A0A061IBP3_CRIGR Loading...

Battenin

AlphaFold DB , UniProt , Accession A0A061IBP3, Species CRIGR (Cricetulus griseus, Chinese hamster), Gene Cln3, Length 439 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
1M37.7Very low34.5Very low231 Ų231150.8 Ų150.8100%1.13879%0.794SS**  066.50-74.3177.6165.400107.1
2E27.6Very low34.3Very low186 Ų186152.5 Ų152.587%0.86979%0.794SS**  54.2105.770.4-70.6-175.3147.200110.7
3S36.4Very low34Very low114 Ų114154.2 Ų154.280%0.79780%0.796SS**  86.990.285.6-172.90000110.9
4C36.8Very low33.8Very low134 Ų134149.8 Ų149.891%0.90579%0.785SS**  trans-165.151.4160.2-127.10000113.1
5A39.5Very low33.7Very low99 Ų99152.2 Ų152.282%0.81879%0.79SS**SBendtrans-134.8-6.3171.600000114.3
6G36.8Very low33.7Very low65 Ų65157.1 Ų157.167%0.6780%0.795SS**SBendtrans-92.8-4.7-178.400000116.1
7S36.1Very low33.7Very low77 Ų77158.9 Ų158.954%0.53880%0.8SS.*SBendtrans-88.6-18.1-168-162.30000114.9
8W31.5Very low33.6Very low211 Ų211159.9 Ų159.980%0.79980%0.802SS**SBendtrans-91.4-20.3-171.4-77.495.4000115
9R31.5Very low33.7Very low229 Ų229161.7 Ų161.786%0.86481%0.807SS**THydrogen-bonded Turntrans-82.4-9.9173.7-86.1-171.3-169.7178.94.1114.7
10R33.6Very low33.6Very low208 Ų208160.1 Ų160.179%0.78581%0.806SS**THydrogen-bonded Turntrans-90.2-14.8178.5-156178.8-68.2-156.2-0.8112.9
11L32Very low33.6Very low105 Ų105159.5 Ų159.555%0.5581%0.806SS.*THydrogen-bonded Turntrans-89.3-25.8-178-85.3153.2000113.6
12E31.4Very low33.6Very low171 Ų171154 Ų15480%0.79979%0.788SS**THydrogen-bonded Turntrans-80.9-16.5175.4-73.1-177.5146.300113.6
13H30.9Very low34.1Very low175 Ų175153.1 Ų153.181%0.8178%0.783SS**THydrogen-bonded Turntrans-94.1-0.3177.2-129.3-65.7000113.7
14S31.7Very low34.2Very low92 Ų92153.5 Ų153.564%0.64378%0.783SS**SBendtrans-107.46.6-174.2-167.60000114.2
15Q32.2Very low34.5Very low186 Ų186155.8 Ų155.887%0.86978%0.78SS**SBendtrans-120.827.7178.8-77.9-167-26.300113.5
16R33.4Very low34.7Very low230 Ų230154.9 Ų154.987%0.86877%0.773SS**  trans-137.740.7173.7-146.7-177.9-156.2-171.85.5113.4
17E32.9Very low35.4Very low189 Ų189154.6 Ų154.688%0.88376%0.759SS**  trans-104.891.2154.5-72.4179.5174.100105.1E19E17-E19 PolarHBondContact O-N 2.79Å; E17-E19 VanDerWaalsContact O-N 3.14Å
18E33.1Very low36.5Very low176 Ų176155.5 Ų155.582%0.82276%0.763SS**  trans-57.6112.1158.8-84.8171.8142.100106.2T20E18-T20 PolarHBondContact O-N 3.14Å
19E34.6Very low37.7Very low195 Ų195152.6 Ų152.691%0.91176%0.763SS**  trans-5884.5156.3-88.2177146.700107.3E17 D21E17-E19 PolarHBondContact O-N 2.79Å; E17-E19 VanDerWaalsContact O-N 3.14Å; E19-D21 VanDerWaalsContact C-N 3.31Å; E19-D21 PolarHBondContact O-N 3.09Å; E19-D21 VanDerWaalsContact O-N 3.09Å
20T32Very low39.3Very low128 Ų128148.4 Ų148.479%0.78576%0.758SS**  trans-63.5101.7152.25.60000105.8E18E18-T20 PolarHBondContact O-N 3.14Å
21D33.1Very low40.9Very low148 Ų148139.6 Ų139.679%0.79173%0.728SS**  trans-41.3125.6159.3-97.9-35.8000107.6E19 E23E19-D21 VanDerWaalsContact C-N 3.31Å; E19-D21 PolarHBondContact O-N 3.09Å; E19-D21 VanDerWaalsContact O-N 3.09Å; D21-E23 PolarHBondContact O-N 2.86Å
