I366-Q368 PolarHBondContact O-N 2.93Å; I366-L369 PolarHBondContact O-N 3.45Å; I366-L370 HydrophobicContact CG2-CD1 3.59Å; I366-L370 HydrophobicContact CG2-CG 4.24Å; I366-L370 WeakPolarHBondContact O-CB 3.43Å; I366-L370 VanDerWaalsContact O-CG 3.26Å; I366-L370 WeakPolarHBondContact O-CG 3.35Å; I366-L370 PolarHBondContact O-N 3.29Å; I366-L441 HydrophobicContact CG1-CD2 3.98Å; I366-V444 HydrophobicContact CG1-CG2 4.15Å; I366-V444 HydrophobicContact CG2-CG1 4.45Å; I366-V444 HydrophobicContact CG2-CG2 3.98Å
367V95Very high91.9Very high0 Ų031.7 Ų31.70%016%0.163CC..Hα-helixtrans-59.4-43.5177.1169.10000111.2L306 F307 P317 F321 Y363 L364 G365 S371L306-V367 HydrophobicContact CB-CG1 4.23Å; L306-V367 HydrophobicContact CD2-CG1 4.48Å; L306-V367 HydrophobicContact CD2-CG2 4.26Å; F307-V367 HydrophobicContact CE1-CG1 4.04Å; P317-V367 HydrophobicContact CB-CG2 4.23Å; F321-V367 HydrophobicContact CE2-CB 4.47Å; F321-V367 HydrophobicContact CE2-CG1 3.96Å; F321-V367 WeakPolarHBondContact CE2-O 3.36Å; F321-V367 HydrophobicContact CZ-CG1 3.87Å; Y363-V367 HydrophobicContact CD1-CG2 4.17Å; Y363-V367 HydrophobicContact CE1-CG2 3.72Å; Y363-V367 WeakPolarHBondContact O-CG2 3.35Å; Y363-V367 PolarHBondContact O-N 3.44Å; L364-V367 PolarHBondContact O-N 3.38Å; G365-V367 PolarHBondContact O-N 2.91Å; V367-S371 WeakPolarHBondContact O-CB 3.33Å; V367-S371 PolarHBondContact O-N 2.99Å; V367-S371 PolarHBondContact O-OG 2.91Å
368Q94.3Very high92.3Very high0 Ų034.2 Ų34.20%017%0.174CC..Hα-helixtrans-59.2-53175.4-81176.5-0.200112.2S343 L364 G365 I366 L370 S371 L372S343-Q368 PolarHBondContact O-NE2 3.45Å; S343-Q368 WeakPolarHBondContact OG-CG 3.43Å; L364-Q368 PolarHBondContact O-N 3.16Å; G365-Q368 WeakPolarHBondContact O-CB 3.33Å; G365-Q368 PolarHBondContact O-N 3.42Å; I366-Q368 VanDerWaalsContact C-N 3.33Å; I366-Q368 PolarHBondContact O-N 2.93Å; Q368-L370 VanDerWaalsContact C-N 3.34Å; Q368-L370 PolarHBondContact O-N 3.44Å; Q368-S371 PolarHBondContact O-N 3.28Å; Q368-S371 PolarHBondContact O-OG 3.47Å; Q368-L372 PolarHBondContact O-N 3.03Å; Q368-L372 VanDerWaalsContact O-N 3.1Å
369L94.8Very high92.5Very high0 Ų032.3 Ų32.30%017%0.165CC..Hα-helixtrans-63-40.4-177.5-64.6-175.5000112.1G365 I366 L372 R373 Y416 V417 L441 V444 M445G365-L369 WeakPolarHBondContact O-CG 3.37Å; G365-L369 PolarHBondContact O-N 3.29Å; I366-L369 PolarHBondContact O-N 3.45Å; L369-L372 PolarHBondContact O-N 3.22Å; L369-R373 WeakPolarHBondContact O-CG 3.46Å; L369-R373 PolarHBondContact O-N 2.91Å; L369-Y416 HydrophobicContact CD1-CD2 4.23Å; L369-Y416 VanDerWaalsContact CD2-CB 3.48Å; L369-Y416 HydrophobicContact CD2-CG 4.33Å; L369-V417 HydrophobicContact CD2-CG2 4.34Å; L369-L441 HydrophobicContact CD1-CB 4.23Å; L369-L441 HydrophobicContact CD1-CD2 3.8Å; L369-V444 HydrophobicContact CB-CG1 4.18Å; L369-M445 HydrophobicContact CB-CG 4.43Å; L369-M445 HydrophobicContact CB-SD 3.84Å; L369-M445 HydrophobicContact CD1-CG 3.84Å; L369-M445 HydrophobicContact CD1-SD 4.3Å; L369-M445 HydrophobicContact CD2-SD 4.33Å; L369-M445 HydrophobicContact CG-SD 4.37Å
370L95Very high92.7Very high1 Ų131.1 Ų31.11%0.00515%0.15CC..Hα-helixtrans-66.7-42.3175.4-70.1171.5000112.3P317 K318 F321 I366 Q368 L372 R373 Y374 V444P317-L370 HydrophobicContact CB-CD1 3.77Å; P317-L370 HydrophobicContact CG-CD1 3.88Å; K318-L370 HydrophobicContact CB-CD1 4.45Å; K318-L370 HydrophobicContact CD-CD2 4.4Å; K318-L370 HydrophobicContact CG-CD1 3.7Å; K318-L370 HydrophobicContact CG-CD2 3.44Å; K318-L370 VanDerWaalsContact CG-CD2 3.44Å; K318-L370 HydrophobicContact CG-CG 4.23Å; F321-L370 HydrophobicContact CD2-CB 3.53Å; F321-L370 HydrophobicContact CD2-CD1 4.43Å; F321-L370 HydrophobicContact CE2-CB 3.91Å; F321-L370 HydrophobicContact CG-CB 4.37Å; I366-L370 HydrophobicContact CG2-CD1 3.59Å; I366-L370 HydrophobicContact CG2-CG 4.24Å; I366-L370 WeakPolarHBondContact O-CB 3.43Å; I366-L370 VanDerWaalsContact O-CG 3.26Å; I366-L370 WeakPolarHBondContact O-CG 3.35Å; I366-L370 PolarHBondContact O-N 3.29Å; Q368-L370 VanDerWaalsContact C-N 3.34Å; Q368-L370 PolarHBondContact O-N 3.44Å; L370-L372 VanDerWaalsContact C-N 3.25Å; L370-L372 PolarHBondContact O-N 2.92Å; L370-R373 PolarHBondContact O-N 2.94Å; L370-R373 VanDerWaalsContact O-N 3.12Å; L370-Y374 HydrophobicContact CD2-CE2 4.27Å; L370-Y374 VanDerWaalsContact O-CD2 3.28Å; L370-Y374 WeakPolarHBondContact O-CD2 3.15Å; L370-Y374 PolarHBondContact O-N 2.99Å; L370-Y374 VanDerWaalsContact O-N 3.09Å; L370-V444 HydrophobicContact CD2-CG1 3.63Å; L370-V444 HydrophobicContact CG-CG1 3.71Å
371S95Very high92.9Very high0 Ų031.2 Ų31.20%016%0.163CC..Hα-helixtrans-59.8-38177.771.80000112I336 F340 V367 Q368 M375I336-S371 VanDerWaalsContact CG2-O 3.25Å; I336-S371 WeakPolarHBondContact CG2-O 3.47Å; F340-S371 WeakPolarHBondContact CB-OG 3.43Å; F340-S371 WeakPolarHBondContact CD2-OG 3.35Å; V367-S371 WeakPolarHBondContact O-CB 3.33Å; V367-S371 PolarHBondContact O-N 2.99Å; V367-S371 PolarHBondContact O-OG 2.91Å; Q368-S371 PolarHBondContact O-N 3.28Å; Q368-S371 PolarHBondContact O-OG 3.47Å; S371-M375 WeakPolarHBondContact O-CB 3.48Å; S371-M375 PolarHBondContact O-N 3.35Å
372L93.5Very high93Very high10 Ų1034.5 Ų34.55%0.05219%0.186CC..Hα-helixtrans-65.1-44.7173-78.1170.8000112.3F340 Q368 L369 L370 Y374 M375 L380 V417 C420 L421F340-L372 HydrophobicContact CD2-CD2 4.47Å; F340-L372 HydrophobicContact CD2-CG 4.14Å; F340-L372 HydrophobicContact CE1-CD2 3.93Å; F340-L372 HydrophobicContact CE2-CD1 3.87Å; F340-L372 HydrophobicContact CE2-CD2 3.87Å; F340-L372 HydrophobicContact CE2-CG 3.61Å; F340-L372 HydrophobicContact CZ-CD1 4.09Å; F340-L372 HydrophobicContact CZ-CD2 3.56Å; F340-L372 HydrophobicContact CZ-CG 3.84Å; Q368-L372 PolarHBondContact O-N 3.03Å; Q368-L372 VanDerWaalsContact O-N 3.1Å; L369-L372 PolarHBondContact O-N 3.22Å; L370-L372 VanDerWaalsContact C-N 3.25Å; L370-L372 PolarHBondContact O-N 2.92Å; L372-Y374 VanDerWaalsContact C-N 3.3Å; L372-Y374 PolarHBondContact O-N 3.32Å; L372-M375 PolarHBondContact O-N 3.35Å; L372-L380 HydrophobicContact CD2-CD1 3.57Å; L372-V417 HydrophobicContact CD1-CB 4.12Å; L372-V417 HydrophobicContact CD1-CG1 4.23Å; L372-V417 HydrophobicContact CD1-CG2 3.7Å; L372-C420 HydrophobicContact CD1-CB 4.32Å; L372-L421 HydrophobicContact CD2-CD2 4.23Å
373R92.2Very high93Very high76 Ų7633.3 Ų33.329%0.28718%0.18SC..Hα-helixtrans-59.9-37.6179.6-79.8-171.261.11651.6113.3L369 L370 V444 M445 K446L369-R373 WeakPolarHBondContact O-CG 3.46Å; L369-R373 PolarHBondContact O-N 2.91Å; L370-R373 PolarHBondContact O-N 2.94Å; L370-R373 VanDerWaalsContact O-N 3.12Å; R373-V444 WeakPolarHBondContact CD-O 3.46Å; R373-V444 PolarHBondContact NH1-O 2.64Å; R373-M445 HydrophobicContact CG-CE 4.49Å; R373-M445 HydrophobicContact CG-SD 4.07Å; R373-K446 PolarHBondContact NH1-O 3.01Å
374Y93.3Very high93Very high38 Ų3836.5 Ų36.515%0.14919%0.194CC..THydrogen-bonded Turntrans-92.5-0.2-178.3-70.5-75000113.9F321 K322 Q333 L370 L372F321-Y374 HydrophobicContact CB-CD2 3.3Å; F321-Y374 HydrophobicContact CB-CE2 3.83Å; F321-Y374 HydrophobicContact CB-CG 3.88Å; F321-Y374 HydrophobicContact CG-CD2 4.31Å; K322-Y374 HydrophobicContact CB-CD1 4.48Å; K322-Y374 HydrophobicContact CB-CE1 3.75Å; K322-Y374 HydrophobicContact CD-CD1 4.46Å; K322-Y374 HydrophobicContact CD-CE1 3.71Å; K322-Y374 HydrophobicContact CG-CE1 4.32Å; Q333-Y374 PolarHBondContact NE2-O 3.27Å; L370-Y374 HydrophobicContact CD2-CE2 4.27Å; L370-Y374 VanDerWaalsContact O-CD2 3.28Å; L370-Y374 WeakPolarHBondContact O-CD2 3.15Å; L370-Y374 PolarHBondContact O-N 2.99Å; L370-Y374 VanDerWaalsContact O-N 3.09Å; L372-Y374 VanDerWaalsContact C-N 3.3Å; L372-Y374 PolarHBondContact O-N 3.32Å
375M93.5Very high92.9Very high16 Ų1641.8 Ų41.88%0.07922%0.223CC..SBendtrans-79.7133.9177.6-163.9172.5-61.200111.2I336 K337 F340 S371 L372 T379 L380 V383I336-M375 HydrophobicContact CG2-CB 4.36Å; I336-M375 HydrophobicContact CG2-CE 4.14Å; K337-M375 HydrophobicContact CB-CE 4.48Å; F340-M375 HydrophobicContact CB-CE 3.82Å; F340-M375 HydrophobicContact CD1-CE 3.9Å; F340-M375 HydrophobicContact CG-CE 4.07Å; S371-M375 WeakPolarHBondContact O-CB 3.48Å; S371-M375 PolarHBondContact O-N 3.35Å; L372-M375 PolarHBondContact O-N 3.35Å; M375-T379 HydrophobicContact CG-CG2 3.76Å; M375-T379 HydrophobicContact SD-CG2 3.87Å; M375-L380 HydrophobicContact CG-CB 4.42Å; M375-L380 HydrophobicContact SD-CB 4.3Å; M375-L380 HydrophobicContact SD-CD1 4.06Å; M375-V383 HydrophobicContact SD-CG2 3.89Å
376A92.1Very high92.8Very high25 Ų2545 Ų4521%0.20724%0.24CC..  trans-69.5151.6175.100000111.1Q333 D378 T379 L380Q333-A376 HydrophobicContact CG-CB 4.16Å; A376-D378 VanDerWaalsContact C-N 3.28Å; A376-D378 PolarHBondContact O-N 3.41Å; A376-T379 PolarHBondContact O-N 3.43Å; A376-T379 VanDerWaalsContact O-N 3.09Å; A376-L380 WeakPolarHBondContact O-CB 3.34Å; A376-L380 PolarHBondContact O-N 3.07Å
377K90.2Very high92.8Very high181 Ų18144.5 Ų44.579%0.78724%0.237SC*.Hα-helixtrans-54.5-41.4-178.3-66.5-175.1178.7-178.20113.3L380 A381K377-L380 PolarHBondContact O-N 3.1Å; K377-A381 PolarHBondContact O-N 3.12Å
378D91Very high92.6Very high115 Ų11545.3 Ų45.362%0.61524%0.241SC*.Hα-helixtrans-64.8-42.7179.7-52.2-32.1000111.3A376 A381 S382A376-D378 VanDerWaalsContact C-N 3.28Å; A376-D378 PolarHBondContact O-N 3.41Å; D378-A381 PolarHBondContact O-N 3.11Å; D378-S382 PolarHBondContact O-N 2.86Å; D378-S382 VanDerWaalsContact O-N 3.16Å
379T92Very high92.5Very high18 Ų1852 Ų5211%0.1127%0.273CS..Hα-helixtrans-68.6-40.1178-50.70000111Q333 K337 M375 A376 A381 S382 V383Q333-T379 HydrophobicContact CB-CG2 4.33Å; K337-T379 HydrophobicContact CB-CG2 3.92Å; K337-T379 HydrophobicContact CD-CG2 4Å; K337-T379 HydrophobicContact CG-CG2 4.39Å; M375-T379 HydrophobicContact CG-CG2 3.76Å; M375-T379 HydrophobicContact SD-CG2 3.87Å; A376-T379 PolarHBondContact O-N 3.43Å; A376-T379 VanDerWaalsContact O-N 3.09Å; T379-A381 PolarHBondContact O-N 3.37Å; T379-S382 WeakPolarHBondContact O-CB 3.05Å; T379-S382 PolarHBondContact O-N 3.32Å; T379-S382 VanDerWaalsContact O-N 3.1Å; T379-S382 PolarHBondContact O-OG 3.24Å; T379-V383 PolarHBondContact O-N 3.26Å
380L91.7Very high92.5Very high34 Ų3454 Ų5418%0.17828%0.281CS..Hα-helixtrans-60.6-44175.5-169.371.5000111.5L372 M375 A376 K377 S382 V383 K384 L421L372-L380 HydrophobicContact CD2-CD1 3.57Å; M375-L380 HydrophobicContact CG-CB 4.42Å; M375-L380 HydrophobicContact SD-CB 4.3Å; M375-L380 HydrophobicContact SD-CD1 4.06Å; A376-L380 WeakPolarHBondContact O-CB 3.34Å; A376-L380 PolarHBondContact O-N 3.07Å; K377-L380 PolarHBondContact O-N 3.1Å; L380-S382 VanDerWaalsContact C-N 3.25Å; L380-S382 PolarHBondContact O-N 2.69Å; L380-V383 WeakPolarHBondContact O-CG2 3.45Å; L380-V383 PolarHBondContact O-N 3.24Å; L380-K384 PolarHBondContact O-N 3.36Å; L380-L421 HydrophobicContact CD1-CD2 3.52Å; L380-L421 HydrophobicContact CG-CD2 4.01Å
381A90.7Very high92.4Very high73 Ų7354.2 Ų54.260%0.60328%0.283SS*.Hα-helixtrans-60.5-36.8174.500000111.8K377 D378 T379 V383 K384K377-A381 PolarHBondContact O-N 3.12Å; D378-A381 PolarHBondContact O-N 3.11Å; T379-A381 PolarHBondContact O-N 3.37Å; A381-V383 VanDerWaalsContact C-N 3.3Å; A381-V383 PolarHBondContact O-N 3.17Å; A381-K384 PolarHBondContact O-N 3.06Å
382S92.3Very high92.3Very high72 Ų7260 Ų6050%0.50331%0.311SS..Hα-helixtrans-67.7-24.5-179.983.60000114.7K337 D378 T379 L380K337-S382 PolarHBondContact NZ-OG 3.46Å; D378-S382 PolarHBondContact O-N 2.86Å; D378-S382 VanDerWaalsContact O-N 3.16Å; T379-S382 WeakPolarHBondContact O-CB 3.05Å; T379-S382 PolarHBondContact O-N 3.32Å; T379-S382 VanDerWaalsContact O-N 3.1Å; T379-S382 PolarHBondContact O-OG 3.24Å; L380-S382 VanDerWaalsContact C-N 3.25Å; L380-S382 PolarHBondContact O-N 2.69Å
383V93.2Very high92.2Very high5 Ų565.4 Ų65.43%0.0333%0.334CS..Hα-helixtrans-106.3-2.7-178.6-65.50000113.8K337 F340 L341 M375 T379 L380 A381 D385 D386 A387K337-V383 HydrophobicContact CD-CG1 3.81Å; K337-V383 HydrophobicContact CG-CG1 3.73Å; F340-V383 HydrophobicContact CD1-CG2 4.45Å; F340-V383 HydrophobicContact CE1-CG2 4.36Å; L341-V383 HydrophobicContact CD1-CG1 4.16Å; L341-V383 HydrophobicContact CD2-CB 4.45Å; L341-V383 HydrophobicContact CD2-CG1 4.4Å; L341-V383 HydrophobicContact CG-CG1 4.48Å; M375-V383 HydrophobicContact SD-CG2 3.89Å; T379-V383 PolarHBondContact O-N 3.26Å; L380-V383 WeakPolarHBondContact O-CG2 3.45Å; L380-V383 PolarHBondContact O-N 3.24Å; A381-V383 VanDerWaalsContact C-N 3.3Å; A381-V383 PolarHBondContact O-N 3.17Å; V383-D385 PolarHBondContact O-N 3.34Å; V383-D386 PolarHBondContact O-N 2.93Å; V383-A387 WeakPolarHBondContact O-CB 3.46Å; V383-A387 PolarHBondContact O-N 3.23Å
384K92.3Very high92.3Very high73 Ų7361.8 Ų61.832%0.31732%0.321SS..Hα-helixtrans-51-54-168.4-177.5177.9175.2177.30113.3L380 A381 L388 L421L380-K384 PolarHBondContact O-N 3.36Å; A381-K384 PolarHBondContact O-N 3.06Å; K384-L388 HydrophobicContact CG-CD1 3.9Å; K384-L388 WeakPolarHBondContact O-CB 3.48Å; K384-L388 WeakPolarHBondContact O-CD1 3.41Å; K384-L388 VanDerWaalsContact O-CG 3.23Å; K384-L388 WeakPolarHBondContact O-CG 3.45Å; K384-L388 PolarHBondContact O-N 3.11Å; K384-L421 WeakPolarHBondContact CE-O 3.48Å
385D90.8Very high92.4Very high129 Ų12961 Ų6169%0.6932%0.319SS*.Hα-helixtrans-70-44.7-173.3-62.4-28.5000112.2V383 L388 Q389V383-D385 PolarHBondContact O-N 3.34Å; D385-L388 PolarHBondContact O-N 3.1Å; D385-Q389 PolarHBondContact O-N 3.01Å
386D92Very high92.4Very high68 Ų6862.8 Ų62.836%0.36434%0.336SS..Hα-helixtrans-63.5-44.6177.3-174.132.7000111.2V383 L388 Q389 K390V383-D386 PolarHBondContact O-N 2.93Å; D386-L388 PolarHBondContact O-N 2.9Å; D386-Q389 PolarHBondContact O-N 3.03Å; D386-K390 WeakPolarHBondContact O-CB 3.41Å; D386-K390 WeakPolarHBondContact O-CG 3.43Å; D386-K390 PolarHBondContact O-N 3.49Å; D386-K390 WeakPolarHBondContact OD1-CE 3.48Å
387A93.4Very high92.4Very high0 Ų061.9 Ų61.90%033%0.328CS..Hα-helixtrans-65.4-36.6178.500000112.9F340 L344 V383 S391 L421F340-A387 HydrophobicContact CE1-CB 3.56Å; F340-A387 HydrophobicContact CZ-CB 4.01Å; L344-A387 HydrophobicContact CD1-CB 3.96Å; V383-A387 WeakPolarHBondContact O-CB 3.46Å; V383-A387 PolarHBondContact O-N 3.23Å; A387-S391 WeakPolarHBondContact O-CB 3.41Å; A387-S391 PolarHBondContact O-N 3.24Å; A387-S391 PolarHBondContact O-OG 3Å; A387-L421 HydrophobicContact CB-CD1 3.71Å; A387-L421 HydrophobicContact CB-CD2 4.49Å
388L91.8Very high92.5Very high17 Ų1753.3 Ų53.39%0.08929%0.291CS..Hα-helixtrans-66.5-46.1174.3-76.7166000111.3K384 D385 D386 K390 S391 M392 L421 Q422K384-L388 HydrophobicContact CG-CD1 3.9Å; K384-L388 WeakPolarHBondContact O-CB 3.48Å; K384-L388 WeakPolarHBondContact O-CD1 3.41Å; K384-L388 VanDerWaalsContact O-CG 3.23Å; K384-L388 WeakPolarHBondContact O-CG 3.45Å; K384-L388 PolarHBondContact O-N 3.11Å; D385-L388 PolarHBondContact O-N 3.1Å; D386-L388 PolarHBondContact O-N 2.9Å; L388-K390 PolarHBondContact O-N 3.45Å; L388-S391 WeakPolarHBondContact CA-OG 3.45Å; L388-S391 PolarHBondContact O-N 3.27Å; L388-S391 PolarHBondContact O-OG 3.25Å; L388-M392 WeakPolarHBondContact O-CB 3.44Å; L388-M392 VanDerWaalsContact O-CG 3.3Å; L388-M392 WeakPolarHBondContact O-CG 3.47Å; L388-M392 PolarHBondContact O-N 2.96Å; L388-L421 HydrophobicContact CD2-CB 4.21Å; L388-L421 HydrophobicContact CD2-CD1 4.04Å; L388-L421 HydrophobicContact CG-CB 4.37Å; L388-L421 HydrophobicContact CG-CD1 3.96Å; L388-Q422 HydrophobicContact CD1-CG 4.02Å; L388-Q422 HydrophobicContact CD2-CG 4.39Å
389Q92.7Very high92.6Very high142 Ų14251 Ų5166%0.66428%0.278SS*.Hα-helixtrans-61.3-45.4178.2-173.4179.1-11.400111.5D385 D386 K393D385-Q389 PolarHBondContact O-N 3.01Å; D386-Q389 PolarHBondContact O-N 3.03Å; Q389-K393 PolarHBondContact O-N 3.19Å
390K93.9Very high92.3Very high41 Ų4151.8 Ų51.818%0.17829%0.287CS..Hα-helixtrans-65.9-40.3177.1-69.1-173.5-173.6-1510112.5L344 D345 D386 L388 K393 A394L344-K390 HydrophobicContact CB-CB 4.23Å; L344-K390 HydrophobicContact CB-CD 4.29Å; L344-K390 HydrophobicContact CD1-CB 4.3Å; D345-K390 WeakPolarHBondContact OD1-CE 3.49Å; D345-K390 IonicContact OD1-NZ 3.86Å; D345-K390 PolarHBondContact OD1-NZ 3.39Å; D345-K390 IonicContact OD2-NZ 3.04Å; D345-K390 PolarHBondContact OD2-NZ 2.9Å; D386-K390 WeakPolarHBondContact O-CB 3.41Å; D386-K390 WeakPolarHBondContact O-CG 3.43Å; D386-K390 PolarHBondContact O-N 3.49Å; D386-K390 WeakPolarHBondContact OD1-CE 3.48Å; L388-K390 PolarHBondContact O-N 3.45Å; K390-K393 PolarHBondContact O-N 3.44Å; K390-A394 WeakPolarHBondContact O-CB 3.28Å; K390-A394 PolarHBondContact O-N 3.43Å
391S93.1Very high92.1Very high5 Ų550.3 Ų50.34%0.03528%0.279CS..Hα-helixtrans-69.4-36.2178.965.90000112.4A387 L388 A394 L395 F414A387-S391 WeakPolarHBondContact O-CB 3.41Å; A387-S391 PolarHBondContact O-N 3.24Å; A387-S391 PolarHBondContact O-OG 3Å; L388-S391 WeakPolarHBondContact CA-OG 3.45Å; L388-S391 PolarHBondContact O-N 3.27Å; L388-S391 PolarHBondContact O-OG 3.25Å; S391-A394 PolarHBondContact O-N 2.7Å; S391-L395 WeakPolarHBondContact O-CB 3.27Å; S391-L395 PolarHBondContact O-N 3.24Å; S391-F414 WeakPolarHBondContact O-CD2 3.29Å
392M92Very high91.5Very high121 Ų12149 Ų4960%0.59626%0.264SS*.Hα-helixtrans-64.5-44.6172.2-73-178.972.700111.9L388 A394 L395 A396 F414L388-M392 WeakPolarHBondContact O-CB 3.44Å; L388-M392 VanDerWaalsContact O-CG 3.3Å; L388-M392 WeakPolarHBondContact O-CG 3.47Å; L388-M392 PolarHBondContact O-N 2.96Å; M392-A394 VanDerWaalsContact C-N 3.3Å; M392-A394 PolarHBondContact O-N 3.28Å; M392-L395 PolarHBondContact O-N 3.12Å; M392-A396 PolarHBondContact O-N 3.4Å; M392-F414 HydrophobicContact CB-CE2 4.44Å; M392-F414 HydrophobicContact CG-CE2 3.78Å; M392-F414 HydrophobicContact CG-CZ 4.09Å
393K93Very high91Very high124 Ų12448.3 Ų48.354%0.53925%0.251SS..Hα-helixtrans-59-44.7173.3-177-176177-171.30110.8Q389 K390 A396 N397Q389-K393 PolarHBondContact O-N 3.19Å; K390-K393 PolarHBondContact O-N 3.44Å; K393-A396 PolarHBondContact O-N 2.93Å; K393-N397 PolarHBondContact O-N 2.66Å
394A93.8Very high90.6Very high1 Ų151.3 Ų51.31%0.00827%0.267CS..Hα-helixtrans-61.9-46.3177.100000111.5W347 K390 S391 M392 A396 N397 H398W347-A394 HydrophobicContact CG-CB 4.48Å; K390-A394 WeakPolarHBondContact O-CB 3.28Å; K390-A394 PolarHBondContact O-N 3.43Å; S391-A394 PolarHBondContact O-N 2.7Å; M392-A394 VanDerWaalsContact C-N 3.3Å; M392-A394 PolarHBondContact O-N 3.28Å; A394-A396 VanDerWaalsContact C-N 3.34Å; A394-A396 PolarHBondContact O-N 2.91Å; A394-N397 PolarHBondContact O-N 3.11Å; A394-H398 PolarHBondContact O-N 3.37Å; A394-H398 PolarHBondContact O-ND1 2.88Å
395L94.4Very high90.4Very high21 Ų2149.8 Ų49.811%0.1126%0.262CS..Hα-helixtrans-56.3-48.5176.8177.566.1000111.2S391 M392 N397 H398 L399 K411 F414 F430S391-L395 WeakPolarHBondContact O-CB 3.27Å; S391-L395 PolarHBondContact O-N 3.24Å; M392-L395 PolarHBondContact O-N 3.12Å; L395-N397 VanDerWaalsContact C-N 3.31Å; L395-N397 PolarHBondContact O-N 3.38Å; L395-H398 PolarHBondContact O-N 3.28Å; L395-L399 HydrophobicContact CD1-CD1 3.97Å; L395-L399 HydrophobicContact CD1-CD2 4.43Å; L395-L399 HydrophobicContact CD1-CG 3.98Å; L395-L399 HydrophobicContact CD2-CD1 4.41Å; L395-L399 HydrophobicContact CG-CD1 3.86Å; L395-L399 HydrophobicContact CG-CG 4.24Å; L395-L399 WeakPolarHBondContact O-CB 3.37Å; L395-L399 VanDerWaalsContact O-CG 3.29Å; L395-L399 WeakPolarHBondContact O-CG 3.11Å; L395-L399 PolarHBondContact O-N 2.99Å; L395-K411 HydrophobicContact CD1-CG 4.45Å; L395-F414 HydrophobicContact CB-CB 4.24Å; L395-F414 HydrophobicContact CB-CD2 3.88Å; L395-F414 HydrophobicContact CB-CE2 4.45Å; L395-F414 HydrophobicContact CB-CG 4.03Å; L395-F414 HydrophobicContact CD1-CB 4.05Å; L395-F414 HydrophobicContact CD1-CG 4.32Å; L395-F414 HydrophobicContact CD2-CB 4.42Å; L395-F414 HydrophobicContact CD2-CD1 3.67Å; L395-F414 HydrophobicContact CD2-CD2 4.11Å; L395-F414 HydrophobicContact CD2-CE1 3.85Å; L395-F414 HydrophobicContact CD2-CE2 4.3Å; L395-F414 HydrophobicContact CD2-CG 3.79Å; L395-F414 HydrophobicContact CD2-CZ 4.16Å; L395-F414 HydrophobicContact CG-CB 4.46Å; L395-F414 HydrophobicContact CG-CG 4.26Å; L395-F430 HydrophobicContact CD2-CE2 4.35Å; L395-F430 HydrophobicContact CD2-CZ 3.88Å
396A93.2Very high90.4Very high53 Ų5344.1 Ų44.144%0.43823%0.231SC..Hα-helixtrans-56.1-46.3177.600000111.6M392 K393 A394 H398 L399 A400M392-A396 PolarHBondContact O-N 3.4Å; K393-A396 PolarHBondContact O-N 2.93Å; A394-A396 VanDerWaalsContact C-N 3.34Å; A394-A396 PolarHBondContact O-N 2.91Å; A396-H398 PolarHBondContact O-N 3.03Å; A396-L399 PolarHBondContact O-N 3.43Å; A396-A400 WeakPolarHBondContact O-CB 3.32Å; A396-A400 PolarHBondContact O-N 3.01Å
397N92.6Very high90.4Very high7 Ų743 Ų434%0.03722%0.224CC..Hα-helixtrans-66.7-35.2179.9-68.3-7.4000112.7S348 I353 K393 A394 L395 S401 W511S348-N397 PolarHBondContact O-ND2 2.87Å; I353-N397 HydrophobicContact CD1-CB 3.75Å; K393-N397 PolarHBondContact O-N 2.66Å; A394-N397 PolarHBondContact O-N 3.11Å; L395-N397 VanDerWaalsContact C-N 3.31Å; L395-N397 PolarHBondContact O-N 3.38Å; N397-S401 PolarHBondContact O-N 2.94Å; N397-W511 PolarHBondContact O-NE1 2.99Å
398H93.5Very high90.3Very high0 Ų043.3 Ų43.30%023%0.226CC..Hα-helixtrans-70.1-40.2174.1-73.775.7000112.4W347 I353 R361 A394 L395 A396 A400 S401 I406 Q407W347-H398 AromaticContact CD1-CE1 3.57Å; W347-H398 AromaticContact CD2-CE1 3.69Å; W347-H398 AromaticContact CD2-NE2 3.71Å; W347-H398 AromaticContact CE2-CE1 3.29Å; W347-H398 AromaticContact CE2-NE2 3.18Å; W347-H398 AromaticContact CG-CE1 3.85Å; W347-H398 AromaticContact CH2-NE2 3.75Å; W347-H398 AromaticContact CZ2-CE1 3.82Å; W347-H398 AromaticContact CZ2-NE2 3.22Å; W347-H398 WeakPolarHBondContact CZ2-NE2 3.41Å; W347-H398 AromaticContact NE1-CE1 3.17Å; W347-H398 PolarHBondContact NE1-CE1 2.97Å; W347-H398 AromaticContact NE1-NE2 3.56Å; W347-H398 PolarHBondContact O-CE1 3.19Å; W347-H398 VanDerWaalsContact O-CE1 3.24Å; I353-H398 WeakPolarHBondContact CD1-ND1 3.41Å; R361-H398 PolarHBondContact NH1-CD2 2.85Å; R361-H398 PolarHBondContact NH1-NE2 3.13Å; R361-H398 PolarHBondContact NH2-CE1 3.37Å; R361-H398 PolarHBondContact NH2-NE2 3.03Å; A394-H398 PolarHBondContact O-N 3.37Å; A394-H398 PolarHBondContact O-ND1 2.88Å; L395-H398 PolarHBondContact O-N 3.28Å; A396-H398 PolarHBondContact O-N 3.03Å; H398-A400 VanDerWaalsContact C-N 3.26Å; H398-A400 PolarHBondContact O-N 2.84Å; H398-S401 WeakPolarHBondContact O-CB 3.31Å; H398-S401 PolarHBondContact O-N 3.39Å; H398-I406 HydrophobicContact CB-CG2 4.48Å; H398-I406 PolarHBondContact CD2-O 3.32Å; H398-Q407 WeakPolarHBondContact O-CG 3.4Å
399L91.7Very high90.3Very high67 Ų6742.6 Ų42.635%0.35122%0.222SC..Hα-helixtrans-67.6-29.4177.1-68.4179000112.1L395 A396 S401 Q407 K411L395-L399 HydrophobicContact CD1-CD1 3.97Å; L395-L399 HydrophobicContact CD1-CD2 4.43Å; L395-L399 HydrophobicContact CD1-CG 3.98Å; L395-L399 HydrophobicContact CD2-CD1 4.41Å; L395-L399 HydrophobicContact CG-CD1 3.86Å; L395-L399 HydrophobicContact CG-CG 4.24Å; L395-L399 WeakPolarHBondContact O-CB 3.37Å; L395-L399 VanDerWaalsContact O-CG 3.29Å; L395-L399 WeakPolarHBondContact O-CG 3.11Å; L395-L399 PolarHBondContact O-N 2.99Å; A396-L399 PolarHBondContact O-N 3.43Å; L399-S401 PolarHBondContact O-N 3.32Å; L399-Q407 HydrophobicContact CD2-CB 4.49Å; L399-K411 HydrophobicContact CD2-CD 4.23Å; L399-K411 HydrophobicContact CD2-CG 3.87Å
400A87.4Confident90.4Very high35 Ų3535.9 Ų35.929%0.28919%0.191SC..THydrogen-bonded Turntrans-71.2-12.8171.800000113.2A396 H398A396-A400 WeakPolarHBondContact O-CB 3.32Å; A396-A400 PolarHBondContact O-N 3.01Å; H398-A400 VanDerWaalsContact C-N 3.26Å; H398-A400 PolarHBondContact O-N 2.84Å
401S86.9Confident90.4Very high2 Ų235.4 Ų35.41%0.01419%0.189CC..SBendtrans-63.1134.3173.1-172.90000110.2N397 H398 L399 R403 Q407 W511N397-S401 PolarHBondContact O-N 2.94Å; H398-S401 WeakPolarHBondContact O-CB 3.31Å; H398-S401 PolarHBondContact O-N 3.39Å; L399-S401 PolarHBondContact O-N 3.32Å; S401-R403 PolarHBondContact O-N 3.03Å; S401-R403 PolarHBondContact OG-N 3.01Å; S401-Q407 PolarHBondContact O-NE2 3.22Å; S401-W511 VanDerWaalsContact CB-CZ2 3.46Å
402P78.3Confident90.4Very high46 Ų4635.2 Ų35.230%0.29919%0.188SC..SBendtrans-72.8-9172.929-33.7000114H550P402-H550 HydrophobicContact CB-CB 3.28Å; P402-H550 HydrophobicContact CG-CB 3.58Å
403R81.2Confident90.5Very high57 Ų5729.6 Ų29.622%0.21516%0.16CC..  trans-97128.2-178-58.3173.152.394.8-5.4112S401 D405 I406 Q407S401-R403 PolarHBondContact O-N 3.03Å; S401-R403 PolarHBondContact OG-N 3.01Å; R403-D405 VanDerWaalsContact C-N 3.35Å; R403-D405 WeakPolarHBondContact CB-OD1 3.41Å; R403-D405 IonicContact CZ-OD1 2.68Å; R403-D405 IonicContact CZ-OD2 3.76Å; R403-D405 IonicContact NE-OD1 3.57Å; R403-D405 PolarHBondContact NE-OD1 3.48Å; R403-D405 VanDerWaalsContact NE-OD1 3.14Å; R403-D405 IonicContact NE-OD2 2.81Å; R403-D405 IonicContact NH2-OD1 2.94Å; R403-D405 IonicContact NH2-OD2 2.66Å; R403-D405 PolarHBondContact NH2-OD2 2.97Å; R403-D405 PolarHBondContact O-N 2.94Å; R403-I406 HydrophobicContact CB-CB 4.47Å; R403-I406 HydrophobicContact CB-CD1 4.27Å; R403-I406 HydrophobicContact CB-CG1 4.33Å; R403-I406 PolarHBondContact O-N 3.32Å; R403-Q407 WeakPolarHBondContact O-CG 3.21Å; R403-Q407 PolarHBondContact O-N 3.04Å; R403-Q407 VanDerWaalsContact O-N 3.14Å
404D85.4Confident90.5Very high68 Ų6824.6 Ų24.636%0.36414%0.139SC..Hα-helixtrans-65.1-33.7-177.1-173.360.4000113.6I406 Q407 T408D404-I406 PolarHBondContact O-N 3Å; D404-Q407 PolarHBondContact O-N 3.21Å; D404-T408 WeakPolarHBondContact O-CB 3.28Å; D404-T408 PolarHBondContact O-N 3.44Å; D404-T408 PolarHBondContact O-OG1 3.07Å
405D87.7Confident90.4Very high41 Ų4125.8 Ų25.822%0.21914%0.144CC..Hα-helixtrans-62.5-43.2177.360.9-10.7000112.3I358 R403 T408 L409 L437I358-D405 HydrophobicContact CD1-CB 4.19Å; R403-D405 VanDerWaalsContact C-N 3.35Å; R403-D405 WeakPolarHBondContact CB-OD1 3.41Å; R403-D405 IonicContact CZ-OD1 2.68Å; R403-D405 IonicContact CZ-OD2 3.76Å; R403-D405 IonicContact NE-OD1 3.57Å; R403-D405 PolarHBondContact NE-OD1 3.48Å; R403-D405 VanDerWaalsContact NE-OD1 3.14Å; R403-D405 IonicContact NE-OD2 2.81Å; R403-D405 IonicContact NH2-OD1 2.94Å; R403-D405 IonicContact NH2-OD2 2.66Å; R403-D405 PolarHBondContact NH2-OD2 2.97Å; R403-D405 PolarHBondContact O-N 2.94Å; D405-T408 PolarHBondContact O-N 2.82Å; D405-L409 PolarHBondContact O-N 3.43Å; D405-L437 HydrophobicContact CB-CD1 4.12Å
406I90Very high90.3Very high10 Ų1026.6 Ų26.65%0.05115%0.146CC..Hα-helixtrans-66.5-43.8174.5-65.3178.5000110.8I353 I358 H398 R403 D404 T408 L409 G410I353-I406 HydrophobicContact CG2-CD1 4.37Å; I353-I406 HydrophobicContact CG2-CG2 3.76Å; I358-I406 HydrophobicContact CD1-CG1 4.25Å; H398-I406 HydrophobicContact CB-CG2 4.48Å; H398-I406 PolarHBondContact CD2-O 3.32Å; R403-I406 HydrophobicContact CB-CB 4.47Å; R403-I406 HydrophobicContact CB-CD1 4.27Å; R403-I406 HydrophobicContact CB-CG1 4.33Å; R403-I406 PolarHBondContact O-N 3.32Å; D404-I406 PolarHBondContact O-N 3Å; I406-T408 VanDerWaalsContact C-N 3.28Å; I406-T408 PolarHBondContact O-N 3.1Å; I406-L409 PolarHBondContact O-N 3.38Å; I406-G410 PolarHBondContact O-N 2.96Å
407Q91.8Very high90.2Very high46 Ų4624.1 Ų24.122%0.21513%0.125CC..Hα-helixtrans-59.7-42.7176.5-66.6-178.124.400111H398 L399 S401 R403 D404 G410 K411H398-Q407 WeakPolarHBondContact O-CG 3.4Å; L399-Q407 HydrophobicContact CD2-CB 4.49Å; S401-Q407 PolarHBondContact O-NE2 3.22Å; R403-Q407 WeakPolarHBondContact O-CG 3.21Å; R403-Q407 PolarHBondContact O-N 3.04Å; R403-Q407 VanDerWaalsContact O-N 3.14Å; D404-Q407 PolarHBondContact O-N 3.21Å; Q407-G410 PolarHBondContact O-N 3.43Å; Q407-K411 VanDerWaalsContact O-CG 3.27Å; Q407-K411 WeakPolarHBondContact O-CG 3.47Å; Q407-K411 PolarHBondContact O-N 2.89Å
408T92.3Very high90.2Very high6 Ų624.1 Ų24.14%0.03713%0.126CC..Hα-helixtrans-61.4-48.3178.4-660000111.6D404 D405 I406 G410 K411 V412 Y432 V438D404-T408 WeakPolarHBondContact O-CB 3.28Å; D404-T408 PolarHBondContact O-N 3.44Å; D404-T408 PolarHBondContact O-OG1 3.07Å; D405-T408 PolarHBondContact O-N 2.82Å; I406-T408 VanDerWaalsContact C-N 3.28Å; I406-T408 PolarHBondContact O-N 3.1Å; T408-G410 VanDerWaalsContact C-N 3.32Å; T408-G410 PolarHBondContact O-N 3.21Å; T408-K411 PolarHBondContact O-N 3.27Å; T408-V412 HydrophobicContact CG2-CG2 4.37Å; T408-V412 WeakPolarHBondContact O-CG2 3.46Å; T408-V412 PolarHBondContact O-N 2.88Å; T408-Y432 HydrophobicContact CG2-CG 4.48Å; T408-V438 HydrophobicContact CG2-CG2 3.77Å
409L92.5Very high90Very high2 Ų229.4 Ų29.41%0.0115%0.148CC..Hα-helixtrans-57-45.8174.9-75.9176.4000111.9W347 I358 R361 L362 D405 I406 K411 V412 V413 L437 L441W347-L409 HydrophobicContact CH2-CB 4.22Å; W347-L409 HydrophobicContact CZ2-CB 4.45Å; I358-L409 HydrophobicContact CD1-CD1 3.46Å; I358-L409 VanDerWaalsContact CD1-CD1 3.46Å; I358-L409 HydrophobicContact CG1-CD1 4.31Å; R361-L409 HydrophobicContact CB-CD1 3.91Å; L362-L409 HydrophobicContact CD1-CD2 4Å; D405-L409 PolarHBondContact O-N 3.43Å; I406-L409 PolarHBondContact O-N 3.38Å; L409-K411 PolarHBondContact O-N 3.18Å; L409-V412 PolarHBondContact O-N 3.19Å; L409-V413 WeakPolarHBondContact O-CB 3.33Å; L409-V413 VanDerWaalsContact O-CG2 3.31Å; L409-V413 WeakPolarHBondContact O-CG2 3.48Å; L409-V413 PolarHBondContact O-N 3.38Å; L409-L437 HydrophobicContact CD1-CD1 4.46Å; L409-L437 HydrophobicContact CD2-CB 4.05Å; L409-L437 HydrophobicContact CD2-CD1 4.41Å; L409-L437 HydrophobicContact CG-CD1 4.21Å; L409-L441 HydrophobicContact CD2-CD1 3.81Å
410G93.9Very high89.8Confident1 Ų128 Ų281%0.0114%0.144CC..Hα-helixtrans-59.3-45.9178.300000112.9I406 Q407 T408 F414I406-G410 PolarHBondContact O-N 2.96Å; Q407-G410 PolarHBondContact O-N 3.43Å; T408-G410 VanDerWaalsContact C-N 3.32Å; T408-G410 PolarHBondContact O-N 3.21Å; G410-F414 WeakPolarHBondContact O-CB 3.46Å; G410-F414 PolarHBondContact O-N 3.08Å
411K93Very high89.9Confident31 Ų3126.6 Ų26.614%0.13513%0.132CC..Hα-helixtrans-60.6-51.4177.6-70.9165.2-172.3170.10111.7L395 L399 Q407 T408 L409 Q415 F430L395-K411 HydrophobicContact CD1-CG 4.45Å; L399-K411 HydrophobicContact CD2-CD 4.23Å; L399-K411 HydrophobicContact CD2-CG 3.87Å; Q407-K411 VanDerWaalsContact O-CG 3.27Å; Q407-K411 WeakPolarHBondContact O-CG 3.47Å; Q407-K411 PolarHBondContact O-N 2.89Å; T408-K411 PolarHBondContact O-N 3.27Å; L409-K411 PolarHBondContact O-N 3.18Å; K411-Q415 WeakPolarHBondContact O-CB 3.42Å; K411-Q415 PolarHBondContact O-N 3.01Å; K411-F430 HydrophobicContact CB-CB 3.93Å; K411-F430 HydrophobicContact CB-CD2 4.24Å; K411-F430 HydrophobicContact CB-CG 4.11Å; K411-F430 HydrophobicContact CD-CB 4.21Å; K411-F430 HydrophobicContact CG-CB 4.09Å; K411-F430 HydrophobicContact CG-CD1 4.38Å; K411-F430 HydrophobicContact CG-CG 4.09Å
412V93.1Very high89.9Confident1 Ų128.9 Ų28.91%0.00614%0.142CC..Hα-helixtrans-66.3-47.6-174.9176.20000111.4T408 L409 F414 Q415 Y416 Y432 V438 L441T408-V412 HydrophobicContact CG2-CG2 4.37Å; T408-V412 WeakPolarHBondContact O-CG2 3.46Å; T408-V412 PolarHBondContact O-N 2.88Å; L409-V412 PolarHBondContact O-N 3.19Å; V412-F414 PolarHBondContact O-N 3.11Å; V412-Q415 PolarHBondContact O-N 3.37Å; V412-Y416 HydrophobicContact CG1-CD2 3.88Å; V412-Y416 HydrophobicContact CG1-CE2 3.72Å; V412-Y416 VanDerWaalsContact O-CD2 3.26Å; V412-Y416 WeakPolarHBondContact O-CD2 3.3Å; V412-Y416 PolarHBondContact O-N 3Å; V412-Y416 VanDerWaalsContact O-N 3.14Å; V412-Y432 HydrophobicContact CG2-CD1 3.86Å; V412-Y432 HydrophobicContact CG2-CD2 4.22Å; V412-Y432 HydrophobicContact CG2-CE1 3.67Å; V412-Y432 HydrophobicContact CG2-CE2 4.06Å; V412-Y432 HydrophobicContact CG2-CG 4.14Å; V412-V438 HydrophobicContact CG2-CG2 4.14Å; V412-L441 HydrophobicContact CB-CD1 4.1Å; V412-L441 HydrophobicContact CG1-CB 4.1Å; V412-L441 HydrophobicContact CG1-CD1 3.7Å
413V93.9Very high90Very high2 Ų231.7 Ų31.71%0.01216%0.16CC..Hα-helixtrans-63.3-44.9179.71740000110.4W347 L409 Q415 Y416 V417 L441W347-V413 HydrophobicContact CH2-CG2 4.29Å; W347-V413 HydrophobicContact CZ2-CB 4.01Å; W347-V413 HydrophobicContact CZ2-CG1 4.24Å; W347-V413 HydrophobicContact CZ2-CG2 3.79Å; L409-V413 WeakPolarHBondContact O-CB 3.33Å; L409-V413 VanDerWaalsContact O-CG2 3.31Å; L409-V413 WeakPolarHBondContact O-CG2 3.48Å; L409-V413 PolarHBondContact O-N 3.38Å; V413-Q415 VanDerWaalsContact C-N 3.34Å; V413-Q415 PolarHBondContact O-N 3.14Å; V413-Y416 PolarHBondContact O-N 3.37Å; V413-V417 HydrophobicContact CG1-CG2 4.06Å; V413-V417 WeakPolarHBondContact O-CB 3.44Å; V413-V417 WeakPolarHBondContact O-CG2 3.33Å; V413-V417 PolarHBondContact O-N 2.95Å; V413-L441 HydrophobicContact CG2-CD1 3.84Å; V413-L441 HydrophobicContact CG2-CD2 4.26Å