22P38.5Very low43Very low117 Ų117139 Ų13976%0.7672%0.722SS**  trans-63.7107173.724.5-28.8000107
23E37.6Very low45.3Very low166 Ų166133.5 Ų133.578%0.77670%0.703SS**  trans-41.6132.7163-166.3177.6171.900107.6D21 Q25D21-E23 PolarHBondContact O-N 2.86Å; E23-Q25 VanDerWaalsContact C-N 3.27Å; E23-Q25 PolarHBondContact O-N 2.67Å
24P38.3Very low47.8Very low123 Ų123126.5 Ų126.580%0.79968%0.675SS**  trans-62.294-176.122.7-30.8000108.6A26P24-A26 PolarHBondContact O-N 3.1Å; P24-A26 VanDerWaalsContact O-N 3.1Å
25Q43.9Very low50.4Low181 Ų181126.5 Ų126.585%0.84667%0.665SS**PPolyproline II helixtrans-59.9119.9-179.9-76.6-173.3-700106.9E23E23-Q25 VanDerWaalsContact C-N 3.27Å; E23-Q25 PolarHBondContact O-N 2.67Å
26A44.5Very low53.2Low80 Ų80125 Ų12566%0.66165%0.651SS**PPolyproline II helixtrans-52.4130.3173.500000108P24P24-A26 PolarHBondContact O-N 3.1Å; P24-A26 VanDerWaalsContact O-N 3.1Å
27P51.5Low55.9Low59 Ų59118.1 Ų118.138%0.38363%0.628SS.*PPolyproline II helixtrans-57.9140.9-17622-31.7000109.4S31 Q32P27-S31 WeakPolarHBondContact CB-OG 3.43Å; P27-Q32 HydrophobicContact CG-CG 3.96Å
28P58.7Low58.8Low96 Ų96109.7 Ų109.762%0.62359%0.589SS**PPolyproline II helixtrans-52.8142.9-173.617.1-28.7000111.1D30 S31 Q32P28-D30 PolarHBondContact O-N 3.31Å; P28-S31 WeakPolarHBondContact CD-OG 3.37Å; P28-S31 WeakPolarHBondContact O-CA 3.47Å; P28-S31 WeakPolarHBondContact O-CB 3.46Å; P28-S31 PolarHBondContact O-N 2.81Å; P28-S31 PolarHBondContact O-OG 2.97Å; P28-Q32 PolarHBondContact O-N 2.61Å
29L57.3Low61.7Low151 Ų151101.5 Ų101.579%0.79155%0.551SS**Hα-helixtrans-46.9-35.5-174-96.9136.3000114.2Q32 S33L29-Q32 PolarHBondContact O-N 2.96Å; L29-S33 PolarHBondContact O-N 3.09Å; L29-S33 VanDerWaalsContact O-N 3.09Å
30D63.6Low64.6Low141 Ų14195.3 Ų95.375%0.75452%0.523SS*.Hα-helixtrans-66.1-37.2177.1-68.7-29.8000112.9P28 S33 A34P28-D30 PolarHBondContact O-N 3.31Å; D30-S33 PolarHBondContact O-N 3.01Å; D30-A34 PolarHBondContact O-N 3.46Å
31S68.5Low67.6Low22 Ų2289.2 Ų89.215%0.15449%0.486CS..Hα-helixtrans-72.6-33.6177.170.20000112.7P27 P28 Q35P27-S31 WeakPolarHBondContact CB-OG 3.43Å; P28-S31 WeakPolarHBondContact CD-OG 3.37Å; P28-S31 WeakPolarHBondContact O-CA 3.47Å; P28-S31 WeakPolarHBondContact O-CB 3.46Å; P28-S31 PolarHBondContact O-N 2.81Å; P28-S31 PolarHBondContact O-OG 2.97Å; S31-Q35 WeakPolarHBondContact O-CB 3.49Å; S31-Q35 VanDerWaalsContact O-CG 3.22Å; S31-Q35 WeakPolarHBondContact O-CG 3.22Å; S31-Q35 PolarHBondContact O-N 3.37Å
32Q74.7Confident70.6Confident92 Ų9282.2 Ų82.243%0.4345%0.448SS..Hα-helixtrans-68.3-40.7172.6-72.4-172.43.800111.7P27 P28 L29 Q35 W36P27-Q32 HydrophobicContact CG-CG 3.96Å; P28-Q32 PolarHBondContact O-N 2.61Å; L29-Q32 PolarHBondContact O-N 2.96Å; Q32-Q35 PolarHBondContact O-N 3.44Å; Q32-W36 WeakPolarHBondContact O-CB 3.43Å; Q32-W36 PolarHBondContact O-N 2.96Å