414F94.3Very high89.9Confident20 Ų2038.1 Ų38.19%0.08819%0.193CC..Hα-helixtrans-60.5-43.1176.8178.4-92000112.3S391 M392 L395 G410 V412 Y416 V417 S418 I428 F430S391-F414 WeakPolarHBondContact O-CD2 3.29Å; M392-F414 HydrophobicContact CB-CE2 4.44Å; M392-F414 HydrophobicContact CG-CE2 3.78Å; M392-F414 HydrophobicContact CG-CZ 4.09Å; L395-F414 HydrophobicContact CB-CB 4.24Å; L395-F414 HydrophobicContact CB-CD2 3.88Å; L395-F414 HydrophobicContact CB-CE2 4.45Å; L395-F414 HydrophobicContact CB-CG 4.03Å; L395-F414 HydrophobicContact CD1-CB 4.05Å; L395-F414 HydrophobicContact CD1-CG 4.32Å; L395-F414 HydrophobicContact CD2-CB 4.42Å; L395-F414 HydrophobicContact CD2-CD1 3.67Å; L395-F414 HydrophobicContact CD2-CD2 4.11Å; L395-F414 HydrophobicContact CD2-CE1 3.85Å; L395-F414 HydrophobicContact CD2-CE2 4.3Å; L395-F414 HydrophobicContact CD2-CG 3.79Å; L395-F414 HydrophobicContact CD2-CZ 4.16Å; L395-F414 HydrophobicContact CG-CB 4.46Å; L395-F414 HydrophobicContact CG-CG 4.26Å; G410-F414 WeakPolarHBondContact O-CB 3.46Å; G410-F414 PolarHBondContact O-N 3.08Å; V412-F414 PolarHBondContact O-N 3.11Å; F414-Y416 VanDerWaalsContact C-N 3.33Å; F414-Y416 PolarHBondContact O-N 3.29Å; F414-V417 PolarHBondContact O-N 3.05Å; F414-S418 VanDerWaalsContact O-CB 3.3Å; F414-S418 WeakPolarHBondContact O-CB 3.39Å; F414-S418 PolarHBondContact O-N 3.46Å; F414-I428 HydrophobicContact CE1-CD1 3.85Å; F414-I428 HydrophobicContact CZ-CD1 4.48Å; F414-F430 AromaticContact CD1-CE2 3.79Å; F414-F430 HydrophobicContact CD1-CE2 3.79Å; F414-F430 HydrophobicContact CD1-CZ 4.38Å; F414-F430 HydrophobicContact CE1-CE2 4.21Å; F414-F430 HydrophobicContact CE1-CZ 4.49Å
415Q92.2Very high89.4Confident25 Ų2540.7 Ų40.712%0.11720%0.202CC..Hα-helixtrans-56.7-46.3177.4169.3167.10.500111.8K411 V412 V413 K419 I428 N429K411-Q415 WeakPolarHBondContact O-CB 3.42Å; K411-Q415 PolarHBondContact O-N 3.01Å; V412-Q415 PolarHBondContact O-N 3.37Å; V413-Q415 VanDerWaalsContact C-N 3.34Å; V413-Q415 PolarHBondContact O-N 3.14Å; Q415-K419 WeakPolarHBondContact O-CB 3.46Å; Q415-K419 PolarHBondContact O-N 3.36Å; Q415-I428 WeakPolarHBondContact CG-O 3.19Å; Q415-I428 PolarHBondContact NE2-O 3.31Å; Q415-I428 PolarHBondContact OE1-O 2.87Å; Q415-N429 PolarHBondContact NE2-OD1 3.34Å
416Y91.5Very high88.6Confident39 Ų3947.6 Ų47.615%0.15323%0.233CC..Hα-helixtrans-69.5-43.1177-77.6-65.2000113.1L369 V412 V413 F414 S418 K419 C420 Q442 M445L369-Y416 HydrophobicContact CD1-CD2 4.23Å; L369-Y416 VanDerWaalsContact CD2-CB 3.48Å; L369-Y416 HydrophobicContact CD2-CG 4.33Å; V412-Y416 HydrophobicContact CG1-CD2 3.88Å; V412-Y416 HydrophobicContact CG1-CE2 3.72Å; V412-Y416 VanDerWaalsContact O-CD2 3.26Å; V412-Y416 WeakPolarHBondContact O-CD2 3.3Å; V412-Y416 PolarHBondContact O-N 3Å; V412-Y416 VanDerWaalsContact O-N 3.14Å; V413-Y416 PolarHBondContact O-N 3.37Å; F414-Y416 VanDerWaalsContact C-N 3.33Å; F414-Y416 PolarHBondContact O-N 3.29Å; Y416-S418 VanDerWaalsContact C-N 3.35Å; Y416-S418 PolarHBondContact O-N 3.42Å; Y416-K419 PolarHBondContact O-N 3.19Å; Y416-C420 PolarHBondContact O-N 3.32Å; Y416-C420 PolarHBondContact O-SG 2.87Å; Y416-C420 VanDerWaalsContact O-SG 3.39Å; Y416-Q442 WeakPolarHBondContact OH-CG 3.47Å; Y416-M445 HydrophobicContact CD1-CB 4.06Å; Y416-M445 HydrophobicContact CD1-CE 3.79Å; Y416-M445 HydrophobicContact CD1-CG 3.72Å; Y416-M445 HydrophobicContact CD2-CG 4.21Å; Y416-M445 HydrophobicContact CE1-CB 3.69Å; Y416-M445 HydrophobicContact CE1-CE 4.47Å; Y416-M445 HydrophobicContact CE1-CG 3.83Å; Y416-M445 HydrophobicContact CE2-CG 4.32Å; Y416-M445 HydrophobicContact CG-CE 4.34Å; Y416-M445 HydrophobicContact CG-CG 3.92Å
417V92.2Very high87.8Confident1 Ų151.7 Ų51.71%0.00626%0.256CS..Hα-helixtrans-59-47.5177.21710000110.5L369 L372 V413 F414 K419 C420 L421L369-V417 HydrophobicContact CD2-CG2 4.34Å; L372-V417 HydrophobicContact CD1-CB 4.12Å; L372-V417 HydrophobicContact CD1-CG1 4.23Å; L372-V417 HydrophobicContact CD1-CG2 3.7Å; V413-V417 HydrophobicContact CG1-CG2 4.06Å; V413-V417 WeakPolarHBondContact O-CB 3.44Å; V413-V417 WeakPolarHBondContact O-CG2 3.33Å; V413-V417 PolarHBondContact O-N 2.95Å; F414-V417 PolarHBondContact O-N 3.05Å; V417-K419 PolarHBondContact O-N 3.02Å; V417-C420 PolarHBondContact O-N 3.34Å; V417-L421 HydrophobicContact CG1-CD1 3.65Å; V417-L421 HydrophobicContact CG1-CG 4.39Å; V417-L421 WeakPolarHBondContact O-CB 3.45Å; V417-L421 VanDerWaalsContact O-CG 3.32Å; V417-L421 WeakPolarHBondContact O-CG 3.37Å; V417-L421 PolarHBondContact O-N 3.43Å
418S90.7Very high87.1Confident7 Ų752.6 Ų52.65%0.04926%0.261CS..Hα-helixtrans-61.9-44.1177.9-166.90000111.5F414 Y416 C420 L421 Q422 I428F414-S418 VanDerWaalsContact O-CB 3.3Å; F414-S418 WeakPolarHBondContact O-CB 3.39Å; F414-S418 PolarHBondContact O-N 3.46Å; Y416-S418 VanDerWaalsContact C-N 3.35Å; Y416-S418 PolarHBondContact O-N 3.42Å; S418-C420 VanDerWaalsContact C-N 3.32Å; S418-C420 PolarHBondContact O-N 2.98Å; S418-L421 PolarHBondContact O-N 3.37Å; S418-Q422 PolarHBondContact O-N 2.7Å; S418-I428 WeakPolarHBondContact OG-CD1 3.32Å
419K89.5Confident86.5Confident110 Ų11058.2 Ų58.248%0.47829%0.291SS..Hα-helixtrans-59.8-40.9177.2-176.5-179.9179.5-174.90112.2Q415 Y416 V417Q415-K419 WeakPolarHBondContact O-CB 3.46Å; Q415-K419 PolarHBondContact O-N 3.36Å; Y416-K419 PolarHBondContact O-N 3.19Å; V417-K419 PolarHBondContact O-N 3.02Å
420C88.5Confident86Confident38 Ų3861 Ų6126%0.25730%0.303SS..Hα-helixtrans-70.7-39.5177.9-70.80000112.5L372 Y416 V417 S418L372-C420 HydrophobicContact CD1-CB 4.32Å; Y416-C420 PolarHBondContact O-N 3.32Å; Y416-C420 PolarHBondContact O-SG 2.87Å; Y416-C420 VanDerWaalsContact O-SG 3.39Å; V417-C420 PolarHBondContact O-N 3.34Å; S418-C420 VanDerWaalsContact C-N 3.32Å; S418-C420 PolarHBondContact O-N 2.98Å
421L89Confident85.4Confident6 Ų666.3 Ų66.33%0.03134%0.337CS..Hα-helixtrans-80.6-26.8-177.2-66.7174.8000113.6L372 L380 K384 A387 L388 V417 S418L372-L421 HydrophobicContact CD2-CD2 4.23Å; L380-L421 HydrophobicContact CD1-CD2 3.52Å; L380-L421 HydrophobicContact CG-CD2 4.01Å; K384-L421 WeakPolarHBondContact CE-O 3.48Å; A387-L421 HydrophobicContact CB-CD1 3.71Å; A387-L421 HydrophobicContact CB-CD2 4.49Å; L388-L421 HydrophobicContact CD2-CB 4.21Å; L388-L421 HydrophobicContact CD2-CD1 4.04Å; L388-L421 HydrophobicContact CG-CB 4.37Å; L388-L421 HydrophobicContact CG-CD1 3.96Å; V417-L421 HydrophobicContact CG1-CD1 3.65Å; V417-L421 HydrophobicContact CG1-CG 4.39Å; V417-L421 WeakPolarHBondContact O-CB 3.45Å; V417-L421 VanDerWaalsContact O-CG 3.32Å; V417-L421 WeakPolarHBondContact O-CG 3.37Å; V417-L421 PolarHBondContact O-N 3.43Å; S418-L421 PolarHBondContact O-N 3.37Å
422Q87.3Confident84.8Confident50 Ų5068 Ų6823%0.23434%0.344CS..  trans-135.468.4-176.1-66.2173.5-33.400111.2L388 S418 E424 Q425L388-Q422 HydrophobicContact CD1-CG 4.02Å; L388-Q422 HydrophobicContact CD2-CG 4.39Å; S418-Q422 PolarHBondContact O-N 2.7Å; Q422-E424 PolarHBondContact O-N 2.99Å; Q422-E424 VanDerWaalsContact O-N 3.15Å; Q422-Q425 HydrophobicContact CB-CB 4.26Å; Q422-Q425 PolarHBondContact O-N 2.82Å
423P80.4Confident84Confident104 Ų10473.6 Ų73.668%0.67537%0.373SS*.THydrogen-bonded Turntrans-66.7-16.5-176.727.5-35.7000114.2
424E78.5Confident83.2Confident193 Ų19378.2 Ų78.290%0.90241%0.412SS*.THydrogen-bonded Turntrans-81.8-15.4179.4-63.4172.6-174.300113.1Q422Q422-E424 PolarHBondContact O-N 2.99Å; Q422-E424 VanDerWaalsContact O-N 3.15Å
425Q76.2Confident82.8Confident121 Ų12178.7 Ų78.757%0.56542%0.418SS*.SBendtrans-90.1149.3-176.8-130.7165.8-1800110.8Q422 N427Q422-Q425 HydrophobicContact CB-CB 4.26Å; Q422-Q425 PolarHBondContact O-N 2.82Å; Q425-N427 PolarHBondContact O-N 3.13Å
426E70.3Confident82.5Confident186 Ų18682.5 Ų82.587%0.86945%0.445SS*.  trans-55.5137.5175.1-75.4-172.5164.800110.8I428E426-I428 PolarHBondContact O-N 3.35Å
427N71.8Confident82.3Confident97 Ų9782 Ų8252%0.51944%0.444SS..  trans-58.8115.1-178.9-75.2-43.9000110Q425 N429Q425-N427 PolarHBondContact O-N 3.13Å; N427-N429 PolarHBondContact O-N 2.94Å; N427-N429 VanDerWaalsContact O-N 3.1Å
428I77.7Confident82.1Confident65 Ų6582.2 Ų82.233%0.33345%0.445SS..  trans-66.1110.6172-54.7177000107.5F414 Q415 S418 E426 F430F414-I428 HydrophobicContact CE1-CD1 3.85Å; F414-I428 HydrophobicContact CZ-CD1 4.48Å; Q415-I428 WeakPolarHBondContact CG-O 3.19Å; Q415-I428 PolarHBondContact NE2-O 3.31Å; Q415-I428 PolarHBondContact OE1-O 2.87Å; S418-I428 WeakPolarHBondContact OG-CD1 3.32Å; E426-I428 PolarHBondContact O-N 3.35Å; I428-F430 HydrophobicContact CG2-CD2 3.96Å; I428-F430 HydrophobicContact CG2-CE2 3.33Å; I428-F430 HydrophobicContact CG2-CZ 3.69Å
429N79.2Confident82Confident124 Ų12486.3 Ų86.366%0.66347%0.467SS*.  trans-106.9111.8177.2-82.2-25000109.8Q415 N427Q415-N429 PolarHBondContact NE2-OD1 3.34Å; N427-N429 PolarHBondContact O-N 2.94Å; N427-N429 VanDerWaalsContact O-N 3.1Å
430F82.1Confident82Confident59 Ų5982.2 Ų82.226%0.25945%0.454SS..  trans-90.2140.7169.4-69.2-76.8000110.5L395 K411 F414 I428 Y432L395-F430 HydrophobicContact CD2-CE2 4.35Å; L395-F430 HydrophobicContact CD2-CZ 3.88Å; K411-F430 HydrophobicContact CB-CB 3.93Å; K411-F430 HydrophobicContact CB-CD2 4.24Å; K411-F430 HydrophobicContact CB-CG 4.11Å; K411-F430 HydrophobicContact CD-CB 4.21Å; K411-F430 HydrophobicContact CG-CB 4.09Å; K411-F430 HydrophobicContact CG-CD1 4.38Å; K411-F430 HydrophobicContact CG-CG 4.09Å; F414-F430 AromaticContact CD1-CE2 3.79Å; F414-F430 HydrophobicContact CD1-CE2 3.79Å; F414-F430 HydrophobicContact CD1-CZ 4.38Å; F414-F430 HydrophobicContact CE1-CE2 4.21Å; F414-F430 HydrophobicContact CE1-CZ 4.49Å; I428-F430 HydrophobicContact CG2-CD2 3.96Å; I428-F430 HydrophobicContact CG2-CE2 3.33Å; I428-F430 HydrophobicContact CG2-CZ 3.69Å; F430-Y432 HydrophobicContact CB-CD1 4.29Å; F430-Y432 WeakPolarHBondContact O-CD1 3.27Å; F430-Y432 VanDerWaalsContact O-CE1 3.25Å; F430-Y432 WeakPolarHBondContact O-CE1 3.47Å
431P81.6Confident82.2Confident113 Ų11380.5 Ų80.573%0.73444%0.442SS*.  trans-73130.2168.129.4-31.7000109.9
432Y81.3Confident82.2Confident68 Ų6883.1 Ų83.127%0.26745%0.454SS..  trans-150.9155.7172.247.4-101.9000110.4T408 V412 F430 V438T408-Y432 HydrophobicContact CG2-CG 4.48Å; V412-Y432 HydrophobicContact CG2-CD1 3.86Å; V412-Y432 HydrophobicContact CG2-CD2 4.22Å; V412-Y432 HydrophobicContact CG2-CE1 3.67Å; V412-Y432 HydrophobicContact CG2-CE2 4.06Å; V412-Y432 HydrophobicContact CG2-CG 4.14Å; F430-Y432 HydrophobicContact CB-CD1 4.29Å; F430-Y432 WeakPolarHBondContact O-CD1 3.27Å; F430-Y432 VanDerWaalsContact O-CE1 3.25Å; F430-Y432 WeakPolarHBondContact O-CE1 3.47Å; Y432-V438 HydrophobicContact CD2-CG1 4.28Å; Y432-V438 HydrophobicContact CD2-CG2 3.94Å; Y432-V438 HydrophobicContact CE2-CG1 3.69Å; Y432-V438 HydrophobicContact CE2-CG2 4.18Å
433N76.1Confident82.3Confident118 Ų11886.2 Ų86.263%0.63147%0.468SS*.  trans-77.9148.1179-66.9-36.5000110.9S435N433-S435 PolarHBondContact O-N 2.93Å
434A77.4Confident82.7Confident99 Ų9981.3 Ų81.382%0.81844%0.436SS*.  trans-60.6127.5170.400000109.3
435S85.2Confident83.1Confident30 Ų3073.8 Ų73.821%0.2140%0.402CS..  trans-150.9155.4178.575.40000109.9N433 L437 V438 D439N433-S435 PolarHBondContact O-N 2.93Å; S435-L437 PolarHBondContact O-N 2.65Å; S435-L437 VanDerWaalsContact O-N 3.08Å; S435-V438 WeakPolarHBondContact O-CB 3.32Å; S435-V438 PolarHBondContact O-N 3.19Å; S435-V438 WeakPolarHBondContact OG-CG2 3.38Å; S435-V438 PolarHBondContact OG-N 3.33Å; S435-D439 PolarHBondContact O-N 3.36Å; S435-D439 VanDerWaalsContact O-N 3.14Å
436P86.4Confident83.5Confident105 Ų10574.5 Ų74.568%0.68240%0.403SS*.Hα-helixtrans-57.6-24.9176.822.2-34.1000113.1A440P436-A440 WeakPolarHBondContact O-CB 3.18Å; P436-A440 PolarHBondContact O-N 3.09Å; P436-A440 VanDerWaalsContact O-N 3.11Å
437L87.4Confident82.9Confident29 Ų2972.7 Ų72.715%0.15240%0.399CS..Hα-helixtrans-65.1-43.2174.4-57.8178.9000111.6I358 L362 D405 L409 S435 L441I358-L437 HydrophobicContact CD1-CD1 4.31Å; I358-L437 HydrophobicContact CG1-CD1 4.11Å; I358-L437 HydrophobicContact CG1-CD2 4.33Å; L362-L437 HydrophobicContact CB-CD2 4.42Å; L362-L437 HydrophobicContact CD2-CD2 3.95Å; D405-L437 HydrophobicContact CB-CD1 4.12Å; L409-L437 HydrophobicContact CD1-CD1 4.46Å; L409-L437 HydrophobicContact CD2-CB 4.05Å; L409-L437 HydrophobicContact CD2-CD1 4.41Å; L409-L437 HydrophobicContact CG-CD1 4.21Å; S435-L437 PolarHBondContact O-N 2.65Å; S435-L437 VanDerWaalsContact O-N 3.08Å; L437-L441 WeakPolarHBondContact O-CG 3.23Å; L437-L441 PolarHBondContact O-N 3.02Å
438V87.6Confident82.2Confident4 Ų473.9 Ų73.92%0.02440%0.402CS..Hα-helixtrans-67.1-45.5178.1179.80000109.6T408 V412 Y432 S435 A440 L441 Q442T408-V438 HydrophobicContact CG2-CG2 3.77Å; V412-V438 HydrophobicContact CG2-CG2 4.14Å; Y432-V438 HydrophobicContact CD2-CG1 4.28Å; Y432-V438 HydrophobicContact CD2-CG2 3.94Å; Y432-V438 HydrophobicContact CE2-CG1 3.69Å; Y432-V438 HydrophobicContact CE2-CG2 4.18Å; S435-V438 WeakPolarHBondContact O-CB 3.32Å; S435-V438 PolarHBondContact O-N 3.19Å; S435-V438 WeakPolarHBondContact OG-CG2 3.38Å; S435-V438 PolarHBondContact OG-N 3.33Å; V438-A440 VanDerWaalsContact C-N 3.31Å; V438-A440 PolarHBondContact O-N 2.97Å; V438-L441 PolarHBondContact O-N 3.19Å; V438-Q442 HydrophobicContact CG1-CG 4.05Å; V438-Q442 WeakPolarHBondContact O-CB 3.34Å; V438-Q442 VanDerWaalsContact O-CG 3.28Å; V438-Q442 WeakPolarHBondContact O-CG 3.24Å; V438-Q442 PolarHBondContact O-N 3.21Å
439D89.4Confident80.1Confident93 Ų9379.6 Ų79.650%0.49743%0.427SS..Hα-helixtrans-58.4-43.7-179-65.5-27.8000111.6S435 Q442 E443S435-D439 PolarHBondContact O-N 3.36Å; S435-D439 VanDerWaalsContact O-N 3.14Å; D439-Q442 PolarHBondContact O-N 3.46Å; D439-E443 WeakPolarHBondContact O-CB 3.36Å; D439-E443 PolarHBondContact O-N 3.33Å
440A89.4Confident77.7Confident25 Ų2583.1 Ų83.121%0.20744%0.439CS..Hα-helixtrans-62.2-43.2177.300000112.8L362 P436 V438 V444L362-A440 HydrophobicContact CD1-CB 4.16Å; L362-A440 HydrophobicContact CD2-CB 4.1Å; P436-A440 WeakPolarHBondContact O-CB 3.18Å; P436-A440 PolarHBondContact O-N 3.09Å; P436-A440 VanDerWaalsContact O-N 3.11Å; V438-A440 VanDerWaalsContact C-N 3.31Å; V438-A440 PolarHBondContact O-N 2.97Å; A440-V444 WeakPolarHBondContact O-CG2 3.37Å; A440-V444 PolarHBondContact O-N 3.37Å
441L91.3Very high75.2Confident1 Ų183.2 Ų83.21%0.00546%0.458CS..Hα-helixtrans-69.2-38.4176.9-68173.1000111.9L362 I366 L369 L409 V412 V413 L437 V438 V444 M445L362-L441 HydrophobicContact CD1-CD1 4.39Å; L362-L441 HydrophobicContact CD1-CD2 3.98Å; L362-L441 HydrophobicContact CD1-CG 3.81Å; I366-L441 HydrophobicContact CG1-CD2 3.98Å; L369-L441 HydrophobicContact CD1-CB 4.23Å; L369-L441 HydrophobicContact CD1-CD2 3.8Å; L409-L441 HydrophobicContact CD2-CD1 3.81Å; V412-L441 HydrophobicContact CB-CD1 4.1Å; V412-L441 HydrophobicContact CG1-CB 4.1Å; V412-L441 HydrophobicContact CG1-CD1 3.7Å; V413-L441 HydrophobicContact CG2-CD1 3.84Å; V413-L441 HydrophobicContact CG2-CD2 4.26Å; L437-L441 WeakPolarHBondContact O-CG 3.23Å; L437-L441 PolarHBondContact O-N 3.02Å; V438-L441 PolarHBondContact O-N 3.19Å; L441-V444 PolarHBondContact O-N 2.87Å; L441-M445 PolarHBondContact O-N 2.92Å
442Q90Very high72.5Confident62 Ų6285.1 Ų85.129%0.2946%0.461SS..Hα-helixtrans-65.1-42.7176.4-73.8-174.1-6.200111.8Y416 V438 D439 V444 M445 K446Y416-Q442 WeakPolarHBondContact OH-CG 3.47Å; V438-Q442 HydrophobicContact CG1-CG 4.05Å; V438-Q442 WeakPolarHBondContact O-CB 3.34Å; V438-Q442 VanDerWaalsContact O-CG 3.28Å; V438-Q442 WeakPolarHBondContact O-CG 3.24Å; V438-Q442 PolarHBondContact O-N 3.21Å; D439-Q442 PolarHBondContact O-N 3.46Å; Q442-V444 PolarHBondContact O-N 3.31Å; Q442-M445 CarbonylContact O-C 3.58Å; Q442-M445 PolarHBondContact O-N 3.47Å; Q442-K446 WeakPolarHBondContact O-CG 3.47Å; Q442-K446 PolarHBondContact O-N 3.47Å
443E89Confident70Confident114 Ų11486.2 Ų86.253%0.53348%0.479SS..Hα-helixtrans-58.1-39.4176.6-167.5-167.7151.600111.8D439 M445 K446D439-E443 WeakPolarHBondContact O-CB 3.36Å; D439-E443 PolarHBondContact O-N 3.33Å; E443-M445 VanDerWaalsContact C-N 3.25Å; E443-M445 PolarHBondContact O-N 3.34Å; E443-K446 PolarHBondContact O-N 3.21Å
444V88.7Confident67.9Low1 Ų185.4 Ų85.41%0.00648%0.483CS..Hα-helixtrans-66.5-26.9176.1170.20000112.6I366 L369 L370 R373 A440 L441 Q442I366-V444 HydrophobicContact CG1-CG2 4.15Å; I366-V444 HydrophobicContact CG2-CG1 4.45Å; I366-V444 HydrophobicContact CG2-CG2 3.98Å; L369-V444 HydrophobicContact CB-CG1 4.18Å; L370-V444 HydrophobicContact CD2-CG1 3.63Å; L370-V444 HydrophobicContact CG-CG1 3.71Å; R373-V444 WeakPolarHBondContact CD-O 3.46Å; R373-V444 PolarHBondContact NH1-O 2.64Å; A440-V444 WeakPolarHBondContact O-CG2 3.37Å; A440-V444 PolarHBondContact O-N 3.37Å; L441-V444 PolarHBondContact O-N 2.87Å; Q442-V444 PolarHBondContact O-N 3.31Å
445M87.4Confident65.8Low35 Ų3588.2 Ų88.217%0.17248%0.477CS..Hα-helixtrans-97.2-5.4-178.9-69.9-57.8-70.600114.5L369 R373 Y416 L441 Q442 E443 D447L369-M445 HydrophobicContact CB-CG 4.43Å; L369-M445 HydrophobicContact CB-SD 3.84Å; L369-M445 HydrophobicContact CD1-CG 3.84Å; L369-M445 HydrophobicContact CD1-SD 4.3Å; L369-M445 HydrophobicContact CD2-SD 4.33Å; L369-M445 HydrophobicContact CG-SD 4.37Å; R373-M445 HydrophobicContact CG-CE 4.49Å; R373-M445 HydrophobicContact CG-SD 4.07Å; Y416-M445 HydrophobicContact CD1-CB 4.06Å; Y416-M445 HydrophobicContact CD1-CE 3.79Å; Y416-M445 HydrophobicContact CD1-CG 3.72Å; Y416-M445 HydrophobicContact CD2-CG 4.21Å; Y416-M445 HydrophobicContact CE1-CB 3.69Å; Y416-M445 HydrophobicContact CE1-CE 4.47Å; Y416-M445 HydrophobicContact CE1-CG 3.83Å; Y416-M445 HydrophobicContact CE2-CG 4.32Å; Y416-M445 HydrophobicContact CG-CE 4.34Å; Y416-M445 HydrophobicContact CG-CG 3.92Å; L441-M445 PolarHBondContact O-N 2.92Å; Q442-M445 CarbonylContact O-C 3.58Å; Q442-M445 PolarHBondContact O-N 3.47Å; E443-M445 VanDerWaalsContact C-N 3.25Å; E443-M445 PolarHBondContact O-N 3.34Å; M445-D447 PolarHBondContact O-N 3.34Å
446K85Confident63.1Low136 Ų13690.8 Ų90.859%0.59150%0.5SS*.SBendtrans-63.8132.3171.6-73.9172-172.1172.30109.4R373 Q442 E443 E448R373-K446 PolarHBondContact NH1-O 3.01Å; Q442-K446 WeakPolarHBondContact O-CG 3.47Å; Q442-K446 PolarHBondContact O-N 3.47Å; E443-K446 PolarHBondContact O-N 3.21Å; K446-E448 PolarHBondContact O-N 3.23Å
447D57.6Low60.6Low149 Ų14996.8 Ų96.880%0.79751%0.509SS*.  trans-59.5124.7173.6-71.3-38.9000108.2M445 Q449M445-D447 PolarHBondContact O-N 3.34Å; D447-Q449 PolarHBondContact O-N 3.26Å
448E55.8Low57.9Low122 Ų12299.4 Ų99.457%0.5752%0.523SS*.  trans-66.8109.1165-68.4-178.5167.900104.1K446 E450K446-E448 PolarHBondContact O-N 3.23Å; E448-E450 PolarHBondContact O-N 3.24Å
449Q33.6Very low55Low185 Ų185105.5 Ų105.586%0.86456%0.556SS**  trans-48.9123.2162.7-73.9-175.3-1900105.4D447 G451D447-Q449 PolarHBondContact O-N 3.26Å; Q449-G451 PolarHBondContact O-N 2.84Å
450E29.9Very low52.1Low197 Ų197110.2 Ų110.292%0.92158%0.575SS**  trans-5780.1169.5-74.9-178.8152.200107.4E448 D452E448-E450 PolarHBondContact O-N 3.24Å; E450-D452 PolarHBondContact O-N 3.15Å
451G29.5Very low49.3Very low62 Ų62114 Ų11464%0.63960%0.596SS**  trans-77.685.5167.800000105.7Q449 S453Q449-G451 PolarHBondContact O-N 2.84Å; G451-S453 PolarHBondContact O-N 3.31Å
452D24.8Very low46.4Very low152 Ų152122.1 Ų122.181%0.81364%0.638SS**  trans-23.7127139.3-101.5-29.4000110.2E450E450-D452 PolarHBondContact O-N 3.15Å
453S29.1Very low43.5Very low91 Ų91124.3 Ų124.364%0.63665%0.651SS**  trans6669.7165.3720000118.2G451 F455G451-S453 PolarHBondContact O-N 3.31Å; S453-F455 PolarHBondContact O-N 3.28Å
454S31.6Very low40.4Very low102 Ų102126.4 Ų126.471%0.71367%0.666SS**  trans-86.430.2140.763.40000112.2A456S454-A456 PolarHBondContact O-N 3.29Å; S454-A456 VanDerWaalsContact O-N 3.11Å
455F32.6Very low37.7Very low158 Ų158133 Ų13369%0.69370%0.695SS**THydrogen-bonded Turntrans-67.78.4162.9-88.5-80.8000113.2S453S453-F455 PolarHBondContact O-N 3.28Å
456A29.1Very low34.7Very low84 Ų84140.4 Ų140.469%0.69473%0.729SS**THydrogen-bonded Turntrans-127.635.6-170.900000115.1S454S454-A456 PolarHBondContact O-N 3.29Å; S454-A456 VanDerWaalsContact O-N 3.11Å
457R33.6Very low31.9Very low230 Ų230142.8 Ų142.887%0.86874%0.74SS**SBendtrans-136.10.4162-88.8-167.8177.7174-0.9116.5
458D31.6Very low30.3Very low85 Ų85145.2 Ų145.246%0.45575%0.746SS.*SBendtrans-107.1-2.1178.6-81.9-18000113.8R243R243-D458 IonicContact CZ-OD2 3.59Å; R243-D458 VanDerWaalsContact CZ-OD2 3.23Å; R243-D458 VanDerWaalsContact NH1-CB 3.3Å; R243-D458 IonicContact NH1-OD2 2.62Å; R243-D458 PolarHBondContact NH1-OD2 3.49Å; R243-D458 IonicContact NH2-OD2 3.91Å; R243-D458 PolarHBondContact NH2-OD2 2.99Å
459D26.3Very low28.7Very low132 Ų132147.9 Ų147.971%0.70676%0.759SS**SBendtrans-112.2127.6172.3-89.6-30.5000109.4
460Q29.3Very low28.2Very low191 Ų191148.1 Ų148.189%0.89376%0.76SS**  trans82.663.2-178.1-56.4174.30.100116.3
461T30.6Very low27.9Very low106 Ų106143.8 Ų143.865%0.6575%0.749SS**  trans-135.589.3133.7-1.80000108.1L463T461-L463 HydrophobicContact CG2-CD2 4.02Å; T461-L463 PolarHBondContact O-N 3.07Å
462L29.7Very low27.6Very low170 Ų170146.5 Ų146.589%0.8976%0.758SS**  trans-54102139-87.5157.7000104.2D464L462-D464 PolarHBondContact O-N 3.09Å
463L29.5Very low27.5Very low108 Ų108144.9 Ų144.957%0.56576%0.759SS**  trans-70.585.5-176.9-71.2163.4000108.5T461 F465T461-L463 HydrophobicContact CG2-CD2 4.02Å; T461-L463 PolarHBondContact O-N 3.07Å; L463-F465 HydrophobicContact CB-CD1 4.47Å; L463-F465 HydrophobicContact CB-CD2 4.05Å; L463-F465 HydrophobicContact CB-CE1 4Å; L463-F465 HydrophobicContact CB-CE2 3.53Å; L463-F465 HydrophobicContact CB-CZ 3.52Å; L463-F465 HydrophobicContact CD1-CE1 4.13Å; L463-F465 HydrophobicContact CD1-CE2 4.4Å; L463-F465 HydrophobicContact CD1-CZ 3.65Å; L463-F465 HydrophobicContact CD2-CE1 4.31Å; L463-F465 HydrophobicContact CG-CE1 4.37Å; L463-F465 HydrophobicContact CG-CZ 4.07Å; L463-F465 VanDerWaalsContact O-CD2 3.23Å; L463-F465 WeakPolarHBondContact O-CD2 3.48Å; L463-F465 PolarHBondContact O-N 3.41Å
464D24.1Very low27.4Very low159 Ų159145.1 Ų145.185%0.8577%0.766SS**  trans-68.6110.3149.7-78.8-28.1000106.5L462L462-D464 PolarHBondContact O-N 3.09Å
465F30.3Very low26.9Very low138 Ų138148.4 Ų148.461%0.60578%0.776SS**  trans-90.2104.6-177.4-69.5-79.7000109.5L463L463-F465 HydrophobicContact CB-CD1 4.47Å; L463-F465 HydrophobicContact CB-CD2 4.05Å; L463-F465 HydrophobicContact CB-CE1 4Å; L463-F465 HydrophobicContact CB-CE2 3.53Å; L463-F465 HydrophobicContact CB-CZ 3.52Å; L463-F465 HydrophobicContact CD1-CE1 4.13Å; L463-F465 HydrophobicContact CD1-CE2 4.4Å; L463-F465 HydrophobicContact CD1-CZ 3.65Å; L463-F465 HydrophobicContact CD2-CE1 4.31Å; L463-F465 HydrophobicContact CG-CE1 4.37Å; L463-F465 HydrophobicContact CG-CZ 4.07Å; L463-F465 VanDerWaalsContact O-CD2 3.23Å; L463-F465 WeakPolarHBondContact O-CD2 3.48Å; L463-F465 PolarHBondContact O-N 3.41Å
466E25.9Very low26.5Very low192 Ų192144.2 Ų144.290%0.89778%0.777SS**  trans-103.5148.8159.6-73.6-170.6163.800111
467F24.8Very low26.3Very low186 Ų186149.3 Ų149.382%0.81679%0.786SS**  trans-80.5144.3-161.7-83.9-111.1000113.7
468E24.7Very low25.9Very low200 Ų200143.3 Ų143.394%0.93579%0.786SS**  trans-137.1131.1145.1-71.8-167.2161.800110.1
469E21.9Very low25.5Very low177 Ų177147.8 Ų147.883%0.82780%0.804SS**  trans-98.7138.1173.4-74.1-176.4152.200109.3
470E23.7Very low25.4Very low191 Ų191148.2 Ų148.289%0.89381%0.812SS**  trans-139.3155.5161.9-91.9-85.1142.500109.2
471P23.4Very low25.1Very low106 Ų106145.1 Ų145.169%0.68881%0.809SS**  trans-97.1161.4-137.836-35.6000115.5
472S22.6Very low24.9Very low119 Ų119148.1 Ų148.183%0.83282%0.82SS**  trans-57125.3173.653.20000113.9
473S24.4Very low24.6Very low118 Ų118144.4 Ų144.483%0.82581%0.814SS**  trans-136106142.258.30000108.9
474A26Very low24.4Very low95 Ų95146 Ų14679%0.78582%0.823SS**  trans-100.5112.5171.900000107.5
475N22Very low24.5Very low172 Ų172143.2 Ų143.292%0.9282%0.816SS**  trans-104.9111.7156.6-80.2-12.9000107.1
476G24Very low24.2Very low70 Ų70139.9 Ų139.972%0.72282%0.82SS**  trans-109.4154.5150.300000106.5
477E24.6Very low24.3Very low191 Ų191140.3 Ų140.389%0.89382%0.822SS**  cis-157.1129.936.3-71.5171.8164.600107.1
478A25.3Very low24.5Very low103 Ų103138 Ų13885%0.85182%0.823SS**  75.6114.394.300000115.5
479E21.7Very low24.7Very low180 Ų180136 Ų13684%0.84182%0.819SS**  trans-70153.2174.2-61.7167.4153.200112.9
480T25.7Very low25.3Very low141 Ų141133 Ų13387%0.86582%0.815SS**  trans-144.8128.5151.641.40000110.5
481C23.4Very low25.7Very low125 Ų125133 Ų13385%0.84582%0.815SS**  trans-119.3127.7171.7-49.80000108.7
482I25.4Very low26.2Very low170 Ų170134.9 Ų134.987%0.87282%0.824SS**  trans-98.8132.4172.5-64.2174000108.5
483A23.6Very low26.8Very low92 Ų92135.4 Ų135.476%0.7682%0.818SS**  trans-86.5137.9173.900000111.2
484D24.2Very low27.2Very low141 Ų141136.3 Ų136.375%0.75481%0.813SS**  trans-147.4163150.4-154.66.6000112.7K533D484-K533 PolarHBondContact O-NZ 2.96Å
485S26.3Very low28.1Very low101 Ų101141.3 Ų141.371%0.70681%0.812SS**  trans-111.3150.2-150.7-32.30000110.9
486G25.7Very low29.8Very low68 Ų68139.2 Ų139.270%0.70181%0.81SS**  trans172.2133.9171.100000113.4
487E26.1Very low31.9Very low200 Ų200138 Ų13894%0.93579%0.785SS**  trans-75.3161.1-164-65.8159.9150.300115.2
488V30.4Very low34.2Very low139 Ų139131.8 Ų131.884%0.84276%0.761SS**  trans-134.3120.8166.2-176.50000109.7
489D28.6Very low36.8Very low157 Ų157134.3 Ų134.384%0.8476%0.756SS**  trans-69.9146.5170.4-85.2-35.2000112
490P34.2Very low39.7Very low114 Ų114126.3 Ų126.374%0.7472%0.719SS**  trans-112.8115.1178.135.7-21.2000112.1
491E32.6Very low42.5Very low192 Ų192123.3 Ų123.390%0.89770%0.703SS**  trans-148.4122.6153.3-72-165.216200110
492V33.6Very low45.4Very low145 Ų145124.7 Ų124.788%0.87969%0.692SS**  -174.8134.4107.2171.20000109.5
493N34.7Very low48.2Very low130 Ų130117.3 Ų117.370%0.69565%0.654SS**  trans-56.6142.9178.7-168.531.9000115.9
494D34.2Very low51.1Low136 Ų136116.9 Ų116.973%0.72764%0.636SS**  173.4121.3120.2-92.1-20.4000112.6
495R45Very low54Low201 Ų201114.3 Ų114.376%0.75862%0.62SS**  trans72.9110.3-174.4-59.8-174.9-179.3175.42.1115.4F497R495-F497 VanDerWaalsContact C-N 3.3Å; R495-F497 HydrophobicContact CB-CD2 4.23Å; R495-F497 HydrophobicContact CB-CE2 3.72Å; R495-F497 HydrophobicContact CB-CZ 4.19Å; R495-F497 WeakPolarHBondContact O-CD2 3.19Å; R495-F497 PolarHBondContact O-N 3.05Å
496S56.9Low57Low128 Ų128109.5 Ų109.590%0.89559%0.586SS**  trans-73.776.8179.459.30000111.5
497F68.5Low59.9Low45 Ų45106.3 Ų106.320%0.19755%0.553CS.*  trans-69155.5163.8-62.2-75.6000110.2R495 Q499 Y516 V520R495-F497 VanDerWaalsContact C-N 3.3Å; R495-F497 HydrophobicContact CB-CD2 4.23Å; R495-F497 HydrophobicContact CB-CE2 3.72Å; R495-F497 HydrophobicContact CB-CZ 4.19Å; R495-F497 WeakPolarHBondContact O-CD2 3.19Å; R495-F497 PolarHBondContact O-N 3.05Å; F497-Q499 PolarHBondContact O-N 3.16Å; F497-Y516 HydrophobicContact CE1-CE1 4.12Å; F497-V520 HydrophobicContact CD1-CB 4.17Å; F497-V520 HydrophobicContact CD1-CG1 3.99Å; F497-V520 HydrophobicContact CD2-CG1 4.04Å; F497-V520 HydrophobicContact CE1-CB 4.1Å; F497-V520 HydrophobicContact CE1-CG1 3.8Å; F497-V520 HydrophobicContact CE2-CG1 3.85Å; F497-V520 HydrophobicContact CG-CG1 4.1Å; F497-V520 HydrophobicContact CZ-CB 4.49Å; F497-V520 HydrophobicContact CZ-CG1 3.73Å
498P72.6Confident62.7Low59 Ų5999.3 Ų99.338%0.38352%0.522SS..  trans-52.1124177.6-23.831.8000111.4S525P498-S525 PolarHBondContact O-OG 3.23Å
499Q80.1Confident65.5Low157 Ų15794.3 Ų94.373%0.73449%0.49SS*.  trans-89107.4174.6-77-159.63.800110.3F497F497-Q499 PolarHBondContact O-N 3.16Å
500L82.8Confident68.3Low12 Ų1286.8 Ų86.86%0.06345%0.45CS..  trans-85151.8-179.3-64144.1000110.5E505 L509 A522 S525 R528L500-E505 HydrophobicContact CD2-CB 4.32Å; L500-E505 HydrophobicContact CD2-CG 3.64Å; L500-E505 WeakPolarHBondContact CD2-OE1 3.32Å; L500-E505 WeakPolarHBondContact CD2-OE2 3.37Å; L500-L509 HydrophobicContact CD1-CD1 3.72Å; L500-L509 HydrophobicContact CD2-CD1 3.75Å; L500-L509 HydrophobicContact CG-CD1 4.38Å; L500-A522 HydrophobicContact CD1-CB 3.76Å; L500-S525 PolarHBondContact N-OG 2.97Å; L500-R528 PolarHBondContact O-NH2 3.14Å
501S84.1Confident70.6Confident78 Ų7881.6 Ų81.655%0.54542%0.416SS..  trans-104.9-22.6-175.1-63.70000113.6L529S501-L529 VanDerWaalsContact O-CD2 3.23Å; S501-L529 WeakPolarHBondContact O-CD2 3.44Å
502Y83.4Confident72.6Confident154 Ų15476 Ų7660%0.60439%0.392SS*.  trans-120.4141.5-172.4-63.7-78.1000111.1E504 E505 C506Y502-E504 VanDerWaalsContact C-N 3.31Å; Y502-E505 PolarHBondContact O-N 3.15Å; Y502-C506 PolarHBondContact O-N 3.36Å; Y502-C506 PolarHBondContact O-SG 3.23Å
503I85.5Confident74.7Confident15 Ų1569.7 Ų69.78%0.07735%0.354CS..Hα-helixtrans-67.8-39.5-180-68.4175.4000109.2E505 C506 I507 L526 L529 L540 V544I503-E505 VanDerWaalsContact C-N 3.31Å; I503-E505 PolarHBondContact O-N 2.65Å; I503-C506 WeakPolarHBondContact O-CB 3.13Å; I503-C506 PolarHBondContact O-N 3.23Å; I503-C506 VanDerWaalsContact O-N 3.15Å; I503-I507 HydrophobicContact CG2-CD1 3.91Å; I503-I507 HydrophobicContact CG2-CG1 4.41Å; I503-I507 WeakPolarHBondContact O-CG1 3.47Å; I503-I507 PolarHBondContact O-N 2.89Å; I503-L526 HydrophobicContact CG2-CD1 3.99Å; I503-L529 HydrophobicContact CG1-CB 3.84Å; I503-L529 HydrophobicContact CG1-CD1 4.49Å; I503-L540 HydrophobicContact CD1-CD1 4.48Å; I503-V544 HydrophobicContact CG2-CG2 3.97Å
504E83.9Confident76.8Confident82 Ų8272.3 Ų72.338%0.38336%0.359SS..Hα-helixtrans-56.7-46.1178.3-57.788.7162.800111.2L355 Y502 C506 I507 D508L355-E504 HydrophobicContact CD1-CG 3.9Å; Y502-E504 VanDerWaalsContact C-N 3.31Å; E504-C506 VanDerWaalsContact C-N 3.34Å; E504-C506 PolarHBondContact O-N 2.94Å; E504-I507 PolarHBondContact O-N 3.25Å; E504-D508 PolarHBondContact O-N 3.11Å
505E85.8Confident79Confident88 Ų8871.1 Ų71.141%0.41135%0.349SS..Hα-helixtrans-64.8-38178.8-161.6-175.6-174.900111.8L500 Y502 I503 D508 L509L500-E505 HydrophobicContact CD2-CB 4.32Å; L500-E505 HydrophobicContact CD2-CG 3.64Å; L500-E505 WeakPolarHBondContact CD2-OE1 3.32Å; L500-E505 WeakPolarHBondContact CD2-OE2 3.37Å; Y502-E505 PolarHBondContact O-N 3.15Å; I503-E505 VanDerWaalsContact C-N 3.31Å; I503-E505 PolarHBondContact O-N 2.65Å; E505-D508 PolarHBondContact O-N 3.11Å; E505-L509 WeakPolarHBondContact O-CG 3.5Å; E505-L509 PolarHBondContact O-N 3.11Å
506C88.6Confident80.9Confident0 Ų065.6 Ų65.60%033%0.329CS..Hα-helixtrans-63.5-43.5174.4-62.80000111.1Y502 I503 E504 L509 L510 A522 L526 L529Y502-C506 PolarHBondContact O-N 3.36Å; Y502-C506 PolarHBondContact O-SG 3.23Å; I503-C506 WeakPolarHBondContact O-CB 3.13Å; I503-C506 PolarHBondContact O-N 3.23Å; I503-C506 VanDerWaalsContact O-N 3.15Å; E504-C506 VanDerWaalsContact C-N 3.34Å; E504-C506 PolarHBondContact O-N 2.94Å; C506-L509 PolarHBondContact O-N 3.47Å; C506-L510 WeakPolarHBondContact O-CB 3.32Å; C506-L510 VanDerWaalsContact O-CG 3.23Å; C506-L510 WeakPolarHBondContact O-CG 3.26Å; C506-L510 PolarHBondContact O-N 3.12Å; C506-A522 HydrophobicContact CB-CB 4.28Å; C506-L526 HydrophobicContact CB-CB 4.26Å; C506-L526 HydrophobicContact CB-CD1 4.14Å; C506-L529 VanDerWaalsContact SG-CD1 3.58Å
507I86.4Confident82.2Confident0 Ų065.5 Ų65.50%032%0.315CS..Hα-helixtrans-63.6-45.8178.9-66.9168.8000110.6C354 L355 I503 E504 L509 L510 W511 V544 L547C354-I507 HydrophobicContact CB-CG2 3.48Å; C354-I507 VanDerWaalsContact CB-CG2 3.48Å; L355-I507 HydrophobicContact CD1-CD1 3.71Å; L355-I507 HydrophobicContact CD2-CD1 3.32Å; L355-I507 HydrophobicContact CG-CD1 3.49Å; L355-I507 VanDerWaalsContact CG-CD1 3.49Å; I503-I507 HydrophobicContact CG2-CD1 3.91Å; I503-I507 HydrophobicContact CG2-CG1 4.41Å; I503-I507 WeakPolarHBondContact O-CG1 3.47Å; I503-I507 PolarHBondContact O-N 2.89Å; E504-I507 PolarHBondContact O-N 3.25Å; I507-L509 VanDerWaalsContact C-N 3.26Å; I507-L509 PolarHBondContact O-N 3.37Å; I507-L510 PolarHBondContact O-N 3.47Å; I507-L510 VanDerWaalsContact O-N 3.16Å; I507-W511 HydrophobicContact CG2-CE3 4.33Å; I507-W511 VanDerWaalsContact O-CB 3.26Å; I507-W511 WeakPolarHBondContact O-CB 3.45Å; I507-W511 PolarHBondContact O-N 3.08Å; I507-V544 HydrophobicContact CD1-CG2 3.97Å; I507-L547 HydrophobicContact CG1-CD2 4.36Å; I507-L547 HydrophobicContact CG2-CD2 4.43Å
508D85.5Confident83.1Confident53 Ų5366.5 Ų66.528%0.28332%0.32SS..Hα-helixtrans-55.1-43.8178.3-74.6-33.6000111.7P350 S351 E504 E505 W511 D512P350-D508 WeakPolarHBondContact CB-OD1 3.42Å; P350-D508 WeakPolarHBondContact CD-OD1 3.46Å; S351-D508 WeakPolarHBondContact CA-OD1 3.5Å; S351-D508 WeakPolarHBondContact CB-OD1 3.5Å; S351-D508 PolarHBondContact N-OD1 3.05Å; S351-D508 PolarHBondContact OG-OD1 3.27Å; S351-D508 PolarHBondContact OG-OD2 3.39Å; E504-D508 PolarHBondContact O-N 3.11Å; E505-D508 PolarHBondContact O-N 3.11Å; D508-W511 PolarHBondContact O-N 2.89Å; D508-D512 PolarHBondContact O-N 3.41Å
509L88Confident83.9Confident34 Ų3463.7 Ų63.718%0.17830%0.301CS..Hα-helixtrans-71.3-39177.7-67.2177.4000113L500 E505 C506 I507 W511 S513 Q518 A522L500-L509 HydrophobicContact CD1-CD1 3.72Å; L500-L509 HydrophobicContact CD2-CD1 3.75Å; L500-L509 HydrophobicContact CG-CD1 4.38Å; E505-L509 WeakPolarHBondContact O-CG 3.5Å; E505-L509 PolarHBondContact O-N 3.11Å; C506-L509 PolarHBondContact O-N 3.47Å; I507-L509 VanDerWaalsContact C-N 3.26Å; I507-L509 PolarHBondContact O-N 3.37Å; L509-W511 PolarHBondContact O-N 3.03Å; L509-S513 WeakPolarHBondContact O-CA 3.49Å; L509-S513 WeakPolarHBondContact O-CB 3.33Å; L509-S513 PolarHBondContact O-N 3.26Å; L509-Q518 HydrophobicContact CD1-CB 4.29Å; L509-Q518 HydrophobicContact CD2-CB 4.06Å; L509-Q518 VanDerWaalsContact CD2-OE1 3.3Å; L509-A522 HydrophobicContact CB-CB 3.68Å; L509-A522 HydrophobicContact CD1-CB 4.18Å
510L87.4Confident84.2Confident0 Ų056.2 Ų56.20%027%0.266CS..Hα-helixtrans-67.3-28.5175.3-71172.2000112.3C506 I507 F519 A522 L523 L526 L547 L551C506-L510 WeakPolarHBondContact O-CB 3.32Å; C506-L510 VanDerWaalsContact O-CG 3.23Å; C506-L510 WeakPolarHBondContact O-CG 3.26Å; C506-L510 PolarHBondContact O-N 3.12Å; I507-L510 PolarHBondContact O-N 3.47Å; I507-L510 VanDerWaalsContact O-N 3.16Å; L510-F519 HydrophobicContact CD2-CD2 4.06Å; L510-F519 HydrophobicContact CD2-CE2 3.85Å; L510-F519 HydrophobicContact CD2-CG 4.49Å; L510-F519 HydrophobicContact CD2-CZ 4.1Å; L510-A522 HydrophobicContact CD2-CB 4.2Å; L510-A522 HydrophobicContact CG-CB 3.97Å; L510-L523 HydrophobicContact CD1-CD1 4.47Å; L510-L523 HydrophobicContact CD2-CB 3.93Å; L510-L523 HydrophobicContact CD2-CD1 4.2Å; L510-L526 HydrophobicContact CD1-CD2 3.71Å; L510-L547 HydrophobicContact CB-CD2 4.49Å; L510-L547 HydrophobicContact CD1-CD2 4.33Å; L510-L551 HydrophobicContact CB-CD1 4.39Å; L510-L551 HydrophobicContact CD2-CD2 4.21Å
511W82.9Confident84.4Confident5 Ų555.6 Ų55.62%0.01926%0.263CS..Hα-helixtrans-78.5-36.7-175.7-160.3-76.7000113.9P350 I353 C354 N397 S401 I507 D508 L509 L547 R554P350-W511 HydrophobicContact CB-CB 3.62Å; P350-W511 HydrophobicContact CB-CD2 4.07Å; P350-W511 HydrophobicContact CB-CG 3.54Å; P350-W511 HydrophobicContact CG-CB 4.5Å; P350-W511 HydrophobicContact CG-CG 4.47Å; I353-W511 HydrophobicContact CB-CH2 4.39Å; I353-W511 HydrophobicContact CB-CZ2 4.28Å; I353-W511 HydrophobicContact CG2-CH2 3.38Å; I353-W511 HydrophobicContact CG2-CZ2 3.32Å; I353-W511 HydrophobicContact CG2-CZ3 4.24Å; C354-W511 HydrophobicContact CB-CE3 3.91Å; C354-W511 HydrophobicContact CB-CH2 4.41Å; C354-W511 HydrophobicContact CB-CZ3 3.49Å; C354-W511 VanDerWaalsContact CB-CZ3 3.49Å; N397-W511 PolarHBondContact O-NE1 2.99Å; S401-W511 VanDerWaalsContact CB-CZ2 3.46Å; I507-W511 HydrophobicContact CG2-CE3 4.33Å; I507-W511 VanDerWaalsContact O-CB 3.26Å; I507-W511 WeakPolarHBondContact O-CB 3.45Å; I507-W511 PolarHBondContact O-N 3.08Å; D508-W511 PolarHBondContact O-N 2.89Å; L509-W511 PolarHBondContact O-N 3.03Å; W511-L547 HydrophobicContact CD2-CD1 4.49Å; W511-L547 HydrophobicContact CE3-CD1 3.36Å; W511-L547 HydrophobicContact CZ3-CD1 3.36Å; W511-R554 PolarHBondContact O-NH1 3.27Å; W511-R554 PolarHBondContact O-NH2 3.04Å
512D75.8Confident84.7Confident75 Ų7551.9 Ų51.940%0.40124%0.238SC..Hα-helixtrans-151.717.3-176.4-142.823.1000115.7D508 K514 R554D508-D512 PolarHBondContact O-N 3.41Å; D512-K514 PolarHBondContact O-N 3.48Å; D512-R554 IonicContact OD1-NH1 2.63Å
513S77.6Confident85Confident11 Ų1144.6 Ų44.68%0.07721%0.209CC..  trans-65.1128.4175.7-173.80000111.1L509 E515 Q518 F555L509-S513 WeakPolarHBondContact O-CA 3.49Å; L509-S513 WeakPolarHBondContact O-CB 3.33Å; L509-S513 PolarHBondContact O-N 3.26Å; S513-E515 PolarHBondContact OG-N 3.06Å; S513-E515 VanDerWaalsContact OG-N 3.12Å; S513-E515 PolarHBondContact OG-O 3.44Å; S513-Q518 WeakPolarHBondContact OG-CB 3.39Å; S513-Q518 PolarHBondContact OG-OE1 2.93Å; S513-Q518 VanDerWaalsContact OG-OE1 3.08Å; S513-F555 WeakPolarHBondContact O-CE2 3.33Å
514K77.2Confident85.1Confident185 Ų18546.2 Ų46.280%0.80422%0.221SC*.  trans-89.3-6.8170.2-61.6-176.5-177.5179.30112.1D512 F555D512-K514 PolarHBondContact O-N 3.48Å; K514-F555 WeakPolarHBondContact O-CZ 3.4Å
515E82.1Confident85.4Confident112 Ų11242.5 Ų42.552%0.52320%0.204SC..  trans-102.5121.8-177.1-71.1-175.4-166.500110.9S513 E517 Q518 F519S513-E515 PolarHBondContact OG-N 3.06Å; S513-E515 VanDerWaalsContact OG-N 3.12Å; S513-E515 PolarHBondContact OG-O 3.44Å; E515-E517 VanDerWaalsContact C-N 3.34Å; E515-E517 PolarHBondContact O-N 2.94Å; E515-Q518 HydrophobicContact CB-CB 4.19Å; E515-Q518 HydrophobicContact CB-CG 3.91Å; E515-Q518 PolarHBondContact O-N 2.84Å; E515-Q518 VanDerWaalsContact OE2-CD 3.26Å; E515-Q518 PolarHBondContact OE2-NE2 3.09Å; E515-F519 PolarHBondContact O-N 3.26Å; E515-F519 VanDerWaalsContact O-N 3.08Å
516Y84.2Confident85.6Confident84 Ų8438.3 Ų38.333%0.32918%0.184SC..Hα-helixtrans-52.5-48.3-179.4168.5-102.8000113F497 Q518 F519 V520 F555 H556 F557F497-Y516 HydrophobicContact CE1-CE1 4.12Å; Y516-Q518 VanDerWaalsContact C-N 3.34Å; Y516-Q518 PolarHBondContact O-N 2.94Å; Y516-F519 PolarHBondContact O-N 3.3Å; Y516-V520 HydrophobicContact CD2-CG2 3.95Å; Y516-V520 HydrophobicContact CE1-CG2 4.49Å; Y516-V520 HydrophobicContact CE2-CG2 3.54Å; Y516-V520 WeakPolarHBondContact O-CG2 3.31Å; Y516-V520 PolarHBondContact O-N 3.44Å; Y516-F555 HydrophobicContact CD2-CB 3.75Å; Y516-F555 HydrophobicContact CD2-CD1 4.47Å; Y516-F555 HydrophobicContact CD2-CG 4.17Å; Y516-F555 HydrophobicContact CE2-CB 4.36Å; Y516-H556 WeakPolarHBondContact CE2-O 3.38Å; Y516-F557 HydrophobicContact CE2-CB 4.44Å
517E84.6Confident85.5Confident127 Ų12740.8 Ų40.859%0.59320%0.196SC*.Hα-helixtrans-66-37-175.4-65-173.7171.100112.5E515 G521E515-E517 VanDerWaalsContact C-N 3.34Å; E515-E517 PolarHBondContact O-N 2.94Å; E517-G521 PolarHBondContact O-N 3.34Å
518Q87.6Confident85.5Confident65 Ų6544.1 Ų44.130%0.30421%0.209SC..Hα-helixtrans-68.9-45.4177.1-64.6-177.90.700111.2L509 S513 E515 Y516 G521 A522L509-Q518 HydrophobicContact CD1-CB 4.29Å; L509-Q518 HydrophobicContact CD2-CB 4.06Å; L509-Q518 VanDerWaalsContact CD2-OE1 3.3Å; S513-Q518 WeakPolarHBondContact OG-CB 3.39Å; S513-Q518 PolarHBondContact OG-OE1 2.93Å; S513-Q518 VanDerWaalsContact OG-OE1 3.08Å; E515-Q518 HydrophobicContact CB-CB 4.19Å; E515-Q518 HydrophobicContact CB-CG 3.91Å; E515-Q518 PolarHBondContact O-N 2.84Å; E515-Q518 VanDerWaalsContact OE2-CD 3.26Å; E515-Q518 PolarHBondContact OE2-NE2 3.09Å; Y516-Q518 VanDerWaalsContact C-N 3.34Å; Y516-Q518 PolarHBondContact O-N 2.94Å; Q518-G521 PolarHBondContact O-N 3.45Å; Q518-A522 VanDerWaalsContact O-CB 3.26Å; Q518-A522 WeakPolarHBondContact O-CB 3.46Å; Q518-A522 PolarHBondContact O-N 3.28Å
519F88.2Confident85.6Confident0 Ų041.8 Ų41.80%020%0.196CC..Hα-helixtrans-61.4-47.7178.7-177.5-90.5000111.7L510 E515 Y516 A522 L523 L551 F555 F560L510-F519 HydrophobicContact CD2-CD2 4.06Å; L510-F519 HydrophobicContact CD2-CE2 3.85Å; L510-F519 HydrophobicContact CD2-CG 4.49Å; L510-F519 HydrophobicContact CD2-CZ 4.1Å; E515-F519 PolarHBondContact O-N 3.26Å; E515-F519 VanDerWaalsContact O-N 3.08Å; Y516-F519 PolarHBondContact O-N 3.3Å; F519-A522 PolarHBondContact O-N 3.12Å; F519-L523 PolarHBondContact O-N 2.68Å; F519-L523 VanDerWaalsContact O-N 3.07Å; F519-L551 HydrophobicContact CZ-CD2 4.46Å; F519-F555 HydrophobicContact CB-CD2 3.8Å; F519-F555 HydrophobicContact CB-CE2 3.74Å; F519-F555 AromaticContact CD1-CD2 3.78Å; F519-F555 HydrophobicContact CD1-CD2 3.78Å; F519-F555 HydrophobicContact CD1-CE2 4.44Å; F519-F555 HydrophobicContact CD2-CD2 4.29Å; F519-F555 HydrophobicContact CD2-CE2 4.22Å; F519-F555 HydrophobicContact CE1-CD2 4.44Å; F519-F555 AromaticContact CG-CD2 3.69Å; F519-F555 HydrophobicContact CG-CD2 3.69Å; F519-F555 AromaticContact CG-CE2 3.89Å; F519-F555 HydrophobicContact CG-CE2 3.89Å; F519-F560 HydrophobicContact CE1-CD2 4.07Å; F519-F560 AromaticContact CE1-CE2 3.7Å; F519-F560 HydrophobicContact CE1-CE2 3.7Å; F519-F560 AromaticContact CZ-CE2 3.83Å; F519-F560 HydrophobicContact CZ-CE2 3.83Å
520V86.1Confident85.6Confident0 Ų040.4 Ų40.40%019%0.189CC..Hα-helixtrans-68.1-40.9178.6177.20000111.2F497 Y516 A522 L523 C524 F557F497-V520 HydrophobicContact CD1-CB 4.17Å; F497-V520 HydrophobicContact CD1-CG1 3.99Å; F497-V520 HydrophobicContact CD2-CG1 4.04Å; F497-V520 HydrophobicContact CE1-CB 4.1Å; F497-V520 HydrophobicContact CE1-CG1 3.8Å; F497-V520 HydrophobicContact CE2-CG1 3.85Å; F497-V520 HydrophobicContact CG-CG1 4.1Å; F497-V520 HydrophobicContact CZ-CB 4.49Å; F497-V520 HydrophobicContact CZ-CG1 3.73Å; Y516-V520 HydrophobicContact CD2-CG2 3.95Å; Y516-V520 HydrophobicContact CE1-CG2 4.49Å; Y516-V520 HydrophobicContact CE2-CG2 3.54Å; Y516-V520 WeakPolarHBondContact O-CG2 3.31Å; Y516-V520 PolarHBondContact O-N 3.44Å; V520-A522 VanDerWaalsContact C-N 3.34Å; V520-A522 PolarHBondContact O-N 2.68Å; V520-L523 PolarHBondContact O-N 3.43Å; V520-C524 WeakPolarHBondContact O-CB 3.35Å; V520-C524 PolarHBondContact O-N 3.49Å; V520-C524 PolarHBondContact O-SG 3.01Å; V520-F557 HydrophobicContact CG1-CD1 4.41Å; V520-F557 HydrophobicContact CG1-CD2 3.96Å; V520-F557 HydrophobicContact CG1-CE1 4.3Å; V520-F557 HydrophobicContact CG1-CE2 3.81Å; V520-F557 HydrophobicContact CG1-CG 4.28Å; V520-F557 HydrophobicContact CG1-CZ 4Å; V520-F557 HydrophobicContact CG2-CB 4.05Å; V520-F557 HydrophobicContact CG2-CD1 4.39Å; V520-F557 HydrophobicContact CG2-CD2 4.21Å; V520-F557 HydrophobicContact CG2-CG 3.98Å
521G87.7Confident85.6Confident0 Ų044.2 Ų44.20%020%0.203CC..Hα-helixtrans-61.3-39.7175.700000113.4E517 Q518 S525E517-G521 PolarHBondContact O-N 3.34Å; Q518-G521 PolarHBondContact O-N 3.45Å; G521-S525 WeakPolarHBondContact O-CB 3.34Å; G521-S525 PolarHBondContact O-N 3.46Å; G521-S525 PolarHBondContact O-OG 2.83Å
522A90.5Very high85.6Confident0 Ų050.7 Ų50.70%023%0.228CC..Hα-helixtrans-63-48.9173.500000112.3L500 C506 L509 L510 Q518 F519 V520 C524 S525 L526L500-A522 HydrophobicContact CD1-CB 3.76Å; C506-A522 HydrophobicContact CB-CB 4.28Å; L509-A522 HydrophobicContact CB-CB 3.68Å; L509-A522 HydrophobicContact CD1-CB 4.18Å; L510-A522 HydrophobicContact CD2-CB 4.2Å; L510-A522 HydrophobicContact CG-CB 3.97Å; Q518-A522 VanDerWaalsContact O-CB 3.26Å; Q518-A522 WeakPolarHBondContact O-CB 3.46Å; Q518-A522 PolarHBondContact O-N 3.28Å; F519-A522 PolarHBondContact O-N 3.12Å; V520-A522 VanDerWaalsContact C-N 3.34Å; V520-A522 PolarHBondContact O-N 2.68Å; A522-C524 VanDerWaalsContact C-N 3.34Å; A522-C524 PolarHBondContact O-N 3.08Å; A522-S525 PolarHBondContact O-N 3.36Å; A522-L526 VanDerWaalsContact O-CB 3.29Å; A522-L526 WeakPolarHBondContact O-CB 3.21Å; A522-L526 PolarHBondContact O-N 3.34Å
523L89.2Confident85.2Confident0 Ų054.4 Ų54.40%024%0.24CC..Hα-helixtrans-60.7-44.3178.7-168.561.1000111.8L510 F519 V520 L548 L551 F557 F560 T563L510-L523 HydrophobicContact CD1-CD1 4.47Å; L510-L523 HydrophobicContact CD2-CB 3.93Å; L510-L523 HydrophobicContact CD2-CD1 4.2Å; F519-L523 PolarHBondContact O-N 2.68Å; F519-L523 VanDerWaalsContact O-N 3.07Å; V520-L523 PolarHBondContact O-N 3.43Å; L523-L548 HydrophobicContact CD1-CD2 4.27Å; L523-L551 HydrophobicContact CD1-CD2 4.1Å; L523-F557 HydrophobicContact CD2-CD1 4.4Å; L523-F557 HydrophobicContact CD2-CE1 4.3Å; L523-F560 HydrophobicContact CD2-CD2 3.6Å; L523-F560 HydrophobicContact CD2-CE2 3.83Å; L523-T563 HydrophobicContact CD2-CG2 4.21Å; L523-T563 HydrophobicContact CG-CG2 3.83Å
524C87.8Confident84.7Confident49 Ų4957 Ų5733%0.33126%0.256SS..Hα-helixtrans-69.6-35.4179.5-63.30000112.6V520 A522V520-C524 WeakPolarHBondContact O-CB 3.35Å; V520-C524 PolarHBondContact O-N 3.49Å; V520-C524 PolarHBondContact O-SG 3.01Å; A522-C524 VanDerWaalsContact C-N 3.34Å; A522-C524 PolarHBondContact O-N 3.08Å
525S90Very high83.9Confident4 Ų454.3 Ų54.33%0.02826%0.257CS..Hα-helixtrans-73.1-34.9178.4-650000112.2P498 L500 G521 A522 E527 R528 L529P498-S525 PolarHBondContact O-OG 3.23Å; L500-S525 PolarHBondContact N-OG 2.97Å; G521-S525 WeakPolarHBondContact O-CB 3.34Å; G521-S525 PolarHBondContact O-N 3.46Å; G521-S525 PolarHBondContact O-OG 2.83Å; A522-S525 PolarHBondContact O-N 3.36Å; S525-E527 PolarHBondContact O-N 3.37Å; S525-R528 PolarHBondContact O-N 3.22Å; S525-L529 WeakPolarHBondContact O-CG 3.26Å; S525-L529 PolarHBondContact O-N 2.87Å
526L90Very high83.1Confident0 Ų050.5 Ų50.50%025%0.248CC..Hα-helixtrans-58.1-45.4-174.7-177.460.6000112.3I503 C506 L510 A522 R528 L529 I530 V544 L548I503-L526 HydrophobicContact CG2-CD1 3.99Å; C506-L526 HydrophobicContact CB-CB 4.26Å; C506-L526 HydrophobicContact CB-CD1 4.14Å; L510-L526 HydrophobicContact CD1-CD2 3.71Å; A522-L526 VanDerWaalsContact O-CB 3.29Å; A522-L526 WeakPolarHBondContact O-CB 3.21Å; A522-L526 PolarHBondContact O-N 3.34Å; L526-R528 VanDerWaalsContact C-N 3.34Å; L526-R528 PolarHBondContact O-N 3.4Å; L526-L529 PolarHBondContact O-N 2.92Å; L526-L529 VanDerWaalsContact O-N 3.15Å; L526-I530 HydrophobicContact CD1-CD1 3.95Å; L526-I530 HydrophobicContact CD1-CG1 4.15Å; L526-I530 HydrophobicContact CG-CD1 3.75Å; L526-I530 HydrophobicContact CG-CG1 4.43Å; L526-I530 WeakPolarHBondContact O-CD1 3.49Å; L526-I530 VanDerWaalsContact O-CG1 3.32Å; L526-I530 WeakPolarHBondContact O-CG1 3.15Å; L526-I530 PolarHBondContact O-N 3.21Å; L526-V544 HydrophobicContact CD1-CG1 4.24Å; L526-V544 HydrophobicContact CD2-CG1 4.01Å; L526-V544 HydrophobicContact CG-CG1 4.45Å; L526-L548 HydrophobicContact CD2-CD2 4.13Å
527E87Confident82.4Confident52 Ų5246.8 Ų46.824%0.24323%0.234CC..Hα-helixtrans-54.2-50.5177.8-166-158.3148.900111.5S525 L529 I530 R531 Q566 A570S525-E527 PolarHBondContact O-N 3.37Å; E527-L529 VanDerWaalsContact C-N 3.31Å; E527-L529 PolarHBondContact O-N 2.97Å; E527-I530 PolarHBondContact O-N 2.65Å; E527-R531 WeakPolarHBondContact O-CG 3.27Å; E527-R531 PolarHBondContact O-N 2.62Å; E527-R531 IonicContact OE1-CZ 2.67Å; E527-R531 IonicContact OE1-NE 3.54Å; E527-R531 PolarHBondContact OE1-NE 3.32Å; E527-R531 IonicContact OE1-NH2 2.89Å; E527-Q566 HydrophobicContact CG-CB 4.4Å; E527-A570 HydrophobicContact CG-CB 4.05Å
528R86.5Confident82Confident70 Ų7044.8 Ų44.826%0.26422%0.224SC..Hα-helixtrans-62.2-39.6-179.9179.9-178.558.6700.3111.6L500 S525 L526 R532L500-R528 PolarHBondContact O-NH2 3.14Å; S525-R528 PolarHBondContact O-N 3.22Å; L526-R528 VanDerWaalsContact C-N 3.34Å; L526-R528 PolarHBondContact O-N 3.4Å; R528-R532 VanDerWaalsContact NH1-CZ 3.26Å; R528-R532 PolarHBondContact O-N 3.07Å
529L87.7Confident81.3Confident5 Ų547.7 Ų47.73%0.02624%0.242CC..Hα-helixtrans-70.7-38.1-177.3-68.6175.3000112.5S501 I503 C506 S525 L526 E527 R532S501-L529 VanDerWaalsContact O-CD2 3.23Å; S501-L529 WeakPolarHBondContact O-CD2 3.44Å; I503-L529 HydrophobicContact CG1-CB 3.84Å; I503-L529 HydrophobicContact CG1-CD1 4.49Å; C506-L529 VanDerWaalsContact SG-CD1 3.58Å; S525-L529 WeakPolarHBondContact O-CG 3.26Å; S525-L529 PolarHBondContact O-N 2.87Å; L526-L529 PolarHBondContact O-N 2.92Å; L526-L529 VanDerWaalsContact O-N 3.15Å; E527-L529 VanDerWaalsContact C-N 3.31Å; E527-L529 PolarHBondContact O-N 2.97Å; L529-R532 PolarHBondContact O-N 2.75Å
530I88.2Confident81.1Confident4 Ų449.6 Ų49.62%0.02125%0.252CS..Hα-helixtrans-64.5-43.8175.1-64.3156.9000110.8L526 E527 R532 V544 A570 K574L526-I530 HydrophobicContact CD1-CD1 3.95Å; L526-I530 HydrophobicContact CD1-CG1 4.15Å; L526-I530 HydrophobicContact CG-CD1 3.75Å; L526-I530 HydrophobicContact CG-CG1 4.43Å; L526-I530 WeakPolarHBondContact O-CD1 3.49Å; L526-I530 VanDerWaalsContact O-CG1 3.32Å; L526-I530 WeakPolarHBondContact O-CG1 3.15Å; L526-I530 PolarHBondContact O-N 3.21Å; E527-I530 PolarHBondContact O-N 2.65Å; I530-R532 VanDerWaalsContact C-N 3.29Å; I530-R532 PolarHBondContact O-N 3.28Å; I530-V544 HydrophobicContact CD1-CG1 4.04Å; I530-A570 HydrophobicContact CB-CB 4.25Å; I530-A570 HydrophobicContact CG2-CB 4.04Å; I530-K574 HydrophobicContact CG2-CB 4.22Å; I530-K574 HydrophobicContact CG2-CG 4.48Å; I530-K574 PolarHBondContact O-NZ 3.32Å
531R86.9Confident81.2Confident81 Ų8149.7 Ų49.731%0.30625%0.253SS..Hα-helixtrans-66.4-28.8-178.5-69.6179.7175.7-74.74.8112.9E527 A570 E610E527-R531 WeakPolarHBondContact O-CG 3.27Å; E527-R531 PolarHBondContact O-N 2.62Å; E527-R531 IonicContact OE1-CZ 2.67Å; E527-R531 IonicContact OE1-NE 3.54Å; E527-R531 PolarHBondContact OE1-NE 3.32Å; E527-R531 IonicContact OE1-NH2 2.89Å; R531-A570 HydrophobicContact CG-CB 3.78Å; R531-E610 IonicContact CZ-OE1 3.89Å; R531-E610 IonicContact CZ-OE2 3.13Å; R531-E610 IonicContact NH1-OE1 3.31Å; R531-E610 PolarHBondContact NH1-OE1 3.23Å; R531-E610 IonicContact NH1-OE2 3.56Å; R531-E610 PolarHBondContact NH1-OE2 3.44Å; R531-E610 IonicContact NH2-OE1 2.65Å; R531-E610 IonicContact NH2-OE2 2.65Å; R531-E610 PolarHBondContact NH2-OE2 3.37Å
532R82.6Confident81.3Confident141 Ų14150.9 Ų50.953%0.53226%0.26SS..SBendtrans-61.2142.6176-83.3-178.8170.2-179.2-2.1111.1R528 L529 I530 T534 K574R528-R532 VanDerWaalsContact NH1-CZ 3.26Å; R528-R532 PolarHBondContact O-N 3.07Å; L529-R532 PolarHBondContact O-N 2.75Å; I530-R532 VanDerWaalsContact C-N 3.29Å; I530-R532 PolarHBondContact O-N 3.28Å; R532-T534 WeakPolarHBondContact CB-OG1 3.32Å; R532-T534 PolarHBondContact O-N 2.98Å; R532-T534 PolarHBondContact O-OG1 3.05Å; R532-K574 PolarHBondContact O-NZ 3.46Å
533K67Low81.1Confident153 Ų15352.6 Ų52.667%0.66527%0.268SS*.  trans-73.655.6173.6-72.1-171.1177-174.60111.7D484D484-K533 PolarHBondContact O-NZ 2.96Å
534T67.6Low81.2Confident66 Ų6652.6 Ų52.641%0.40527%0.268SS..  trans-83131.2178.9-250000109.1R532 G536 S537R532-T534 WeakPolarHBondContact CB-OG1 3.32Å; R532-T534 PolarHBondContact O-N 2.98Å; R532-T534 PolarHBondContact O-OG1 3.05Å; T534-G536 PolarHBondContact O-N 3.25Å; T534-S537 WeakPolarHBondContact O-CB 3.35Å; T534-S537 PolarHBondContact O-N 3.16Å; T534-S537 PolarHBondContact O-OG 2.87Å
535P60.5Low81.4Confident128 Ų12850.3 Ų50.383%0.83125%0.253SS*.THydrogen-bonded Turntrans-54.4136176.7-21.631000111.2S537P535-S537 VanDerWaalsContact C-N 3.29Å; P535-S537 PolarHBondContact O-N 3.4Å
536G65.2Low81.3Confident32 Ų3253.2 Ų53.233%0.3326%0.263SS..THydrogen-bonded Turntrans81.7-7.8-179.600000115.8T534 H538 D539 L540T534-G536 PolarHBondContact O-N 3.25Å; G536-H538 PolarHBondContact O-N 2.99Å; G536-D539 PolarHBondContact O-N 3.22Å; G536-D539 VanDerWaalsContact O-N 3.17Å; G536-L540 PolarHBondContact O-N 3.35Å
537S70.4Confident81.3Confident5 Ų553.7 Ų53.74%0.03527%0.265CS..THydrogen-bonded Turntrans-64-19.1176.754.70000114.4T534 P535 A541 K574T534-S537 WeakPolarHBondContact O-CB 3.35Å; T534-S537 PolarHBondContact O-N 3.16Å; T534-S537 PolarHBondContact O-OG 2.87Å; P535-S537 VanDerWaalsContact C-N 3.29Å; P535-S537 PolarHBondContact O-N 3.4Å; S537-A541 PolarHBondContact O-N 3.41Å; S537-K574 WeakPolarHBondContact OG-CE 3.43Å; S537-K574 PolarHBondContact OG-NZ 2.86Å
538H75.6Confident81.5Confident85 Ų8551.2 Ų51.239%0.39425%0.254SS..THydrogen-bonded Turntrans-68.1-49.3172.8-60.8-81.2000110.7G536 L540 A541 E575G536-H538 PolarHBondContact O-N 2.99Å; H538-L540 PolarHBondContact O-N 3.42Å; H538-A541 WeakPolarHBondContact O-CB 3.45Å; H538-A541 PolarHBondContact O-N 3.16Å; H538-E575 IonicContact CG-OE2 3.23Å; H538-E575 IonicContact ND1-OE2 3.48Å; H538-E575 PolarHBondContact ND1-OE2 3.27Å
539D72.8Confident81.7Confident127 Ų12748 Ų4868%0.67924%0.242SC*.THydrogen-bonded Turntrans-65.6-24.5-177.4-52.3-29.5000112.4G536G536-D539 PolarHBondContact O-N 3.22Å; G536-D539 VanDerWaalsContact O-N 3.17Å
540L83.4Confident81.7Confident40 Ų4048.7 Ų48.721%0.20925%0.245CC..THydrogen-bonded Turntrans-91.4-13.3-180-59.7173.5000113.5L355 I503 G536 H538 V542 E543 V544L355-L540 HydrophobicContact CB-CD2 4.18Å; L355-L540 HydrophobicContact CD1-CD2 4.04Å; L355-L540 HydrophobicContact CD2-CB 4.31Å; L355-L540 HydrophobicContact CD2-CD2 3.8Å; L355-L540 HydrophobicContact CG-CD2 4.21Å; I503-L540 HydrophobicContact CD1-CD1 4.48Å; G536-L540 PolarHBondContact O-N 3.35Å; H538-L540 PolarHBondContact O-N 3.42Å; L540-V542 VanDerWaalsContact C-N 3.29Å; L540-V542 PolarHBondContact O-N 3.2Å; L540-E543 PolarHBondContact O-N 3.5Å; L540-V544 WeakPolarHBondContact O-CB 3.21Å; L540-V544 VanDerWaalsContact O-CG2 3.25Å; L540-V544 WeakPolarHBondContact O-CG2 3.41Å; L540-V544 PolarHBondContact O-N 3.07Å
541A89Confident81.7Confident2 Ų248.8 Ų48.82%0.01725%0.246CC..Hα-helixtrans-64.3-36.4-170.400000112.1S537 H538 V545 C571 E575 V579S537-A541 PolarHBondContact O-N 3.41Å; H538-A541 WeakPolarHBondContact O-CB 3.45Å; H538-A541 PolarHBondContact O-N 3.16Å; A541-V545 WeakPolarHBondContact O-CB 3.39Å; A541-V545 PolarHBondContact O-N 3Å; A541-C571 HydrophobicContact CB-CB 4.39Å; A541-E575 HydrophobicContact CB-CB 3.95Å; A541-V579 HydrophobicContact CB-CG2 3.99Å
542V88.9Confident81.4Confident24 Ų2449.4 Ų49.415%0.14526%0.255CS..Hα-helixtrans-68.8-43.9179178.80000110.7L540 V545 R546 E578 V579L540-V542 VanDerWaalsContact C-N 3.29Å; L540-V542 PolarHBondContact O-N 3.2Å; V542-V545 WeakPolarHBondContact O-CG1 3.47Å; V542-V545 PolarHBondContact O-N 3.43Å; V542-R546 WeakPolarHBondContact O-CG 3.33Å; V542-R546 PolarHBondContact O-N 3.3Å; V542-R546 VanDerWaalsContact O-N 3.13Å; V542-E578 HydrophobicContact CG2-CB 3.73Å; V542-V579 HydrophobicContact CG2-CG2 4.05Å
543E86.5Confident81.3Confident36 Ų3646.9 Ų46.917%0.16825%0.248CC..Hα-helixtrans-67.7-42.9179.8-74.273.6-165.500111C354 L355 L540 R546 L547C354-E543 WeakPolarHBondContact O-CB 3.33Å; L355-E543 HydrophobicContact CD2-CB 3.97Å; L540-E543 PolarHBondContact O-N 3.5Å; E543-R546 PolarHBondContact O-N 2.96Å; E543-L547 PolarHBondContact O-N 3.24Å
544V90.5Very high81.7Confident1 Ų144.2 Ų44.21%0.00623%0.234CC..Hα-helixtrans-65-39.6175.9175.70000111.3L355 I503 I507 L526 I530 L540 R546 L547 L548L355-V544 HydrophobicContact CD2-CG2 3.92Å; I503-V544 HydrophobicContact CG2-CG2 3.97Å; I507-V544 HydrophobicContact CD1-CG2 3.97Å; L526-V544 HydrophobicContact CD1-CG1 4.24Å; L526-V544 HydrophobicContact CD2-CG1 4.01Å; L526-V544 HydrophobicContact CG-CG1 4.45Å; I530-V544 HydrophobicContact CD1-CG1 4.04Å; L540-V544 WeakPolarHBondContact O-CB 3.21Å; L540-V544 VanDerWaalsContact O-CG2 3.25Å; L540-V544 WeakPolarHBondContact O-CG2 3.41Å; L540-V544 PolarHBondContact O-N 3.07Å; V544-R546 VanDerWaalsContact C-N 3.31Å; V544-R546 PolarHBondContact O-N 2.94Å; V544-L547 WeakPolarHBondContact O-CB 3.33Å; V544-L547 PolarHBondContact O-N 3.16Å; V544-L548 HydrophobicContact CG1-CD1 3.84Å; V544-L548 HydrophobicContact CG1-CG 4.32Å; V544-L548 WeakPolarHBondContact O-CG 3.06Å; V544-L548 PolarHBondContact O-N 3.2Å
545V92.8Very high82.1Confident0 Ų043.4 Ų43.40%023%0.225CC..Hα-helixtrans-64.8-38.417895.10000111.2A541 V542 L547 L548 V549 M568 C571 V579 L583A541-V545 WeakPolarHBondContact O-CB 3.39Å; A541-V545 PolarHBondContact O-N 3Å; V542-V545 WeakPolarHBondContact O-CG1 3.47Å; V542-V545 PolarHBondContact O-N 3.43Å; V545-L547 VanDerWaalsContact C-N 3.31Å; V545-L547 PolarHBondContact O-N 2.72Å; V545-L548 PolarHBondContact O-N 2.71Å; V545-L548 VanDerWaalsContact O-N 3.13Å; V545-V549 VanDerWaalsContact O-CG2 3.31Å; V545-V549 WeakPolarHBondContact O-CG2 3.09Å; V545-V549 PolarHBondContact O-N 2.94Å; V545-M568 HydrophobicContact CG2-CB 4.24Å; V545-M568 HydrophobicContact CG2-CG 4.18Å; V545-C571 HydrophobicContact CB-CB 4.21Å; V545-C571 HydrophobicContact CG2-CB 4.19Å; V545-V579 HydrophobicContact CB-CG1 4.12Å; V545-V579 HydrophobicContact CG1-CG1 4.06Å; V545-V579 HydrophobicContact CG2-CG1 3.94Å; V545-L583 HydrophobicContact CG1-CD2 4.42Å; V545-L583 HydrophobicContact CG2-CD1 4.37Å; V545-L583 HydrophobicContact CG2-CD2 3.83Å; V545-L583 HydrophobicContact CG2-CG 4.26Å
546R89.1Confident82.9Confident66 Ų6644.4 Ų44.425%0.24922%0.218CC..Hα-helixtrans-62.5-38.2177.2-71.7175.6-171.4-76.55.2111.5V542 E543 V544 H550 C582V542-R546 WeakPolarHBondContact O-CG 3.33Å; V542-R546 PolarHBondContact O-N 3.3Å; V542-R546 VanDerWaalsContact O-N 3.13Å; E543-R546 PolarHBondContact O-N 2.96Å; V544-R546 VanDerWaalsContact C-N 3.31Å; V544-R546 PolarHBondContact O-N 2.94Å; R546-H550 PolarHBondContact O-CD2 3.17Å; R546-H550 VanDerWaalsContact O-CD2 3.31Å; R546-C582 PolarHBondContact NH1-SG 3.41Å; R546-C582 VanDerWaalsContact NH1-SG 3.39Å
547L89.1Confident83.5Confident9 Ų943.9 Ų43.95%0.04721%0.207CC..Hα-helixtrans-60.4-52.4169.8179.586.5000111.2I507 L510 W511 E543 V544 V545 V549 H550 L551I507-L547 HydrophobicContact CG1-CD2 4.36Å; I507-L547 HydrophobicContact CG2-CD2 4.43Å; L510-L547 HydrophobicContact CB-CD2 4.49Å; L510-L547 HydrophobicContact CD1-CD2 4.33Å; W511-L547 HydrophobicContact CD2-CD1 4.49Å; W511-L547 HydrophobicContact CE3-CD1 3.36Å; W511-L547 HydrophobicContact CZ3-CD1 3.36Å; E543-L547 PolarHBondContact O-N 3.24Å; V544-L547 WeakPolarHBondContact O-CB 3.33Å; V544-L547 PolarHBondContact O-N 3.16Å; V545-L547 VanDerWaalsContact C-N 3.31Å; V545-L547 PolarHBondContact O-N 2.72Å; L547-V549 PolarHBondContact O-N 3.35Å; L547-H550 CarbonylContact O-C 3.57Å; L547-H550 PolarHBondContact O-N 3.47Å; L547-L551 PolarHBondContact O-N 2.84Å
548L92.1Very high83.8Confident0 Ų051.8 Ų51.80%024%0.243CC..Hα-helixtrans-62.4-39.8-173.2-71.1166.4000112.7L523 L526 V544 V545 H550 L551 R564 C567 M568L523-L548 HydrophobicContact CD1-CD2 4.27Å; L526-L548 HydrophobicContact CD2-CD2 4.13Å; V544-L548 HydrophobicContact CG1-CD1 3.84Å; V544-L548 HydrophobicContact CG1-CG 4.32Å; V544-L548 WeakPolarHBondContact O-CG 3.06Å; V544-L548 PolarHBondContact O-N 3.2Å; V545-L548 PolarHBondContact O-N 2.71Å; V545-L548 VanDerWaalsContact O-N 3.13Å; L548-H550 PolarHBondContact O-N 2.86Å; L548-L551 HydrophobicContact CD2-CD2 4.36Å; L548-L551 PolarHBondContact O-N 3.46Å; L548-R564 HydrophobicContact CD2-CG 4.31Å; L548-R564 WeakPolarHBondContact O-CD 3.48Å; L548-C567 HydrophobicContact CD1-CB 3.48Å; L548-C567 VanDerWaalsContact CD1-CB 3.48Å; L548-C567 HydrophobicContact CD2-CB 3.9Å; L548-C567 HydrophobicContact CG-CB 4.36Å; L548-M568 HydrophobicContact CB-CG 3.71Å; L548-M568 HydrophobicContact CB-SD 4.44Å; L548-M568 HydrophobicContact CD1-CG 4.1Å
549V90.6Very high84.1Confident3 Ų353.8 Ų53.82%0.01825%0.25CS..Hα-helixtrans-53.8-40.4177.2167.50000111.2V545 L547 M568 L583 E586 R596 I600V545-V549 VanDerWaalsContact O-CG2 3.31Å; V545-V549 WeakPolarHBondContact O-CG2 3.09Å; V545-V549 PolarHBondContact O-N 2.94Å; L547-V549 PolarHBondContact O-N 3.35Å; V549-M568 HydrophobicContact CG2-CE 3.54Å; V549-L583 HydrophobicContact CG2-CD2 3.58Å; V549-E586 HydrophobicContact CG1-CB 4.37Å; V549-E586 HydrophobicContact CG1-CG 4.31Å; V549-R596 VanDerWaalsContact O-CD 3.31Å; V549-R596 WeakPolarHBondContact O-CD 3.24Å; V549-I600 HydrophobicContact CG1-CD1 3.92Å; V549-I600 HydrophobicContact CG1-CG1 4.43Å; V549-I600 HydrophobicContact CG2-CD1 4.4Å; V549-I600 HydrophobicContact CG2-CG1 4.22Å
550H87.3Confident84.8Confident20 Ų2047.7 Ų47.79%0.09322%0.218CC..THydrogen-bonded Turntrans-108.612.3-176.1-50.7-89.3000114.4P402 R546 L547 L548 D552 E586 R596P402-H550 HydrophobicContact CB-CB 3.28Å; P402-H550 HydrophobicContact CG-CB 3.58Å; R546-H550 PolarHBondContact O-CD2 3.17Å; R546-H550 VanDerWaalsContact O-CD2 3.31Å; L547-H550 CarbonylContact O-C 3.57Å; L547-H550 PolarHBondContact O-N 3.47Å; L548-H550 PolarHBondContact O-N 2.86Å; H550-D552 PolarHBondContact O-N 3.44Å; H550-E586 IonicContact CE1-OE2 3.79Å; H550-E586 IonicContact NE2-OE1 3.6Å; H550-E586 IonicContact NE2-OE2 2.71Å; H550-R596 PolarHBondContact ND1-NH1 3.25Å; H550-R596 PolarHBondContact O-NH2 3.01Å
551L88.1Confident84.8Confident6 Ų648.8 Ų48.83%0.03122%0.224CC..  trans-68.9121.3179.3-175.169.8000110.4L510 F519 L523 L547 L548 F560 R564L510-L551 HydrophobicContact CB-CD1 4.39Å; L510-L551 HydrophobicContact CD2-CD2 4.21Å; F519-L551 HydrophobicContact CZ-CD2 4.46Å; L523-L551 HydrophobicContact CD1-CD2 4.1Å; L547-L551 PolarHBondContact O-N 2.84Å; L548-L551 HydrophobicContact CD2-CD2 4.36Å; L548-L551 PolarHBondContact O-N 3.46Å; L551-F560 HydrophobicContact CD2-CE2 4.09Å; L551-F560 HydrophobicContact CD2-CZ 4.03Å; L551-F560 HydrophobicContact CG-CZ 4.1Å; L551-R564 PolarHBondContact O-NH1 3.06Å
552D79.6Confident84.8Confident93 Ų9353.3 Ų53.350%0.49725%0.245SC..  trans-84.3146.1178.4-75.1-41.1000113.3H550 R554 R596H550-D552 PolarHBondContact O-N 3.44Å; D552-R554 VanDerWaalsContact C-N 3.33Å; D552-R554 PolarHBondContact O-N 2.98Å; D552-R596 IonicContact OD1-CZ 3.54Å; D552-R596 IonicContact OD1-NH2 3.11Å; D552-R596 PolarHBondContact OD1-NH2 3.43Å; D552-R596 IonicContact OD2-NH2 3.86Å
553K80.7Confident84.8Confident88 Ų8853.1 Ų53.138%0.38324%0.244SC..  trans-76.182.5175-169.9172.2-168.6160.50110.1F555 F557 F560 D561K553-F555 WeakPolarHBondContact CG-O 3.2Å; K553-F557 WeakPolarHBondContact CE-O 3.3Å; K553-F557 PolarHBondContact NZ-O 2.79Å; K553-F560 HydrophobicContact CB-CD1 3.8Å; K553-F560 HydrophobicContact CB-CE1 3.71Å; K553-F560 HydrophobicContact CB-CG 4.38Å; K553-F560 HydrophobicContact CB-CZ 4.22Å; K553-F560 HydrophobicContact CD-CB 4.26Å; K553-F560 HydrophobicContact CD-CD1 3.91Å; K553-F560 HydrophobicContact CD-CG 4.23Å; K553-F560 HydrophobicContact CG-CB 4.36Å; K553-F560 HydrophobicContact CG-CD1 3.78Å; K553-F560 HydrophobicContact CG-CE1 4.19Å; K553-F560 HydrophobicContact CG-CG 3.95Å; K553-D561 IonicContact NZ-OD2 3.06Å; K553-D561 PolarHBondContact NZ-OD2 3.44Å
554R75.7Confident85.1Confident97 Ų9752.2 Ų52.237%0.36624%0.239SC..  trans-71.6-32.4-178.7-61.3-179-169.3-166.82.7113.5W511 D512 D552W511-R554 PolarHBondContact O-NH1 3.27Å; W511-R554 PolarHBondContact O-NH2 3.04Å; D512-R554 IonicContact OD1-NH1 2.63Å; D552-R554 VanDerWaalsContact C-N 3.33Å; D552-R554 PolarHBondContact O-N 2.98Å
555F76.2Confident85.2Confident50 Ų5052.6 Ų52.622%0.21924%0.241CC..SBendtrans-122.5151.5178.5-56.2-82.3000110.8S513 K514 Y516 F519 K553 F557S513-F555 WeakPolarHBondContact O-CE2 3.33Å; K514-F555 WeakPolarHBondContact O-CZ 3.4Å; Y516-F555 HydrophobicContact CD2-CB 3.75Å; Y516-F555 HydrophobicContact CD2-CD1 4.47Å; Y516-F555 HydrophobicContact CD2-CG 4.17Å; Y516-F555 HydrophobicContact CE2-CB 4.36Å; F519-F555 HydrophobicContact CB-CD2 3.8Å; F519-F555 HydrophobicContact CB-CE2 3.74Å; F519-F555 AromaticContact CD1-CD2 3.78Å; F519-F555 HydrophobicContact CD1-CD2 3.78Å; F519-F555 HydrophobicContact CD1-CE2 4.44Å; F519-F555 HydrophobicContact CD2-CD2 4.29Å; F519-F555 HydrophobicContact CD2-CE2 4.22Å; F519-F555 HydrophobicContact CE1-CD2 4.44Å; F519-F555 AromaticContact CG-CD2 3.69Å; F519-F555 HydrophobicContact CG-CD2 3.69Å; F519-F555 AromaticContact CG-CE2 3.89Å; F519-F555 HydrophobicContact CG-CE2 3.89Å; K553-F555 WeakPolarHBondContact CG-O 3.2Å; F555-F557 PolarHBondContact O-N 3.31Å
556H76.6Confident85.2Confident148 Ų14855.3 Ų55.369%0.68525%0.254SS*.  trans-70.7103.6170.6-176.777.4000109.8Y516Y516-H556 WeakPolarHBondContact CE2-O 3.38Å
557F78.4Confident85.4Confident22 Ų2252.1 Ų52.110%0.09624%0.242CC..  trans-126.7119.5170.3170-130.6000107.5Y516 V520 L523 K553 F555 K559 F560Y516-F557 HydrophobicContact CE2-CB 4.44Å; V520-F557 HydrophobicContact CG1-CD1 4.41Å; V520-F557 HydrophobicContact CG1-CD2 3.96Å; V520-F557 HydrophobicContact CG1-CE1 4.3Å; V520-F557 HydrophobicContact CG1-CE2 3.81Å; V520-F557 HydrophobicContact CG1-CG 4.28Å; V520-F557 HydrophobicContact CG1-CZ 4Å; V520-F557 HydrophobicContact CG2-CB 4.05Å; V520-F557 HydrophobicContact CG2-CD1 4.39Å; V520-F557 HydrophobicContact CG2-CD2 4.21Å; V520-F557 HydrophobicContact CG2-CG 3.98Å; L523-F557 HydrophobicContact CD2-CD1 4.4Å; L523-F557 HydrophobicContact CD2-CE1 4.3Å; K553-F557 WeakPolarHBondContact CE-O 3.3Å; K553-F557 PolarHBondContact NZ-O 2.79Å; F555-F557 PolarHBondContact O-N 3.31Å; F557-K559 VanDerWaalsContact C-N 3.3Å; F557-K559 HydrophobicContact CE1-CB 4.14Å; F557-K559 HydrophobicContact CE2-CB 4.22Å; F557-K559 HydrophobicContact CZ-CB 3.77Å; F557-K559 PolarHBondContact O-N 3.43Å; F557-F560 HydrophobicContact CB-CB 4.16Å; F557-F560 HydrophobicContact CD1-CB 3.67Å; F557-F560 HydrophobicContact CD1-CD2 4.32Å; F557-F560 VanDerWaalsContact CD1-N 3.31Å; F557-F560 HydrophobicContact CG-CB 4.29Å; F557-F560 VanDerWaalsContact O-CB 3.29Å; F557-F560 WeakPolarHBondContact O-CB 3.36Å; F557-F560 PolarHBondContact O-N 3.36Å; F557-F560 VanDerWaalsContact O-N 3.15Å
558E76.3Confident85.7Confident170 Ų17051.8 Ų51.879%0.79424%0.24SC*.THydrogen-bonded Turntrans-55.8-43.5-172.5-83.6-176.415000112.2F560E558-F560 PolarHBondContact O-N 3.36Å
559K82.5Confident85.8Confident127 Ų12751.8 Ų51.855%0.55224%0.24SC*.THydrogen-bonded Turntrans-92.715.1-177.5-61.2-177.2178.9177.30114F557 D561 E562 T563F557-K559 VanDerWaalsContact C-N 3.3Å; F557-K559 HydrophobicContact CE1-CB 4.14Å; F557-K559 HydrophobicContact CE2-CB 4.22Å; F557-K559 HydrophobicContact CZ-CB 3.77Å; F557-K559 PolarHBondContact O-N 3.43Å; K559-D561 PolarHBondContact O-N 2.79Å; K559-E562 PolarHBondContact O-N 3.07Å; K559-T563 PolarHBondContact O-N 2.97Å; K559-T563 PolarHBondContact O-OG1 3.4Å
560F87.4Confident85.9Confident0 Ų051.7 Ų51.70%024%0.239CC..Hα-helixtrans-53.7-52.9-174.2176.2-97.7000112.9F519 L523 L551 K553 F557 E558 E562 T563 R564F519-F560 HydrophobicContact CE1-CD2 4.07Å; F519-F560 AromaticContact CE1-CE2 3.7Å; F519-F560 HydrophobicContact CE1-CE2 3.7Å; F519-F560 AromaticContact CZ-CE2 3.83Å; F519-F560 HydrophobicContact CZ-CE2 3.83Å; L523-F560 HydrophobicContact CD2-CD2 3.6Å; L523-F560 HydrophobicContact CD2-CE2 3.83Å; L551-F560 HydrophobicContact CD2-CE2 4.09Å; L551-F560 HydrophobicContact CD2-CZ 4.03Å; L551-F560 HydrophobicContact CG-CZ 4.1Å; K553-F560 HydrophobicContact CB-CD1 3.8Å; K553-F560 HydrophobicContact CB-CE1 3.71Å; K553-F560 HydrophobicContact CB-CG 4.38Å; K553-F560 HydrophobicContact CB-CZ 4.22Å; K553-F560 HydrophobicContact CD-CB 4.26Å; K553-F560 HydrophobicContact CD-CD1 3.91Å; K553-F560 HydrophobicContact CD-CG 4.23Å; K553-F560 HydrophobicContact CG-CB 4.36Å; K553-F560 HydrophobicContact CG-CD1 3.78Å; K553-F560 HydrophobicContact CG-CE1 4.19Å; K553-F560 HydrophobicContact CG-CG 3.95Å; F557-F560 HydrophobicContact CB-CB 4.16Å; F557-F560 HydrophobicContact CD1-CB 3.67Å; F557-F560 HydrophobicContact CD1-CD2 4.32Å; F557-F560 VanDerWaalsContact CD1-N 3.31Å; F557-F560 HydrophobicContact CG-CB 4.29Å; F557-F560 VanDerWaalsContact O-CB 3.29Å; F557-F560 WeakPolarHBondContact O-CB 3.36Å; F557-F560 PolarHBondContact O-N 3.36Å; F557-F560 VanDerWaalsContact O-N 3.15Å; E558-F560 PolarHBondContact O-N 3.36Å; F560-E562 VanDerWaalsContact C-N 3.34Å; F560-E562 PolarHBondContact O-N 3.5Å; F560-T563 PolarHBondContact O-N 3.37Å; F560-R564 VanDerWaalsContact O-CB 3.28Å; F560-R564 WeakPolarHBondContact O-CB 3.31Å; F560-R564 PolarHBondContact O-N 2.88Å
561D84.4Confident86.2Confident62 Ų6250.8 Ų50.833%0.33224%0.235SC..Hα-helixtrans-66-40.4-175.1-56.6-72000110.5K553 K559 R564 V565K553-D561 IonicContact NZ-OD2 3.06Å; K553-D561 PolarHBondContact NZ-OD2 3.44Å; K559-D561 PolarHBondContact O-N 2.79Å; D561-R564 IonicContact OD1-NH2 3.19Å; D561-V565 VanDerWaalsContact O-CG2 3.32Å; D561-V565 WeakPolarHBondContact O-CG2 3.5Å; D561-V565 PolarHBondContact O-N 3.13Å
562E88.2Confident86.5Confident98 Ų9850.5 Ų50.546%0.45823%0.234SC..Hα-helixtrans-62-51173.5-77.7-176.8156.800112.4K559 F560 R564 V565 Q566K559-E562 PolarHBondContact O-N 3.07Å; F560-E562 VanDerWaalsContact C-N 3.34Å; F560-E562 PolarHBondContact O-N 3.5Å; E562-R564 VanDerWaalsContact C-N 3.33Å; E562-R564 PolarHBondContact O-N 2.96Å; E562-V565 PolarHBondContact O-N 2.87Å; E562-Q566 WeakPolarHBondContact O-CG 3.45Å; E562-Q566 PolarHBondContact O-N 2.96Å
563T89.2Confident87.2Confident20 Ų2046.9 Ų46.912%0.12322%0.215CC..Hα-helixtrans-64.8-38.8-179.1-510000111.3L523 K559 F560 Q566 C567L523-T563 HydrophobicContact CD2-CG2 4.21Å; L523-T563 HydrophobicContact CG-CG2 3.83Å; K559-T563 PolarHBondContact O-N 2.97Å; K559-T563 PolarHBondContact O-OG1 3.4Å; F560-T563 PolarHBondContact O-N 3.37Å; T563-Q566 PolarHBondContact O-N 3.18Å; T563-C567 PolarHBondContact O-N 3.06Å; T563-C567 PolarHBondContact O-SG 3.47Å; T563-C567 VanDerWaalsContact O-SG 3.35Å
564R92.4Very high87.7Confident17 Ų1744 Ų446%0.06420%0.203CC..Hα-helixtrans-59.4-48.9174.5-177.3-178.873.4-174-6.7111.2L548 L551 F560 D561 E562 Q566 C567 M568 D599L548-R564 HydrophobicContact CD2-CG 4.31Å; L548-R564 WeakPolarHBondContact O-CD 3.48Å; L551-R564 PolarHBondContact O-NH1 3.06Å; F560-R564 VanDerWaalsContact O-CB 3.28Å; F560-R564 WeakPolarHBondContact O-CB 3.31Å; F560-R564 PolarHBondContact O-N 2.88Å; D561-R564 IonicContact OD1-NH2 3.19Å; E562-R564 VanDerWaalsContact C-N 3.33Å; E562-R564 PolarHBondContact O-N 2.96Å; R564-Q566 VanDerWaalsContact C-N 3.31Å; R564-Q566 PolarHBondContact O-N 3.1Å; R564-C567 WeakPolarHBondContact O-CB 3.31Å; R564-C567 PolarHBondContact O-N 3.4Å; R564-M568 WeakPolarHBondContact O-CG 3.32Å; R564-M568 PolarHBondContact O-N 3.36Å; R564-D599 IonicContact CZ-OD2 3.35Å; R564-D599 IonicContact NH2-OD2 3.63Å; R564-D599 PolarHBondContact NH2-OD2 3.27Å
565V92.6Very high88.5Confident9 Ų941.9 Ų41.96%0.05520%0.197CC..Hα-helixtrans-61.6-40.4176.4170.10000110.8D561 E562 C567 M568 V569 D599 R602 A603 L606D561-V565 VanDerWaalsContact O-CG2 3.32Å; D561-V565 WeakPolarHBondContact O-CG2 3.5Å; D561-V565 PolarHBondContact O-N 3.13Å; E562-V565 PolarHBondContact O-N 2.87Å; V565-C567 VanDerWaalsContact C-N 3.35Å; V565-C567 PolarHBondContact O-N 3.06Å; V565-M568 WeakPolarHBondContact O-CB 3.35Å; V565-M568 PolarHBondContact O-N 2.81Å; V565-M568 VanDerWaalsContact O-N 3.13Å; V565-V569 HydrophobicContact CG1-CG2 4.34Å; V565-V569 VanDerWaalsContact O-CG2 3.29Å; V565-V569 WeakPolarHBondContact O-CG2 3.46Å; V565-V569 PolarHBondContact O-N 2.89Å; V565-D599 HydrophobicContact CG2-CB 3.88Å; V565-R602 HydrophobicContact CG1-CG 4.41Å; V565-A603 HydrophobicContact CG1-CB 4.23Å; V565-L606 HydrophobicContact CG1-CD1 3.81Å
566Q92.2Very high89.4Confident56 Ų5640.6 Ų40.626%0.26219%0.193SC..Hα-helixtrans-63.2-37.6175.8-69.4-56.5-33.700113E527 E562 T563 R564 M568 V569 A570E527-Q566 HydrophobicContact CG-CB 4.4Å; E562-Q566 WeakPolarHBondContact O-CG 3.45Å; E562-Q566 PolarHBondContact O-N 2.96Å; T563-Q566 PolarHBondContact O-N 3.18Å; R564-Q566 VanDerWaalsContact C-N 3.31Å; R564-Q566 PolarHBondContact O-N 3.1Å; Q566-M568 VanDerWaalsContact C-N 3.35Å; Q566-V569 PolarHBondContact O-N 3.45Å; Q566-A570 WeakPolarHBondContact O-CB 3.4Å; Q566-A570 PolarHBondContact O-N 3.24Å
567C93.2Very high90.2Very high0 Ų036.8 Ų36.80%018%0.177CC..Hα-helixtrans-63.1-41.2171.7-67.90000111.6L548 T563 R564 V565 V569 A570 C571L548-C567 HydrophobicContact CD1-CB 3.48Å; L548-C567 VanDerWaalsContact CD1-CB 3.48Å; L548-C567 HydrophobicContact CD2-CB 3.9Å; L548-C567 HydrophobicContact CG-CB 4.36Å; T563-C567 PolarHBondContact O-N 3.06Å; T563-C567 PolarHBondContact O-SG 3.47Å; T563-C567 VanDerWaalsContact O-SG 3.35Å; R564-C567 WeakPolarHBondContact O-CB 3.31Å; R564-C567 PolarHBondContact O-N 3.4Å; V565-C567 VanDerWaalsContact C-N 3.35Å; V565-C567 PolarHBondContact O-N 3.06Å; C567-V569 VanDerWaalsContact C-N 3.35Å; C567-A570 WeakPolarHBondContact O-CB 3.29Å; C567-A570 PolarHBondContact O-N 2.84Å; C567-C571 PolarHBondContact O-N 3.04Å
568M95.3Very high91Very high2 Ų241.2 Ų41.21%0.0120%0.198CC..Hα-helixtrans-64-40.6175.7-63.7171.67200111.8V545 L548 V549 R564 V565 Q566 C571 C572 L583 I600 A603V545-M568 HydrophobicContact CG2-CB 4.24Å; V545-M568 HydrophobicContact CG2-CG 4.18Å; L548-M568 HydrophobicContact CB-CG 3.71Å; L548-M568 HydrophobicContact CB-SD 4.44Å; L548-M568 HydrophobicContact CD1-CG 4.1Å; V549-M568 HydrophobicContact CG2-CE 3.54Å; R564-M568 WeakPolarHBondContact O-CG 3.32Å; R564-M568 PolarHBondContact O-N 3.36Å; V565-M568 WeakPolarHBondContact O-CB 3.35Å; V565-M568 PolarHBondContact O-N 2.81Å; V565-M568 VanDerWaalsContact O-N 3.13Å; Q566-M568 VanDerWaalsContact C-N 3.35Å; M568-C571 PolarHBondContact O-N 3.01Å; M568-C572 WeakPolarHBondContact O-CB 3.43Å; M568-C572 PolarHBondContact O-N 3.11Å; M568-L583 HydrophobicContact CE-CD2 3.58Å; M568-I600 HydrophobicContact CE-CG1 3.84Å; M568-A603 HydrophobicContact CB-CB 3.86Å; M568-A603 HydrophobicContact CE-CB 4.42Å
569V94.3Very high91.9Very high0 Ų033.1 Ų33.10%016%0.16CC..Hα-helixtrans-60.9-45.7172.91730000110.4V565 Q566 C567 C571 C572 V573 A603 L606 A607V565-V569 HydrophobicContact CG1-CG2 4.34Å; V565-V569 VanDerWaalsContact O-CG2 3.29Å; V565-V569 WeakPolarHBondContact O-CG2 3.46Å; V565-V569 PolarHBondContact O-N 2.89Å; Q566-V569 PolarHBondContact O-N 3.45Å; C567-V569 VanDerWaalsContact C-N 3.35Å; V569-C571 VanDerWaalsContact C-N 3.35Å; V569-C571 PolarHBondContact O-N 3.32Å; V569-C572 PolarHBondContact O-N 2.96Å; V569-C572 VanDerWaalsContact O-N 3.16Å; V569-V573 HydrophobicContact CG1-CG2 4.1Å; V569-V573 VanDerWaalsContact O-CG2 3.29Å; V569-V573 WeakPolarHBondContact O-CG2 3.49Å; V569-V573 PolarHBondContact O-N 3.27Å; V569-A603 HydrophobicContact CG2-CB 4.16Å; V569-L606 HydrophobicContact CG1-CB 4.38Å; V569-L606 HydrophobicContact CG2-CB 3.55Å; V569-L606 HydrophobicContact CG2-CD1 4.07Å; V569-L606 HydrophobicContact CG2-CG 4.48Å; V569-A607 HydrophobicContact CG1-CB 4.24Å
570A93Very high92.5Very high1 Ų127 Ų271%0.00813%0.134CC..Hα-helixtrans-58.5-44.4176.800000112E527 I530 R531 Q566 C567 K574E527-A570 HydrophobicContact CG-CB 4.05Å; I530-A570 HydrophobicContact CB-CB 4.25Å; I530-A570 HydrophobicContact CG2-CB 4.04Å; R531-A570 HydrophobicContact CG-CB 3.78Å; Q566-A570 WeakPolarHBondContact O-CB 3.4Å; Q566-A570 PolarHBondContact O-N 3.24Å; C567-A570 WeakPolarHBondContact O-CB 3.29Å; C567-A570 PolarHBondContact O-N 2.84Å; A570-K574 VanDerWaalsContact O-CB 3.23Å; A570-K574 WeakPolarHBondContact O-CB 3.47Å; A570-K574 PolarHBondContact O-N 3.46Å; A570-K574 VanDerWaalsContact O-N 3.08Å
571C94Very high92.8Very high0 Ų028.8 Ų28.80%015%0.148CC..Hα-helixtrans-59.2-47.9173.4-71.20000111.6A541 V545 C567 M568 V569 V573 K574 E575 V579A541-C571 HydrophobicContact CB-CB 4.39Å; V545-C571 HydrophobicContact CB-CB 4.21Å; V545-C571 HydrophobicContact CG2-CB 4.19Å; C567-C571 PolarHBondContact O-N 3.04Å; M568-C571 PolarHBondContact O-N 3.01Å; V569-C571 VanDerWaalsContact C-N 3.35Å; V569-C571 PolarHBondContact O-N 3.32Å; C571-V573 PolarHBondContact O-N 3.12Å; C571-K574 WeakPolarHBondContact O-CB 3.3Å; C571-K574 PolarHBondContact O-N 3.14Å; C571-E575 PolarHBondContact O-N 3.02Å; C571-V579 HydrophobicContact CB-CG1 4.23Å; C571-V579 HydrophobicContact CB-CG2 4.43Å
572C95.3Very high93.2Very high0 Ų026 Ų260%013%0.133CC..Hα-helixtrans-70.5-32.2-176.1-168.30000112.8M568 V569 K574 E575 P576 V579 A607M568-C572 WeakPolarHBondContact O-CB 3.43Å; M568-C572 PolarHBondContact O-N 3.11Å; V569-C572 PolarHBondContact O-N 2.96Å; V569-C572 VanDerWaalsContact O-N 3.16Å; C572-K574 VanDerWaalsContact C-N 3.3Å; C572-E575 CarbonylContact O-C 3.51Å; C572-P576 WeakPolarHBondContact O-CA 3.42Å; C572-P576 WeakPolarHBondContact O-CG 3.29Å; C572-V579 HydrophobicContact CB-CB 4.42Å; C572-V579 HydrophobicContact CB-CG1 3.73Å; C572-A607 HydrophobicContact CB-CB 3.71Å
573V93.1Very high93.5Very high17 Ų1721.3 Ų21.310%0.10311%0.112CC..Hα-helixtrans-72.7-29.8173.6174.30000111.3V569 C571 A607 E610 L611V569-V573 HydrophobicContact CG1-CG2 4.1Å; V569-V573 VanDerWaalsContact O-CG2 3.29Å; V569-V573 WeakPolarHBondContact O-CG2 3.49Å; V569-V573 PolarHBondContact O-N 3.27Å; C571-V573 PolarHBondContact O-N 3.12Å; V573-A607 HydrophobicContact CG2-CB 4.01Å; V573-E610 HydrophobicContact CG1-CG 4.23Å; V573-E610 HydrophobicContact CG2-CB 3.89Å; V573-E610 HydrophobicContact CG2-CG 3.89Å; V573-L611 HydrophobicContact CG1-CD2 4.14Å; V573-L611 HydrophobicContact CG2-CG 4.35Å
574K91.2Very high93.8Very high29 Ų2920.5 Ų20.513%0.12611%0.107CC..Hα-helixtrans-73.7-46.7180-17466.7172.1-151.40112.5I530 R532 S537 A570 C571 C572I530-K574 HydrophobicContact CG2-CB 4.22Å; I530-K574 HydrophobicContact CG2-CG 4.48Å; I530-K574 PolarHBondContact O-NZ 3.32Å; R532-K574 PolarHBondContact O-NZ 3.46Å; S537-K574 WeakPolarHBondContact OG-CE 3.43Å; S537-K574 PolarHBondContact OG-NZ 2.86Å; A570-K574 VanDerWaalsContact O-CB 3.23Å; A570-K574 WeakPolarHBondContact O-CB 3.47Å; A570-K574 PolarHBondContact O-N 3.46Å; A570-K574 VanDerWaalsContact O-N 3.08Å; C571-K574 WeakPolarHBondContact O-CB 3.3Å; C571-K574 PolarHBondContact O-N 3.14Å; C572-K574 VanDerWaalsContact C-N 3.3Å
575E93Very high93.8Very high52 Ų5225.6 Ų25.624%0.24313%0.131CC..SBendtrans-132.580.6179.4-167.652.9-124.100110.5H538 A541 C571 C572 I577 E578 V579H538-E575 IonicContact CG-OE2 3.23Å; H538-E575 IonicContact ND1-OE2 3.48Å; H538-E575 PolarHBondContact ND1-OE2 3.27Å; A541-E575 HydrophobicContact CB-CB 3.95Å; C571-E575 PolarHBondContact O-N 3.02Å; C572-E575 CarbonylContact O-C 3.51Å; E575-I577 PolarHBondContact O-N 3.45Å; E575-E578 HydrophobicContact CG-CB 4.24Å; E575-V579 HydrophobicContact CB-CG2 4.09Å; E575-V579 WeakPolarHBondContact O-CB 3.31Å; E575-V579 VanDerWaalsContact O-CG2 3.24Å; E575-V579 WeakPolarHBondContact O-CG2 3.38Å; E575-V579 PolarHBondContact O-N 2.98Å
576P94.4Very high93.7Very high22 Ų2225.9 Ų25.914%0.14313%0.132CC..Hα-helixtrans-65.7-38.9-164.9-22.633.3000115.6C572 A580 L611 I655 F659C572-P576 WeakPolarHBondContact O-CA 3.42Å; C572-P576 WeakPolarHBondContact O-CG 3.29Å; P576-A580 WeakPolarHBondContact O-CB 3.36Å; P576-A580 PolarHBondContact O-N 2.86Å; P576-L611 HydrophobicContact CB-CD1 4.03Å; P576-L611 HydrophobicContact CG-CD1 4.14Å; P576-L611 HydrophobicContact CG-CD2 4.1Å; P576-I655 HydrophobicContact CB-CD1 3.58Å; P576-I655 HydrophobicContact CG-CD1 4.14Å; P576-F659 HydrophobicContact CB-CE2 3.95Å; P576-F659 HydrophobicContact CB-CZ 3.92Å; P576-F659 WeakPolarHBondContact O-CE2 3.33Å; P576-F659 VanDerWaalsContact O-CZ 3.28Å; P576-F659 WeakPolarHBondContact O-CZ 3.38Å
577I94.5Very high93.7Very high69 Ų6923.3 Ų23.335%0.35412%0.12SC..Hα-helixtrans-76.4-56.1-169.5-60.8174.7000109.9E575 A580 A581 I655E575-I577 PolarHBondContact O-N 3.45Å; I577-A580 PolarHBondContact O-N 2.86Å; I577-A581 WeakPolarHBondContact O-CB 3.38Å; I577-A581 PolarHBondContact O-N 3.28Å; I577-I655 HydrophobicContact CD1-CG2 4.39Å; I577-I655 HydrophobicContact CG1-CG2 4.47Å
578E93.8Very high93.6Very high114 Ų11426 Ų2653%0.53313%0.132SC..Hα-helixtrans-67.5-42-176-61.7-58.513700112.1V542 E575 A581 C582V542-E578 HydrophobicContact CG2-CB 3.73Å; E575-E578 HydrophobicContact CG-CB 4.24Å; E578-A581 PolarHBondContact O-N 3.03Å; E578-C582 WeakPolarHBondContact O-CB 3.2Å; E578-C582 PolarHBondContact O-N 2.83Å
579V95.1Very high93.2Very high0 Ų028.2 Ų28.20%014%0.144CC..Hα-helixtrans-67.8-40.7178.41750000111.1A541 V542 V545 C571 C572 E575 C582 L583A541-V579 HydrophobicContact CB-CG2 3.99Å; V542-V579 HydrophobicContact CG2-CG2 4.05Å; V545-V579 HydrophobicContact CB-CG1 4.12Å; V545-V579 HydrophobicContact CG1-CG1 4.06Å; V545-V579 HydrophobicContact CG2-CG1 3.94Å; C571-V579 HydrophobicContact CB-CG1 4.23Å; C571-V579 HydrophobicContact CB-CG2 4.43Å; C572-V579 HydrophobicContact CB-CB 4.42Å; C572-V579 HydrophobicContact CB-CG1 3.73Å; E575-V579 HydrophobicContact CB-CG2 4.09Å; E575-V579 WeakPolarHBondContact O-CB 3.31Å; E575-V579 VanDerWaalsContact O-CG2 3.24Å; E575-V579 WeakPolarHBondContact O-CG2 3.38Å; E575-V579 PolarHBondContact O-N 2.98Å; V579-C582 PolarHBondContact O-N 2.75Å; V579-L583 HydrophobicContact CG1-CD1 4.01Å; V579-L583 HydrophobicContact CG1-CG 4.28Å; V579-L583 WeakPolarHBondContact O-CB 3.32Å; V579-L583 VanDerWaalsContact O-CG 3.29Å; V579-L583 WeakPolarHBondContact O-CG 3.39Å; V579-L583 PolarHBondContact O-N 3.05Å
580A95.3Very high92.6Very high0 Ų038 Ų380%019%0.186CC..Hα-helixtrans-66.3-39.5177.500000112.3P576 I577 L583 C584 L604 F659P576-A580 WeakPolarHBondContact O-CB 3.36Å; P576-A580 PolarHBondContact O-N 2.86Å; I577-A580 PolarHBondContact O-N 2.86Å; A580-L583 PolarHBondContact O-N 2.98Å; A580-C584 WeakPolarHBondContact O-CB 3.38Å; A580-C584 PolarHBondContact O-N 3.24Å; A580-C584 PolarHBondContact O-SG 2.99Å; A580-L604 HydrophobicContact CB-CD2 3.98Å; A580-F659 HydrophobicContact CB-CD1 3.77Å; A580-F659 HydrophobicContact CB-CD2 4Å; A580-F659 HydrophobicContact CB-CE1 3.49Å; A580-F659 VanDerWaalsContact CB-CE1 3.49Å; A580-F659 HydrophobicContact CB-CE2 3.72Å; A580-F659 HydrophobicContact CB-CG 4.02Å; A580-F659 HydrophobicContact CB-CZ 3.46Å; A580-F659 VanDerWaalsContact CB-CZ 3.46Å
581A93.7Very high91.8Very high37 Ų3745.2 Ų45.231%0.30622%0.22SC..Hα-helixtrans-59.3-49.4173.800000111I577 E578 L583 C584 E585I577-A581 WeakPolarHBondContact O-CB 3.38Å; I577-A581 PolarHBondContact O-N 3.28Å; E578-A581 PolarHBondContact O-N 3.03Å; A581-L583 VanDerWaalsContact C-N 3.35Å; A581-L583 PolarHBondContact O-N 3.26Å; A581-C584 PolarHBondContact O-N 3.02Å; A581-E585 PolarHBondContact O-N 3.16Å
582C92.5Very high91.1Very high2 Ų245.5 Ų45.51%0.01422%0.222CC..Hα-helixtrans-56.8-45.5175.8179.30000112.5R546 E578 V579 E585 E586R546-C582 PolarHBondContact NH1-SG 3.41Å; R546-C582 VanDerWaalsContact NH1-SG 3.39Å; E578-C582 WeakPolarHBondContact O-CB 3.2Å; E578-C582 PolarHBondContact O-N 2.83Å; V579-C582 PolarHBondContact O-N 2.75Å; C582-E585 PolarHBondContact O-N 3Å; C582-E586 PolarHBondContact O-N 3.44Å
583L95.6Very high90.5Very high0 Ų049.6 Ų49.60%025%0.246CC..Hα-helixtrans-67-39.5179-74.4179.9000112.1V545 V549 M568 V579 A580 A581 E585 E586 V587 I600 L604V545-L583 HydrophobicContact CG1-CD2 4.42Å; V545-L583 HydrophobicContact CG2-CD1 4.37Å; V545-L583 HydrophobicContact CG2-CD2 3.83Å; V545-L583 HydrophobicContact CG2-CG 4.26Å; V549-L583 HydrophobicContact CG2-CD2 3.58Å; M568-L583 HydrophobicContact CE-CD2 3.58Å; V579-L583 HydrophobicContact CG1-CD1 4.01Å; V579-L583 HydrophobicContact CG1-CG 4.28Å; V579-L583 WeakPolarHBondContact O-CB 3.32Å; V579-L583 VanDerWaalsContact O-CG 3.29Å; V579-L583 WeakPolarHBondContact O-CG 3.39Å; V579-L583 PolarHBondContact O-N 3.05Å; A580-L583 PolarHBondContact O-N 2.98Å; A581-L583 VanDerWaalsContact C-N 3.35Å; A581-L583 PolarHBondContact O-N 3.26Å; L583-E585 VanDerWaalsContact C-N 3.34Å; L583-E585 PolarHBondContact O-N 2.8Å; L583-E586 PolarHBondContact O-N 3.42Å; L583-V587 WeakPolarHBondContact O-CG2 3.45Å; L583-V587 PolarHBondContact O-N 3.29Å; L583-V587 VanDerWaalsContact O-N 3.16Å; L583-I600 HydrophobicContact CB-CG2 3.7Å; L583-I600 HydrophobicContact CD2-CG1 4.2Å; L583-I600 HydrophobicContact CD2-CG2 3.88Å; L583-I600 HydrophobicContact CG-CG2 4.23Å; L583-I600 WeakPolarHBondContact O-CG2 3.35Å; L583-L604 HydrophobicContact CB-CD1 4.35Å; L583-L604 HydrophobicContact CB-CD2 4.11Å; L583-L604 HydrophobicContact CB-CG 4.33Å; L583-L604 HydrophobicContact CD1-CD2 3.93Å; L583-L604 HydrophobicContact CD1-CG 4.2Å
584C94.7Very high90.1Very high3 Ų351.9 Ų51.92%0.0226%0.257CS..Hα-helixtrans-61.6-43.4176.1-70.40000111.2A580 A581 E586 V587 F588 P662A580-C584 WeakPolarHBondContact O-CB 3.38Å; A580-C584 PolarHBondContact O-N 3.24Å; A580-C584 PolarHBondContact O-SG 2.99Å; A581-C584 PolarHBondContact O-N 3.02Å; C584-E586 VanDerWaalsContact C-N 3.35Å; C584-E586 PolarHBondContact O-N 2.84Å; C584-V587 PolarHBondContact O-N 3.4Å; C584-F588 WeakPolarHBondContact O-CD2 3.49Å; C584-F588 WeakPolarHBondContact O-CE2 3.36Å; C584-P662 HydrophobicContact CB-CB 3.97Å
585E92.8Very high89.7Confident125 Ų12556.7 Ų56.758%0.58428%0.284SS*.Hα-helixtrans-58.3-45.5175.1-72.6177.1173.300111.9A581 C582 L583 V587 F588 N589A581-E585 PolarHBondContact O-N 3.16Å; C582-E585 PolarHBondContact O-N 3Å; L583-E585 VanDerWaalsContact C-N 3.34Å; L583-E585 PolarHBondContact O-N 2.8Å; E585-V587 VanDerWaalsContact C-N 3.29Å; E585-V587 PolarHBondContact O-N 2.82Å; E585-F588 PolarHBondContact O-N 3.48Å; E585-F588 VanDerWaalsContact O-N 3.11Å; E585-N589 PolarHBondContact O-N 3.27Å; E585-N589 VanDerWaalsContact O-N 3.08Å
586E91.6Very high89.4Confident15 Ų1556.1 Ų56.17%0.0728%0.279CS..Hα-helixtrans-66-26.4-179.5-71.7-59.5161.900114V549 H550 C582 L583 C584 F588 N589 T592 I600V549-E586 HydrophobicContact CG1-CB 4.37Å; V549-E586 HydrophobicContact CG1-CG 4.31Å; H550-E586 IonicContact CE1-OE2 3.79Å; H550-E586 IonicContact NE2-OE1 3.6Å; H550-E586 IonicContact NE2-OE2 2.71Å; C582-E586 PolarHBondContact O-N 3.44Å; L583-E586 PolarHBondContact O-N 3.42Å; C584-E586 VanDerWaalsContact C-N 3.35Å; C584-E586 PolarHBondContact O-N 2.84Å; E586-F588 VanDerWaalsContact C-N 3.3Å; E586-F588 PolarHBondContact O-N 3.31Å; E586-N589 WeakPolarHBondContact O-CB 3.44Å; E586-N589 PolarHBondContact O-N 3.4Å; E586-N589 PolarHBondContact OE2-ND2 3.2Å; E586-N589 VanDerWaalsContact OE2-ND2 3.11Å; E586-T592 WeakPolarHBondContact O-CB 3.4Å; E586-T592 PolarHBondContact O-OG1 2.75Å; E586-T592 PolarHBondContact OE2-OG1 3.45Å; E586-I600 HydrophobicContact CB-CD1 3.85Å
587V92.1Very high89.2Confident1 Ų156 Ų561%0.00628%0.277CS..Hα-helixtrans-64.9-36.7173.41710000111.2L583 C584 E585 K597 I600 L601 L663 T679 I683L583-V587 WeakPolarHBondContact O-CG2 3.45Å; L583-V587 PolarHBondContact O-N 3.29Å; L583-V587 VanDerWaalsContact O-N 3.16Å; C584-V587 PolarHBondContact O-N 3.4Å; E585-V587 VanDerWaalsContact C-N 3.29Å; E585-V587 PolarHBondContact O-N 2.82Å; V587-K597 VanDerWaalsContact O-CD 3.24Å; V587-K597 WeakPolarHBondContact O-CD 3.25Å; V587-K597 WeakPolarHBondContact O-CE 3.27Å; V587-K597 PolarHBondContact O-NZ 3.17Å; V587-I600 HydrophobicContact CG2-CB 3.92Å; V587-I600 HydrophobicContact CG2-CD1 4.33Å; V587-I600 HydrophobicContact CG2-CG2 3.45Å; V587-I600 VanDerWaalsContact CG2-CG2 3.45Å; V587-L601 HydrophobicContact CG1-CD2 4.3Å; V587-L601 HydrophobicContact CG2-CD2 4.12Å; V587-L601 HydrophobicContact CG2-CG 4.23Å; V587-L663 HydrophobicContact CG1-CD1 4.43Å; V587-T679 HydrophobicContact CG1-CG2 4.5Å; V587-I683 HydrophobicContact CG1-CD1 3.94Å; V587-I683 HydrophobicContact CG1-CG1 4.33Å
588F90.5Very high89Confident56 Ų5654.7 Ų54.725%0.24627%0.27CS..Hα-helixtrans-89.9-9-179.8-57.9-67.3000113.2C584 E585 E586 K590 L663 G666 L670 I683C584-F588 WeakPolarHBondContact O-CD2 3.49Å; C584-F588 WeakPolarHBondContact O-CE2 3.36Å; E585-F588 PolarHBondContact O-N 3.48Å; E585-F588 VanDerWaalsContact O-N 3.11Å; E586-F588 VanDerWaalsContact C-N 3.3Å; E586-F588 PolarHBondContact O-N 3.31Å; F588-K590 PolarHBondContact O-N 3.11Å; F588-L663 HydrophobicContact CE2-CD1 4.04Å; F588-L663 HydrophobicContact CZ-CD1 3.96Å; F588-L663 WeakPolarHBondContact CZ-O 3.25Å; F588-G666 VanDerWaalsContact CZ-C 3.47Å; F588-G666 VanDerWaalsContact CZ-CA 3.41Å; F588-L670 HydrophobicContact CD1-CD2 4.47Å; F588-L670 HydrophobicContact CE1-CD1 4.19Å; F588-L670 HydrophobicContact CE1-CG 4.39Å; F588-I683 HydrophobicContact CE1-CD1 3.85Å; F588-I683 HydrophobicContact CZ-CD1 4.14Å
589N87.6Confident88.9Confident49 Ų4950.8 Ų50.826%0.26225%0.252SS..  trans-60.5130.6172.5-171.8-8.1000110.5E585 E586 E591 K597E585-N589 PolarHBondContact O-N 3.27Å; E585-N589 VanDerWaalsContact O-N 3.08Å; E586-N589 WeakPolarHBondContact O-CB 3.44Å; E586-N589 PolarHBondContact O-N 3.4Å; E586-N589 PolarHBondContact OE2-ND2 3.2Å; E586-N589 VanDerWaalsContact OE2-ND2 3.11Å; N589-E591 VanDerWaalsContact C-N 3.3Å; N589-E591 PolarHBondContact OD1-N 3.2Å; N589-K597 WeakPolarHBondContact O-CE 3.31Å; N589-K597 PolarHBondContact O-NZ 2.83Å
590K80Confident88.8Confident205 Ų20550.9 Ų50.989%0.89125%0.253SS*.SBendtrans-72.5-25.1-179.3-67.5-174.7179.91800112.6F588 T592F588-K590 PolarHBondContact O-N 3.11Å; K590-T592 VanDerWaalsContact C-N 3.32Å
591E77.2Confident88.8Confident154 Ų15450.9 Ų50.972%0.7225%0.253SS*.SBendtrans-81.9-15.3-178.1-61.4178.5179.300112.2N589 V593N589-E591 VanDerWaalsContact C-N 3.3Å; N589-E591 PolarHBondContact OD1-N 3.2Å; E591-V593 PolarHBondContact O-N 3.13Å
592T80.2Confident88.7Confident6 Ų650.3 Ų50.34%0.03724%0.243CC..SBendtrans-77.7124.9-179.3-570000110.8E586 K590 R596 K597 I600E586-T592 WeakPolarHBondContact O-CB 3.4Å; E586-T592 PolarHBondContact O-OG1 2.75Å; E586-T592 PolarHBondContact OE2-OG1 3.45Å; K590-T592 VanDerWaalsContact C-N 3.32Å; T592-R596 HydrophobicContact CG2-CB 3.85Å; T592-K597 HydrophobicContact CG2-CG 3.82Å; T592-K597 WeakPolarHBondContact O-CE 3.45Å; T592-I600 HydrophobicContact CG2-CD1 4.34Å
593V82.1Confident88.8Confident85 Ų8550.2 Ų50.252%0.51524%0.242SC..  trans-64.2140.8177.9-176.30000110.8E591 L595 R596 K597E591-V593 PolarHBondContact O-N 3.13Å; V593-L595 VanDerWaalsContact C-N 3.29Å; V593-L595 PolarHBondContact O-N 3.26Å; V593-R596 WeakPolarHBondContact O-CA 3.46Å; V593-R596 WeakPolarHBondContact O-CB 3.32Å; V593-R596 PolarHBondContact O-N 3.11Å; V593-K597 PolarHBondContact O-N 2.61Å; V593-K597 VanDerWaalsContact O-N 3.11Å
594I84.1Confident88.8Confident66 Ų6650.2 Ų50.234%0.33824%0.242SC..Hα-helixtrans-49.5-45-177.6-70.1167.2000112.8R596 K597 M598 D675I594-R596 VanDerWaalsContact C-N 3.3Å; I594-R596 PolarHBondContact O-N 3.02Å; I594-K597 WeakPolarHBondContact O-CA 3.01Å; I594-K597 VanDerWaalsContact O-CB 3.32Å; I594-K597 WeakPolarHBondContact O-CB 3.31Å; I594-K597 PolarHBondContact O-N 3.49Å; I594-M598 HydrophobicContact CG2-CE 4.14Å; I594-M598 HydrophobicContact CG2-CG 4.45Å; I594-M598 WeakPolarHBondContact O-CG 3.41Å; I594-M598 PolarHBondContact O-N 3.33Å; I594-D675 HydrophobicContact CD1-CB 4.3Å
595L83.6Confident88.7Confident129 Ų12950.1 Ų50.168%0.67524%0.241SC*.Hα-helixtrans-57-42.2177.3-103.5129.3000112.5V593 K597 M598 D599V593-L595 VanDerWaalsContact C-N 3.29Å; V593-L595 PolarHBondContact O-N 3.26Å; L595-K597 VanDerWaalsContact C-N 3.34Å; L595-K597 PolarHBondContact O-N 3.01Å; L595-M598 WeakPolarHBondContact O-CB 3.38Å; L595-M598 PolarHBondContact O-N 3.15Å; L595-D599 PolarHBondContact O-N 2.99Å
596R87.3Confident88.7Confident41 Ų4144.5 Ų44.516%0.15522%0.215CC..Hα-helixtrans-66.6-37.3175.9-66177.5177.2-178-0.6111.2V549 H550 D552 T592 V593 I594 M598 D599 I600V549-R596 VanDerWaalsContact O-CD 3.31Å; V549-R596 WeakPolarHBondContact O-CD 3.24Å; H550-R596 PolarHBondContact ND1-NH1 3.25Å; H550-R596 PolarHBondContact O-NH2 3.01Å; D552-R596 IonicContact OD1-CZ 3.54Å; D552-R596 IonicContact OD1-NH2 3.11Å; D552-R596 PolarHBondContact OD1-NH2 3.43Å; D552-R596 IonicContact OD2-NH2 3.86Å; T592-R596 HydrophobicContact CG2-CB 3.85Å; V593-R596 WeakPolarHBondContact O-CA 3.46Å; V593-R596 WeakPolarHBondContact O-CB 3.32Å; V593-R596 PolarHBondContact O-N 3.11Å; I594-R596 VanDerWaalsContact C-N 3.3Å; I594-R596 PolarHBondContact O-N 3.02Å; R596-M598 VanDerWaalsContact C-N 3.32Å; R596-M598 PolarHBondContact O-N 3.5Å; R596-D599 PolarHBondContact O-N 2.94Å; R596-I600 WeakPolarHBondContact O-CD1 3.11Å; R596-I600 WeakPolarHBondContact O-CG1 3.41Å; R596-I600 PolarHBondContact O-N 3.17Å
597K89.6Confident88.8Confident19 Ų1943.8 Ų43.88%0.08321%0.212CC..Hα-helixtrans-59.8-42.7172.6-58.8-174.8175-162.90111.5V587 N589 T592 V593 I594 L595 D599 I600 L601 T679V587-K597 VanDerWaalsContact O-CD 3.24Å; V587-K597 WeakPolarHBondContact O-CD 3.25Å; V587-K597 WeakPolarHBondContact O-CE 3.27Å; V587-K597 PolarHBondContact O-NZ 3.17Å; N589-K597 WeakPolarHBondContact O-CE 3.31Å; N589-K597 PolarHBondContact O-NZ 2.83Å; T592-K597 HydrophobicContact CG2-CG 3.82Å; T592-K597 WeakPolarHBondContact O-CE 3.45Å; V593-K597 PolarHBondContact O-N 2.61Å; V593-K597 VanDerWaalsContact O-N 3.11Å; I594-K597 WeakPolarHBondContact O-CA 3.01Å; I594-K597 VanDerWaalsContact O-CB 3.32Å; I594-K597 WeakPolarHBondContact O-CB 3.31Å; I594-K597 PolarHBondContact O-N 3.49Å; L595-K597 VanDerWaalsContact C-N 3.34Å; L595-K597 PolarHBondContact O-N 3.01Å; K597-D599 VanDerWaalsContact C-N 3.34Å; K597-D599 PolarHBondContact O-N 2.93Å; K597-I600 PolarHBondContact O-N 3.44Å; K597-L601 VanDerWaalsContact O-CG 3.31Å; K597-L601 WeakPolarHBondContact O-CG 3.3Å; K597-L601 PolarHBondContact O-N 3.36Å; K597-T679 HydrophobicContact CD-CG2 4.42Å
598M90.2Very high88.9Confident42 Ų4243.8 Ų43.821%0.20721%0.212CC..Hα-helixtrans-62.6-41.8176.9-62-52.4112.300111.7I594 L595 R596 L601 R602 T679 R682I594-M598 HydrophobicContact CG2-CE 4.14Å; I594-M598 HydrophobicContact CG2-CG 4.45Å; I594-M598 WeakPolarHBondContact O-CG 3.41Å; I594-M598 PolarHBondContact O-N 3.33Å; L595-M598 WeakPolarHBondContact O-CB 3.38Å; L595-M598 PolarHBondContact O-N 3.15Å; R596-M598 VanDerWaalsContact C-N 3.32Å; R596-M598 PolarHBondContact O-N 3.5Å; M598-L601 HydrophobicContact CE-CD1 4.31Å; M598-L601 PolarHBondContact O-N 3.11Å; M598-R602 VanDerWaalsContact O-CB 3.3Å; M598-R602 WeakPolarHBondContact O-CB 3.46Å; M598-R602 PolarHBondContact O-N 2.96Å; M598-T679 HydrophobicContact CE-CG2 4.34Å; M598-R682 HydrophobicContact CE-CB 4.43Å; M598-R682 HydrophobicContact SD-CB 3.84Å; M598-R682 HydrophobicContact SD-CG 3.75Å
599D90.6Very high88.9Confident32 Ų3241.1 Ų41.117%0.17120%0.2CC..Hα-helixtrans-67.1-37.9176.9-72-15000112.7R564 V565 L595 R596 K597 R602 A603R564-D599 IonicContact CZ-OD2 3.35Å; R564-D599 IonicContact NH2-OD2 3.63Å; R564-D599 PolarHBondContact NH2-OD2 3.27Å; V565-D599 HydrophobicContact CG2-CB 3.88Å; L595-D599 PolarHBondContact O-N 2.99Å; R596-D599 PolarHBondContact O-N 2.94Å; K597-D599 VanDerWaalsContact C-N 3.34Å; K597-D599 PolarHBondContact O-N 2.93Å; D599-R602 WeakPolarHBondContact O-CB 3.36Å; D599-R602 PolarHBondContact O-N 3.11Å; D599-A603 WeakPolarHBondContact O-CB 3.47Å; D599-A603 PolarHBondContact O-N 3.37Å
600I94.8Very high89.1Confident1 Ų139.3 Ų39.31%0.00519%0.19CC..Hα-helixtrans-61.7-50.8173.9-67.8160.6000110.4V549 M568 L583 E586 V587 T592 R596 K597 R602 A603 L604V549-I600 HydrophobicContact CG1-CD1 3.92Å; V549-I600 HydrophobicContact CG1-CG1 4.43Å; V549-I600 HydrophobicContact CG2-CD1 4.4Å; V549-I600 HydrophobicContact CG2-CG1 4.22Å; M568-I600 HydrophobicContact CE-CG1 3.84Å; L583-I600 HydrophobicContact CB-CG2 3.7Å; L583-I600 HydrophobicContact CD2-CG1 4.2Å; L583-I600 HydrophobicContact CD2-CG2 3.88Å; L583-I600 HydrophobicContact CG-CG2 4.23Å; L583-I600 WeakPolarHBondContact O-CG2 3.35Å; E586-I600 HydrophobicContact CB-CD1 3.85Å; V587-I600 HydrophobicContact CG2-CB 3.92Å; V587-I600 HydrophobicContact CG2-CD1 4.33Å; V587-I600 HydrophobicContact CG2-CG2 3.45Å; V587-I600 VanDerWaalsContact CG2-CG2 3.45Å; T592-I600 HydrophobicContact CG2-CD1 4.34Å; R596-I600 WeakPolarHBondContact O-CD1 3.11Å; R596-I600 WeakPolarHBondContact O-CG1 3.41Å; R596-I600 PolarHBondContact O-N 3.17Å; K597-I600 PolarHBondContact O-N 3.44Å; I600-R602 PolarHBondContact O-N 3.47Å; I600-A603 PolarHBondContact O-N 3.15Å; I600-A603 VanDerWaalsContact O-N 3.14Å; I600-L604 HydrophobicContact CG2-CD1 4.19Å; I600-L604 WeakPolarHBondContact O-CG 3.48Å; I600-L604 PolarHBondContact O-N 3.3Å
601L94.2Very high89.6Confident0 Ų029.7 Ų29.70%015%0.148CC..Hα-helixtrans-58.2-39.3177.3-68.6171.1000110.7V587 K597 M598 L604 Q605 L663 R682 I683 T686V587-L601 HydrophobicContact CG1-CD2 4.3Å; V587-L601 HydrophobicContact CG2-CD2 4.12Å; V587-L601 HydrophobicContact CG2-CG 4.23Å; K597-L601 VanDerWaalsContact O-CG 3.31Å; K597-L601 WeakPolarHBondContact O-CG 3.3Å; K597-L601 PolarHBondContact O-N 3.36Å; M598-L601 HydrophobicContact CE-CD1 4.31Å; M598-L601 PolarHBondContact O-N 3.11Å; L601-L604 PolarHBondContact O-N 3.42Å; L601-Q605 WeakPolarHBondContact O-CG 3.18Å; L601-Q605 PolarHBondContact O-N 2.96Å; L601-L663 HydrophobicContact CD2-CD1 3.94Å; L601-L663 HydrophobicContact CD2-CD2 3.98Å; L601-R682 HydrophobicContact CB-CG 4.43Å; L601-R682 HydrophobicContact CD1-CB 3.87Å; L601-R682 HydrophobicContact CD1-CG 3.72Å; L601-I683 HydrophobicContact CD1-CG1 3.86Å; L601-I683 HydrophobicContact CD2-CG1 3.83Å; L601-T686 HydrophobicContact CD2-CG2 4.37Å
602R91.8Very high90.2Very high25 Ų2522.4 Ų22.49%0.09412%0.115CC..Hα-helixtrans-64.4-45.1176.2-174.255.1175166.8-2.8112.4V565 M598 D599 I600 L604 Q605 L606 L622 S626V565-R602 HydrophobicContact CG1-CG 4.41Å; M598-R602 VanDerWaalsContact O-CB 3.3Å; M598-R602 WeakPolarHBondContact O-CB 3.46Å; M598-R602 PolarHBondContact O-N 2.96Å; D599-R602 WeakPolarHBondContact O-CB 3.36Å; D599-R602 PolarHBondContact O-N 3.11Å; I600-R602 PolarHBondContact O-N 3.47Å; R602-L604 VanDerWaalsContact C-N 3.32Å; R602-L604 PolarHBondContact O-N 3.5Å; R602-Q605 PolarHBondContact O-N 2.82Å; R602-L606 HydrophobicContact CG-CD1 3.96Å; R602-L606 HydrophobicContact CG-CG 4.47Å; R602-L606 VanDerWaalsContact O-CG 3.27Å; R602-L606 WeakPolarHBondContact O-CG 3.26Å; R602-L606 PolarHBondContact O-N 3.36Å; R602-L622 PolarHBondContact NH2-O 3.46Å; R602-S626 PolarHBondContact NH1-OG 3.17Å
603A94.4Very high90.4Very high0 Ų023.6 Ų23.60%012%0.119CC..Hα-helixtrans-60.2-42.2176.600000111.5V565 M568 V569 D599 I600 L606 A607V565-A603 HydrophobicContact CG1-CB 4.23Å; M568-A603 HydrophobicContact CB-CB 3.86Å; M568-A603 HydrophobicContact CE-CB 4.42Å; V569-A603 HydrophobicContact CG2-CB 4.16Å; D599-A603 WeakPolarHBondContact O-CB 3.47Å; D599-A603 PolarHBondContact O-N 3.37Å; I600-A603 PolarHBondContact O-N 3.15Å; I600-A603 VanDerWaalsContact O-N 3.14Å; A603-L606 PolarHBondContact O-N 3.32Å; A603-A607 VanDerWaalsContact O-CB 3.27Å; A603-A607 WeakPolarHBondContact O-CB 3.35Å; A603-A607 PolarHBondContact O-N 3.25Å
604L96Very high90.5Very high0 Ų020.3 Ų20.30%010%0.102CC..Hα-helixtrans-62.2-42.9176-71.7169.6000112.5A580 L583 I600 L601 R602 S608 F659 F690A580-L604 HydrophobicContact CB-CD2 3.98Å; L583-L604 HydrophobicContact CB-CD1 4.35Å; L583-L604 HydrophobicContact CB-CD2 4.11Å; L583-L604 HydrophobicContact CB-CG 4.33Å; L583-L604 HydrophobicContact CD1-CD2 3.93Å; L583-L604 HydrophobicContact CD1-CG 4.2Å; I600-L604 HydrophobicContact CG2-CD1 4.19Å; I600-L604 WeakPolarHBondContact O-CG 3.48Å; I600-L604 PolarHBondContact O-N 3.3Å; L601-L604 PolarHBondContact O-N 3.42Å; R602-L604 VanDerWaalsContact C-N 3.32Å; R602-L604 PolarHBondContact O-N 3.5Å; L604-S608 WeakPolarHBondContact O-CB 3.37Å; L604-S608 PolarHBondContact O-N 3.07Å; L604-S608 PolarHBondContact O-OG 3.35Å; L604-F659 HydrophobicContact CD2-CD1 4.11Å; L604-F659 HydrophobicContact CD2-CE1 4.07Å; L604-F690 HydrophobicContact CB-CE1 4.31Å; L604-F690 HydrophobicContact CB-CZ 3.99Å
605Q92.9Very high90.3Very high1 Ų121 Ų211%0.00511%0.111CC..Hα-helixtrans-62.6-45175.1-70.9176.5-8.200112.1L601 R602 S608 C609 T686 F693L601-Q605 WeakPolarHBondContact O-CG 3.18Å; L601-Q605 PolarHBondContact O-N 2.96Å; R602-Q605 PolarHBondContact O-N 2.82Å; Q605-S608 WeakPolarHBondContact CA-OG 3.16Å; Q605-S608 PolarHBondContact O-OG 2.86Å; Q605-C609 WeakPolarHBondContact O-CB 3.4Å; Q605-C609 PolarHBondContact O-N 3.35Å; Q605-T686 HydrophobicContact CG-CG2 3.79Å; Q605-T686 PolarHBondContact NE2-OG1 3.36Å; Q605-F693 WeakPolarHBondContact O-CE2 3.47Å
606L92.4Very high89.8Confident8 Ų819.3 Ų19.34%0.04211%0.11CC..Hα-helixtrans-68.4-41.2-179.1-66.5169.1000111.4V565 V569 R602 A603 C609 E610 V618 L622V565-L606 HydrophobicContact CG1-CD1 3.81Å; V569-L606 HydrophobicContact CG1-CB 4.38Å; V569-L606 HydrophobicContact CG2-CB 3.55Å; V569-L606 HydrophobicContact CG2-CD1 4.07Å; V569-L606 HydrophobicContact CG2-CG 4.48Å; R602-L606 HydrophobicContact CG-CD1 3.96Å; R602-L606 HydrophobicContact CG-CG 4.47Å; R602-L606 VanDerWaalsContact O-CG 3.27Å; R602-L606 WeakPolarHBondContact O-CG 3.26Å; R602-L606 PolarHBondContact O-N 3.36Å; A603-L606 PolarHBondContact O-N 3.32Å; L606-C609 WeakPolarHBondContact O-CB 3.3Å; L606-C609 PolarHBondContact O-N 3.37Å; L606-E610 PolarHBondContact O-N 3.14Å; L606-V618 HydrophobicContact CB-CG1 4.4Å; L606-V618 HydrophobicContact CD2-CG1 3.49Å; L606-V618 VanDerWaalsContact CD2-CG1 3.49Å; L606-V618 HydrophobicContact CG-CG1 4.47Å; L606-L622 HydrophobicContact CD2-CB 3.82Å; L606-L622 HydrophobicContact CD2-CD1 3.86Å; L606-L622 HydrophobicContact CD2-CG 4.47Å
607A94.2Very high89Confident0 Ų017.9 Ų17.90%011%0.107CC..Hα-helixtrans-64.8-43.5176.500000112.1V569 C572 V573 A603 C609 E610 L611V569-A607 HydrophobicContact CG1-CB 4.24Å; C572-A607 HydrophobicContact CB-CB 3.71Å; V573-A607 HydrophobicContact CG2-CB 4.01Å; A603-A607 VanDerWaalsContact O-CB 3.27Å; A603-A607 WeakPolarHBondContact O-CB 3.35Å; A603-A607 PolarHBondContact O-N 3.25Å; A607-C609 VanDerWaalsContact C-N 3.34Å; A607-C609 PolarHBondContact O-N 3.25Å; A607-E610 PolarHBondContact O-N 2.71Å; A607-L611 WeakPolarHBondContact O-CB 3.45Å; A607-L611 WeakPolarHBondContact O-CD1 3.42Å; A607-L611 VanDerWaalsContact O-CG 3.23Å; A607-L611 WeakPolarHBondContact O-CG 3.33Å; A607-L611 PolarHBondContact O-N 3.26Å
608S93.4Very high87.9Confident0 Ų017.7 Ų17.70%011%0.107CC..Hα-helixtrans-63.5-38.5175.351.90000112.4L604 Q605 L611 A612 F652 F693L604-S608 WeakPolarHBondContact O-CB 3.37Å; L604-S608 PolarHBondContact O-N 3.07Å; L604-S608 PolarHBondContact O-OG 3.35Å; Q605-S608 WeakPolarHBondContact CA-OG 3.16Å; Q605-S608 PolarHBondContact O-OG 2.86Å; S608-L611 PolarHBondContact O-N 3.13Å; S608-A612 VanDerWaalsContact O-CB 3.3Å; S608-A612 WeakPolarHBondContact O-CB 3.3Å; S608-A612 PolarHBondContact O-N 3.08Å; S608-F652 VanDerWaalsContact CB-CE2 3.41Å; S608-F693 VanDerWaalsContact OG-CD2 3.29Å; S608-F693 WeakPolarHBondContact OG-CD2 3.49Å
609C90.7Very high86.6Confident0 Ų024.6 Ų24.60%014%0.136CC..Hα-helixtrans-61.2-46.7171.5-175.90000112Q605 L606 A607 L611 A612 W613 V618 L622 F693Q605-C609 WeakPolarHBondContact O-CB 3.4Å; Q605-C609 PolarHBondContact O-N 3.35Å; L606-C609 WeakPolarHBondContact O-CB 3.3Å; L606-C609 PolarHBondContact O-N 3.37Å; A607-C609 VanDerWaalsContact C-N 3.34Å; A607-C609 PolarHBondContact O-N 3.25Å; C609-L611 VanDerWaalsContact C-N 3.34Å; C609-L611 PolarHBondContact O-N 2.95Å; C609-A612 PolarHBondContact O-N 2.95Å; C609-W613 PolarHBondContact O-N 3.3Å; C609-V618 HydrophobicContact CB-CG2 4.49Å; C609-L622 HydrophobicContact CB-CD1 3.59Å; C609-F693 HydrophobicContact CB-CD1 4.44Å; C609-F693 HydrophobicContact CB-CD2 4.4Å; C609-F693 HydrophobicContact CB-CE1 3.87Å; C609-F693 HydrophobicContact CB-CE2 3.79Å; C609-F693 HydrophobicContact CB-CZ 3.53Å
610E90.7Very high84.9Confident12 Ų1229.7 Ų29.76%0.05616%0.162CC..Hα-helixtrans-64.3-38.5179.4-178.1169.1162.600111.9R531 V573 L606 A607 A612 G614 P615 V618R531-E610 IonicContact CZ-OE1 3.89Å; R531-E610 IonicContact CZ-OE2 3.13Å; R531-E610 IonicContact NH1-OE1 3.31Å; R531-E610 PolarHBondContact NH1-OE1 3.23Å; R531-E610 IonicContact NH1-OE2 3.56Å; R531-E610 PolarHBondContact NH1-OE2 3.44Å; R531-E610 IonicContact NH2-OE1 2.65Å; R531-E610 IonicContact NH2-OE2 2.65Å; R531-E610 PolarHBondContact NH2-OE2 3.37Å; V573-E610 HydrophobicContact CG1-CG 4.23Å; V573-E610 HydrophobicContact CG2-CB 3.89Å; V573-E610 HydrophobicContact CG2-CG 3.89Å; L606-E610 PolarHBondContact O-N 3.14Å; A607-E610 PolarHBondContact O-N 2.71Å; E610-A612 VanDerWaalsContact C-N 3.34Å; E610-G614 CarbonylContact O-C 3.58Å; E610-G614 WeakPolarHBondContact O-CA 3.32Å; E610-G614 PolarHBondContact O-N 3.12Å; E610-P615 HydrophobicContact CG-CB 4.19Å; E610-V618 HydrophobicContact CB-CG2 3.8Å
611L91.8Very high82.9Confident2 Ų231.4 Ų31.41%0.0117%0.171CC..Hα-helixtrans-69.1-32.1175.7-71.4164.8000112.4V573 P576 A607 S608 C609 R651 F652 I655 F659V573-L611 HydrophobicContact CG1-CD2 4.14Å; V573-L611 HydrophobicContact CG2-CG 4.35Å; P576-L611 HydrophobicContact CB-CD1 4.03Å; P576-L611 HydrophobicContact CG-CD1 4.14Å; P576-L611 HydrophobicContact CG-CD2 4.1Å; A607-L611 WeakPolarHBondContact O-CB 3.45Å; A607-L611 WeakPolarHBondContact O-CD1 3.42Å; A607-L611 VanDerWaalsContact O-CG 3.23Å; A607-L611 WeakPolarHBondContact O-CG 3.33Å; A607-L611 PolarHBondContact O-N 3.26Å; S608-L611 PolarHBondContact O-N 3.13Å; C609-L611 VanDerWaalsContact C-N 3.34Å; C609-L611 PolarHBondContact O-N 2.95Å; L611-R651 WeakPolarHBondContact O-CB 3.43Å; L611-R651 PolarHBondContact O-N 3.22Å; L611-F652 HydrophobicContact CB-CB 3.83Å; L611-F652 HydrophobicContact CB-CD2 4.35Å; L611-F652 HydrophobicContact CD1-CD2 4.25Å; L611-F652 PolarHBondContact O-N 3.3Å; L611-I655 HydrophobicContact CD1-CD1 4.18Å; L611-F659 HydrophobicContact CD1-CZ 4.26Å
612A88.8Confident81.1Confident2 Ų231.8 Ų31.82%0.01717%0.173CC..Hα-helixtrans-82.1-44.8-179.100000113.6S608 C609 E610 N650 F652 F693S608-A612 VanDerWaalsContact O-CB 3.3Å; S608-A612 WeakPolarHBondContact O-CB 3.3Å; S608-A612 PolarHBondContact O-N 3.08Å; C609-A612 PolarHBondContact O-N 2.95Å; E610-A612 VanDerWaalsContact C-N 3.34Å; A612-N650 WeakPolarHBondContact CA-OD1 3.36Å; A612-F652 HydrophobicContact CB-CB 4.02Å; A612-F693 HydrophobicContact CB-CB 3.86Å; A612-F693 HydrophobicContact CB-CD1 4.41Å; A612-F693 HydrophobicContact CB-CG 4.39Å
613W85.3Confident79.2Confident31 Ų3135.5 Ų35.512%0.11720%0.199CC..Hα-helixtrans-126.35-168.8-58.7-26000114C609 A617 I635 A638 V692 F693C609-W613 PolarHBondContact O-N 3.3Å; W613-A617 HydrophobicContact CB-CB 3.49Å; W613-A617 VanDerWaalsContact CB-CB 3.49Å; W613-A617 HydrophobicContact CE3-CB 4.32Å; W613-I635 HydrophobicContact CH2-CG2 3.78Å; W613-I635 HydrophobicContact CZ3-CG2 4.08Å; W613-A638 HydrophobicContact CZ3-CB 4.31Å; W613-V692 HydrophobicContact CH2-CG1 4.22Å; W613-V692 HydrophobicContact CZ2-CG1 4.35Å; W613-F693 HydrophobicContact CD2-CD1 4.44Å; W613-F693 HydrophobicContact CE3-CD1 4.32Å; W613-F693 HydrophobicContact CE3-CE1 4.04Å; W613-F693 AromaticContact CH2-CD1 3.9Å; W613-F693 HydrophobicContact CH2-CD1 3.9Å; W613-F693 AromaticContact CH2-CE1 3.73Å; W613-F693 HydrophobicContact CH2-CE1 3.73Å; W613-F693 AromaticContact CZ2-CD1 3.99Å; W613-F693 HydrophobicContact CZ2-CD1 3.99Å; W613-F693 HydrophobicContact CZ2-CE1 4.29Å; W613-F693 HydrophobicContact CZ3-CD1 4.08Å; W613-F693 AromaticContact CZ3-CE1 3.6Å; W613-F693 HydrophobicContact CZ3-CE1 3.6Å
614G83.6Confident76.9Confident16 Ų1640.2 Ų40.217%0.16523%0.228CC..  trans84169-179.400000114.5E610 S616 A617E610-G614 CarbonylContact O-C 3.58Å; E610-G614 WeakPolarHBondContact O-CA 3.32Å; E610-G614 PolarHBondContact O-N 3.12Å; G614-S616 VanDerWaalsContact C-N 3.33Å; G614-S616 PolarHBondContact O-N 3.49Å; G614-A617 WeakPolarHBondContact O-CB 3.48Å; G614-A617 PolarHBondContact O-N 2.75Å
615P79.7Confident74.6Confident80 Ų8046.7 Ų46.752%0.51926%0.263SS..Hα-helixtrans-65.8-31.3-171.322.7-32.3000113.7E610 A617 V618E610-P615 HydrophobicContact CG-CB 4.19Å; P615-A617 PolarHBondContact O-N 3.11Å; P615-V618 PolarHBondContact O-N 2.98Å
616S72.5Confident72.4Confident94 Ų9447.1 Ų47.166%0.65727%0.265SS*.Hα-helixtrans-66.8-24.9178.2-52.10000113.1G614 V618G614-S616 VanDerWaalsContact C-N 3.33Å; G614-S616 PolarHBondContact O-N 3.49Å; S616-V618 VanDerWaalsContact C-N 3.32Å; S616-V618 PolarHBondContact O-N 3.35Å
617A70.4Confident70Confident11 Ų1150.8 Ų50.89%0.09129%0.292CS..Hα-helixtrans-72.5-26.4-178.100000112.8W613 G614 P615 K619 L620 N621W613-A617 HydrophobicContact CB-CB 3.49Å; W613-A617 VanDerWaalsContact CB-CB 3.49Å; W613-A617 HydrophobicContact CE3-CB 4.32Å; G614-A617 WeakPolarHBondContact O-CB 3.48Å; G614-A617 PolarHBondContact O-N 2.75Å; P615-A617 PolarHBondContact O-N 3.11Å; A617-K619 PolarHBondContact O-N 3.43Å; A617-L620 PolarHBondContact O-N 2.88Å; A617-N621 WeakPolarHBondContact O-CB 3.26Å; A617-N621 PolarHBondContact O-N 3.5Å; A617-N621 PolarHBondContact O-ND2 3.2Å
618V67.2Low67.9Low14 Ų1453.2 Ų53.29%0.08531%0.309CS..Hα-helixtrans-62.4-44.7-178.3-177.70000111.2L606 C609 E610 P615 S616 L620 L622L606-V618 HydrophobicContact CB-CG1 4.4Å; L606-V618 HydrophobicContact CD2-CG1 3.49Å; L606-V618 VanDerWaalsContact CD2-CG1 3.49Å; L606-V618 HydrophobicContact CG-CG1 4.47Å; C609-V618 HydrophobicContact CB-CG2 4.49Å; E610-V618 HydrophobicContact CB-CG2 3.8Å; P615-V618 PolarHBondContact O-N 2.98Å; S616-V618 VanDerWaalsContact C-N 3.32Å; S616-V618 PolarHBondContact O-N 3.35Å; V618-L620 VanDerWaalsContact C-N 3.27Å; V618-L620 PolarHBondContact O-N 3.4Å; V618-L622 PolarHBondContact O-N 3.04Å
619K63.3Low65.7Low188 Ų18854.9 Ų54.982%0.81732%0.318SS*.Hα-helixtrans-66-26.8179.3-75.5-177.3177178.30113.6A617A617-K619 PolarHBondContact O-N 3.43Å
620L53.8Low64Low139 Ų13959.7 Ų59.773%0.72834%0.343SS*.Hα-helixtrans-90-29.3-173.8-77.2162.8000113.4A617 V618A617-L620 PolarHBondContact O-N 2.88Å; V618-L620 VanDerWaalsContact C-N 3.27Å; V618-L620 PolarHBondContact O-N 3.4Å
621N53.1Low62.5Low36 Ų3659.5 Ų59.519%0.19335%0.345CS..Hα-helixtrans-117.7-14.3-162-60.7-32.3000114.6A617 A638A617-N621 WeakPolarHBondContact O-CB 3.26Å; A617-N621 PolarHBondContact O-N 3.5Å; A617-N621 PolarHBondContact O-ND2 3.2Å; N621-A638 HydrophobicContact CB-CB 4.43Å; N621-A638 WeakPolarHBondContact OD1-CB 3.46Å
622L58.1Low61.1Low8 Ų859.9 Ų59.94%0.04235%0.347CS..  trans-13758.5-172.9-72.2162.1000110.2R602 L606 C609 V618 I635 F693R602-L622 PolarHBondContact NH2-O 3.46Å; L606-L622 HydrophobicContact CD2-CB 3.82Å; L606-L622 HydrophobicContact CD2-CD1 3.86Å; L606-L622 HydrophobicContact CD2-CG 4.47Å; C609-L622 HydrophobicContact CB-CD1 3.59Å; V618-L622 PolarHBondContact O-N 3.04Å; L622-I635 HydrophobicContact CD2-CD1 3.54Å; L622-I635 HydrophobicContact CD2-CG1 4.18Å; L622-I635 HydrophobicContact CG-CD1 4.44Å; L622-F693 HydrophobicContact CD1-CZ 4.02Å
623T51.3Low59.9Low104 Ų10464.4 Ų64.464%0.63837%0.368SS*.  trans-66.615516848.20000110.9D625 S626T623-D625 PolarHBondContact O-N 3.35Å; T623-S626 PolarHBondContact O-N 3.15Å
624T46.5Very low58.8Low99 Ų9966.7 Ų66.761%0.60739%0.387SS*.THydrogen-bonded Turntrans-53.8-15-160.412.40000117.3
625D46Very low57.8Low136 Ų13666 Ų6673%0.72738%0.38SS*.THydrogen-bonded Turntrans-108.923.4-178-68.1-28.3000114.5T623 S627T623-D625 PolarHBondContact O-N 3.35Å; D625-S627 PolarHBondContact O-N 3.46Å
626S47Very low57Low9 Ų963.2 Ų63.26%0.06336%0.361CS..THydrogen-bonded Turntrans-72.228.2178.378.20000114R602 T623 S628R602-S626 PolarHBondContact NH1-OG 3.17Å; T623-S626 PolarHBondContact O-N 3.15Å; S626-S628 PolarHBondContact O-N 2.97Å
627S41.8Very low56.6Low85 Ų8560.4 Ų60.459%0.59434%0.343SS*.THydrogen-bonded Turntrans-76.1-3.4171.851.30000113.3D625D625-S627 PolarHBondContact O-N 3.46Å
628S50Low56.3Low51 Ų5160.4 Ų60.436%0.35734%0.343SS..SBendtrans-97.5152.8172.677.50000111.6S626 D630 G631S626-S628 PolarHBondContact O-N 2.97Å; S628-D630 PolarHBondContact O-N 2.86Å; S628-D630 WeakPolarHBondContact OG-CB 3.32Å; S628-D630 PolarHBondContact OG-N 2.9Å; S628-G631 WeakPolarHBondContact O-CA 3.31Å; S628-G631 PolarHBondContact O-N 3.03Å
629L48.1Very low56.1Low36 Ų3661.7 Ų61.719%0.18835%0.353CS..Hα-helixtrans-43.9-32.8168-174.777.4000114.3G631 L632 Q633 S728 L772L629-G631 PolarHBondContact O-N 2.66Å; L629-L632 PolarHBondContact O-N 3.31Å; L629-Q633 PolarHBondContact O-N 2.79Å; L629-Q633 VanDerWaalsContact O-N 3.11Å; L629-S728 WeakPolarHBondContact CD1-OG 3.49Å; L629-L772 HydrophobicContact CD1-CD1 3.92Å; L629-L772 HydrophobicContact CD1-CD2 3.84Å; L629-L772 HydrophobicContact CD1-CG 4.35Å; L629-L772 HydrophobicContact CD2-CD1 3.62Å; L629-L772 HydrophobicContact CD2-CD2 3.48Å; L629-L772 VanDerWaalsContact CD2-CD2 3.48Å; L629-L772 HydrophobicContact CD2-CG 3.48Å; L629-L772 VanDerWaalsContact CD2-CG 3.48Å; L629-L772 HydrophobicContact CG-CD1 4.37Å; L629-L772 HydrophobicContact CG-CD2 4.13Å; L629-L772 HydrophobicContact CG-CG 4.5Å
630D54.3Low56Low100 Ų10060.2 Ų60.254%0.53534%0.342SS..Hα-helixtrans-61.9-30.6176.7-59.7-39000111.7S628 Q633 C634S628-D630 PolarHBondContact O-N 2.86Å; S628-D630 WeakPolarHBondContact OG-CB 3.32Å; S628-D630 PolarHBondContact OG-N 2.9Å; D630-Q633 PolarHBondContact O-N 3.42Å; D630-C634 WeakPolarHBondContact O-CB 3.19Å; D630-C634 PolarHBondContact O-N 3.45Å; D630-C634 PolarHBondContact O-SG 3.06Å; D630-C634 VanDerWaalsContact O-SG 3.4Å
631G61Low56.1Low9 Ų962.7 Ų62.79%0.09334%0.341CS..Hα-helixtrans-59-51.617200000111.8S628 L629 Q633 C634 I635S628-G631 WeakPolarHBondContact O-CA 3.31Å; S628-G631 PolarHBondContact O-N 3.03Å; L629-G631 PolarHBondContact O-N 2.66Å; G631-Q633 VanDerWaalsContact C-N 3.33Å; G631-Q633 PolarHBondContact O-N 2.8Å; G631-C634 WeakPolarHBondContact O-CB 3.34Å; G631-C634 PolarHBondContact O-N 3.27Å; G631-I635 WeakPolarHBondContact O-CD1 3.38Å; G631-I635 WeakPolarHBondContact O-CG1 3.47Å; G631-I635 PolarHBondContact O-N 3.22Å
632L61.2Low56.1Low10 Ų1062.9 Ų62.95%0.05235%0.346CS..Hα-helixtrans-62.4-39.1176.8-81.4169.8000112.1L629 I635 L636 E685 C688 T689 V732L629-L632 PolarHBondContact O-N 3.31Å; L632-I635 PolarHBondContact O-N 3.38Å; L632-L636 WeakPolarHBondContact O-CB 3.32Å; L632-L636 VanDerWaalsContact O-CG 3.29Å; L632-L636 WeakPolarHBondContact O-CG 3.25Å; L632-L636 PolarHBondContact O-N 3.11Å; L632-E685 HydrophobicContact CD1-CG 4.01Å; L632-E685 HydrophobicContact CG-CG 4.45Å; L632-C688 HydrophobicContact CD1-CB 4.04Å; L632-C688 HydrophobicContact CD2-CB 4.01Å; L632-T689 HydrophobicContact CD2-CG2 4.49Å; L632-V732 HydrophobicContact CD2-CG2 4.45Å
633Q62.9Low55.5Low97 Ų9765.8 Ų65.845%0.45338%0.378SS..Hα-helixtrans-65.4-40.4174.7-72.7-172.23.100112.6L629 D630 G631 L636 A637L629-Q633 PolarHBondContact O-N 2.79Å; L629-Q633 VanDerWaalsContact O-N 3.11Å; D630-Q633 PolarHBondContact O-N 3.42Å; G631-Q633 VanDerWaalsContact C-N 3.33Å; G631-Q633 PolarHBondContact O-N 2.8Å; Q633-L636 PolarHBondContact O-N 3.2Å; Q633-A637 WeakPolarHBondContact O-CB 3.22Å; Q633-A637 PolarHBondContact O-N 3.07Å
634C62.2Low55Low78 Ų7868.5 Ų68.553%0.52739%0.388SS..Hα-helixtrans-61.5-43.7173.9-82.60000111.7D630 G631 A637 A638D630-C634 WeakPolarHBondContact O-CB 3.19Å; D630-C634 PolarHBondContact O-N 3.45Å; D630-C634 PolarHBondContact O-SG 3.06Å; D630-C634 VanDerWaalsContact O-SG 3.4Å; G631-C634 WeakPolarHBondContact O-CB 3.34Å; G631-C634 PolarHBondContact O-N 3.27Å; C634-A637 PolarHBondContact O-N 3.13Å; C634-A638 WeakPolarHBondContact O-CB 3.41Å; C634-A638 PolarHBondContact O-N 3.36Å
635I62.7Low55Low3 Ų366.9 Ų66.92%0.01539%0.385CS..Hα-helixtrans-64.3-42.9177.4-61.7160.9000110.4W613 L622 G631 L632 A637 A638 S639 T689 V692 F693W613-I635 HydrophobicContact CH2-CG2 3.78Å; W613-I635 HydrophobicContact CZ3-CG2 4.08Å; L622-I635 HydrophobicContact CD2-CD1 3.54Å; L622-I635 HydrophobicContact CD2-CG1 4.18Å; L622-I635 HydrophobicContact CG-CD1 4.44Å; G631-I635 WeakPolarHBondContact O-CD1 3.38Å; G631-I635 WeakPolarHBondContact O-CG1 3.47Å; G631-I635 PolarHBondContact O-N 3.22Å; L632-I635 PolarHBondContact O-N 3.38Å; I635-A637 VanDerWaalsContact C-N 3.34Å; I635-A637 PolarHBondContact O-N 3.01Å; I635-A638 PolarHBondContact O-N 3.45Å; I635-S639 PolarHBondContact O-N 2.79Å; I635-T689 HydrophobicContact CD1-CG2 3.74Å; I635-V692 HydrophobicContact CG2-CB 4.3Å; I635-V692 HydrophobicContact CG2-CG1 3.69Å; I635-F693 HydrophobicContact CG2-CE1 3.65Å; I635-F693 HydrophobicContact CG2-CZ 4Å
636L63.8Low55.3Low21 Ų2169.9 Ų69.911%0.1139%0.391CS..Hα-helixtrans-60.9-41.8173.9-75.3168.4000111.9L632 Q633 S639 R640 V692 V732 E735L632-L636 WeakPolarHBondContact O-CB 3.32Å; L632-L636 VanDerWaalsContact O-CG 3.29Å; L632-L636 WeakPolarHBondContact O-CG 3.25Å; L632-L636 PolarHBondContact O-N 3.11Å; Q633-L636 PolarHBondContact O-N 3.2Å; L636-S639 WeakPolarHBondContact O-CB 3.46Å; L636-S639 PolarHBondContact O-N 2.92Å; L636-R640 PolarHBondContact O-N 3.47Å; L636-V692 HydrophobicContact CD2-CG1 4.26Å; L636-V692 HydrophobicContact CD2-CG2 3.78Å; L636-V692 HydrophobicContact CG-CG2 4.25Å; L636-V732 HydrophobicContact CD1-CG2 4.16Å; L636-E735 HydrophobicContact CD1-CG 4.25Å; L636-E735 HydrophobicContact CD2-CB 3.68Å; L636-E735 HydrophobicContact CD2-CG 4.03Å
637A64.9Low55.9Low35 Ų3574.5 Ų74.529%0.28943%0.43SS..Hα-helixtrans-66.4-36.7176.200000112.4Q633 C634 I635 R640Q633-A637 WeakPolarHBondContact O-CB 3.22Å; Q633-A637 PolarHBondContact O-N 3.07Å; C634-A637 PolarHBondContact O-N 3.13Å; I635-A637 VanDerWaalsContact C-N 3.34Å; I635-A637 PolarHBondContact O-N 3.01Å; A637-R640 PolarHBondContact O-N 3.47Å
638A62.3Low57.1Low11 Ų1174.4 Ų74.49%0.09143%0.426CS..Hα-helixtrans-67.1-40.7175.500000112.1W613 N621 C634 I635 R640 R641 S642W613-A638 HydrophobicContact CZ3-CB 4.31Å; N621-A638 HydrophobicContact CB-CB 4.43Å; N621-A638 WeakPolarHBondContact OD1-CB 3.46Å; C634-A638 WeakPolarHBondContact O-CB 3.41Å; C634-A638 PolarHBondContact O-N 3.36Å; I635-A638 PolarHBondContact O-N 3.45Å; A638-R640 PolarHBondContact O-N 3.42Å; A638-R641 PolarHBondContact O-N 2.92Å; A638-S642 PolarHBondContact O-N 3.18Å
639S62.9Low58.5Low41 Ų4179.9 Ų79.929%0.28745%0.446SS..Hα-helixtrans-52.6-39.7174.2-174.60000111.8I635 L636 R641I635-S639 PolarHBondContact O-N 2.79Å; L636-S639 WeakPolarHBondContact O-CB 3.46Å; L636-S639 PolarHBondContact O-N 2.92Å; S639-R641 PolarHBondContact O-N 3.21Å
640R63Low60.4Low157 Ų15780.3 Ų80.359%0.59245%0.449SS*.Hα-helixtrans-69.1-30.1177.3-62.8-179.6-169.41635.9114.2L636 A637 A638 E735L636-R640 PolarHBondContact O-N 3.47Å; A637-R640 PolarHBondContact O-N 3.47Å; A638-R640 PolarHBondContact O-N 3.42Å; R640-E735 IonicContact CZ-OE2 3.73Å; R640-E735 IonicContact NE-OE2 3.23Å; R640-E735 IonicContact NH2-OE1 3.75Å; R640-E735 PolarHBondContact NH2-OE1 2.96Å; R640-E735 IonicContact NH2-OE2 2.67Å; R640-E735 PolarHBondContact NH2-OE2 3.01Å
641R55.3Low62.2Low190 Ų19081.3 Ų81.372%0.71745%0.445SS*.Hα-helixtrans-80.2-27.6-178.5-64-178.4-156.3163.36.5112.6A638 S639 G643 N644A638-R641 PolarHBondContact O-N 2.92Å; S639-R641 PolarHBondContact O-N 3.21Å; R641-G643 PolarHBondContact O-N 3.18Å; R641-N644 PolarHBondContact O-N 3.41Å
642S52Low63.8Low40 Ų4080.9 Ų80.928%0.2844%0.44SS..Hα-helixtrans-62.5-25.3-176.9-165.10000113.3A638 N644 A645A638-S642 PolarHBondContact O-N 3.18Å; S642-N644 PolarHBondContact O-N 3.42Å; S642-A645 PolarHBondContact O-N 3.45Å; S642-A645 VanDerWaalsContact O-N 3.09Å
643G47.2Very low65.3Low69 Ų6981.4 Ų81.471%0.71145%0.446SS*.THydrogen-bonded Turntrans-57.9-14175.600000115.7R641R641-G643 PolarHBondContact O-N 3.18Å
644N40.2Very low66.7Low162 Ų16280.2 Ų80.287%0.86645%0.453SS*.THydrogen-bonded Turntrans-107.6-6.1178.4-74.3-13.9000114.7R641 S642R641-N644 PolarHBondContact O-N 3.41Å; S642-N644 PolarHBondContact O-N 3.42Å
645A46.9Very low68.3Low64 Ų6478 Ų7853%0.52944%0.436SS..SBendtrans-88.8154.9172.400000109.7S642 A647S642-A645 PolarHBondContact O-N 3.45Å; S642-A645 VanDerWaalsContact O-N 3.09Å; A645-A647 PolarHBondContact O-N 3.43Å
646K51.6Low69.8Low199 Ų19977.9 Ų77.987%0.86544%0.435SS*.SBendtrans-41.9112.6175.9-91.5179.5173.9178.10109.1T648K646-T648 PolarHBondContact O-N 3.14Å
647A58.7Low71.3Confident107 Ų10778 Ų7888%0.88444%0.437SS*.  trans-55.4100.7-17000000110.9A645A645-A647 PolarHBondContact O-N 3.43Å
648T67Low72.8Confident83 Ų8382.4 Ų82.451%0.50945%0.45SS..  trans-79.7128.6170.440.60000108.5K646 N650K646-T648 PolarHBondContact O-N 3.14Å; T648-N650 PolarHBondContact O-N 3.05Å
649E81Confident74.5Confident166 Ų16681.9 Ų81.978%0.77645%0.446SS*.  trans-59.2128.2176.9-175.5-178.6-174.900110.7R651E649-R651 PolarHBondContact O-N 3.23Å
650N88.1Confident76.1Confident45 Ų4580 Ų8024%0.24143%0.432CS..  trans-78.488176.3-175.3-17.1000109.8A612 T648 F652 A653 F693A612-N650 WeakPolarHBondContact CA-OD1 3.36Å; T648-N650 PolarHBondContact O-N 3.05Å; N650-F652 PolarHBondContact O-N 3.41Å; N650-F652 WeakPolarHBondContact OD1-CB 3.4Å; N650-F652 PolarHBondContact OD1-N 3.29Å; N650-F652 VanDerWaalsContact OD1-N 3.1Å; N650-A653 HydrophobicContact CB-CB 4.3Å; N650-A653 PolarHBondContact O-N 2.79Å; N650-A653 PolarHBondContact OD1-N 3.06Å; N650-F693 PolarHBondContact ND2-O 2.9Å
651R92.1Very high77.6Confident120 Ų12075.2 Ų75.245%0.45342%0.415SS..Hα-helixtrans-66.6-20.9178.4-62.1-174.3-66.9139.8-1.5112.5L611 E649L611-R651 WeakPolarHBondContact O-CB 3.43Å; L611-R651 PolarHBondContact O-N 3.22Å; E649-R651 PolarHBondContact O-N 3.23Å
652F93.8Very high79.5Confident0 Ų068.7 Ų68.70%040%0.397CS..Hα-helixtrans-74.3-32.2177.9-171.4-109.4000112.9S608 L611 A612 N650 A654 I655 S656 F659 F690 F693S608-F652 VanDerWaalsContact CB-CE2 3.41Å; L611-F652 HydrophobicContact CB-CB 3.83Å; L611-F652 HydrophobicContact CB-CD2 4.35Å; L611-F652 HydrophobicContact CD1-CD2 4.25Å; L611-F652 PolarHBondContact O-N 3.3Å; A612-F652 HydrophobicContact CB-CB 4.02Å; N650-F652 PolarHBondContact O-N 3.41Å; N650-F652 WeakPolarHBondContact OD1-CB 3.4Å; N650-F652 PolarHBondContact OD1-N 3.29Å; N650-F652 VanDerWaalsContact OD1-N 3.1Å; F652-A654 VanDerWaalsContact C-N 3.34Å; F652-A654 PolarHBondContact O-N 3.07Å; F652-I655 HydrophobicContact CD2-CD1 4.37Å; F652-I655 HydrophobicContact CD2-CG1 4.19Å; F652-I655 CarbonylContact O-C 3.36Å; F652-I655 WeakPolarHBondContact O-CG1 3.42Å; F652-I655 PolarHBondContact O-N 3.38Å; F652-I655 VanDerWaalsContact O-N 3.11Å; F652-S656 WeakPolarHBondContact O-CA 3.5Å; F652-S656 WeakPolarHBondContact O-CB 3.11Å; F652-S656 PolarHBondContact O-N 3.27Å; F652-F659 HydrophobicContact CE2-CB 4.03Å; F652-F659 AromaticContact CE2-CD1 3.76Å; F652-F659 HydrophobicContact CE2-CD1 3.76Å; F652-F659 AromaticContact CE2-CD2 3.78Å; F652-F659 HydrophobicContact CE2-CD2 3.78Å; F652-F659 HydrophobicContact CE2-CE1 4.1Å; F652-F659 HydrophobicContact CE2-CE2 4.15Å; F652-F659 AromaticContact CE2-CG 3.58Å; F652-F659 HydrophobicContact CE2-CG 3.58Å; F652-F659 HydrophobicContact CE2-CZ 4.29Å; F652-F659 HydrophobicContact CZ-CB 3.99Å; F652-F659 HydrophobicContact CZ-CD1 4.35Å; F652-F659 HydrophobicContact CZ-CG 4.07Å; F652-F690 HydrophobicContact CE1-CB 4.21Å; F652-F690 HydrophobicContact CE1-CD1 4.4Å; F652-F690 HydrophobicContact CZ-CB 4.19Å; F652-F690 AromaticContact CZ-CD1 3.82Å; F652-F690 HydrophobicContact CZ-CD1 3.82Å; F652-F690 HydrophobicContact CZ-CE1 4.46Å; F652-F690 HydrophobicContact CZ-CG 4.1Å; F652-F693 HydrophobicContact CD1-CB 3.71Å; F652-F693 HydrophobicContact CE1-CB 4Å
653A92.2Very high81.6Confident21 Ų2166.8 Ų66.817%0.17438%0.383CS..Hα-helixtrans-52.7-47.8-173.400000113.3N650 I655 S656N650-A653 HydrophobicContact CB-CB 4.3Å; N650-A653 PolarHBondContact O-N 2.79Å; N650-A653 PolarHBondContact OD1-N 3.06Å; A653-I655 PolarHBondContact O-N 3.37Å; A653-S656 PolarHBondContact O-OG 3.23Å
654A92.8Very high83.9Confident73 Ų7363.8 Ų63.860%0.60335%0.351SS*.Hα-helixtrans-70.3-30.3-17800000113.7F652F652-A654 VanDerWaalsContact C-N 3.34Å; F652-A654 PolarHBondContact O-N 3.07Å
655I95.1Very high86.4Confident32 Ų3261.9 Ų61.916%0.16434%0.335CS..Hα-helixtrans-100-6.5-17761.5174.6000113.2P576 I577 L611 F652 A653 P657 K658 F659P576-I655 HydrophobicContact CB-CD1 3.58Å; P576-I655 HydrophobicContact CG-CD1 4.14Å; I577-I655 HydrophobicContact CD1-CG2 4.39Å; I577-I655 HydrophobicContact CG1-CG2 4.47Å; L611-I655 HydrophobicContact CD1-CD1 4.18Å; F652-I655 HydrophobicContact CD2-CD1 4.37Å; F652-I655 HydrophobicContact CD2-CG1 4.19Å; F652-I655 CarbonylContact O-C 3.36Å; F652-I655 WeakPolarHBondContact O-CG1 3.42Å; F652-I655 PolarHBondContact O-N 3.38Å; F652-I655 VanDerWaalsContact O-N 3.11Å; A653-I655 PolarHBondContact O-N 3.37Å; I655-P657 VanDerWaalsContact C-N 3.28Å; I655-P657 VanDerWaalsContact O-N 3.1Å; I655-K658 WeakPolarHBondContact O-CA 3.18Å; I655-K658 VanDerWaalsContact O-CB 3.29Å; I655-K658 WeakPolarHBondContact O-CB 3.3Å; I655-K658 PolarHBondContact O-N 3.14Å; I655-F659 HydrophobicContact CD1-CE2 3.99Å; I655-F659 HydrophobicContact CG1-CE2 4.44Å
656S95Very high88.4Confident0 Ų059.4 Ų59.40%032%0.316CS..Hα-helixtrans-50.3-36.1-176.960.10000114.8F652 A653 K658 F659 F660 M703F652-S656 WeakPolarHBondContact O-CA 3.5Å; F652-S656 WeakPolarHBondContact O-CB 3.11Å; F652-S656 PolarHBondContact O-N 3.27Å; A653-S656 PolarHBondContact O-OG 3.23Å; S656-K658 VanDerWaalsContact C-N 3.27Å; S656-K658 PolarHBondContact O-N 2.88Å; S656-F659 PolarHBondContact O-N 3.48Å; S656-F660 WeakPolarHBondContact O-CB 3.46Å; S656-F660 PolarHBondContact O-N 3Å; S656-M703 WeakPolarHBondContact OG-CE 3.43Å
657P96.2Very high90.3Very high24 Ų2450 Ų5016%0.15628%0.275CS..Hα-helixtrans-62.4-32174.7-24.737.8000113.7I655 F659 F660 Y661 Y699I655-P657 VanDerWaalsContact C-N 3.28Å; I655-P657 VanDerWaalsContact O-N 3.1Å; P657-F659 VanDerWaalsContact C-N 3.26Å; P657-F659 PolarHBondContact O-N 3.49Å; P657-F660 PolarHBondContact O-N 3.44Å; P657-Y661 HydrophobicContact CB-CD2 3.82Å; P657-Y661 HydrophobicContact CB-CE2 3.91Å; P657-Y661 WeakPolarHBondContact O-CB 3.47Å; P657-Y661 WeakPolarHBondContact O-CD2 3.36Å; P657-Y661 PolarHBondContact O-N 3.4Å; P657-Y699 HydrophobicContact CG-CD1 4.04Å; P657-Y699 HydrophobicContact CG-CD2 3.91Å; P657-Y699 HydrophobicContact CG-CG 3.63Å
658K95.7Very high91.7Very high127 Ų12749 Ų4955%0.55225%0.253SS*.Hα-helixtrans-71.3-21.6179.8-60.2-69.1-174.1170.50112.5I655 S656 P662I655-K658 WeakPolarHBondContact O-CA 3.18Å; I655-K658 VanDerWaalsContact O-CB 3.29Å; I655-K658 WeakPolarHBondContact O-CB 3.3Å; I655-K658 PolarHBondContact O-N 3.14Å; S656-K658 VanDerWaalsContact C-N 3.27Å; S656-K658 PolarHBondContact O-N 2.88Å; K658-P662 VanDerWaalsContact O-CD 3.29Å; K658-P662 WeakPolarHBondContact O-CD 3.45Å; K658-P662 VanDerWaalsContact O-CG 3.24Å; K658-P662 WeakPolarHBondContact O-CG 3.35Å
659F96.6Very high92.6Very high0 Ų049.5 Ų49.50%026%0.26CS..Hα-helixtrans-89.8-44171.2-77.8-117.7000110.9P576 A580 L604 L611 F652 I655 S656 P657 F690P576-F659 HydrophobicContact CB-CE2 3.95Å; P576-F659 HydrophobicContact CB-CZ 3.92Å; P576-F659 WeakPolarHBondContact O-CE2 3.33Å; P576-F659 VanDerWaalsContact O-CZ 3.28Å; P576-F659 WeakPolarHBondContact O-CZ 3.38Å; A580-F659 HydrophobicContact CB-CD1 3.77Å; A580-F659 HydrophobicContact CB-CD2 4Å; A580-F659 HydrophobicContact CB-CE1 3.49Å; A580-F659 VanDerWaalsContact CB-CE1 3.49Å; A580-F659 HydrophobicContact CB-CE2 3.72Å; A580-F659 HydrophobicContact CB-CG 4.02Å; A580-F659 HydrophobicContact CB-CZ 3.46Å; A580-F659 VanDerWaalsContact CB-CZ 3.46Å; L604-F659 HydrophobicContact CD2-CD1 4.11Å; L604-F659 HydrophobicContact CD2-CE1 4.07Å; L611-F659 HydrophobicContact CD1-CZ 4.26Å; F652-F659 HydrophobicContact CE2-CB 4.03Å; F652-F659 AromaticContact CE2-CD1 3.76Å; F652-F659 HydrophobicContact CE2-CD1 3.76Å; F652-F659 AromaticContact CE2-CD2 3.78Å; F652-F659 HydrophobicContact CE2-CD2 3.78Å; F652-F659 HydrophobicContact CE2-CE1 4.1Å; F652-F659 HydrophobicContact CE2-CE2 4.15Å; F652-F659 AromaticContact CE2-CG 3.58Å; F652-F659 HydrophobicContact CE2-CG 3.58Å; F652-F659 HydrophobicContact CE2-CZ 4.29Å; F652-F659 HydrophobicContact CZ-CB 3.99Å; F652-F659 HydrophobicContact CZ-CD1 4.35Å; F652-F659 HydrophobicContact CZ-CG 4.07Å; I655-F659 HydrophobicContact CD1-CE2 3.99Å; I655-F659 HydrophobicContact CG1-CE2 4.44Å; S656-F659 PolarHBondContact O-N 3.48Å; P657-F659 VanDerWaalsContact C-N 3.26Å; P657-F659 PolarHBondContact O-N 3.49Å; F659-F690 HydrophobicContact CB-CD2 4.22Å; F659-F690 HydrophobicContact CB-CE2 3.95Å; F659-F690 HydrophobicContact CB-CZ 4.13Å; F659-F690 HydrophobicContact CD1-CE1 4.25Å; F659-F690 HydrophobicContact CD1-CZ 4.12Å
660F96.6Very high92.7Very high0 Ų043.2 Ų43.20%023%0.231CC..Hα-helixtrans-67.7-52.1-173-175.9-87.5000112.6S656 P657 L663 F664 L687 F690 L691 M703 L707S656-F660 WeakPolarHBondContact O-CB 3.46Å; S656-F660 PolarHBondContact O-N 3Å; P657-F660 PolarHBondContact O-N 3.44Å; F660-L663 PolarHBondContact O-N 3.24Å; F660-F664 HydrophobicContact CD1-CB 4.06Å; F660-F664 HydrophobicContact CD1-CG 4.46Å; F660-F664 HydrophobicContact CE1-CB 3.84Å; F660-F664 HydrophobicContact CE1-CD1 4.4Å; F660-F664 AromaticContact CE1-CD2 3.9Å; F660-F664 HydrophobicContact CE1-CD2 3.9Å; F660-F664 AromaticContact CE1-CG 3.8Å; F660-F664 HydrophobicContact CE1-CG 3.8Å; F660-F664 HydrophobicContact CZ-CB 4.42Å; F660-F664 AromaticContact CZ-CD2 3.97Å; F660-F664 HydrophobicContact CZ-CD2 3.97Å; F660-F664 HydrophobicContact CZ-CG 4.32Å; F660-F664 WeakPolarHBondContact O-CB 3.46Å; F660-F664 PolarHBondContact O-N 3.09Å; F660-L687 HydrophobicContact CD2-CB 4.39Å; F660-L687 HydrophobicContact CD2-CD2 3.69Å; F660-L687 HydrophobicContact CE2-CB 3.93Å; F660-L687 HydrophobicContact CE2-CD2 3.79Å; F660-L687 HydrophobicContact CE2-CG 4.39Å; F660-L687 HydrophobicContact CG-CD2 4.15Å; F660-L687 HydrophobicContact CZ-CD2 4.31Å; F660-F690 HydrophobicContact CB-CD2 4.5Å; F660-F690 HydrophobicContact CD2-CB 4.45Å; F660-L691 HydrophobicContact CE2-CD2 4.25Å; F660-L691 HydrophobicContact CE2-CG 4.27Å; F660-M703 HydrophobicContact CB-CG 4.41Å; F660-M703 HydrophobicContact CB-SD 3.52Å; F660-M703 VanDerWaalsContact CB-SD 3.52Å; F660-M703 HydrophobicContact CD1-CB 4.06Å; F660-M703 HydrophobicContact CD1-CG 3.79Å; F660-M703 HydrophobicContact CD1-SD 4.04Å; F660-M703 HydrophobicContact CD2-CB 4.22Å; F660-M703 HydrophobicContact CD2-CG 4.41Å; F660-M703 HydrophobicContact CD2-SD 4.04Å; F660-M703 HydrophobicContact CE1-CB 3.95Å; F660-M703 HydrophobicContact CE1-CG 4.15Å; F660-M703 HydrophobicContact CE2-CB 4.1Å; F660-M703 HydrophobicContact CG-CB 4.21Å; F660-M703 HydrophobicContact CG-CG 3.95Å; F660-M703 HydrophobicContact CG-SD 3.6Å; F660-M703 HydrophobicContact CZ-CB 3.97Å; F660-M703 WeakPolarHBondContact CZ-O 3.46Å; F660-L707 HydrophobicContact CZ-CB 4.23Å
661Y96.4Very high92.1Very high58 Ų5848.1 Ų48.123%0.22725%0.251CS..Hα-helixtrans-70-42-169.5-75.5-62.1000114.8P657 L663 F664 F665 S702 M703P657-Y661 HydrophobicContact CB-CD2 3.82Å; P657-Y661 HydrophobicContact CB-CE2 3.91Å; P657-Y661 WeakPolarHBondContact O-CB 3.47Å; P657-Y661 WeakPolarHBondContact O-CD2 3.36Å; P657-Y661 PolarHBondContact O-N 3.4Å; Y661-L663 VanDerWaalsContact C-N 3.28Å; Y661-L663 PolarHBondContact O-N 3.26Å; Y661-F664 HydrophobicContact CD1-CD1 4.34Å; Y661-F664 PolarHBondContact O-N 2.89Å; Y661-F665 AromaticContact CD1-CE2 3.75Å; Y661-F665 HydrophobicContact CD1-CE2 3.75Å; Y661-F665 AromaticContact CD1-CZ 3.87Å; Y661-F665 HydrophobicContact CD1-CZ 3.87Å; Y661-F665 HydrophobicContact CG-CE2 4.05Å; Y661-F665 WeakPolarHBondContact O-CB 3.33Å; Y661-F665 WeakPolarHBondContact O-CD2 3.33Å; Y661-F665 WeakPolarHBondContact O-CG 3.28Å; Y661-F665 PolarHBondContact O-N 3.08Å; Y661-S702 PolarHBondContact OH-OG 3.16Å; Y661-M703 HydrophobicContact CE2-CG 4.36Å
662P94.4Very high91.1Very high52 Ų5244 Ų4434%0.33824%0.237SC..Hα-helixtrans-57.4-43.6175.1-26.837.2000112.1C584 K658 G666C584-P662 HydrophobicContact CB-CB 3.97Å; K658-P662 VanDerWaalsContact O-CD 3.29Å; K658-P662 WeakPolarHBondContact O-CD 3.45Å; K658-P662 VanDerWaalsContact O-CG 3.24Å; K658-P662 WeakPolarHBondContact O-CG 3.35Å; P662-G666 PolarHBondContact O-N 2.94Å
663L95.1Very high90Very high0 Ų049.8 Ų49.80%027%0.268CS..Hα-helixtrans-71.1-41178.5-158.972.9000112V587 F588 L601 F660 Y661 W667 I683 T686 L687 F690V587-L663 HydrophobicContact CG1-CD1 4.43Å; F588-L663 HydrophobicContact CE2-CD1 4.04Å; F588-L663 HydrophobicContact CZ-CD1 3.96Å; F588-L663 WeakPolarHBondContact CZ-O 3.25Å; L601-L663 HydrophobicContact CD2-CD1 3.94Å; L601-L663 HydrophobicContact CD2-CD2 3.98Å; F660-L663 PolarHBondContact O-N 3.24Å; Y661-L663 VanDerWaalsContact C-N 3.28Å; Y661-L663 PolarHBondContact O-N 3.26Å; L663-W667 WeakPolarHBondContact O-CB 3.42Å; L663-W667 PolarHBondContact O-N 2.99Å; L663-I683 HydrophobicContact CD1-CG1 4.47Å; L663-I683 HydrophobicContact CD1-CG2 4.37Å; L663-I683 HydrophobicContact CD2-CG2 3.83Å; L663-I683 HydrophobicContact CG-CG2 3.66Å; L663-T686 HydrophobicContact CD2-CG2 3.75Å; L663-L687 HydrophobicContact CB-CD2 4.16Å; L663-L687 HydrophobicContact CD2-CD2 4.22Å; L663-L687 HydrophobicContact CD2-CG 4.43Å; L663-L687 HydrophobicContact CG-CD2 4.5Å; L663-F690 HydrophobicContact CD2-CE2 3.96Å
664F95.6Very high89Confident7 Ų751.9 Ų51.93%0.03129%0.291CS..Hα-helixtrans-64.2-45.3178.6175.3-100000112.8F660 Y661 W667 M668 L687 L707 T710F660-F664 HydrophobicContact CD1-CB 4.06Å; F660-F664 HydrophobicContact CD1-CG 4.46Å; F660-F664 HydrophobicContact CE1-CB 3.84Å; F660-F664 HydrophobicContact CE1-CD1 4.4Å; F660-F664 AromaticContact CE1-CD2 3.9Å; F660-F664 HydrophobicContact CE1-CD2 3.9Å; F660-F664 AromaticContact CE1-CG 3.8Å; F660-F664 HydrophobicContact CE1-CG 3.8Å; F660-F664 HydrophobicContact CZ-CB 4.42Å; F660-F664 AromaticContact CZ-CD2 3.97Å; F660-F664 HydrophobicContact CZ-CD2 3.97Å; F660-F664 HydrophobicContact CZ-CG 4.32Å; F660-F664 WeakPolarHBondContact O-CB 3.46Å; F660-F664 PolarHBondContact O-N 3.09Å; Y661-F664 HydrophobicContact CD1-CD1 4.34Å; Y661-F664 PolarHBondContact O-N 2.89Å; F664-W667 HydrophobicContact CD2-CE3 4.06Å; F664-W667 HydrophobicContact CD2-CZ3 4.28Å; F664-W667 HydrophobicContact CE2-CE3 4.34Å; F664-W667 HydrophobicContact CE2-CZ3 4.18Å; F664-W667 WeakPolarHBondContact O-CB 3.3Å; F664-W667 PolarHBondContact O-N 3.29Å; F664-M668 HydrophobicContact CD1-CE 3.75Å; F664-M668 HydrophobicContact CD1-SD 4.38Å; F664-M668 HydrophobicContact CE1-CE 3.38Å; F664-M668 HydrophobicContact CE1-CG 4.5Å; F664-M668 HydrophobicContact CE1-SD 3.66Å; F664-M668 HydrophobicContact CE2-SD 4.44Å; F664-M668 HydrophobicContact CZ-CE 4.09Å; F664-M668 HydrophobicContact CZ-CG 4.43Å; F664-M668 HydrophobicContact CZ-SD 3.71Å; F664-M668 WeakPolarHBondContact O-CG 3.32Å; F664-M668 PolarHBondContact O-N 3.03Å; F664-L687 HydrophobicContact CB-CD1 4.35Å; F664-L687 HydrophobicContact CB-CD2 4.04Å; F664-L687 HydrophobicContact CD2-CD1 4.14Å; F664-L707 HydrophobicContact CD2-CD1 4.47Å; F664-L707 HydrophobicContact CE2-CD1 4.44Å; F664-T710 HydrophobicContact CE2-CG2 4.31Å; F664-T710 HydrophobicContact CZ-CG2 4.34Å; F664-T710 WeakPolarHBondContact CZ-OG1 3.35Å
665F93.7Very high87.8Confident121 Ų12154.8 Ų54.853%0.53130%0.296SS..Hα-helixtrans-67.8-41.3179.1-69.8-54.1000111.9Y661 W667 M668Y661-F665 AromaticContact CD1-CE2 3.75Å; Y661-F665 HydrophobicContact CD1-CE2 3.75Å; Y661-F665 AromaticContact CD1-CZ 3.87Å; Y661-F665 HydrophobicContact CD1-CZ 3.87Å; Y661-F665 HydrophobicContact CG-CE2 4.05Å; Y661-F665 WeakPolarHBondContact O-CB 3.33Å; Y661-F665 WeakPolarHBondContact O-CD2 3.33Å; Y661-F665 WeakPolarHBondContact O-CG 3.28Å; Y661-F665 PolarHBondContact O-N 3.08Å; F665-W667 VanDerWaalsContact C-N 3.34Å; F665-M668 HydrophobicContact CD1-CE 3.31Å; F665-M668 HydrophobicContact CE1-CE 3.82Å; F665-M668 HydrophobicContact CG-CE 4.36Å; F665-M668 PolarHBondContact O-N 3.2Å
666G89.3Confident87Confident13 Ų1356 Ų5613%0.13430%0.304CS..Hα-helixtrans-63-42172.900000111.8F588 P662 M668 S669F588-G666 VanDerWaalsContact CZ-C 3.47Å; F588-G666 VanDerWaalsContact CZ-CA 3.41Å; P662-G666 PolarHBondContact O-N 2.94Å; G666-M668 VanDerWaalsContact C-N 3.32Å; G666-M668 PolarHBondContact O-N 2.93Å; G666-S669 PolarHBondContact O-N 3.32Å; G666-S669 PolarHBondContact O-OG 2.7Å
667W91.8Very high86.5Confident2 Ų258.7 Ų58.71%0.00831%0.314CS..Hα-helixtrans-59-39.1177.918062.6000113.4L663 F664 F665 S669 L670 F680 I683 L687 L707 T710 L711 M725L663-W667 WeakPolarHBondContact O-CB 3.42Å; L663-W667 PolarHBondContact O-N 2.99Å; F664-W667 HydrophobicContact CD2-CE3 4.06Å; F664-W667 HydrophobicContact CD2-CZ3 4.28Å; F664-W667 HydrophobicContact CE2-CE3 4.34Å; F664-W667 HydrophobicContact CE2-CZ3 4.18Å; F664-W667 WeakPolarHBondContact O-CB 3.3Å; F664-W667 PolarHBondContact O-N 3.29Å; F665-W667 VanDerWaalsContact C-N 3.34Å; W667-S669 PolarHBondContact O-N 3.49Å; W667-L670 WeakPolarHBondContact O-CB 3.21Å; W667-L670 PolarHBondContact O-N 3.5Å; W667-L670 VanDerWaalsContact O-N 3.17Å; W667-F680 AromaticContact CD1-CD2 3.65Å; W667-F680 AromaticContact CD1-CE2 3.88Å; W667-F680 HydrophobicContact CD2-CE2 4.24Å; W667-F680 AromaticContact CE2-CD2 3.97Å; W667-F680 AromaticContact CE2-CE1 3.93Å; W667-F680 AromaticContact CE2-CE2 3.48Å; W667-F680 VanDerWaalsContact CE2-CE2 3.48Å; W667-F680 AromaticContact CE2-CZ 3.45Å; W667-F680 VanDerWaalsContact CE2-CZ 3.45Å; W667-F680 HydrophobicContact CG-CE2 4.46Å; W667-F680 HydrophobicContact CH2-CZ 4.14Å; W667-F680 HydrophobicContact CZ2-CD1 4.45Å; W667-F680 AromaticContact CZ2-CE1 3.62Å; W667-F680 HydrophobicContact CZ2-CE1 3.62Å; W667-F680 AromaticContact CZ2-CE2 3.77Å; W667-F680 HydrophobicContact CZ2-CE2 3.77Å; W667-F680 AromaticContact CZ2-CZ 3.23Å; W667-F680 HydrophobicContact CZ2-CZ 3.23Å; W667-F680 AromaticContact NE1-CD1 3.74Å; W667-F680 AromaticContact NE1-CD2 3.23Å; W667-F680 AromaticContact NE1-CE1 3.75Å; W667-F680 AromaticContact NE1-CE2 3.25Å; W667-F680 VanDerWaalsContact NE1-CE2 3.25Å; W667-F680 AromaticContact NE1-CG 3.48Å; W667-F680 AromaticContact NE1-CZ 3.52Å; W667-F680 PolarHBondContact NE1-O 3.34Å; W667-I683 HydrophobicContact CB-CG2 3.61Å; W667-I683 HydrophobicContact CD2-CG2 4.48Å; W667-I683 HydrophobicContact CG-CB 4.23Å; W667-I683 HydrophobicContact CG-CG2 3.59Å; W667-L687 HydrophobicContact CD2-CD1 4.02Å; W667-L687 HydrophobicContact CE3-CD1 3.81Å; W667-L687 HydrophobicContact CG-CD1 4.38Å; W667-L687 HydrophobicContact CZ3-CD1 4.36Å; W667-L707 HydrophobicContact CH2-CD1 4.24Å; W667-L707 HydrophobicContact CZ3-CD1 3.97Å; W667-T710 HydrophobicContact CZ3-CG2 3.94Å; W667-L711 HydrophobicContact CH2-CD1 4.46Å; W667-L711 HydrophobicContact CH2-CD2 3.44Å; W667-L711 VanDerWaalsContact CH2-CD2 3.44Å; W667-L711 HydrophobicContact CH2-CG 3.74Å; W667-L711 HydrophobicContact CZ2-CD2 3.85Å; W667-M725 HydrophobicContact CZ2-SD 4.05Å
668M87.4Confident85.9Confident86 Ų8663.8 Ų63.842%0.42434%0.336SS..THydrogen-bonded Turntrans-65.4-16.9175.4-72.3-167.8-62.800114.1F664 F665 G666 T710F664-M668 HydrophobicContact CD1-CE 3.75Å; F664-M668 HydrophobicContact CD1-SD 4.38Å; F664-M668 HydrophobicContact CE1-CE 3.38Å; F664-M668 HydrophobicContact CE1-CG 4.5Å; F664-M668 HydrophobicContact CE1-SD 3.66Å; F664-M668 HydrophobicContact CE2-SD 4.44Å; F664-M668 HydrophobicContact CZ-CE 4.09Å; F664-M668 HydrophobicContact CZ-CG 4.43Å; F664-M668 HydrophobicContact CZ-SD 3.71Å; F664-M668 WeakPolarHBondContact O-CG 3.32Å; F664-M668 PolarHBondContact O-N 3.03Å; F665-M668 HydrophobicContact CD1-CE 3.31Å; F665-M668 HydrophobicContact CE1-CE 3.82Å; F665-M668 HydrophobicContact CG-CE 4.36Å; F665-M668 PolarHBondContact O-N 3.2Å; G666-M668 VanDerWaalsContact C-N 3.32Å; G666-M668 PolarHBondContact O-N 2.93Å; M668-T710 HydrophobicContact CG-CG2 3.74Å; M668-T710 HydrophobicContact SD-CG2 3.73Å
669S84.9Confident85.5Confident93 Ų9357.9 Ų57.965%0.6531%0.31SS*.THydrogen-bonded Turntrans-93.2-7.7177.2670000113.7G666 W667G666-S669 PolarHBondContact O-N 3.32Å; G666-S669 PolarHBondContact O-OG 2.7Å; W667-S669 PolarHBondContact O-N 3.49Å
670L84.1Confident85.2Confident33 Ų3358.4 Ų58.417%0.17331%0.312CS..SBendtrans-73.5144.7175.8-68174.7000111.5F588 W667 T679 F680 I683F588-L670 HydrophobicContact CD1-CD2 4.47Å; F588-L670 HydrophobicContact CE1-CD1 4.19Å; F588-L670 HydrophobicContact CE1-CG 4.39Å; W667-L670 WeakPolarHBondContact O-CB 3.21Å; W667-L670 PolarHBondContact O-N 3.5Å; W667-L670 VanDerWaalsContact O-N 3.17Å; L670-T679 HydrophobicContact CD1-CG2 4.41Å; L670-F680 HydrophobicContact CB-CD2 4.17Å; L670-I683 HydrophobicContact CD1-CD1 3.56Å
671K75.6Confident84.8Confident149 Ų14960.1 Ų60.165%0.64832%0.321SS*.  trans-88.7143.8171.9-64.2-176-179.9-178.30109.3D673 D676K671-D673 PolarHBondContact O-N 3.35Å; K671-D673 VanDerWaalsContact O-N 3.14Å; K671-D676 WeakPolarHBondContact O-CB 3.48Å
672M71.7Confident84.5Confident34 Ų3459 Ų5917%0.16732%0.317CS..SBendtrans-77.912.7-179.3-78.4-91.8-61.100113.4F680 L714 H717 V722M672-F680 HydrophobicContact CG-CE2 4.34Å; M672-F680 HydrophobicContact CG-CZ 4.37Å; M672-F680 HydrophobicContact SD-CD1 3.5Å; M672-F680 VanDerWaalsContact SD-CD1 3.5Å; M672-F680 HydrophobicContact SD-CD2 4.21Å; M672-F680 HydrophobicContact SD-CE1 3.3Å; M672-F680 WeakPolarHBondContact SD-CE1 3.44Å; M672-F680 HydrophobicContact SD-CE2 4.03Å; M672-F680 HydrophobicContact SD-CG 3.97Å; M672-F680 HydrophobicContact SD-CZ 3.58Å; M672-F680 VanDerWaalsContact SD-CZ 3.58Å; M672-L714 HydrophobicContact CE-CD1 4.46Å; M672-L714 HydrophobicContact CE-CD2 4.3Å; M672-L714 HydrophobicContact SD-CD1 4.26Å; M672-H717 VanDerWaalsContact CE-NE2 3.31Å; M672-H717 WeakPolarHBondContact CE-NE2 3.46Å; M672-V722 HydrophobicContact CE-CB 4.35Å; M672-V722 HydrophobicContact CE-CG1 3.81Å; M672-V722 HydrophobicContact CE-CG2 3.64Å
673D69.4Low84.4Confident121 Ų12156.5 Ų56.565%0.64730%0.301SS*.SBendtrans-122.2138-164.4-37.3-15000109.4K671K671-D673 PolarHBondContact O-N 3.35Å; K671-D673 VanDerWaalsContact O-N 3.14Å
674G71Confident84.3Confident64 Ų6456.5 Ų56.566%0.6630%0.301SS*.THydrogen-bonded Turntrans72.8-139.3173.500000114.5D676 Y677G674-D676 PolarHBondContact O-N 2.94Å; G674-Y677 VanDerWaalsContact O-CB 3.32Å; G674-Y677 WeakPolarHBondContact O-CB 3.43Å; G674-Y677 PolarHBondContact O-N 3.25Å
675D67.5Low84Confident134 Ų13457.5 Ų57.572%0.71731%0.306SS*.THydrogen-bonded Turntrans-65.3-24.7-173.1-66.7-24.7000113.6I594 Y677I594-D675 HydrophobicContact CD1-CB 4.3Å; D675-Y677 VanDerWaalsContact C-N 3.28Å; D675-Y677 PolarHBondContact O-N 3.13Å
676D78.6Confident84Confident59 Ų5951.8 Ų51.832%0.31628%0.281SS..Hα-helixtrans-75.1-17.3-179.6-74.3-24.8000112.8K671 G674 Q678 T679 F680K671-D676 WeakPolarHBondContact O-CB 3.48Å; G674-D676 PolarHBondContact O-N 2.94Å; D676-Q678 PolarHBondContact O-N 2.93Å; D676-T679 PolarHBondContact O-N 2.88Å; D676-F680 WeakPolarHBondContact O-CB 3.49Å; D676-F680 PolarHBondContact O-N 2.97Å
677Y84.4Confident84.3Confident56 Ų5651.1 Ų51.122%0.2227%0.274CS..Hα-helixtrans-55.8-46.2-176.5173.5-104.9000112.8G674 D675 F680 L681 E719 V722G674-Y677 VanDerWaalsContact O-CB 3.32Å; G674-Y677 WeakPolarHBondContact O-CB 3.43Å; G674-Y677 PolarHBondContact O-N 3.25Å; D675-Y677 VanDerWaalsContact C-N 3.28Å; D675-Y677 PolarHBondContact O-N 3.13Å; Y677-F680 WeakPolarHBondContact O-CB 3.3Å; Y677-F680 PolarHBondContact O-N 3.14Å; Y677-L681 HydrophobicContact CD1-CD1 4.44Å; Y677-L681 HydrophobicContact CE1-CD1 3.68Å; Y677-L681 HydrophobicContact CE1-CG 4.37Å; Y677-L681 HydrophobicContact CE2-CD1 4.28Å; Y677-L681 HydrophobicContact CE2-CD2 4.38Å; Y677-L681 HydrophobicContact CE2-CG 4.25Å; Y677-L681 WeakPolarHBondContact O-CG 3.32Å; Y677-L681 PolarHBondContact O-N 3.29Å; Y677-L681 WeakPolarHBondContact OH-CD1 3.27Å; Y677-E719 HydrophobicContact CE2-CG 4.24Å; Y677-E719 WeakPolarHBondContact OH-CG 3.41Å; Y677-V722 HydrophobicContact CE2-CG2 3.82Å
678Q83.8Confident84.3Confident131 Ų13151.1 Ų51.161%0.61227%0.274SS*.Hα-helixtrans-70.6-36.1-177.9-148.7166.714.100111.5D676 L681 R682D676-Q678 PolarHBondContact O-N 2.93Å; Q678-L681 PolarHBondContact O-N 3.45Å; Q678-R682 PolarHBondContact O-N 2.93Å; Q678-R682 VanDerWaalsContact O-N 3.11Å
679T87.6Confident84.5Confident2 Ų247 Ų471%0.01225%0.254CS..Hα-helixtrans-66-42.4174-54.60000111V587 K597 M598 L670 D676 L681 R682 I683V587-T679 HydrophobicContact CG1-CG2 4.5Å; K597-T679 HydrophobicContact CD-CG2 4.42Å; M598-T679 HydrophobicContact CE-CG2 4.34Å; L670-T679 HydrophobicContact CD1-CG2 4.41Å; D676-T679 PolarHBondContact O-N 2.88Å; T679-L681 PolarHBondContact O-N 3.4Å; T679-R682 PolarHBondContact O-N 3.41Å; T679-I683 HydrophobicContact CG2-CD1 3.77Å; T679-I683 HydrophobicContact CG2-CG1 4.38Å; T679-I683 VanDerWaalsContact O-CG1 3.27Å; T679-I683 WeakPolarHBondContact O-CG1 3.23Å; T679-I683 PolarHBondContact O-N 3.28Å
680F90.7Very high84.9Confident11 Ų1142.6 Ų42.65%0.04822%0.223CC..Hα-helixtrans-58.2-47.6175.5-178.1-83.9000111.4W667 L670 M672 D676 Y677 R682 G684 L714 M725W667-F680 AromaticContact CD1-CD2 3.65Å; W667-F680 AromaticContact CD1-CE2 3.88Å; W667-F680 HydrophobicContact CD2-CE2 4.24Å; W667-F680 AromaticContact CE2-CD2 3.97Å; W667-F680 AromaticContact CE2-CE1 3.93Å; W667-F680 AromaticContact CE2-CE2 3.48Å; W667-F680 VanDerWaalsContact CE2-CE2 3.48Å; W667-F680 AromaticContact CE2-CZ 3.45Å; W667-F680 VanDerWaalsContact CE2-CZ 3.45Å; W667-F680 HydrophobicContact CG-CE2 4.46Å; W667-F680 HydrophobicContact CH2-CZ 4.14Å; W667-F680 HydrophobicContact CZ2-CD1 4.45Å; W667-F680 AromaticContact CZ2-CE1 3.62Å; W667-F680 HydrophobicContact CZ2-CE1 3.62Å; W667-F680 AromaticContact CZ2-CE2 3.77Å; W667-F680 HydrophobicContact CZ2-CE2 3.77Å; W667-F680 AromaticContact CZ2-CZ 3.23Å; W667-F680 HydrophobicContact CZ2-CZ 3.23Å; W667-F680 AromaticContact NE1-CD1 3.74Å; W667-F680 AromaticContact NE1-CD2 3.23Å; W667-F680 AromaticContact NE1-CE1 3.75Å; W667-F680 AromaticContact NE1-CE2 3.25Å; W667-F680 VanDerWaalsContact NE1-CE2 3.25Å; W667-F680 AromaticContact NE1-CG 3.48Å; W667-F680 AromaticContact NE1-CZ 3.52Å; W667-F680 PolarHBondContact NE1-O 3.34Å; L670-F680 HydrophobicContact CB-CD2 4.17Å; M672-F680 HydrophobicContact CG-CE2 4.34Å; M672-F680 HydrophobicContact CG-CZ 4.37Å; M672-F680 HydrophobicContact SD-CD1 3.5Å; M672-F680 VanDerWaalsContact SD-CD1 3.5Å; M672-F680 HydrophobicContact SD-CD2 4.21Å; M672-F680 HydrophobicContact SD-CE1 3.3Å; M672-F680 WeakPolarHBondContact SD-CE1 3.44Å; M672-F680 HydrophobicContact SD-CE2 4.03Å; M672-F680 HydrophobicContact SD-CG 3.97Å; M672-F680 HydrophobicContact SD-CZ 3.58Å; M672-F680 VanDerWaalsContact SD-CZ 3.58Å; D676-F680 WeakPolarHBondContact O-CB 3.49Å; D676-F680 PolarHBondContact O-N 2.97Å; Y677-F680 WeakPolarHBondContact O-CB 3.3Å; Y677-F680 PolarHBondContact O-N 3.14Å; F680-R682 PolarHBondContact O-N 2.83Å; F680-G684 PolarHBondContact O-N 3Å; F680-G684 VanDerWaalsContact O-N 3.1Å; F680-L714 HydrophobicContact CE1-CD1 4.18Å; F680-L714 HydrophobicContact CZ-CD1 3.85Å; F680-M725 HydrophobicContact CD1-CE 4.28Å; F680-M725 HydrophobicContact CE1-CE 4.22Å; F680-M725 HydrophobicContact CE1-SD 4.47Å
681L89.1Confident85.3Confident36 Ų3641 Ų4119%0.18822%0.215CC..Hα-helixtrans-59.7-48.2178-70.4-175.2000112.1Y677 Q678 T679 I683 G684 E685 A721 V722 M725Y677-L681 HydrophobicContact CD1-CD1 4.44Å; Y677-L681 HydrophobicContact CE1-CD1 3.68Å; Y677-L681 HydrophobicContact CE1-CG 4.37Å; Y677-L681 HydrophobicContact CE2-CD1 4.28Å; Y677-L681 HydrophobicContact CE2-CD2 4.38Å; Y677-L681 HydrophobicContact CE2-CG 4.25Å; Y677-L681 WeakPolarHBondContact O-CG 3.32Å; Y677-L681 PolarHBondContact O-N 3.29Å; Y677-L681 WeakPolarHBondContact OH-CD1 3.27Å; Q678-L681 PolarHBondContact O-N 3.45Å; T679-L681 PolarHBondContact O-N 3.4Å; L681-I683 PolarHBondContact O-N 3.02Å; L681-G684 PolarHBondContact O-N 2.89Å; L681-E685 PolarHBondContact O-N 3.04Å; L681-E685 VanDerWaalsContact O-N 3.09Å; L681-A721 HydrophobicContact CD1-CB 3.98Å; L681-A721 HydrophobicContact CD2-CB 4.46Å; L681-V722 HydrophobicContact CD2-CG2 4.21Å; L681-M725 VanDerWaalsContact CA-CE 3.46Å; L681-M725 HydrophobicContact CB-CE 4.21Å; L681-M725 HydrophobicContact CD2-CE 3.41Å; L681-M725 VanDerWaalsContact CD2-CE 3.41Å; L681-M725 HydrophobicContact CG-CE 4.37Å
682R89.6Confident86Confident34 Ų3434 Ų3413%0.12818%0.184CC..Hα-helixtrans-69.3-34-175.6-163.462.1166.6161.4-1.6112.9M598 L601 Q678 T679 F680 E685 T686M598-R682 HydrophobicContact CE-CB 4.43Å; M598-R682 HydrophobicContact SD-CB 3.84Å; M598-R682 HydrophobicContact SD-CG 3.75Å; L601-R682 HydrophobicContact CB-CG 4.43Å; L601-R682 HydrophobicContact CD1-CB 3.87Å; L601-R682 HydrophobicContact CD1-CG 3.72Å; Q678-R682 PolarHBondContact O-N 2.93Å; Q678-R682 VanDerWaalsContact O-N 3.11Å; T679-R682 PolarHBondContact O-N 3.41Å; F680-R682 PolarHBondContact O-N 2.83Å; R682-E685 IonicContact CZ-OE2 3.87Å; R682-E685 IonicContact NH1-OE1 2.82Å; R682-E685 PolarHBondContact NH1-OE1 3.28Å; R682-E685 IonicContact NH1-OE2 2.64Å; R682-E685 PolarHBondContact NH1-OE2 3.49Å; R682-T686 WeakPolarHBondContact O-CB 3.28Å; R682-T686 PolarHBondContact O-N 3.38Å; R682-T686 PolarHBondContact O-OG1 2.96Å
683I92.5Very high86.8Confident0 Ų032.3 Ų32.30%018%0.176CC..Hα-helixtrans-65.5-46.5172.9-68.5165.3000110.5V587 F588 L601 L663 W667 L670 T679 L681 E685 T686 L687V587-I683 HydrophobicContact CG1-CD1 3.94Å; V587-I683 HydrophobicContact CG1-CG1 4.33Å; F588-I683 HydrophobicContact CE1-CD1 3.85Å; F588-I683 HydrophobicContact CZ-CD1 4.14Å; L601-I683 HydrophobicContact CD1-CG1 3.86Å; L601-I683 HydrophobicContact CD2-CG1 3.83Å; L663-I683 HydrophobicContact CD1-CG1 4.47Å; L663-I683 HydrophobicContact CD1-CG2 4.37Å; L663-I683 HydrophobicContact CD2-CG2 3.83Å; L663-I683 HydrophobicContact CG-CG2 3.66Å; W667-I683 HydrophobicContact CB-CG2 3.61Å; W667-I683 HydrophobicContact CD2-CG2 4.48Å; W667-I683 HydrophobicContact CG-CB 4.23Å; W667-I683 HydrophobicContact CG-CG2 3.59Å; L670-I683 HydrophobicContact CD1-CD1 3.56Å; T679-I683 HydrophobicContact CG2-CD1 3.77Å; T679-I683 HydrophobicContact CG2-CG1 4.38Å; T679-I683 VanDerWaalsContact O-CG1 3.27Å; T679-I683 WeakPolarHBondContact O-CG1 3.23Å; T679-I683 PolarHBondContact O-N 3.28Å; L681-I683 PolarHBondContact O-N 3.02Å; I683-E685 VanDerWaalsContact C-N 3.26Å; I683-E685 PolarHBondContact O-N 3.04Å; I683-T686 WeakPolarHBondContact O-CA 3.1Å; I683-T686 WeakPolarHBondContact O-CB 3.32Å; I683-T686 PolarHBondContact O-N 2.93Å; I683-L687 HydrophobicContact CG2-CD1 4.05Å; I683-L687 HydrophobicContact CG2-CG 4.24Å; I683-L687 WeakPolarHBondContact O-CG 3.13Å; I683-L687 PolarHBondContact O-N 3.44Å
684G91.8Very high87.8Confident1 Ų126.6 Ų26.61%0.0115%0.146CC..Hα-helixtrans-56.3-40.9177.500000112.8F680 L681 L687 C688F680-G684 PolarHBondContact O-N 3Å; F680-G684 VanDerWaalsContact O-N 3.1Å; L681-G684 PolarHBondContact O-N 2.89Å; G684-L687 PolarHBondContact O-N 3.12Å; G684-C688 PolarHBondContact O-N 3.46Å; G684-C688 VanDerWaalsContact O-N 3.14Å; G684-C688 PolarHBondContact O-SG 3.12Å
685E89.6Confident88.5Confident28 Ų2824.4 Ų24.413%0.13112%0.123CC..Hα-helixtrans-65.6-41.1174.4-162.2-167.7151.400112.7L632 L681 R682 I683 L687 C688 T689L632-E685 HydrophobicContact CD1-CG 4.01Å; L632-E685 HydrophobicContact CG-CG 4.45Å; L681-E685 PolarHBondContact O-N 3.04Å; L681-E685 VanDerWaalsContact O-N 3.09Å; R682-E685 IonicContact CZ-OE2 3.87Å; R682-E685 IonicContact NH1-OE1 2.82Å; R682-E685 PolarHBondContact NH1-OE1 3.28Å; R682-E685 IonicContact NH1-OE2 2.64Å; R682-E685 PolarHBondContact NH1-OE2 3.49Å; I683-E685 VanDerWaalsContact C-N 3.26Å; I683-E685 PolarHBondContact O-N 3.04Å; E685-L687 PolarHBondContact O-N 3.42Å; E685-C688 WeakPolarHBondContact O-CB 3.4Å; E685-C688 PolarHBondContact O-N 3.12Å; E685-C688 VanDerWaalsContact O-N 3.17Å; E685-T689 PolarHBondContact O-N 3.03Å; E685-T689 PolarHBondContact O-OG1 3.43Å
686T93.1Very high89.3Confident0 Ų025.6 Ų25.60%012%0.124CC..Hα-helixtrans-62.5-41176.7-57.70000111.9L601 Q605 L663 R682 I683 C688 T689 F690L601-T686 HydrophobicContact CD2-CG2 4.37Å; Q605-T686 HydrophobicContact CG-CG2 3.79Å; Q605-T686 PolarHBondContact NE2-OG1 3.36Å; L663-T686 HydrophobicContact CD2-CG2 3.75Å; R682-T686 WeakPolarHBondContact O-CB 3.28Å; R682-T686 PolarHBondContact O-N 3.38Å; R682-T686 PolarHBondContact O-OG1 2.96Å; I683-T686 WeakPolarHBondContact O-CA 3.1Å; I683-T686 WeakPolarHBondContact O-CB 3.32Å; I683-T686 PolarHBondContact O-N 2.93Å; T686-C688 VanDerWaalsContact C-N 3.32Å; T686-C688 PolarHBondContact O-N 3.4Å; T686-T689 WeakPolarHBondContact CA-OG1 3.28Å; T686-T689 PolarHBondContact O-N 3.12Å; T686-T689 VanDerWaalsContact O-N 3.14Å; T686-T689 PolarHBondContact O-OG1 2.86Å; T686-F690 HydrophobicContact CG2-CE1 3.96Å; T686-F690 HydrophobicContact CG2-CE2 3.91Å; T686-F690 HydrophobicContact CG2-CZ 3.58Å; T686-F690 WeakPolarHBondContact O-CG 3.31Å; T686-F690 PolarHBondContact O-N 3.46Å
687L95.2Very high89.7Confident0 Ų023.7 Ų23.70%012%0.115CC..Hα-helixtrans-61.9-40.6173.6-67.3170.4000111.4F660 L663 F664 W667 I683 G684 E685 T689 F690 L691 L707F660-L687 HydrophobicContact CD2-CB 4.39Å; F660-L687 HydrophobicContact CD2-CD2 3.69Å; F660-L687 HydrophobicContact CE2-CB 3.93Å; F660-L687 HydrophobicContact CE2-CD2 3.79Å; F660-L687 HydrophobicContact CE2-CG 4.39Å; F660-L687 HydrophobicContact CG-CD2 4.15Å; F660-L687 HydrophobicContact CZ-CD2 4.31Å; L663-L687 HydrophobicContact CB-CD2 4.16Å; L663-L687 HydrophobicContact CD2-CD2 4.22Å; L663-L687 HydrophobicContact CD2-CG 4.43Å; L663-L687 HydrophobicContact CG-CD2 4.5Å; F664-L687 HydrophobicContact CB-CD1 4.35Å; F664-L687 HydrophobicContact CB-CD2 4.04Å; F664-L687 HydrophobicContact CD2-CD1 4.14Å; W667-L687 HydrophobicContact CD2-CD1 4.02Å; W667-L687 HydrophobicContact CE3-CD1 3.81Å; W667-L687 HydrophobicContact CG-CD1 4.38Å; W667-L687 HydrophobicContact CZ3-CD1 4.36Å; I683-L687 HydrophobicContact CG2-CD1 4.05Å; I683-L687 HydrophobicContact CG2-CG 4.24Å; I683-L687 WeakPolarHBondContact O-CG 3.13Å; I683-L687 PolarHBondContact O-N 3.44Å; G684-L687 PolarHBondContact O-N 3.12Å; E685-L687 PolarHBondContact O-N 3.42Å; L687-T689 VanDerWaalsContact C-N 3.33Å; L687-T689 PolarHBondContact O-N 3.22Å; L687-F690 HydrophobicContact CD2-CD2 4.4Å; L687-F690 PolarHBondContact O-N 3.37Å; L687-L691 PolarHBondContact O-N 2.99Å; L687-L691 VanDerWaalsContact O-N 3.11Å; L687-L707 HydrophobicContact CB-CD1 4.23Å; L687-L707 HydrophobicContact CD1-CD1 4.04Å
688C92.5Very high89.8Confident1 Ų127.3 Ų27.31%0.00714%0.143CC..Hα-helixtrans-62.5-40.4173.1-66.90000111.6L632 G684 E685 T686 F690 L691 V692 V732L632-C688 HydrophobicContact CD1-CB 4.04Å; L632-C688 HydrophobicContact CD2-CB 4.01Å; G684-C688 PolarHBondContact O-N 3.46Å; G684-C688 VanDerWaalsContact O-N 3.14Å; G684-C688 PolarHBondContact O-SG 3.12Å; E685-C688 WeakPolarHBondContact O-CB 3.4Å; E685-C688 PolarHBondContact O-N 3.12Å; E685-C688 VanDerWaalsContact O-N 3.17Å; T686-C688 VanDerWaalsContact C-N 3.32Å; T686-C688 PolarHBondContact O-N 3.4Å; C688-F690 PolarHBondContact O-N 3.43Å; C688-L691 WeakPolarHBondContact O-CB 3.27Å; C688-L691 PolarHBondContact O-N 3.31Å; C688-V692 WeakPolarHBondContact O-CG2 3.3Å; C688-V692 PolarHBondContact O-N 3.44Å; C688-V692 VanDerWaalsContact O-N 3.13Å; C688-V732 HydrophobicContact CB-CG1 4.44Å; C688-V732 HydrophobicContact CB-CG2 4.31Å
689T91Very high90.2Very high1 Ų126 Ų261%0.00613%0.133CC..Hα-helixtrans-64.1-40.6177.6-11.70000111.7L632 I635 E685 T686 L687 L691 V692 F693L632-T689 HydrophobicContact CD2-CG2 4.49Å; I635-T689 HydrophobicContact CD1-CG2 3.74Å; E685-T689 PolarHBondContact O-N 3.03Å; E685-T689 PolarHBondContact O-OG1 3.43Å; T686-T689 WeakPolarHBondContact CA-OG1 3.28Å; T686-T689 PolarHBondContact O-N 3.12Å; T686-T689 VanDerWaalsContact O-N 3.14Å; T686-T689 PolarHBondContact O-OG1 2.86Å; L687-T689 VanDerWaalsContact C-N 3.33Å; L687-T689 PolarHBondContact O-N 3.22Å; T689-L691 VanDerWaalsContact C-N 3.33Å; T689-L691 PolarHBondContact O-N 3.41Å; T689-V692 PolarHBondContact O-N 2.92Å; T689-V692 VanDerWaalsContact O-N 3.14Å; T689-F693 HydrophobicContact CG2-CD2 4.18Å; T689-F693 HydrophobicContact CG2-CE2 3.36Å; T689-F693 HydrophobicContact CG2-CZ 3.6Å; T689-F693 WeakPolarHBondContact O-CD2 3.42Å; T689-F693 WeakPolarHBondContact O-CG 3.35Å; T689-F693 PolarHBondContact O-N 2.93Å
690F93.2Very high90.5Very high0 Ų025.9 Ų25.90%013%0.133CC..Hα-helixtrans-60.8-40174-64-21.8000112.6L604 F652 F659 F660 L663 T686 L687 C688 V692 F693 S694L604-F690 HydrophobicContact CB-CE1 4.31Å; L604-F690 HydrophobicContact CB-CZ 3.99Å; F652-F690 HydrophobicContact CE1-CB 4.21Å; F652-F690 HydrophobicContact CE1-CD1 4.4Å; F652-F690 HydrophobicContact CZ-CB 4.19Å; F652-F690 AromaticContact CZ-CD1 3.82Å; F652-F690 HydrophobicContact CZ-CD1 3.82Å; F652-F690 HydrophobicContact CZ-CE1 4.46Å; F652-F690 HydrophobicContact CZ-CG 4.1Å; F659-F690 HydrophobicContact CB-CD2 4.22Å; F659-F690 HydrophobicContact CB-CE2 3.95Å; F659-F690 HydrophobicContact CB-CZ 4.13Å; F659-F690 HydrophobicContact CD1-CE1 4.25Å; F659-F690 HydrophobicContact CD1-CZ 4.12Å; F660-F690 HydrophobicContact CB-CD2 4.5Å; F660-F690 HydrophobicContact CD2-CB 4.45Å; L663-F690 HydrophobicContact CD2-CE2 3.96Å; T686-F690 HydrophobicContact CG2-CE1 3.96Å; T686-F690 HydrophobicContact CG2-CE2 3.91Å; T686-F690 HydrophobicContact CG2-CZ 3.58Å; T686-F690 WeakPolarHBondContact O-CG 3.31Å; T686-F690 PolarHBondContact O-N 3.46Å; L687-F690 HydrophobicContact CD2-CD2 4.4Å; L687-F690 PolarHBondContact O-N 3.37Å; C688-F690 PolarHBondContact O-N 3.43Å; F690-V692 VanDerWaalsContact C-N 3.32Å; F690-V692 PolarHBondContact O-N 2.91Å; F690-F693 PolarHBondContact O-N 3.31Å; F690-S694 WeakPolarHBondContact O-CB 3.28Å; F690-S694 PolarHBondContact O-N 3.26Å
691L93Very high90.5Very high0 Ų026.6 Ų26.60%014%0.138CC..Hα-helixtrans-57.7-47.2173.1-70.3177.4000110.8F660 L687 C688 T689 F693 S694 V700 M703 A704 L707 V732 V736F660-L691 HydrophobicContact CE2-CD2 4.25Å; F660-L691 HydrophobicContact CE2-CG 4.27Å; L687-L691 PolarHBondContact O-N 2.99Å; L687-L691 VanDerWaalsContact O-N 3.11Å; C688-L691 WeakPolarHBondContact O-CB 3.27Å; C688-L691 PolarHBondContact O-N 3.31Å; T689-L691 VanDerWaalsContact C-N 3.33Å; T689-L691 PolarHBondContact O-N 3.41Å; L691-F693 PolarHBondContact O-N 3.16Å; L691-S694 PolarHBondContact O-N 3.44Å; L691-S694 PolarHBondContact O-OG 3.48Å; L691-V700 HydrophobicContact CD2-CG2 4.14Å; L691-M703 HydrophobicContact CD2-CB 3.47Å; L691-M703 VanDerWaalsContact CD2-CB 3.47Å; L691-M703 HydrophobicContact CD2-CE 4.3Å; L691-A704 HydrophobicContact CD1-CB 4.22Å; L691-A704 HydrophobicContact CD2-CB 4.17Å; L691-L707 HydrophobicContact CD1-CD2 3.6Å; L691-V732 HydrophobicContact CB-CG1 3.96Å; L691-V732 HydrophobicContact CD1-CG1 4.34Å; L691-V736 HydrophobicContact CB-CG2 4.22Å
692V90.1Very high90.7Very high0 Ų027.3 Ų27.30%015%0.146CC..Hα-helixtrans-59.7-48.4178.2-1770000111.9W613 I635 L636 C688 T689 F690 S694 G695 V732W613-V692 HydrophobicContact CH2-CG1 4.22Å; W613-V692 HydrophobicContact CZ2-CG1 4.35Å; I635-V692 HydrophobicContact CG2-CB 4.3Å; I635-V692 HydrophobicContact CG2-CG1 3.69Å; L636-V692 HydrophobicContact CD2-CG1 4.26Å; L636-V692 HydrophobicContact CD2-CG2 3.78Å; L636-V692 HydrophobicContact CG-CG2 4.25Å; C688-V692 WeakPolarHBondContact O-CG2 3.3Å; C688-V692 PolarHBondContact O-N 3.44Å; C688-V692 VanDerWaalsContact O-N 3.13Å; T689-V692 PolarHBondContact O-N 2.92Å; T689-V692 VanDerWaalsContact O-N 3.14Å; F690-V692 VanDerWaalsContact C-N 3.32Å; F690-V692 PolarHBondContact O-N 2.91Å; V692-S694 VanDerWaalsContact C-N 3.31Å; V692-S694 PolarHBondContact O-N 3.41Å; V692-G695 PolarHBondContact O-N 3.02Å; V692-V732 HydrophobicContact CG2-CG1 3.68Å; V692-V732 HydrophobicContact CG2-CG2 4.48Å
693F90Very high90.9Very high0 Ų025.7 Ų25.70%014%0.14CC..Hα-helixtrans-71.4-23.9-178.2-61.3-38.6000113.6Q605 S608 C609 A612 W613 L622 I635 N650 F652 T689 F690 L691 G695Q605-F693 WeakPolarHBondContact O-CE2 3.47Å; S608-F693 VanDerWaalsContact OG-CD2 3.29Å; S608-F693 WeakPolarHBondContact OG-CD2 3.49Å; C609-F693 HydrophobicContact CB-CD1 4.44Å; C609-F693 HydrophobicContact CB-CD2 4.4Å; C609-F693 HydrophobicContact CB-CE1 3.87Å; C609-F693 HydrophobicContact CB-CE2 3.79Å; C609-F693 HydrophobicContact CB-CZ 3.53Å; A612-F693 HydrophobicContact CB-CB 3.86Å; A612-F693 HydrophobicContact CB-CD1 4.41Å; A612-F693 HydrophobicContact CB-CG 4.39Å; W613-F693 HydrophobicContact CD2-CD1 4.44Å; W613-F693 HydrophobicContact CE3-CD1 4.32Å; W613-F693 HydrophobicContact CE3-CE1 4.04Å; W613-F693 AromaticContact CH2-CD1 3.9Å; W613-F693 HydrophobicContact CH2-CD1 3.9Å; W613-F693 AromaticContact CH2-CE1 3.73Å; W613-F693 HydrophobicContact CH2-CE1 3.73Å; W613-F693 AromaticContact CZ2-CD1 3.99Å; W613-F693 HydrophobicContact CZ2-CD1 3.99Å; W613-F693 HydrophobicContact CZ2-CE1 4.29Å; W613-F693 HydrophobicContact CZ3-CD1 4.08Å; W613-F693 AromaticContact CZ3-CE1 3.6Å; W613-F693 HydrophobicContact CZ3-CE1 3.6Å; L622-F693 HydrophobicContact CD1-CZ 4.02Å; I635-F693 HydrophobicContact CG2-CE1 3.65Å; I635-F693 HydrophobicContact CG2-CZ 4Å; N650-F693 PolarHBondContact ND2-O 2.9Å; F652-F693 HydrophobicContact CD1-CB 3.71Å; F652-F693 HydrophobicContact CE1-CB 4Å; T689-F693 HydrophobicContact CG2-CD2 4.18Å; T689-F693 HydrophobicContact CG2-CE2 3.36Å; T689-F693 HydrophobicContact CG2-CZ 3.6Å; T689-F693 WeakPolarHBondContact O-CD2 3.42Å; T689-F693 WeakPolarHBondContact O-CG 3.35Å; T689-F693 PolarHBondContact O-N 2.93Å; F690-F693 PolarHBondContact O-N 3.31Å; L691-F693 PolarHBondContact O-N 3.16Å; F693-G695 PolarHBondContact O-N 2.74Å
694S90.6Very high91Very high1 Ų125.7 Ų25.71%0.00714%0.14CC..Hα-helixtrans-67.1-18.8173.774.80000113F690 L691 V692 S697 V700F690-S694 WeakPolarHBondContact O-CB 3.28Å; F690-S694 PolarHBondContact O-N 3.26Å; L691-S694 PolarHBondContact O-N 3.44Å; L691-S694 PolarHBondContact O-OG 3.48Å; V692-S694 VanDerWaalsContact C-N 3.31Å; V692-S694 PolarHBondContact O-N 3.41Å; S694-S697 WeakPolarHBondContact O-CB 3.35Å; S694-S697 PolarHBondContact O-N 2.56Å; S694-V700 VanDerWaalsContact OG-CG2 3.26Å; S694-V700 WeakPolarHBondContact OG-CG2 3.28Å
695G84.7Confident91Very high17 Ų1726.1 Ų26.118%0.17514%0.142CC..  trans57.2-153.8-177.600000112.6V692 F693 S697 V700V692-G695 PolarHBondContact O-N 3.02Å; F693-G695 PolarHBondContact O-N 2.74Å; G695-S697 PolarHBondContact O-N 3.1Å; G695-V700 WeakPolarHBondContact O-CB 3.45Å
696Q83.9Confident91.1Very high159 Ų15926.5 Ų26.574%0.74315%0.148SC*.SBendtrans-79.749.5175.9-66.3177.73.200111.8
697S86.8Confident91.2Very high19 Ų1926.5 Ų26.513%0.13315%0.148CC..  trans-71.2161.6175.272.80000111.7S694 G695 Y699 V700S694-S697 WeakPolarHBondContact O-CB 3.35Å; S694-S697 PolarHBondContact O-N 2.56Å; G695-S697 PolarHBondContact O-N 3.1Å; S697-Y699 PolarHBondContact O-N 3.35Å; S697-Y699 PolarHBondContact OG-N 2.81Å; S697-V700 VanDerWaalsContact O-CG1 3.31Å; S697-V700 WeakPolarHBondContact O-CG1 3.33Å; S697-V700 PolarHBondContact O-N 2.91Å; S697-V700 PolarHBondContact OG-N 3.37Å
698V87.9Confident91Very high133 Ų13327 Ų2781%0.80615%0.151SC*.THydrogen-bonded Turntrans-62.2-21.4173.1-110.20000113
699Y91.7Very high91Very high103 Ų10332.7 Ų32.740%0.40417%0.172SC..THydrogen-bonded Turntrans-93.5-18.4-176.4-49.3-67.1000113.6P657 S697 T701 S702 M703P657-Y699 HydrophobicContact CG-CD1 4.04Å; P657-Y699 HydrophobicContact CG-CD2 3.91Å; P657-Y699 HydrophobicContact CG-CG 3.63Å; S697-Y699 PolarHBondContact O-N 3.35Å; S697-Y699 PolarHBondContact OG-N 2.81Å; Y699-T701 PolarHBondContact O-N 3.32Å; Y699-S702 PolarHBondContact O-N 3.5Å; Y699-S702 PolarHBondContact O-OG 3.13Å; Y699-M703 PolarHBondContact O-N 3.15Å
700V92.8Very high91Very high0 Ų034.9 Ų34.90%019%0.186CC..Hα-helixtrans-60.8-35.4-171.875.10000112.5L691 S694 G695 S697 A704 V736 V737L691-V700 HydrophobicContact CD2-CG2 4.14Å; S694-V700 VanDerWaalsContact OG-CG2 3.26Å; S694-V700 WeakPolarHBondContact OG-CG2 3.28Å; G695-V700 WeakPolarHBondContact O-CB 3.45Å; S697-V700 VanDerWaalsContact O-CG1 3.31Å; S697-V700 WeakPolarHBondContact O-CG1 3.33Å; S697-V700 PolarHBondContact O-N 2.91Å; S697-V700 PolarHBondContact OG-N 3.37Å; V700-A704 WeakPolarHBondContact O-CB 3.44Å; V700-A704 PolarHBondContact O-N 3.21Å; V700-V736 HydrophobicContact CG2-CB 3.97Å; V700-V736 HydrophobicContact CG2-CG2 3.79Å; V700-V737 HydrophobicContact CG1-CG2 4.25Å; V700-V737 HydrophobicContact CG2-CG2 4.43Å
701T91.9Very high90.9Very high26 Ų2635 Ų3516%0.1619%0.186CC..Hα-helixtrans-61.5-47.8178.9-53.20000111.9Y699 S705 V737 V741 E745Y699-T701 PolarHBondContact O-N 3.32Å; T701-S705 WeakPolarHBondContact O-CB 3.46Å; T701-S705 PolarHBondContact O-N 2.9Å; T701-S705 PolarHBondContact O-OG 3.35Å; T701-V737 HydrophobicContact CG2-CG1 4.23Å; T701-V741 HydrophobicContact CG2-CG1 3.51Å; T701-E745 HydrophobicContact CG2-CG 3.68Å
702S92.6Very high90.8Very high50 Ų5038.1 Ų38.135%0.3520%0.198SC..Hα-helixtrans-66.5-46.7-178.766.20000110.3Y661 Y699 A704 S705 S706Y661-S702 PolarHBondContact OH-OG 3.16Å; Y699-S702 PolarHBondContact O-N 3.5Å; Y699-S702 PolarHBondContact O-OG 3.13Å; S702-A704 PolarHBondContact O-N 3.07Å; S702-S705 PolarHBondContact O-N 3.25Å; S702-S705 PolarHBondContact O-OG 2.91Å; S702-S706 WeakPolarHBondContact O-CB 3.46Å; S702-S706 PolarHBondContact O-N 2.79Å; S702-S706 PolarHBondContact O-OG 3.26Å; S702-S706 VanDerWaalsContact O-OG 3.1Å
703M94.8Very high90.8Very high0 Ų042.8 Ų42.80%023%0.228CC..Hα-helixtrans-59.4-45.8178.4-64.9-173.2-63.900111.9S656 F660 Y661 L691 Y699 S706 L707S656-M703 WeakPolarHBondContact OG-CE 3.43Å; F660-M703 HydrophobicContact CB-CG 4.41Å; F660-M703 HydrophobicContact CB-SD 3.52Å; F660-M703 VanDerWaalsContact CB-SD 3.52Å; F660-M703 HydrophobicContact CD1-CB 4.06Å; F660-M703 HydrophobicContact CD1-CG 3.79Å; F660-M703 HydrophobicContact CD1-SD 4.04Å; F660-M703 HydrophobicContact CD2-CB 4.22Å; F660-M703 HydrophobicContact CD2-CG 4.41Å; F660-M703 HydrophobicContact CD2-SD 4.04Å; F660-M703 HydrophobicContact CE1-CB 3.95Å; F660-M703 HydrophobicContact CE1-CG 4.15Å; F660-M703 HydrophobicContact CE2-CB 4.1Å; F660-M703 HydrophobicContact CG-CB 4.21Å; F660-M703 HydrophobicContact CG-CG 3.95Å; F660-M703 HydrophobicContact CG-SD 3.6Å; F660-M703 HydrophobicContact CZ-CB 3.97Å; F660-M703 WeakPolarHBondContact CZ-O 3.46Å; Y661-M703 HydrophobicContact CE2-CG 4.36Å; L691-M703 HydrophobicContact CD2-CB 3.47Å; L691-M703 VanDerWaalsContact CD2-CB 3.47Å; L691-M703 HydrophobicContact CD2-CE 4.3Å; Y699-M703 PolarHBondContact O-N 3.15Å; M703-S706 PolarHBondContact O-N 2.75Å; M703-L707 WeakPolarHBondContact O-CB 3.24Å; M703-L707 PolarHBondContact O-N 3.04Å
704A94.4Very high90.8Very high0 Ų044.5 Ų44.50%024%0.237CC..Hα-helixtrans-64.5-44.2178.600000112.2L691 V700 S702 L707 I708 A733 V737L691-A704 HydrophobicContact CD1-CB 4.22Å; L691-A704 HydrophobicContact CD2-CB 4.17Å; V700-A704 WeakPolarHBondContact O-CB 3.44Å; V700-A704 PolarHBondContact O-N 3.21Å; S702-A704 PolarHBondContact O-N 3.07Å; A704-L707 PolarHBondContact O-N 3.13Å; A704-I708 WeakPolarHBondContact O-CG1 3.3Å; A704-I708 PolarHBondContact O-N 3.37Å; A704-A733 HydrophobicContact CB-CB 3.82Å; A704-V737 HydrophobicContact CB-CG2 3.64Å
705S91.6Very high90.8Very high10 Ų1047 Ų477%0.0725%0.249CC..Hα-helixtrans-63.5-41.617872.80000112.2T701 S702 R709T701-S705 WeakPolarHBondContact O-CB 3.46Å; T701-S705 PolarHBondContact O-N 2.9Å; T701-S705 PolarHBondContact O-OG 3.35Å; S702-S705 PolarHBondContact O-N 3.25Å; S702-S705 PolarHBondContact O-OG 2.91Å; S705-R709 WeakPolarHBondContact O-CB 3.42Å; S705-R709 WeakPolarHBondContact O-CG 3.49Å; S705-R709 PolarHBondContact O-N 3.37Å
706S92.6Very high91Very high36 Ų3649.1 Ų49.125%0.25227%0.27SS..Hα-helixtrans-61.9-46.3174.9-64.60000111S702 M703 I708 T710S702-S706 WeakPolarHBondContact O-CB 3.46Å; S702-S706 PolarHBondContact O-N 2.79Å; S702-S706 PolarHBondContact O-OG 3.26Å; S702-S706 VanDerWaalsContact O-OG 3.1Å; M703-S706 PolarHBondContact O-N 2.75Å; S706-I708 PolarHBondContact O-N 2.88Å; S706-T710 WeakPolarHBondContact O-CB 3.23Å; S706-T710 PolarHBondContact O-N 3.41Å; S706-T710 PolarHBondContact O-OG1 3.34Å
707L94.1Very high91.3Very high1 Ų144 Ų441%0.00525%0.246CC..Hα-helixtrans-60-48.4179.5-171.562.9000111.9F660 F664 W667 L687 L691 M703 A704 T710 L711 A729F660-L707 HydrophobicContact CZ-CB 4.23Å; F664-L707 HydrophobicContact CD2-CD1 4.47Å; F664-L707 HydrophobicContact CE2-CD1 4.44Å; W667-L707 HydrophobicContact CH2-CD1 4.24Å; W667-L707 HydrophobicContact CZ3-CD1 3.97Å; L687-L707 HydrophobicContact CB-CD1 4.23Å; L687-L707 HydrophobicContact CD1-CD1 4.04Å; L691-L707 HydrophobicContact CD1-CD2 3.6Å; M703-L707 WeakPolarHBondContact O-CB 3.24Å; M703-L707 PolarHBondContact O-N 3.04Å; A704-L707 PolarHBondContact O-N 3.13Å; L707-T710 PolarHBondContact O-N 3.14Å; L707-L711 HydrophobicContact CD1-CD1 4.09Å; L707-L711 HydrophobicContact CG-CD1 3.95Å; L707-L711 WeakPolarHBondContact O-CB 3.34Å; L707-L711 WeakPolarHBondContact O-CG 3.5Å; L707-L711 PolarHBondContact O-N 3.44Å; L707-A729 HydrophobicContact CD2-CB 4Å; L707-A729 HydrophobicContact CG-CB 4.28Å
708I92.1Very high91.4Very high10 Ų1048 Ų485%0.05127%0.274CS..Hα-helixtrans-65.5-47-178.3-65166.5000111.3A704 S706 T710 L711 W712 F730 A733 M746 I753A704-I708 WeakPolarHBondContact O-CG1 3.3Å; A704-I708 PolarHBondContact O-N 3.37Å; S706-I708 PolarHBondContact O-N 2.88Å; I708-T710 VanDerWaalsContact C-N 3.28Å; I708-T710 PolarHBondContact O-N 2.95Å; I708-L711 PolarHBondContact O-N 3.45Å; I708-W712 WeakPolarHBondContact O-CB 3.49Å; I708-W712 PolarHBondContact O-N 3.06Å; I708-F730 HydrophobicContact CD1-CD2 3.83Å; I708-F730 HydrophobicContact CD1-CE2 4.29Å; I708-F730 HydrophobicContact CG1-CD2 4.37Å; I708-F730 HydrophobicContact CG2-CD2 4.08Å; I708-A733 HydrophobicContact CD1-CB 3.54Å; I708-A733 HydrophobicContact CG1-CB 4.35Å; I708-M746 HydrophobicContact CB-CE 4.08Å; I708-M746 HydrophobicContact CD1-CE 4.16Å; I708-M746 HydrophobicContact CD1-SD 3.53Å; I708-M746 VanDerWaalsContact CD1-SD 3.53Å; I708-M746 HydrophobicContact CG2-CE 3.42Å; I708-M746 VanDerWaalsContact CG2-CE 3.42Å; I708-M746 HydrophobicContact CG2-SD 4.24Å; I708-I753 HydrophobicContact CG2-CD1 4.36Å
709R90.9Very high91.4Very high120 Ų12045.8 Ų45.845%0.45326%0.255SS..Hα-helixtrans-63.1-36.8-179-72.8-178.5-173.1143.16.5111.9S705 E745 D749S705-R709 WeakPolarHBondContact O-CB 3.42Å; S705-R709 WeakPolarHBondContact O-CG 3.49Å; S705-R709 PolarHBondContact O-N 3.37Å; R709-E745 PolarHBondContact NH2-O 3.44Å; R709-E745 VanDerWaalsContact NH2-O 3.12Å; R709-E745 IonicContact NH2-OE2 2.79Å; R709-D749 IonicContact NE-OD2 3.67Å
710T91.5Very high91.3Very high48 Ų4842.6 Ų42.629%0.29425%0.247SC..Hα-helixtrans-71.8-34.5176-610000112.5F664 W667 M668 S706 L707 I708 P713F664-T710 HydrophobicContact CE2-CG2 4.31Å; F664-T710 HydrophobicContact CZ-CG2 4.34Å; F664-T710 WeakPolarHBondContact CZ-OG1 3.35Å; W667-T710 HydrophobicContact CZ3-CG2 3.94Å; M668-T710 HydrophobicContact CG-CG2 3.74Å; M668-T710 HydrophobicContact SD-CG2 3.73Å; S706-T710 WeakPolarHBondContact O-CB 3.23Å; S706-T710 PolarHBondContact O-N 3.41Å; S706-T710 PolarHBondContact O-OG1 3.34Å; L707-T710 PolarHBondContact O-N 3.14Å; I708-T710 VanDerWaalsContact C-N 3.28Å; I708-T710 PolarHBondContact O-N 2.95Å; T710-P713 WeakPolarHBondContact O-CD 3.5Å
711L91.1Very high91.1Very high1 Ų144.5 Ų44.51%0.00526%0.262CS..Hα-helixtrans-76.9-25.1176.6-81.7172.9000113.8W667 L707 I708 P713 L714 M725 V726 A729W667-L711 HydrophobicContact CH2-CD1 4.46Å; W667-L711 HydrophobicContact CH2-CD2 3.44Å; W667-L711 VanDerWaalsContact CH2-CD2 3.44Å; W667-L711 HydrophobicContact CH2-CG 3.74Å; W667-L711 HydrophobicContact CZ2-CD2 3.85Å; L707-L711 HydrophobicContact CD1-CD1 4.09Å; L707-L711 HydrophobicContact CG-CD1 3.95Å; L707-L711 WeakPolarHBondContact O-CB 3.34Å; L707-L711 WeakPolarHBondContact O-CG 3.5Å; L707-L711 PolarHBondContact O-N 3.44Å; I708-L711 PolarHBondContact O-N 3.45Å; L711-P713 VanDerWaalsContact C-CD 3.42Å; L711-L714 HydrophobicContact CD2-CD1 4.21Å; L711-L714 WeakPolarHBondContact O-CB 3.37Å; L711-L714 PolarHBondContact O-N 2.94Å; L711-M725 HydrophobicContact CD1-CG 4.48Å; L711-M725 HydrophobicContact CD1-SD 4.42Å; L711-M725 HydrophobicContact CD2-CG 4.47Å; L711-M725 HydrophobicContact CD2-SD 3.7Å; L711-V726 HydrophobicContact CB-CG1 4.49Å; L711-V726 HydrophobicContact CB-CG2 4.21Å; L711-V726 HydrophobicContact CD2-CG2 4.31Å; L711-A729 HydrophobicContact CD1-CB 3.33Å
712W91.2Very high91Very high67 Ų6743.2 Ų43.225%0.25426%0.255SS..G310 helixtrans-52.4-42.1-173.6178.9-116.2000114.9I708 L714 H715 D752 I753 W756I708-W712 WeakPolarHBondContact O-CB 3.49Å; I708-W712 PolarHBondContact O-N 3.06Å; W712-L714 PolarHBondContact O-N 2.75Å; W712-H715 HydrophobicContact CE3-CB 4.24Å; W712-H715 HydrophobicContact CZ3-CB 4.17Å; W712-H715 PolarHBondContact O-N 2.9Å; W712-H715 PolarHBondContact O-ND1 3.31Å; W712-D752 HydrophobicContact CH2-CB 4.32Å; W712-D752 HydrophobicContact CZ2-CB 3.85Å; W712-I753 HydrophobicContact CE3-CG1 3.82Å; W712-I753 HydrophobicContact CH2-CB 4.38Å; W712-I753 HydrophobicContact CH2-CG1 3.89Å; W712-I753 HydrophobicContact CZ3-CB 4.14Å; W712-I753 HydrophobicContact CZ3-CG1 3.48Å; W712-I753 VanDerWaalsContact CZ3-CG1 3.48Å; W712-W756 HydrophobicContact CH2-CB 4.14Å; W712-W756 HydrophobicContact CZ3-CE3 4.03Å
713P90.6Very high90.9Very high97 Ų9741.8 Ų41.863%0.6324%0.241SC*.G310 helixtrans-58.3-20176.2-24.635.6000114.4T710 L711T710-P713 WeakPolarHBondContact O-CD 3.5Å; L711-P713 VanDerWaalsContact C-CD 3.42Å
714L89.5Confident90.7Very high37 Ų3742.5 Ų42.519%0.19425%0.248CC..G310 helixtrans-930.3-176.3-54.1178.7000113.8M672 F680 L711 W712 G716 H717 V722 V726M672-L714 HydrophobicContact CE-CD1 4.46Å; M672-L714 HydrophobicContact CE-CD2 4.3Å; M672-L714 HydrophobicContact SD-CD1 4.26Å; F680-L714 HydrophobicContact CE1-CD1 4.18Å; F680-L714 HydrophobicContact CZ-CD1 3.85Å; L711-L714 HydrophobicContact CD2-CD1 4.21Å; L711-L714 WeakPolarHBondContact O-CB 3.37Å; L711-L714 PolarHBondContact O-N 2.94Å; W712-L714 PolarHBondContact O-N 2.75Å; L714-G716 PolarHBondContact O-N 2.99Å; L714-G716 VanDerWaalsContact O-N 3.14Å; L714-H717 VanDerWaalsContact O-CB 3.24Å; L714-H717 WeakPolarHBondContact O-CB 3.11Å; L714-H717 PolarHBondContact O-N 3.42Å; L714-V722 HydrophobicContact CB-CG1 3.83Å; L714-V722 HydrophobicContact CD1-CG1 4.23Å; L714-V726 HydrophobicContact CB-CG2 4.12Å
715H90.8Very high90.5Very high54 Ų5443.2 Ų43.225%0.2525%0.251CS..THydrogen-bonded Turntrans-59.2-29-17674.4-86.6000113.8W712 R723 V726 W756W712-H715 HydrophobicContact CE3-CB 4.24Å; W712-H715 HydrophobicContact CZ3-CB 4.17Å; W712-H715 PolarHBondContact O-N 2.9Å; W712-H715 PolarHBondContact O-ND1 3.31Å; H715-R723 WeakPolarHBondContact O-CD 3.42Å; H715-V726 HydrophobicContact CB-CG1 4.26Å; H715-W756 HydrophobicContact CB-CD2 3.96Å; H715-W756 HydrophobicContact CB-CE3 4.16Å; H715-W756 HydrophobicContact CB-CH2 3.9Å; H715-W756 HydrophobicContact CB-CZ2 3.75Å; H715-W756 HydrophobicContact CB-CZ3 4.13Å; H715-W756 AromaticContact CD2-CD1 3.49Å; H715-W756 VanDerWaalsContact CD2-CD1 3.49Å; H715-W756 AromaticContact CD2-CD2 3.95Å; H715-W756 AromaticContact CD2-CE2 3.9Å; H715-W756 AromaticContact CD2-CG 3.69Å; H715-W756 AromaticContact CD2-NE1 3.61Å; H715-W756 WeakPolarHBondContact O-CZ2 3.44Å; H715-W756 PolarHBondContact O-NE1 3.21Å
716G87.5Confident90.5Very high60 Ų6043.2 Ų43.262%0.61925%0.251SS*.THydrogen-bonded Turntrans-96.913.4178.600000114.9L714L714-G716 PolarHBondContact O-N 2.99Å; L714-G716 VanDerWaalsContact O-N 3.14Å
717H90.8Very high90.5Very high53 Ų5341.6 Ų41.625%0.24524%0.239CC..  trans-61.7146.8-174.8-165.1-92.1000112.4M672 L714 E719 V722 R723M672-H717 VanDerWaalsContact CE-NE2 3.31Å; M672-H717 WeakPolarHBondContact CE-NE2 3.46Å; L714-H717 VanDerWaalsContact O-CB 3.24Å; L714-H717 WeakPolarHBondContact O-CB 3.11Å; L714-H717 PolarHBondContact O-N 3.42Å; H717-E719 VanDerWaalsContact C-N 3.29Å; H717-E719 WeakPolarHBondContact ND1-CB 3.38Å; H717-E719 PolarHBondContact ND1-N 3.04Å; H717-E719 VanDerWaalsContact ND1-N 3.12Å; H717-E719 PolarHBondContact O-N 3Å; H717-V722 HydrophobicContact CB-CB 4.03Å; H717-V722 HydrophobicContact CB-CG1 3.74Å; H717-R723 VanDerWaalsContact O-CD 3.3Å; H717-R723 WeakPolarHBondContact O-CD 3.36Å; H717-R723 WeakPolarHBondContact O-CG 3.45Å; H717-R723 PolarHBondContact O-NH1 3.31Å
718S88.7Confident90.3Very high101 Ų10142 Ų4271%0.70624%0.242SC*.SBendtrans-61-39.2-178.8500000112.4R723S718-R723 PolarHBondContact O-NH1 2.81Å
719E88.5Confident90.2Very high87 Ų8741.5 Ų41.541%0.40724%0.24SC..SBendtrans-80.2124.2-175.8-164.553-14500112.7Y677 H717 A721 V722 R723Y677-E719 HydrophobicContact CE2-CG 4.24Å; Y677-E719 WeakPolarHBondContact OH-CG 3.41Å; H717-E719 VanDerWaalsContact C-N 3.29Å; H717-E719 WeakPolarHBondContact ND1-CB 3.38Å; H717-E719 PolarHBondContact ND1-N 3.04Å; H717-E719 VanDerWaalsContact ND1-N 3.12Å; H717-E719 PolarHBondContact O-N 3Å; E719-A721 VanDerWaalsContact C-N 3.33Å; E719-A721 PolarHBondContact O-N 3.32Å; E719-V722 HydrophobicContact CB-CG2 4.13Å; E719-V722 PolarHBondContact O-N 3.43Å; E719-R723 PolarHBondContact O-N 2.92Å
720P89.5Confident90.2Very high36 Ų3636.2 Ų36.223%0.23422%0.22CC..Hα-helixtrans-59.9-36.9-176.9-24.633.7000114.4V722 R723 A724 D766 C769P720-V722 PolarHBondContact O-N 2.99Å; P720-R723 PolarHBondContact O-N 3.45Å; P720-A724 WeakPolarHBondContact O-CB 3.45Å; P720-A724 PolarHBondContact O-N 3.23Å; P720-D766 HydrophobicContact CB-CB 3.78Å; P720-D766 HydrophobicContact CG-CB 4.22Å; P720-C769 PolarHBondContact O-SG 3.45Å
721A88.4Confident90.2Very high40 Ų4034.9 Ų34.933%0.33121%0.211SC..Hα-helixtrans-62.6-33.2-178.400000112.6L681 E719 M725L681-A721 HydrophobicContact CD1-CB 3.98Å; L681-A721 HydrophobicContact CD2-CB 4.46Å; E719-A721 VanDerWaalsContact C-N 3.33Å; E719-A721 PolarHBondContact O-N 3.32Å; A721-M725 PolarHBondContact O-N 2.92Å
722V89.7Confident90.1Very high0 Ų035 Ų350%021%0.211CC..Hα-helixtrans-69.1-47.5175.7179.60000110.1M672 Y677 L681 L714 H717 E719 P720 A724 M725 V726M672-V722 HydrophobicContact CE-CB 4.35Å; M672-V722 HydrophobicContact CE-CG1 3.81Å; M672-V722 HydrophobicContact CE-CG2 3.64Å; Y677-V722 HydrophobicContact CE2-CG2 3.82Å; L681-V722 HydrophobicContact CD2-CG2 4.21Å; L714-V722 HydrophobicContact CB-CG1 3.83Å; L714-V722 HydrophobicContact CD1-CG1 4.23Å; H717-V722 HydrophobicContact CB-CB 4.03Å; H717-V722 HydrophobicContact CB-CG1 3.74Å; E719-V722 HydrophobicContact CB-CG2 4.13Å; E719-V722 PolarHBondContact O-N 3.43Å; P720-V722 PolarHBondContact O-N 2.99Å; V722-A724 VanDerWaalsContact C-N 3.3Å; V722-A724 PolarHBondContact O-N 3.4Å; V722-M725 WeakPolarHBondContact O-CB 3.35Å; V722-M725 PolarHBondContact O-N 2.96Å; V722-M725 VanDerWaalsContact O-N 3.11Å; V722-V726 WeakPolarHBondContact O-CG2 3.35Å; V722-V726 PolarHBondContact O-N 3.47Å; V722-V726 VanDerWaalsContact O-N 3.11Å
723R91.3Very high90.1Very high19 Ų1931.8 Ų31.87%0.07220%0.199CC..Hα-helixtrans-60.8-41.4176.9-60.4-162.8-59-79.1-0.2111.5H715 H717 S718 E719 P720 M725 V726 L727 D764 S765H715-R723 WeakPolarHBondContact O-CD 3.42Å; H717-R723 VanDerWaalsContact O-CD 3.3Å; H717-R723 WeakPolarHBondContact O-CD 3.36Å; H717-R723 WeakPolarHBondContact O-CG 3.45Å; H717-R723 PolarHBondContact O-NH1 3.31Å; S718-R723 PolarHBondContact O-NH1 2.81Å; E719-R723 PolarHBondContact O-N 2.92Å; P720-R723 PolarHBondContact O-N 3.45Å; R723-M725 VanDerWaalsContact C-N 3.33Å; R723-M725 PolarHBondContact O-N 3.44Å; R723-V726 PolarHBondContact O-N 2.92Å; R723-L727 WeakPolarHBondContact O-CG 3.45Å; R723-L727 PolarHBondContact O-N 2.88Å; R723-L727 VanDerWaalsContact O-N 3.12Å; R723-D764 IonicContact CZ-OD1 2.96Å; R723-D764 IonicContact CZ-OD2 3.28Å; R723-D764 IonicContact NE-OD1 3.6Å; R723-D764 IonicContact NE-OD2 2.75Å; R723-D764 PolarHBondContact NE-OD2 2.92Å; R723-D764 IonicContact NH2-OD1 2.94Å; R723-D764 PolarHBondContact NH2-OD1 2.95Å; R723-D764 IonicContact NH2-OD2 3.72Å; R723-D764 PolarHBondContact NH2-OD2 3.46Å; R723-S765 PolarHBondContact NH2-OG 2.88Å
724A89.8Confident90Very high16 Ų1627.6 Ų27.613%0.13217%0.172CC..Hα-helixtrans-59.3-42.317400000111.6P720 V722 V726 L727 S728 L772P720-A724 WeakPolarHBondContact O-CB 3.45Å; P720-A724 PolarHBondContact O-N 3.23Å; V722-A724 VanDerWaalsContact C-N 3.3Å; V722-A724 PolarHBondContact O-N 3.4Å; A724-V726 PolarHBondContact O-N 3.3Å; A724-L727 PolarHBondContact O-N 3Å; A724-S728 WeakPolarHBondContact O-CB 3.17Å; A724-S728 PolarHBondContact O-N 3.15Å; A724-S728 PolarHBondContact O-OG 3.41Å; A724-L772 HydrophobicContact CB-CD1 3.83Å
725M89.6Confident89.8Confident15 Ų1528.3 Ų28.37%0.07418%0.175CC..Hα-helixtrans-60.9-44.3175.9-172.7-160.9-62.400112.3W667 F680 L681 L711 A721 V722 R723 L727 S728 A729W667-M725 HydrophobicContact CZ2-SD 4.05Å; F680-M725 HydrophobicContact CD1-CE 4.28Å; F680-M725 HydrophobicContact CE1-CE 4.22Å; F680-M725 HydrophobicContact CE1-SD 4.47Å; L681-M725 VanDerWaalsContact CA-CE 3.46Å; L681-M725 HydrophobicContact CB-CE 4.21Å; L681-M725 HydrophobicContact CD2-CE 3.41Å; L681-M725 VanDerWaalsContact CD2-CE 3.41Å; L681-M725 HydrophobicContact CG-CE 4.37Å; L711-M725 HydrophobicContact CD1-CG 4.48Å; L711-M725 HydrophobicContact CD1-SD 4.42Å; L711-M725 HydrophobicContact CD2-CG 4.47Å; L711-M725 HydrophobicContact CD2-SD 3.7Å; A721-M725 PolarHBondContact O-N 2.92Å; V722-M725 WeakPolarHBondContact O-CB 3.35Å; V722-M725 PolarHBondContact O-N 2.96Å; V722-M725 VanDerWaalsContact O-N 3.11Å; R723-M725 VanDerWaalsContact C-N 3.33Å; R723-M725 PolarHBondContact O-N 3.44Å; M725-L727 VanDerWaalsContact C-N 3.33Å; M725-L727 PolarHBondContact O-N 2.84Å; M725-S728 WeakPolarHBondContact O-CB 3.39Å; M725-S728 PolarHBondContact O-N 3.14Å; M725-A729 WeakPolarHBondContact O-CB 3.47Å; M725-A729 PolarHBondContact O-N 3.31Å
726V92.2Very high89.7Confident10 Ų1026.1 Ų26.16%0.06117%0.165CC..Hα-helixtrans-57.9-47.4177.5-1790000110.6L711 L714 H715 V722 R723 A724 S728 F730 W756L711-V726 HydrophobicContact CB-CG1 4.49Å; L711-V726 HydrophobicContact CB-CG2 4.21Å; L711-V726 HydrophobicContact CD2-CG2 4.31Å; L714-V726 HydrophobicContact CB-CG2 4.12Å; H715-V726 HydrophobicContact CB-CG1 4.26Å; V722-V726 WeakPolarHBondContact O-CG2 3.35Å; V722-V726 PolarHBondContact O-N 3.47Å; V722-V726 VanDerWaalsContact O-N 3.11Å; R723-V726 PolarHBondContact O-N 2.92Å; A724-V726 PolarHBondContact O-N 3.3Å; V726-S728 VanDerWaalsContact C-N 3.35Å; V726-S728 PolarHBondContact O-N 2.79Å; V726-F730 PolarHBondContact O-N 3.4Å; V726-W756 HydrophobicContact CB-CH2 4.29Å; V726-W756 HydrophobicContact CG1-CH2 4.05Å; V726-W756 HydrophobicContact CG1-CZ3 4.11Å
727L92Very high89.8Confident1 Ų123.4 Ų23.41%0.00514%0.137CC..Hα-helixtrans-63.6-40.5177.3-67.4166.4000112.1R723 A724 M725 F730 L731 W756 V757 C769 L772 A773 V776R723-L727 WeakPolarHBondContact O-CG 3.45Å; R723-L727 PolarHBondContact O-N 2.88Å; R723-L727 VanDerWaalsContact O-N 3.12Å; A724-L727 PolarHBondContact O-N 3Å; M725-L727 VanDerWaalsContact C-N 3.33Å; M725-L727 PolarHBondContact O-N 2.84Å; L727-F730 PolarHBondContact O-N 2.98Å; L727-L731 PolarHBondContact O-N 3.04Å; L727-W756 HydrophobicContact CD1-CH2 4.33Å; L727-W756 HydrophobicContact CD2-CE3 4.37Å; L727-W756 HydrophobicContact CD2-CH2 3.5Å; L727-W756 VanDerWaalsContact CD2-CH2 3.5Å; L727-W756 HydrophobicContact CD2-CZ2 4.42Å; L727-W756 HydrophobicContact CD2-CZ3 3.44Å; L727-W756 VanDerWaalsContact CD2-CZ3 3.44Å; L727-W756 HydrophobicContact CG-CH2 3.61Å; L727-W756 HydrophobicContact CG-CZ2 4.49Å; L727-W756 HydrophobicContact CG-CZ3 4.04Å; L727-V757 HydrophobicContact CD2-CG2 4.19Å; L727-C769 HydrophobicContact CD1-CB 4.32Å; L727-C769 WeakPolarHBondContact CD1-O 3.47Å; L727-L772 HydrophobicContact CB-CB 3.89Å; L727-L772 HydrophobicContact CB-CD1 4.09Å; L727-L772 HydrophobicContact CB-CG 4.47Å; L727-L772 HydrophobicContact CD1-CB 3.71Å; L727-L772 HydrophobicContact CD1-CD1 4.37Å; L727-L772 HydrophobicContact CG-CB 4.37Å; L727-A773 HydrophobicContact CD1-CB 4.33Å; L727-A773 HydrophobicContact CD2-CB 4.26Å; L727-V776 HydrophobicContact CB-CG2 4.38Å; L727-V776 HydrophobicContact CD2-CG2 4.04Å
728S89.7Confident89.6Confident9 Ų923.3 Ų23.36%0.06314%0.141CC..Hα-helixtrans-65.4-44.4-179.8-54.80000112.1L629 A724 M725 V726 F730 L731 V732L629-S728 WeakPolarHBondContact CD1-OG 3.49Å; A724-S728 WeakPolarHBondContact O-CB 3.17Å; A724-S728 PolarHBondContact O-N 3.15Å; A724-S728 PolarHBondContact O-OG 3.41Å; M725-S728 WeakPolarHBondContact O-CB 3.39Å; M725-S728 PolarHBondContact O-N 3.14Å; V726-S728 VanDerWaalsContact C-N 3.35Å; V726-S728 PolarHBondContact O-N 2.79Å; S728-F730 VanDerWaalsContact C-N 3.28Å; S728-F730 PolarHBondContact O-N 3.45Å; S728-L731 PolarHBondContact O-N 3.36Å; S728-V732 WeakPolarHBondContact O-CB 3.38Å; S728-V732 VanDerWaalsContact O-CG2 3.32Å; S728-V732 WeakPolarHBondContact O-CG2 3.35Å; S728-V732 PolarHBondContact O-N 3.37Å
729A91.6Very high89.5Confident1 Ų120.5 Ų20.51%0.00812%0.117CC..Hα-helixtrans-60.6-41.1177.400000111L707 L711 M725 V732 A733L707-A729 HydrophobicContact CD2-CB 4Å; L707-A729 HydrophobicContact CG-CB 4.28Å; L711-A729 HydrophobicContact CD1-CB 3.33Å; M725-A729 WeakPolarHBondContact O-CB 3.47Å; M725-A729 PolarHBondContact O-N 3.31Å; A729-V732 PolarHBondContact O-N 2.77Å; A729-A733 VanDerWaalsContact O-CB 3.28Å; A729-A733 WeakPolarHBondContact O-CB 3.3Å; A729-A733 PolarHBondContact O-N 3.48Å
730F91Very high89.3Confident9 Ų921.9 Ų21.94%0.03912%0.121CC..Hα-helixtrans-65-44175.3-163-85.6000112.1I708 V726 L727 S728 A733 S734 M746 I753 V776 I780I708-F730 HydrophobicContact CD1-CD2 3.83Å; I708-F730 HydrophobicContact CD1-CE2 4.29Å; I708-F730 HydrophobicContact CG1-CD2 4.37Å; I708-F730 HydrophobicContact CG2-CD2 4.08Å; V726-F730 PolarHBondContact O-N 3.4Å; L727-F730 PolarHBondContact O-N 2.98Å; S728-F730 VanDerWaalsContact C-N 3.28Å; S728-F730 PolarHBondContact O-N 3.45Å; F730-A733 PolarHBondContact O-N 3.09Å; F730-S734 WeakPolarHBondContact O-CB 3.43Å; F730-S734 PolarHBondContact O-N 2.97Å; F730-S734 PolarHBondContact O-OG 3.18Å; F730-M746 HydrophobicContact CD2-SD 4.46Å; F730-M746 HydrophobicContact CE2-CE 4.22Å; F730-M746 HydrophobicContact CE2-SD 3.76Å; F730-I753 HydrophobicContact CD2-CD1 4.03Å; F730-I753 HydrophobicContact CD2-CG2 4.2Å; F730-I753 HydrophobicContact CE2-CD1 3.56Å; F730-I753 HydrophobicContact CE2-CG2 3.99Å; F730-I753 HydrophobicContact CZ-CD1 4.49Å; F730-I753 HydrophobicContact CZ-CG2 4.26Å; F730-V776 HydrophobicContact CD1-CG1 3.58Å; F730-V776 HydrophobicContact CD1-CG2 4.42Å; F730-V776 HydrophobicContact CE1-CG1 3.96Å; F730-V776 HydrophobicContact CG-CG1 4.34Å; F730-I780 HydrophobicContact CE1-CD1 4.36Å; F730-I780 HydrophobicContact CE1-CG1 3.91Å; F730-I780 HydrophobicContact CZ-CG1 4.25Å
731L90Very high89.1Confident20 Ų2023 Ų2311%0.10513%0.127CC..Hα-helixtrans-59-50.4175.3-80.8169.9000111.8L727 S728 A733 S734 E735 L772 A775 V776 R779L727-L731 PolarHBondContact O-N 3.04Å; S728-L731 PolarHBondContact O-N 3.36Å; L731-A733 PolarHBondContact O-N 2.97Å; L731-S734 PolarHBondContact O-N 3.47Å; L731-S734 VanDerWaalsContact O-N 3.16Å; L731-S734 PolarHBondContact O-OG 3.07Å; L731-E735 WeakPolarHBondContact O-CG 3.32Å; L731-E735 PolarHBondContact O-N 3.19Å; L731-E735 VanDerWaalsContact O-N 3.1Å; L731-L772 HydrophobicContact CD1-CD2 3.34Å; L731-A775 HydrophobicContact CD1-CB 4.05Å; L731-A775 HydrophobicContact CD2-CB 3.86Å; L731-V776 HydrophobicContact CD1-CG2 4.17Å; L731-V776 HydrophobicContact CD2-CG2 3.96Å; L731-V776 HydrophobicContact CG-CG2 3.6Å; L731-R779 HydrophobicContact CD2-CG 4.1Å
732V89.8Confident89.1Confident2 Ų221.2 Ų21.21%0.01211%0.112CC..Hα-helixtrans-57.4-51.1178.8168.30000110L632 L636 C688 L691 V692 S728 A729 S734 E735 V736L632-V732 HydrophobicContact CD2-CG2 4.45Å; L636-V732 HydrophobicContact CD1-CG2 4.16Å; C688-V732 HydrophobicContact CB-CG1 4.44Å; C688-V732 HydrophobicContact CB-CG2 4.31Å; L691-V732 HydrophobicContact CB-CG1 3.96Å; L691-V732 HydrophobicContact CD1-CG1 4.34Å; V692-V732 HydrophobicContact CG2-CG1 3.68Å; V692-V732 HydrophobicContact CG2-CG2 4.48Å; S728-V732 WeakPolarHBondContact O-CB 3.38Å; S728-V732 VanDerWaalsContact O-CG2 3.32Å; S728-V732 WeakPolarHBondContact O-CG2 3.35Å; S728-V732 PolarHBondContact O-N 3.37Å; A729-V732 PolarHBondContact O-N 2.77Å; V732-S734 VanDerWaalsContact C-N 3.29Å; V732-S734 PolarHBondContact O-N 2.97Å; V732-E735 WeakPolarHBondContact O-CB 3.36Å; V732-E735 PolarHBondContact O-N 3.11Å; V732-V736 HydrophobicContact CG1-CG2 4.37Å; V732-V736 WeakPolarHBondContact O-CG2 3.35Å; V732-V736 PolarHBondContact O-N 3.42Å
733A90.5Very high88.8Confident0 Ų021.5 Ų21.50%012%0.115CC..Hα-helixtrans-56.5-41.617700000112.8A704 I708 A729 F730 L731 E735 V736 V737A704-A733 HydrophobicContact CB-CB 3.82Å; I708-A733 HydrophobicContact CD1-CB 3.54Å; I708-A733 HydrophobicContact CG1-CB 4.35Å; A729-A733 VanDerWaalsContact O-CB 3.28Å; A729-A733 WeakPolarHBondContact O-CB 3.3Å; A729-A733 PolarHBondContact O-N 3.48Å; F730-A733 PolarHBondContact O-N 3.09Å; L731-A733 PolarHBondContact O-N 2.97Å; A733-E735 PolarHBondContact O-N 3.45Å; A733-V736 PolarHBondContact O-N 3.31Å; A733-V737 VanDerWaalsContact O-CB 3.29Å; A733-V737 WeakPolarHBondContact O-CB 3.23Å; A733-V737 WeakPolarHBondContact O-CG2 3.32Å; A733-V737 PolarHBondContact O-N 2.83Å
734S88.2Confident88.5Confident9 Ų923.6 Ų23.66%0.06313%0.13CC..Hα-helixtrans-67.5-19.517876.90000114.4F730 L731 V732F730-S734 WeakPolarHBondContact O-CB 3.43Å; F730-S734 PolarHBondContact O-N 2.97Å; F730-S734 PolarHBondContact O-OG 3.18Å; L731-S734 PolarHBondContact O-N 3.47Å; L731-S734 VanDerWaalsContact O-N 3.16Å; L731-S734 PolarHBondContact O-OG 3.07Å; V732-S734 VanDerWaalsContact C-N 3.29Å; V732-S734 PolarHBondContact O-N 2.97Å
735E86Confident88.2Confident53 Ų5326.9 Ų26.925%0.24814%0.142CC..Hα-helixtrans-88.9-42.7175.8-71.7-75.6162.800112.5L636 R640 L731 V732 A733 R779L636-E735 HydrophobicContact CD1-CG 4.25Å; L636-E735 HydrophobicContact CD2-CB 3.68Å; L636-E735 HydrophobicContact CD2-CG 4.03Å; R640-E735 IonicContact CZ-OE2 3.73Å; R640-E735 IonicContact NE-OE2 3.23Å; R640-E735 IonicContact NH2-OE1 3.75Å; R640-E735 PolarHBondContact NH2-OE1 2.96Å; R640-E735 IonicContact NH2-OE2 2.67Å; R640-E735 PolarHBondContact NH2-OE2 3.01Å; L731-E735 WeakPolarHBondContact O-CG 3.32Å; L731-E735 PolarHBondContact O-N 3.19Å; L731-E735 VanDerWaalsContact O-N 3.1Å; V732-E735 WeakPolarHBondContact O-CB 3.36Å; V732-E735 PolarHBondContact O-N 3.11Å; A733-E735 PolarHBondContact O-N 3.45Å; E735-R779 IonicContact OE1-CZ 3.65Å; E735-R779 IonicContact OE1-NE 3.32Å; E735-R779 PolarHBondContact OE1-NE 3.18Å; E735-R779 IonicContact OE1-NH2 2.92Å; E735-R779 PolarHBondContact OE1-NH2 3.29Å; E735-R779 IonicContact OE2-NH2 3.86Å
736V88.2Confident87.9Confident8 Ų826.2 Ų26.25%0.04814%0.139CC..Hα-helixtrans-86-32.6-176.6-81.90000114.4L691 V700 V732 A733L691-V736 HydrophobicContact CB-CG2 4.22Å; V700-V736 HydrophobicContact CG2-CB 3.97Å; V700-V736 HydrophobicContact CG2-CG2 3.79Å; V732-V736 HydrophobicContact CG1-CG2 4.37Å; V732-V736 WeakPolarHBondContact O-CG2 3.35Å; V732-V736 PolarHBondContact O-N 3.42Å; A733-V736 PolarHBondContact O-N 3.31Å
737V89.4Confident87.4Confident3 Ų328.4 Ų28.42%0.01815%0.148CC..SBendtrans-84.9130.9179.7-174.40000109.1V700 T701 A704 A733 E739 V741 L742V700-V737 HydrophobicContact CG1-CG2 4.25Å; V700-V737 HydrophobicContact CG2-CG2 4.43Å; T701-V737 HydrophobicContact CG2-CG1 4.23Å; A704-V737 HydrophobicContact CB-CG2 3.64Å; A733-V737 VanDerWaalsContact O-CB 3.29Å; A733-V737 WeakPolarHBondContact O-CB 3.23Å; A733-V737 WeakPolarHBondContact O-CG2 3.32Å; A733-V737 PolarHBondContact O-N 2.83Å; V737-E739 PolarHBondContact O-N 3.22Å; V737-V741 HydrophobicContact CG1-CB 4.23Å; V737-V741 HydrophobicContact CG1-CG1 4.35Å; V737-L742 HydrophobicContact CB-CB 4.11Å; V737-L742 HydrophobicContact CB-CD1 4.27Å; V737-L742 HydrophobicContact CG1-CB 3.77Å; V737-L742 HydrophobicContact CG1-CD1 4.26Å; V737-L742 HydrophobicContact CG2-CD1 4.42Å
738P87.6Confident87Confident51 Ų5137.7 Ų37.733%0.33118%0.183SC..  trans-53.6128.3174.1-2634.2000111.4K740 V741 L742P738-K740 PolarHBondContact O-N 3.36Å; P738-V741 HydrophobicContact CB-CB 4.49Å; P738-V741 HydrophobicContact CB-CG2 4.13Å; P738-V741 WeakPolarHBondContact O-CA 3.4Å; P738-V741 WeakPolarHBondContact O-CB 3.25Å; P738-V741 PolarHBondContact O-N 3.02Å; P738-L742 PolarHBondContact O-N 2.84Å
739E86.9Confident86.7Confident42 Ų4239.5 Ų39.520%0.19619%0.192CC..Hα-helixtrans-51.5-38.1-170.9-68.4169.9-148.100114.1V737 A743 I782 L783 R786V737-E739 PolarHBondContact O-N 3.22Å; E739-A743 VanDerWaalsContact O-CB 3.28Å; E739-A743 WeakPolarHBondContact O-CB 3.34Å; E739-A743 PolarHBondContact O-N 3.08Å; E739-I782 WeakPolarHBondContact OE2-CG2 3.44Å; E739-L783 HydrophobicContact CB-CD2 3.84Å; E739-L783 HydrophobicContact CG-CD2 4.19Å; E739-L783 VanDerWaalsContact O-CD2 3.29Å; E739-L783 WeakPolarHBondContact O-CD2 3.38Å; E739-R786 IonicContact OE1-CZ 3.64Å; E739-R786 IonicContact OE1-NH1 2.6Å; E739-R786 PolarHBondContact OE1-NH1 3.24Å; E739-R786 WeakPolarHBondContact OE2-CD 3.48Å; E739-R786 WeakPolarHBondContact OE2-CG 3.43Å; E739-R786 IonicContact OE2-CZ 3.65Å; E739-R786 IonicContact OE2-NE 2.77Å; E739-R786 PolarHBondContact OE2-NE 2.74Å; E739-R786 VanDerWaalsContact OE2-NE 3.11Å; E739-R786 IonicContact OE2-NH1 3.92Å; E739-R786 PolarHBondContact OE2-NH1 3.27Å
740K82.9Confident86.4Confident115 Ų11540.2 Ų40.250%0.520%0.196SC..Hα-helixtrans-63.8-43.3176.8-70.3-176.3179.2-179.10111.8P738 T744 L790P738-K740 PolarHBondContact O-N 3.36Å; K740-T744 PolarHBondContact O-N 3.28Å; K740-T744 PolarHBondContact O-OG1 2.86Å; K740-L790 HydrophobicContact CB-CD2 4.47Å; K740-L790 HydrophobicContact CD-CD2 4.15Å; K740-L790 HydrophobicContact CG-CD2 4.31Å
741V87Confident86.2Confident60 Ų6043.3 Ų43.336%0.36422%0.217SC..Hα-helixtrans-69.4-46.3-178.7-177.30000109.5T701 V737 P738 A743 T744 E745T701-V741 HydrophobicContact CG2-CG1 3.51Å; V737-V741 HydrophobicContact CG1-CB 4.23Å; V737-V741 HydrophobicContact CG1-CG1 4.35Å; P738-V741 HydrophobicContact CB-CB 4.49Å; P738-V741 HydrophobicContact CB-CG2 4.13Å; P738-V741 WeakPolarHBondContact O-CA 3.4Å; P738-V741 WeakPolarHBondContact O-CB 3.25Å; P738-V741 PolarHBondContact O-N 3.02Å; V741-A743 PolarHBondContact O-N 3.33Å; V741-T744 PolarHBondContact O-N 3.39Å; V741-T744 VanDerWaalsContact O-N 3.11Å; V741-E745 PolarHBondContact O-N 2.85Å
742L86.8Confident86.2Confident3 Ų346.9 Ų46.92%0.01624%0.236CC..Hα-helixtrans-61.8-43.3179.1-170.464.8000112.4V737 P738 T744 E745 M746 L783V737-L742 HydrophobicContact CB-CB 4.11Å; V737-L742 HydrophobicContact CB-CD1 4.27Å; V737-L742 HydrophobicContact CG1-CB 3.77Å; V737-L742 HydrophobicContact CG1-CD1 4.26Å; V737-L742 HydrophobicContact CG2-CD1 4.42Å; P738-L742 PolarHBondContact O-N 2.84Å; L742-T744 PolarHBondContact O-N 3.03Å; L742-E745 PolarHBondContact O-N 3.37Å; L742-M746 HydrophobicContact CD1-CG 3.88Å; L742-M746 HydrophobicContact CD1-SD 3.93Å; L742-M746 HydrophobicContact CG-CG 4.41Å; L742-M746 WeakPolarHBondContact O-CB 3.43Å; L742-M746 PolarHBondContact O-N 2.84Å; L742-L783 HydrophobicContact CB-CD2 4.32Å; L742-L783 HydrophobicContact CD2-CD1 4.18Å; L742-L783 HydrophobicContact CD2-CD2 4.35Å
743A84.8Confident86.3Confident6 Ų647 Ų475%0.0524%0.237CC..Hα-helixtrans-62.1-32.1176.700000112.7E739 V741 H747 L783 A787E739-A743 VanDerWaalsContact O-CB 3.28Å; E739-A743 WeakPolarHBondContact O-CB 3.34Å; E739-A743 PolarHBondContact O-N 3.08Å; V741-A743 PolarHBondContact O-N 3.33Å; A743-H747 PolarHBondContact O-N 3.42Å; A743-L783 HydrophobicContact CB-CD2 4.31Å; A743-A787 HydrophobicContact CB-CB 4.2Å
744T84.6Confident86.3Confident63 Ų6349.1 Ų49.139%0.38725%0.247SC..Hα-helixtrans-75.8-46.4178.6-44.20000110.7K740 V741 L742 M746 H747K740-T744 PolarHBondContact O-N 3.28Å; K740-T744 PolarHBondContact O-OG1 2.86Å; V741-T744 PolarHBondContact O-N 3.39Å; V741-T744 VanDerWaalsContact O-N 3.11Å; L742-T744 PolarHBondContact O-N 3.03Å; T744-M746 PolarHBondContact O-N 3.23Å; T744-H747 PolarHBondContact O-ND1 3.49Å
745E84.1Confident86.5Confident85 Ų8556.4 Ų56.440%0.39728%0.277SS..Hα-helixtrans-65.9-35.7179.3-79.9-61.3148.800113.7T701 R709 V741 L742T701-E745 HydrophobicContact CG2-CG 3.68Å; R709-E745 PolarHBondContact NH2-O 3.44Å; R709-E745 VanDerWaalsContact NH2-O 3.12Å; R709-E745 IonicContact NH2-OE2 2.79Å; V741-E745 PolarHBondContact O-N 2.85Å; L742-E745 PolarHBondContact O-N 3.37Å
746M82Confident86.9Confident1 Ų155.4 Ų55.41%0.00527%0.271CS..THydrogen-bonded Turntrans-101.414.4-175.8-62.3-148.576.400113.9I708 F730 L742 T744 R748 D749 L750 I753I708-M746 HydrophobicContact CB-CE 4.08Å; I708-M746 HydrophobicContact CD1-CE 4.16Å; I708-M746 HydrophobicContact CD1-SD 3.53Å; I708-M746 VanDerWaalsContact CD1-SD 3.53Å; I708-M746 HydrophobicContact CG2-CE 3.42Å; I708-M746 VanDerWaalsContact CG2-CE 3.42Å; I708-M746 HydrophobicContact CG2-SD 4.24Å; F730-M746 HydrophobicContact CD2-SD 4.46Å; F730-M746 HydrophobicContact CE2-CE 4.22Å; F730-M746 HydrophobicContact CE2-SD 3.76Å; L742-M746 HydrophobicContact CD1-CG 3.88Å; L742-M746 HydrophobicContact CD1-SD 3.93Å; L742-M746 HydrophobicContact CG-CG 4.41Å; L742-M746 WeakPolarHBondContact O-CB 3.43Å; L742-M746 PolarHBondContact O-N 2.84Å; T744-M746 PolarHBondContact O-N 3.23Å; M746-R748 PolarHBondContact O-N 2.75Å; M746-R748 VanDerWaalsContact O-N 3.11Å; M746-D749 HydrophobicContact CE-CB 3.89Å; M746-D749 PolarHBondContact O-N 3.45Å; M746-L750 HydrophobicContact CB-CD1 3.94Å; M746-L750 HydrophobicContact CB-CG 4.48Å; M746-L750 WeakPolarHBondContact O-CB 3.39Å; M746-L750 PolarHBondContact O-N 3.4Å; M746-I753 HydrophobicContact CE-CD1 3.73Å
747H82.3Confident87.1Confident56 Ų5655.1 Ų55.126%0.25927%0.269SS..THydrogen-bonded Turntrans-56.6-33.9-172.270.2-81.6000114.4A743 T744 L798A743-H747 PolarHBondContact O-N 3.42Å; T744-H747 PolarHBondContact O-ND1 3.49Å; H747-L798 HydrophobicContact CB-CD2 3.35Å; H747-L798 HydrophobicContact CB-CG 4.42Å
748R83.2Confident87.2Confident195 Ų19557.5 Ų57.574%0.73628%0.282SS*.THydrogen-bonded Turntrans-76.7-34.4178.6-58.2-168.9177.6-174.4-3.8112.8M746 P751M746-R748 PolarHBondContact O-N 2.75Å; M746-R748 VanDerWaalsContact O-N 3.11Å; R748-P751 WeakPolarHBondContact O-CD 3.13Å
749D84.3Confident87.5Confident48 Ų4859.8 Ų59.826%0.25729%0.291SS..THydrogen-bonded Turntrans-88.2-29.2-172.2-50.9-45.8000111.8R709 M746 P751 D752 I753R709-D749 IonicContact NE-OD2 3.67Å; M746-D749 HydrophobicContact CE-CB 3.89Å; M746-D749 PolarHBondContact O-N 3.45Å; D749-P751 VanDerWaalsContact C-CD 3.43Å; D749-D752 PolarHBondContact O-N 3.21Å; D749-I753 HydrophobicContact CB-CD1 3.99Å; D749-I753 VanDerWaalsContact O-CG1 3.32Å; D749-I753 WeakPolarHBondContact O-CG1 3.14Å; D749-I753 PolarHBondContact O-N 3.03Å
750L85.3Confident87.7Confident15 Ų1558 Ų588%0.07928%0.283CS..Hα-helixtrans-52.7-41.6-176.4-111.2142.8000115.4M746 Q754 I780M746-L750 HydrophobicContact CB-CD1 3.94Å; M746-L750 HydrophobicContact CB-CG 4.48Å; M746-L750 WeakPolarHBondContact O-CB 3.39Å; M746-L750 PolarHBondContact O-N 3.4Å; L750-Q754 VanDerWaalsContact O-CB 3.31Å; L750-Q754 WeakPolarHBondContact O-CB 3.31Å; L750-Q754 PolarHBondContact O-N 2.63Å; L750-I780 HydrophobicContact CD2-CG1 4.26Å; L750-I780 HydrophobicContact CD2-CG2 3.88Å
751P87Confident88Confident74 Ų7453.9 Ų53.948%0.48127%0.268SS..Hα-helixtrans-62.8-43.1178-2233.6000113R748 D749 Q754 K755R748-P751 WeakPolarHBondContact O-CD 3.13Å; D749-P751 VanDerWaalsContact C-CD 3.43Å; P751-Q754 PolarHBondContact O-N 3.14Å; P751-K755 PolarHBondContact O-N 3.3Å
752D90Very high88.2Confident95 Ų9557.6 Ų57.651%0.50829%0.285SS..Hα-helixtrans-72-42.3-178.6-69.2-31.2000111W712 D749 Q754 K755 W756W712-D752 HydrophobicContact CH2-CB 4.32Å; W712-D752 HydrophobicContact CZ2-CB 3.85Å; D749-D752 PolarHBondContact O-N 3.21Å; D752-Q754 VanDerWaalsContact C-N 3.31Å; D752-Q754 PolarHBondContact O-N 3.03Å; D752-K755 PolarHBondContact O-N 3.44Å; D752-W756 PolarHBondContact O-N 3.07Å
753I90.1Very high88.4Confident5 Ų561.8 Ų61.83%0.02631%0.31CS..Hα-helixtrans-58.3-46.3173.2-64.1169.8000109.9I708 W712 F730 M746 D749 K755 W756 V757 I780I708-I753 HydrophobicContact CG2-CD1 4.36Å; W712-I753 HydrophobicContact CE3-CG1 3.82Å; W712-I753 HydrophobicContact CH2-CB 4.38Å; W712-I753 HydrophobicContact CH2-CG1 3.89Å; W712-I753 HydrophobicContact CZ3-CB 4.14Å; W712-I753 HydrophobicContact CZ3-CG1 3.48Å; W712-I753 VanDerWaalsContact CZ3-CG1 3.48Å; F730-I753 HydrophobicContact CD2-CD1 4.03Å; F730-I753 HydrophobicContact CD2-CG2 4.2Å; F730-I753 HydrophobicContact CE2-CD1 3.56Å; F730-I753 HydrophobicContact CE2-CG2 3.99Å; F730-I753 HydrophobicContact CZ-CD1 4.49Å; F730-I753 HydrophobicContact CZ-CG2 4.26Å; M746-I753 HydrophobicContact CE-CD1 3.73Å; D749-I753 HydrophobicContact CB-CD1 3.99Å; D749-I753 VanDerWaalsContact O-CG1 3.32Å; D749-I753 WeakPolarHBondContact O-CG1 3.14Å; D749-I753 PolarHBondContact O-N 3.03Å; I753-K755 PolarHBondContact O-N 3.48Å; I753-W756 PolarHBondContact O-N 3.1Å; I753-V757 HydrophobicContact CG2-CG2 4.07Å; I753-V757 WeakPolarHBondContact O-CB 3.35Å; I753-V757 WeakPolarHBondContact O-CG2 3.49Å; I753-V757 PolarHBondContact O-N 3.34Å; I753-I780 HydrophobicContact CG2-CD1 4.04Å
754Q90.9Very high88.8Confident45 Ų4562.1 Ų62.121%0.2131%0.312CS..Hα-helixtrans-61.3-45.7178.7-177.3170-4.600111.8L750 P751 D752 W756 V757 D758 I780L750-Q754 VanDerWaalsContact O-CB 3.31Å; L750-Q754 WeakPolarHBondContact O-CB 3.31Å; L750-Q754 PolarHBondContact O-N 2.63Å; P751-Q754 PolarHBondContact O-N 3.14Å; D752-Q754 VanDerWaalsContact C-N 3.31Å; D752-Q754 PolarHBondContact O-N 3.03Å; Q754-W756 VanDerWaalsContact C-N 3.28Å; Q754-W756 PolarHBondContact O-N 2.86Å; Q754-V757 PolarHBondContact O-N 3.37Å; Q754-D758 WeakPolarHBondContact CG-OD2 3.46Å; Q754-D758 WeakPolarHBondContact O-CB 3.45Å; Q754-D758 VanDerWaalsContact O-CG 3.23Å; Q754-D758 PolarHBondContact O-N 3.3Å; Q754-I780 HydrophobicContact CB-CD1 4.16Å; Q754-I780 HydrophobicContact CB-CG2 4.15Å; Q754-I780 HydrophobicContact CG-CG2 4.12Å
755K92.3Very high89Confident161 Ų16163.9 Ų63.970%0.733%0.326SS*.Hα-helixtrans-59.3-42179.6-173-178.3178.9-175.70111.7P751 D752 I753 L759P751-K755 PolarHBondContact O-N 3.3Å; D752-K755 PolarHBondContact O-N 3.44Å; I753-K755 PolarHBondContact O-N 3.48Å; K755-L759 PolarHBondContact O-N 3.14Å
756W94.3Very high89.3Confident33 Ų3362.2 Ų62.213%0.12532%0.32CS..Hα-helixtrans-67.8-45.5175.7171.163.3000112.2W712 H715 V726 L727 D752 I753 Q754 D758 L759 A760W712-W756 HydrophobicContact CH2-CB 4.14Å; W712-W756 HydrophobicContact CZ3-CE3 4.03Å; H715-W756 HydrophobicContact CB-CD2 3.96Å; H715-W756 HydrophobicContact CB-CE3 4.16Å; H715-W756 HydrophobicContact CB-CH2 3.9Å; H715-W756 HydrophobicContact CB-CZ2 3.75Å; H715-W756 HydrophobicContact CB-CZ3 4.13Å; H715-W756 AromaticContact CD2-CD1 3.49Å; H715-W756 VanDerWaalsContact CD2-CD1 3.49Å; H715-W756 AromaticContact CD2-CD2 3.95Å; H715-W756 AromaticContact CD2-CE2 3.9Å; H715-W756 AromaticContact CD2-CG 3.69Å; H715-W756 AromaticContact CD2-NE1 3.61Å; H715-W756 WeakPolarHBondContact O-CZ2 3.44Å; H715-W756 PolarHBondContact O-NE1 3.21Å; V726-W756 HydrophobicContact CB-CH2 4.29Å; V726-W756 HydrophobicContact CG1-CH2 4.05Å; V726-W756 HydrophobicContact CG1-CZ3 4.11Å; L727-W756 HydrophobicContact CD1-CH2 4.33Å; L727-W756 HydrophobicContact CD2-CE3 4.37Å; L727-W756 HydrophobicContact CD2-CH2 3.5Å; L727-W756 VanDerWaalsContact CD2-CH2 3.5Å; L727-W756 HydrophobicContact CD2-CZ2 4.42Å; L727-W756 HydrophobicContact CD2-CZ3 3.44Å; L727-W756 VanDerWaalsContact CD2-CZ3 3.44Å; L727-W756 HydrophobicContact CG-CH2 3.61Å; L727-W756 HydrophobicContact CG-CZ2 4.49Å; L727-W756 HydrophobicContact CG-CZ3 4.04Å; D752-W756 PolarHBondContact O-N 3.07Å; I753-W756 PolarHBondContact O-N 3.1Å; Q754-W756 VanDerWaalsContact C-N 3.28Å; Q754-W756 PolarHBondContact O-N 2.86Å; W756-D758 PolarHBondContact O-N 3.12Å; W756-L759 WeakPolarHBondContact O-CB 3.31Å; W756-L759 PolarHBondContact O-N 3.24Å; W756-A760 WeakPolarHBondContact O-CB 3.42Å; W756-A760 PolarHBondContact O-N 2.97Å
757V92.6Very high89.5Confident1 Ų163.5 Ų63.51%0.00633%0.333CS..Hα-helixtrans-61.9-42.3-179.7168.30000111.7L727 I753 Q754 L759 A760 C761 A773 V776 Q777 I780L727-V757 HydrophobicContact CD2-CG2 4.19Å; I753-V757 HydrophobicContact CG2-CG2 4.07Å; I753-V757 WeakPolarHBondContact O-CB 3.35Å; I753-V757 WeakPolarHBondContact O-CG2 3.49Å; I753-V757 PolarHBondContact O-N 3.34Å; Q754-V757 PolarHBondContact O-N 3.37Å; V757-L759 VanDerWaalsContact C-N 3.29Å; V757-L759 PolarHBondContact O-N 3.06Å; V757-A760 PolarHBondContact O-N 3.14Å; V757-C761 PolarHBondContact O-N 3.25Å; V757-C761 PolarHBondContact O-SG 3.1Å; V757-A773 HydrophobicContact CG1-CB 4.26Å; V757-A773 WeakPolarHBondContact CG1-O 3.35Å; V757-V776 HydrophobicContact CB-CG1 4.42Å; V757-V776 HydrophobicContact CG1-CB 4.04Å; V757-V776 HydrophobicContact CG1-CG1 4.02Å; V757-V776 HydrophobicContact CG2-CB 4.22Å; V757-V776 HydrophobicContact CG2-CG1 3.6Å; V757-Q777 HydrophobicContact CG1-CB 3.86Å; V757-I780 HydrophobicContact CG2-CD1 4.42Å
758D93.1Very high89.6Confident54 Ų5463.4 Ų63.429%0.28934%0.339SS..Hα-helixtrans-61.7-38.9177.1-71.5-20.1000111.2Q754 W756 Q777Q754-D758 WeakPolarHBondContact CG-OD2 3.46Å; Q754-D758 WeakPolarHBondContact O-CB 3.45Å; Q754-D758 VanDerWaalsContact O-CG 3.23Å; Q754-D758 PolarHBondContact O-N 3.3Å; W756-D758 PolarHBondContact O-N 3.12Å; D758-Q777 WeakPolarHBondContact OD1-CG 3.49Å; D758-Q777 PolarHBondContact OD1-NE2 3.39Å
759L92.8Very high89.9Confident99 Ų9954.1 Ų54.152%0.51830%0.304SS..Hα-helixtrans-69.3-49.2174.7-177.263.9000111.3K755 W756 V757 C761 I762 T763K755-L759 PolarHBondContact O-N 3.14Å; W756-L759 WeakPolarHBondContact O-CB 3.31Å; W756-L759 PolarHBondContact O-N 3.24Å; V757-L759 VanDerWaalsContact C-N 3.29Å; V757-L759 PolarHBondContact O-N 3.06Å; L759-C761 VanDerWaalsContact C-N 3.26Å; L759-C761 PolarHBondContact O-N 3.47Å; L759-I762 PolarHBondContact O-N 2.92Å; L759-T763 HydrophobicContact CD1-CG2 3.72Å; L759-T763 HydrophobicContact CG-CG2 4.48Å; L759-T763 WeakPolarHBondContact CG-OG1 3.49Å; L759-T763 PolarHBondContact O-N 3.39Å; L759-T763 PolarHBondContact O-OG1 3.16Å
760A90.7Very high90.2Very high4 Ų456.2 Ų56.23%0.03331%0.308CS..Hα-helixtrans-59.4-34.5-178.200000112.6W756 V757 I762 D764 A773W756-A760 WeakPolarHBondContact O-CB 3.42Å; W756-A760 PolarHBondContact O-N 2.97Å; V757-A760 PolarHBondContact O-N 3.14Å; A760-I762 PolarHBondContact O-N 2.93Å; A760-I762 VanDerWaalsContact O-N 3.14Å; A760-D764 VanDerWaalsContact O-CB 3.25Å; A760-D764 WeakPolarHBondContact O-CB 3.44Å; A760-D764 PolarHBondContact O-N 3.5Å; A760-A773 HydrophobicContact CB-CB 3.97Å
761C90.5Very high90.3Very high28 Ų2861.3 Ų61.319%0.18934%0.335CS..Hα-helixtrans-54.8-31.8174.1-74.20000113.2V757 L759 A773 S774V757-C761 PolarHBondContact O-N 3.25Å; V757-C761 PolarHBondContact O-SG 3.1Å; L759-C761 VanDerWaalsContact C-N 3.26Å; L759-C761 PolarHBondContact O-N 3.47Å; C761-A773 VanDerWaalsContact SG-CB 3.59Å; C761-S774 PolarHBondContact SG-N 2.7Å; C761-S774 VanDerWaalsContact SG-N 3.37Å
762I91.2Very high90.4Very high138 Ų13858 Ų5871%0.70831%0.313SS*.Hα-helixtrans-103.4-42.8-172.2-53.6171.6000110.6L759 A760L759-I762 PolarHBondContact O-N 2.92Å; A760-I762 PolarHBondContact O-N 2.93Å; A760-I762 VanDerWaalsContact O-N 3.14Å
763T90.7Very high90.5Very high91 Ų9153.4 Ų53.456%0.55829%0.289SS*.Hα-helixtrans-108.6-9.8-164.264.60000115L759 S765L759-T763 HydrophobicContact CD1-CG2 3.72Å; L759-T763 HydrophobicContact CG-CG2 4.48Å; L759-T763 WeakPolarHBondContact CG-OG1 3.49Å; L759-T763 PolarHBondContact O-N 3.39Å; L759-T763 PolarHBondContact O-OG1 3.16Å; T763-S765 PolarHBondContact O-N 3.26Å
764D92.1Very high90.6Very high14 Ų1455.5 Ų55.58%0.07530%0.304CS..  trans-63.3138.3179.7-160.4-61.6000110.1R723 A760 D766 C769 R770R723-D764 IonicContact CZ-OD1 2.96Å; R723-D764 IonicContact CZ-OD2 3.28Å; R723-D764 IonicContact NE-OD1 3.6Å; R723-D764 IonicContact NE-OD2 2.75Å; R723-D764 PolarHBondContact NE-OD2 2.92Å; R723-D764 IonicContact NH2-OD1 2.94Å; R723-D764 PolarHBondContact NH2-OD1 2.95Å; R723-D764 IonicContact NH2-OD2 3.72Å; R723-D764 PolarHBondContact NH2-OD2 3.46Å; A760-D764 VanDerWaalsContact O-CB 3.25Å; A760-D764 WeakPolarHBondContact O-CB 3.44Å; A760-D764 PolarHBondContact O-N 3.5Å; D764-D766 VanDerWaalsContact C-N 3.3Å; D764-D766 PolarHBondContact O-N 3.37Å; D764-D766 PolarHBondContact OD1-N 3.42Å; D764-C769 HydrophobicContact CB-CB 4.24Å; D764-C769 VanDerWaalsContact CG-CB 3.48Å; D764-R770 HydrophobicContact CB-CG 3.94Å; D764-R770 PolarHBondContact O-NH1 3.27Å
765S89.7Confident90.5Very high99 Ų9954.9 Ų54.969%0.69231%0.306SS*.SBendtrans-68-32.4-179.2530000112R723 T763 R770R723-S765 PolarHBondContact NH2-OG 2.88Å; T763-S765 PolarHBondContact O-N 3.26Å; S765-R770 PolarHBondContact O-NH1 3.14Å
766D89.6Confident90.4Very high51 Ų5147.2 Ų47.227%0.27327%0.273SS..SBendtrans-91.2135.3-175.1177.7-106.9000112.7P720 D764 C768 C769 R770P720-D766 HydrophobicContact CB-CB 3.78Å; P720-D766 HydrophobicContact CG-CB 4.22Å; D764-D766 VanDerWaalsContact C-N 3.3Å; D764-D766 PolarHBondContact O-N 3.37Å; D764-D766 PolarHBondContact OD1-N 3.42Å; D766-C768 WeakPolarHBondContact OD1-CA 2.95Å; D766-C768 WeakPolarHBondContact OD1-CB 3.09Å; D766-C768 PolarHBondContact OD1-N 3.33Å; D766-C769 HydrophobicContact CB-CB 4.13Å; D766-C769 PolarHBondContact OD1-N 3.27Å; D766-C769 PolarHBondContact OD1-SG 2.95Å; D766-C769 VanDerWaalsContact OD1-SG 3.32Å; D766-R770 WeakPolarHBondContact O-CG 3.48Å; D766-R770 PolarHBondContact O-N 2.88Å
767G85.9Confident90.3Very high27 Ų2749.2 Ų49.228%0.27828%0.284SS..Hα-helixtrans-68.3-34.3-178.800000113.5R770 N771G767-R770 PolarHBondContact O-N 3.44Å; G767-N771 PolarHBondContact O-N 3.02Å; G767-N771 VanDerWaalsContact O-N 3.16Å; G767-N771 PolarHBondContact O-ND2 3.08Å
768C85.9Confident90.2Very high55 Ų5555.7 Ų55.737%0.37231%0.314SS..Hα-helixtrans-69.5-43.2179.1-162.80000110.7D766 R770 N771 L772D766-C768 WeakPolarHBondContact OD1-CA 2.95Å; D766-C768 WeakPolarHBondContact OD1-CB 3.09Å; D766-C768 PolarHBondContact OD1-N 3.33Å; C768-R770 VanDerWaalsContact C-N 3.34Å; C768-R770 PolarHBondContact O-N 3.24Å; C768-N771 PolarHBondContact O-N 3.42Å; C768-L772 WeakPolarHBondContact O-CB 3.37Å; C768-L772 PolarHBondContact O-N 3.5Å
769C88.4Confident90Very high0 Ų056.1 Ų56.10%031%0.312CS..Hα-helixtrans-58.7-42.3174.3-65.20000112.2P720 L727 D764 D766 L772 A773P720-C769 PolarHBondContact O-SG 3.45Å; L727-C769 HydrophobicContact CD1-CB 4.32Å; L727-C769 WeakPolarHBondContact CD1-O 3.47Å; D764-C769 HydrophobicContact CB-CB 4.24Å; D764-C769 VanDerWaalsContact CG-CB 3.48Å; D766-C769 HydrophobicContact CB-CB 4.13Å; D766-C769 PolarHBondContact OD1-N 3.27Å; D766-C769 PolarHBondContact OD1-SG 2.95Å; D766-C769 VanDerWaalsContact OD1-SG 3.32Å; C769-L772 PolarHBondContact O-N 2.62Å; C769-A773 VanDerWaalsContact O-CB 3.31Å; C769-A773 WeakPolarHBondContact O-CB 3.33Å; C769-A773 PolarHBondContact O-N 2.94Å
770R90.7Very high89.8Confident92 Ų9251.5 Ų51.535%0.34729%0.287SS..Hα-helixtrans-61.5-44175-69.6-169.2-60.6-89.60.4112.6D764 S765 D766 G767 C768 A773 S774D764-R770 HydrophobicContact CB-CG 3.94Å; D764-R770 PolarHBondContact O-NH1 3.27Å; S765-R770 PolarHBondContact O-NH1 3.14Å; D766-R770 WeakPolarHBondContact O-CG 3.48Å; D766-R770 PolarHBondContact O-N 2.88Å; G767-R770 PolarHBondContact O-N 3.44Å; C768-R770 VanDerWaalsContact C-N 3.34Å; C768-R770 PolarHBondContact O-N 3.24Å; R770-A773 PolarHBondContact O-N 3.43Å; R770-S774 PolarHBondContact O-N 3.09Å
771N88.6Confident89.6Confident122 Ų12252.7 Ų52.765%0.65230%0.3SS*.Hα-helixtrans-64.1-43.4177.9-70.9-19.6000111.8G767 C768 S774 A775G767-N771 PolarHBondContact O-N 3.02Å; G767-N771 VanDerWaalsContact O-N 3.16Å; G767-N771 PolarHBondContact O-ND2 3.08Å; C768-N771 PolarHBondContact O-N 3.42Å; N771-S774 PolarHBondContact O-N 3.26Å; N771-A775 PolarHBondContact O-N 3.08Å; N771-A775 VanDerWaalsContact O-N 3.07Å
772L88.8Confident89.3Confident3 Ų354 Ų542%0.01631%0.305CS..Hα-helixtrans-60.8-47.4175-86.3176.9000112.5L629 A724 L727 L731 C768 C769 S774 A775 V776L629-L772 HydrophobicContact CD1-CD1 3.92Å; L629-L772 HydrophobicContact CD1-CD2 3.84Å; L629-L772 HydrophobicContact CD1-CG 4.35Å; L629-L772 HydrophobicContact CD2-CD1 3.62Å; L629-L772 HydrophobicContact CD2-CD2 3.48Å; L629-L772 VanDerWaalsContact CD2-CD2 3.48Å; L629-L772 HydrophobicContact CD2-CG 3.48Å; L629-L772 VanDerWaalsContact CD2-CG 3.48Å; L629-L772 HydrophobicContact CG-CD1 4.37Å; L629-L772 HydrophobicContact CG-CD2 4.13Å; L629-L772 HydrophobicContact CG-CG 4.5Å; A724-L772 HydrophobicContact CB-CD1 3.83Å; L727-L772 HydrophobicContact CB-CB 3.89Å; L727-L772 HydrophobicContact CB-CD1 4.09Å; L727-L772 HydrophobicContact CB-CG 4.47Å; L727-L772 HydrophobicContact CD1-CB 3.71Å; L727-L772 HydrophobicContact CD1-CD1 4.37Å; L727-L772 HydrophobicContact CG-CB 4.37Å; L731-L772 HydrophobicContact CD1-CD2 3.34Å; C768-L772 WeakPolarHBondContact O-CB 3.37Å; C768-L772 PolarHBondContact O-N 3.5Å; C769-L772 PolarHBondContact O-N 2.62Å; L772-S774 VanDerWaalsContact C-N 3.26Å; L772-S774 PolarHBondContact O-N 3.33Å; L772-A775 WeakPolarHBondContact O-CB 3.31Å; L772-A775 PolarHBondContact O-N 3.37Å; L772-A775 VanDerWaalsContact O-N 3.14Å; L772-V776 WeakPolarHBondContact O-CG2 3.34Å; L772-V776 PolarHBondContact O-N 3.5Å
773A91.9Very high89Confident0 Ų047.7 Ų47.70%027%0.272CS..Hα-helixtrans-58-42176.300000110.7L727 V757 A760 C761 C769 R770 A775 V776 Q777L727-A773 HydrophobicContact CD1-CB 4.33Å; L727-A773 HydrophobicContact CD2-CB 4.26Å; V757-A773 HydrophobicContact CG1-CB 4.26Å; V757-A773 WeakPolarHBondContact CG1-O 3.35Å; A760-A773 HydrophobicContact CB-CB 3.97Å; C761-A773 VanDerWaalsContact SG-CB 3.59Å; C769-A773 VanDerWaalsContact O-CB 3.31Å; C769-A773 WeakPolarHBondContact O-CB 3.33Å; C769-A773 PolarHBondContact O-N 2.94Å; R770-A773 PolarHBondContact O-N 3.43Å; A773-A775 VanDerWaalsContact C-N 3.34Å; A773-A775 PolarHBondContact O-N 3.18Å; A773-V776 PolarHBondContact O-N 3.09Å; A773-Q777 WeakPolarHBondContact O-CB 3.44Å; A773-Q777 PolarHBondContact O-N 3.41Å
774S91.3Very high88.5Confident48 Ų4848.4 Ų48.434%0.33627%0.268SS..Hα-helixtrans-64.1-38.3177.5-158.40000112.6C761 R770 N771 L772 Q777 Q778C761-S774 PolarHBondContact SG-N 2.7Å; C761-S774 VanDerWaalsContact SG-N 3.37Å; R770-S774 PolarHBondContact O-N 3.09Å; N771-S774 PolarHBondContact O-N 3.26Å; L772-S774 VanDerWaalsContact C-N 3.26Å; L772-S774 PolarHBondContact O-N 3.33Å; S774-Q777 WeakPolarHBondContact O-CB 3.31Å; S774-Q777 PolarHBondContact O-N 2.97Å; S774-Q778 PolarHBondContact O-N 3.14Å; S774-Q778 VanDerWaalsContact O-N 3.13Å
775A90.1Very high87.7Confident32 Ų3256.9 Ų56.926%0.26430%0.299SS..Hα-helixtrans-65.6-42.5173.400000112.2L731 N771 L772 A773 Q777 Q778 R779L731-A775 HydrophobicContact CD1-CB 4.05Å; L731-A775 HydrophobicContact CD2-CB 3.86Å; N771-A775 PolarHBondContact O-N 3.08Å; N771-A775 VanDerWaalsContact O-N 3.07Å; L772-A775 WeakPolarHBondContact O-CB 3.31Å; L772-A775 PolarHBondContact O-N 3.37Å; L772-A775 VanDerWaalsContact O-N 3.14Å; A773-A775 VanDerWaalsContact C-N 3.34Å; A773-A775 PolarHBondContact O-N 3.18Å; A775-Q777 VanDerWaalsContact C-N 3.33Å; A775-Q777 PolarHBondContact O-N 3.3Å; A775-Q778 PolarHBondContact O-N 2.98Å; A775-R779 PolarHBondContact O-N 2.94Å; A775-R779 VanDerWaalsContact O-N 3.14Å
776V90.5Very high86.7Confident1 Ų158.2 Ų58.21%0.00629%0.288CS..Hα-helixtrans-61.6-42.9174.8174.80000110.4L727 F730 L731 V757 L772 A773 Q778 R779 I780L727-V776 HydrophobicContact CB-CG2 4.38Å; L727-V776 HydrophobicContact CD2-CG2 4.04Å; F730-V776 HydrophobicContact CD1-CG1 3.58Å; F730-V776 HydrophobicContact CD1-CG2 4.42Å; F730-V776 HydrophobicContact CE1-CG1 3.96Å; F730-V776 HydrophobicContact CG-CG1 4.34Å; L731-V776 HydrophobicContact CD1-CG2 4.17Å; L731-V776 HydrophobicContact CD2-CG2 3.96Å; L731-V776 HydrophobicContact CG-CG2 3.6Å; V757-V776 HydrophobicContact CB-CG1 4.42Å; V757-V776 HydrophobicContact CG1-CB 4.04Å; V757-V776 HydrophobicContact CG1-CG1 4.02Å; V757-V776 HydrophobicContact CG2-CB 4.22Å; V757-V776 HydrophobicContact CG2-CG1 3.6Å; L772-V776 WeakPolarHBondContact O-CG2 3.34Å; L772-V776 PolarHBondContact O-N 3.5Å; A773-V776 PolarHBondContact O-N 3.09Å; V776-Q778 VanDerWaalsContact C-N 3.31Å; V776-Q778 PolarHBondContact O-N 3.21Å; V776-R779 PolarHBondContact O-N 3.21Å; V776-R779 VanDerWaalsContact O-N 3.09Å; V776-I780 HydrophobicContact CG1-CD1 3.75Å; V776-I780 HydrophobicContact CG1-CG1 4.16Å; V776-I780 WeakPolarHBondContact O-CG1 3.35Å; V776-I780 PolarHBondContact O-N 3.41Å
777Q92Very high85.5Confident75 Ų7557 Ų5735%0.3529%0.285SS..Hα-helixtrans-57.3-44.9178.4-170.2-174.949.200111.3V757 D758 A773 S774 A775 R779 I780 G781V757-Q777 HydrophobicContact CG1-CB 3.86Å; D758-Q777 WeakPolarHBondContact OD1-CG 3.49Å; D758-Q777 PolarHBondContact OD1-NE2 3.39Å; A773-Q777 WeakPolarHBondContact O-CB 3.44Å; A773-Q777 PolarHBondContact O-N 3.41Å; S774-Q777 WeakPolarHBondContact O-CB 3.31Å; S774-Q777 PolarHBondContact O-N 2.97Å; A775-Q777 VanDerWaalsContact C-N 3.33Å; A775-Q777 PolarHBondContact O-N 3.3Å; Q777-R779 PolarHBondContact O-N 2.92Å; Q777-I780 PolarHBondContact O-N 3.31Å; Q777-G781 PolarHBondContact O-N 3.28Å
778Q90.1Very high84.2Confident137 Ų13760.5 Ų60.564%0.6430%0.301SS*.Hα-helixtrans-61.7-43.6175.3-70.8-177.112.300112S774 A775 V776 G781 I782S774-Q778 PolarHBondContact O-N 3.14Å; S774-Q778 VanDerWaalsContact O-N 3.13Å; A775-Q778 PolarHBondContact O-N 2.98Å; V776-Q778 VanDerWaalsContact C-N 3.31Å; V776-Q778 PolarHBondContact O-N 3.21Å; Q778-G781 PolarHBondContact O-N 3.48Å; Q778-I782 WeakPolarHBondContact O-CG1 3.45Å; Q778-I782 PolarHBondContact O-N 3.15Å; Q778-I782 VanDerWaalsContact O-N 3.1Å
779R88.5Confident82.6Confident63 Ų6362.7 Ų62.724%0.23831%0.313CS..Hα-helixtrans-65.1-41.6178.7-73.4-73.8174.8-138.7-0.3112.4L731 E735 A775 V776 Q777 G781 I782 L783L731-R779 HydrophobicContact CD2-CG 4.1Å; E735-R779 IonicContact OE1-CZ 3.65Å; E735-R779 IonicContact OE1-NE 3.32Å; E735-R779 PolarHBondContact OE1-NE 3.18Å; E735-R779 IonicContact OE1-NH2 2.92Å; E735-R779 PolarHBondContact OE1-NH2 3.29Å; E735-R779 IonicContact OE2-NH2 3.86Å; A775-R779 PolarHBondContact O-N 2.94Å; A775-R779 VanDerWaalsContact O-N 3.14Å; V776-R779 PolarHBondContact O-N 3.21Å; V776-R779 VanDerWaalsContact O-N 3.09Å; Q777-R779 PolarHBondContact O-N 2.92Å; R779-G781 VanDerWaalsContact C-N 3.29Å; R779-G781 PolarHBondContact O-N 2.98Å; R779-I782 WeakPolarHBondContact O-CB 3.32Å; R779-I782 PolarHBondContact O-N 2.97Å; R779-I782 VanDerWaalsContact O-N 3.14Å; R779-L783 WeakPolarHBondContact O-CG 3.37Å; R779-L783 PolarHBondContact O-N 3.44Å
780I88.5Confident80.8Confident1 Ų164 Ų641%0.00532%0.32CS..Hα-helixtrans-59.6-41.8172.8-69.9173.6000110.9F730 L750 I753 Q754 V757 V776 Q777 I782 L783 K784F730-I780 HydrophobicContact CE1-CD1 4.36Å; F730-I780 HydrophobicContact CE1-CG1 3.91Å; F730-I780 HydrophobicContact CZ-CG1 4.25Å; L750-I780 HydrophobicContact CD2-CG1 4.26Å; L750-I780 HydrophobicContact CD2-CG2 3.88Å; I753-I780 HydrophobicContact CG2-CD1 4.04Å; Q754-I780 HydrophobicContact CB-CD1 4.16Å; Q754-I780 HydrophobicContact CB-CG2 4.15Å; Q754-I780 HydrophobicContact CG-CG2 4.12Å; V757-I780 HydrophobicContact CG2-CD1 4.42Å; V776-I780 HydrophobicContact CG1-CD1 3.75Å; V776-I780 HydrophobicContact CG1-CG1 4.16Å; V776-I780 WeakPolarHBondContact O-CG1 3.35Å; V776-I780 PolarHBondContact O-N 3.41Å; Q777-I780 PolarHBondContact O-N 3.31Å; I780-I782 VanDerWaalsContact C-N 3.3Å; I780-I782 PolarHBondContact O-N 3.42Å; I780-L783 PolarHBondContact O-N 3.02Å; I780-K784 PolarHBondContact O-N 3.4Å
781G85.9Confident78.8Confident29 Ų2963 Ų6330%0.29933%0.327SS..Hα-helixtrans-58.2-40.6174.600000113.1Q777 Q778 R779 R785Q777-G781 PolarHBondContact O-N 3.28Å; Q778-G781 PolarHBondContact O-N 3.48Å; R779-G781 VanDerWaalsContact C-N 3.29Å; R779-G781 PolarHBondContact O-N 2.98Å; G781-R785 WeakPolarHBondContact O-CG 3.28Å; G781-R785 PolarHBondContact O-N 3.4Å
782I85Confident76.9Confident57 Ų5763.8 Ų63.829%0.29233%0.331SS..Hα-helixtrans-66.9-47.2175.9-64.7166.7000110.8E739 Q778 R779 I780 K784 R785 R786E739-I782 WeakPolarHBondContact OE2-CG2 3.44Å; Q778-I782 WeakPolarHBondContact O-CG1 3.45Å; Q778-I782 PolarHBondContact O-N 3.15Å; Q778-I782 VanDerWaalsContact O-N 3.1Å; R779-I782 WeakPolarHBondContact O-CB 3.32Å; R779-I782 PolarHBondContact O-N 2.97Å; R779-I782 VanDerWaalsContact O-N 3.14Å; I780-I782 VanDerWaalsContact C-N 3.3Å; I780-I782 PolarHBondContact O-N 3.42Å; I782-K784 VanDerWaalsContact C-N 3.32Å; I782-K784 PolarHBondContact O-N 3.47Å; I782-R785 PolarHBondContact O-N 3.14Å; I782-R786 PolarHBondContact O-N 2.86Å; I782-R786 VanDerWaalsContact O-N 3.1Å
783L84.3Confident75.1Confident4 Ų467.5 Ų67.52%0.02136%0.357CS..Hα-helixtrans-56.8-44.6178.3-73.2167.1000111.6E739 L742 A743 R779 I780 R786 A787E739-L783 HydrophobicContact CB-CD2 3.84Å; E739-L783 HydrophobicContact CG-CD2 4.19Å; E739-L783 VanDerWaalsContact O-CD2 3.29Å; E739-L783 WeakPolarHBondContact O-CD2 3.38Å; L742-L783 HydrophobicContact CB-CD2 4.32Å; L742-L783 HydrophobicContact CD2-CD1 4.18Å; L742-L783 HydrophobicContact CD2-CD2 4.35Å; A743-L783 HydrophobicContact CB-CD2 4.31Å; R779-L783 WeakPolarHBondContact O-CG 3.37Å; R779-L783 PolarHBondContact O-N 3.44Å; I780-L783 PolarHBondContact O-N 3.02Å; L783-R786 PolarHBondContact O-N 2.84Å; L783-A787 WeakPolarHBondContact O-CB 3.3Å; L783-A787 PolarHBondContact O-N 2.76Å
784K80.4Confident73Confident106 Ų10669 Ų6946%0.46137%0.367SS..Hα-helixtrans-61.6-46177.3-82.6-172.7163.5-178.40113I780 I782 R786 A787 T788I780-K784 PolarHBondContact O-N 3.4Å; I782-K784 VanDerWaalsContact C-N 3.32Å; I782-K784 PolarHBondContact O-N 3.47Å; K784-R786 VanDerWaalsContact C-N 3.3Å; K784-R786 PolarHBondContact O-N 3.34Å; K784-A787 PolarHBondContact O-N 3.19Å; K784-T788 PolarHBondContact O-N 2.9Å; K784-T788 VanDerWaalsContact O-N 3.12Å; K784-T788 PolarHBondContact O-OG1 2.84Å
785R76.6Confident70.8Confident193 Ų19371.8 Ų71.873%0.72837%0.373SS*.Hα-helixtrans-62.2-37.7179.1-70.4179-163.31785.7112.1G781 I782 T788G781-R785 WeakPolarHBondContact O-CG 3.28Å; G781-R785 PolarHBondContact O-N 3.4Å; I782-R785 PolarHBondContact O-N 3.14Å; R785-T788 PolarHBondContact O-OG1 3.13Å
786R68.2Low68.8Low127 Ų12776.2 Ų76.248%0.47939%0.392SS..Hα-helixtrans-77.4-33.8177.3-67.2-137.4-177.2141.9-6.4112.3E739 I782 L783 K784 T788 T789E739-R786 IonicContact OE1-CZ 3.64Å; E739-R786 IonicContact OE1-NH1 2.6Å; E739-R786 PolarHBondContact OE1-NH1 3.24Å; E739-R786 WeakPolarHBondContact OE2-CD 3.48Å; E739-R786 WeakPolarHBondContact OE2-CG 3.43Å; E739-R786 IonicContact OE2-CZ 3.65Å; E739-R786 IonicContact OE2-NE 2.77Å; E739-R786 PolarHBondContact OE2-NE 2.74Å; E739-R786 VanDerWaalsContact OE2-NE 3.11Å; E739-R786 IonicContact OE2-NH1 3.92Å; E739-R786 PolarHBondContact OE2-NH1 3.27Å; I782-R786 PolarHBondContact O-N 2.86Å; I782-R786 VanDerWaalsContact O-N 3.1Å; L783-R786 PolarHBondContact O-N 2.84Å; K784-R786 VanDerWaalsContact C-N 3.3Å; K784-R786 PolarHBondContact O-N 3.34Å; R786-T788 VanDerWaalsContact C-N 3.29Å; R786-T788 PolarHBondContact O-N 2.7Å; R786-T789 PolarHBondContact O-N 3.15Å; R786-T789 VanDerWaalsContact O-N 3.11Å; R786-T789 PolarHBondContact O-OG1 2.98Å
787A63.8Low66.6Low25 Ų2582.7 Ų82.721%0.20743%0.426CS..Hα-helixtrans-61.6-36.1174.200000112.4A743 L783 K784 T789 L790A743-A787 HydrophobicContact CB-CB 4.2Å; L783-A787 WeakPolarHBondContact O-CB 3.3Å; L783-A787 PolarHBondContact O-N 2.76Å; K784-A787 PolarHBondContact O-N 3.19Å; A787-T789 PolarHBondContact O-N 3.35Å; A787-T789 VanDerWaalsContact O-N 3.15Å; A787-L790 HydrophobicContact CB-CD1 4.42Å; A787-L790 WeakPolarHBondContact O-CB 3.4Å; A787-L790 PolarHBondContact O-N 3.21Å; A787-L790 VanDerWaalsContact O-N 3.16Å
788T58.5Low64.2Low100 Ų10082.6 Ų82.661%0.61343%0.427SS*.THydrogen-bonded Turntrans-64.2-17.4175.841.80000114.7K784 R785 R786K784-T788 PolarHBondContact O-N 2.9Å; K784-T788 VanDerWaalsContact O-N 3.12Å; K784-T788 PolarHBondContact O-OG1 2.84Å; R785-T788 PolarHBondContact O-OG1 3.13Å; R786-T788 VanDerWaalsContact C-N 3.29Å; R786-T788 PolarHBondContact O-N 2.7Å
789T53Low61.7Low102 Ų10286.5 Ų86.563%0.62645%0.445SS*.THydrogen-bonded Turntrans-92.3-0.3177.461.40000114.4R786 A787R786-T789 PolarHBondContact O-N 3.15Å; R786-T789 VanDerWaalsContact O-N 3.11Å; R786-T789 PolarHBondContact O-OG1 2.98Å; A787-T789 PolarHBondContact O-N 3.35Å; A787-T789 VanDerWaalsContact O-N 3.15Å
790L49.7Very low60.4Low28 Ų2887.7 Ų87.715%0.14746%0.456CS..SBendtrans-73143.5177.5-72.8159.6000111.2K740 A787K740-L790 HydrophobicContact CB-CD2 4.47Å; K740-L790 HydrophobicContact CD-CD2 4.15Å; K740-L790 HydrophobicContact CG-CD2 4.31Å; A787-L790 HydrophobicContact CB-CD1 4.42Å; A787-L790 WeakPolarHBondContact O-CB 3.4Å; A787-L790 PolarHBondContact O-N 3.21Å; A787-L790 VanDerWaalsContact O-N 3.16Å
791S49.3Very low58.9Low70 Ų7092.2 Ų92.249%0.4948%0.479SS..  trans-57.4158.6-175.363.50000112S793 S794 K795S791-S793 PolarHBondContact O-N 3.28Å; S791-S793 PolarHBondContact OG-OG 2.82Å; S791-S794 WeakPolarHBondContact O-CB 3.2Å; S791-S794 PolarHBondContact O-N 3.3Å; S791-K795 PolarHBondContact O-N 3.47Å
792L49.6Very low57.4Low139 Ų13995.7 Ų95.773%0.72849%0.489SS*.Hα-helixtrans-48.1-34-178.7-14688.7000113.3K795 L796L792-K795 WeakPolarHBondContact O-CB 3.38Å; L792-K795 PolarHBondContact O-N 3.42Å; L792-L796 PolarHBondContact O-N 3.48Å
793S49.8Very low55.8Low81 Ų8198 Ų9857%0.56650%0.501SS*.Hα-helixtrans-61.8-37.6174.9150000114.2S791S791-S793 PolarHBondContact O-N 3.28Å; S791-S793 PolarHBondContact OG-OG 2.82Å
794S48Very low54Low30 Ų30103.9 Ų103.921%0.2153%0.531CS..Hα-helixtrans-75.6-32.3175.8-43.70000111.9S791 L796 L797 L798S791-S794 WeakPolarHBondContact O-CB 3.2Å; S791-S794 PolarHBondContact O-N 3.3Å; S794-L796 PolarHBondContact O-N 2.94Å; S794-L797 PolarHBondContact O-N 3.49Å; S794-L798 WeakPolarHBondContact O-CB 3.47Å; S794-L798 PolarHBondContact O-N 3.36Å; S794-L798 VanDerWaalsContact O-N 3.14Å
795K45.2Very low52.2Low108 Ų108103.7 Ų103.747%0.4754%0.536SS..Hα-helixtrans-63-32.8174.1-72.9-176.6178.4179.20112.3S791 L792 L797 L798 Q799S791-K795 PolarHBondContact O-N 3.47Å; L792-K795 WeakPolarHBondContact O-CB 3.38Å; L792-K795 PolarHBondContact O-N 3.42Å; K795-L797 VanDerWaalsContact C-N 3.33Å; K795-L798 PolarHBondContact O-N 3.29Å; K795-Q799 PolarHBondContact O-N 2.95Å; K795-Q799 VanDerWaalsContact O-N 3.1Å
796L49.3Very low50.5Low125 Ų12597.4 Ų97.465%0.65452%0.522SS*.Hα-helixtrans-74.3-19.5177.1-115.1142.1000114L792 S794L792-L796 PolarHBondContact O-N 3.48Å; S794-L796 PolarHBondContact O-N 2.94Å
797L42.4Very low49.2Very low136 Ų13695.1 Ų95.171%0.71253%0.525SS*.Hα-helixtrans-90.9-19.2172.7-107.9145.7000112.4S794 K795S794-L797 PolarHBondContact O-N 3.49Å; K795-L797 VanDerWaalsContact C-N 3.33Å
798L42.5Very low47.9Very low73 Ų73100.9 Ų100.938%0.38255%0.552SS.*Hα-helixtrans-88.4-23177.1-94.1155.1000113.1H747 S794 K795H747-L798 HydrophobicContact CB-CD2 3.35Å; H747-L798 HydrophobicContact CB-CG 4.42Å; S794-L798 WeakPolarHBondContact O-CB 3.47Å; S794-L798 PolarHBondContact O-N 3.36Å; S794-L798 VanDerWaalsContact O-N 3.14Å; K795-L798 PolarHBondContact O-N 3.29Å
799Q38Very low47Very low219 Ų219101 Ų101100%1.02355%0.546SS*.  trans-84.70164.2-87-173.4-38.500109.7K795K795-Q799 PolarHBondContact O-N 2.95Å; K795-Q799 VanDerWaalsContact O-N 3.1Å

Retrieved 799 of 799 residues in 179.1 ms (Link to these results)

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