33S81.1Confident73.4Confident57 Ų5780 Ų8040%0.39943%0.425SS..Hα-helixtrans-61.6-44.4175.1-175.80000111.5L29 D30 W36 K37L29-S33 PolarHBondContact O-N 3.09Å; L29-S33 VanDerWaalsContact O-N 3.09Å; D30-S33 PolarHBondContact O-N 3.01Å; S33-W36 PolarHBondContact O-N 3.4Å; S33-K37 WeakPolarHBondContact O-CB 3.49Å; S33-K37 VanDerWaalsContact O-CG 3.29Å; S33-K37 WeakPolarHBondContact O-CG 3.45Å; S33-K37 PolarHBondContact O-N 3.35Å
34A83.3Confident76.2Confident27 Ų2773.7 Ų73.722%0.22340%0.396CS..Hα-helixtrans-63.4-44175.300000112.4D30 W36 K37 N38D30-A34 PolarHBondContact O-N 3.46Å; A34-W36 VanDerWaalsContact C-N 3.35Å; A34-W36 PolarHBondContact O-N 3.23Å; A34-K37 PolarHBondContact O-N 2.97Å; A34-N38 WeakPolarHBondContact O-CB 3.3Å; A34-N38 PolarHBondContact O-N 3.43Å; A34-N38 PolarHBondContact O-ND2 3.42Å
35Q85.9Confident79Confident93 Ų9367.9 Ų67.944%0.43536%0.358SS..Hα-helixtrans-61-41.8176.5-76.1174.513.400112.4S31 Q32 N38 A39S31-Q35 WeakPolarHBondContact O-CB 3.49Å; S31-Q35 VanDerWaalsContact O-CG 3.22Å; S31-Q35 WeakPolarHBondContact O-CG 3.22Å; S31-Q35 PolarHBondContact O-N 3.37Å; Q32-Q35 PolarHBondContact O-N 3.44Å; Q35-N38 PolarHBondContact O-N 3.44Å; Q35-A39 VanDerWaalsContact O-CB 3.3Å; Q35-A39 WeakPolarHBondContact O-CB 2.99Å; Q35-A39 PolarHBondContact O-N 2.87Å
36W89.8Confident81.5Confident154 Ų15459.2 Ų59.258%0.58332%0.318SS*.Hα-helixtrans-70.2-39.4178.4-171.788000112.4Q32 S33 A34 N38 A39 M40Q32-W36 WeakPolarHBondContact O-CB 3.43Å; Q32-W36 PolarHBondContact O-N 2.96Å; S33-W36 PolarHBondContact O-N 3.4Å; A34-W36 VanDerWaalsContact C-N 3.35Å; A34-W36 PolarHBondContact O-N 3.23Å; W36-N38 VanDerWaalsContact C-N 3.34Å; W36-N38 PolarHBondContact O-N 3.33Å; W36-A39 WeakPolarHBondContact O-CB 3.39Å; W36-A39 PolarHBondContact O-N 3.17Å; W36-M40 HydrophobicContact CD2-CG 4.08Å; W36-M40 HydrophobicContact CD2-SD 4.14Å; W36-M40 HydrophobicContact CE3-CG 4.04Å; W36-M40 HydrophobicContact CE3-SD 3.59Å; W36-M40 VanDerWaalsContact CE3-SD 3.59Å; W36-M40 HydrophobicContact CH2-CE 3.87Å; W36-M40 HydrophobicContact CH2-CG 3.94Å; W36-M40 HydrophobicContact CH2-SD 2.97Å; W36-M40 WeakPolarHBondContact CH2-SD 2.97Å; W36-M40 HydrophobicContact CZ2-CE 4.36Å; W36-M40 HydrophobicContact CZ2-CG 3.89Å; W36-M40 HydrophobicContact CZ2-SD 3.53Å; W36-M40 VanDerWaalsContact CZ2-SD 3.53Å; W36-M40 HydrophobicContact CZ3-CE 4.36Å; W36-M40 HydrophobicContact CZ3-CG 4.01Å; W36-M40 HydrophobicContact CZ3-SD 2.99Å; W36-M40 WeakPolarHBondContact CZ3-SD 3.29Å; W36-M40 PolarHBondContact O-N 3.08Å
37K91.9Very high84Confident86 Ų8656.6 Ų56.637%0.37429%0.292SS..Hα-helixtrans-58.7-45.9171.8-75.1174.1-176.4179.30111.6S33 A34 M40 G41 L231 T233S33-K37 WeakPolarHBondContact O-CB 3.49Å; S33-K37 VanDerWaalsContact O-CG 3.29Å; S33-K37 WeakPolarHBondContact O-CG 3.45Å; S33-K37 PolarHBondContact O-N 3.35Å; A34-K37 PolarHBondContact O-N 2.97Å; K37-M40 PolarHBondContact O-N 2.79Å; K37-G41 PolarHBondContact O-N 2.87Å; K37-L231 HydrophobicContact CB-CD1 4.29Å; K37-L231 HydrophobicContact CG-CD1 4.32Å; K37-T233 HydrophobicContact CD-CG2 4.31Å
38N92.6Very high86.1Confident12 Ų1253.9 Ų53.96%0.06428%0.275CS..Hα-helixtrans-65.3-40.9177.2-67.6-21.6000111.4A34 Q35 W36 G41 F42 Y177 M181 T233A34-N38 WeakPolarHBondContact O-CB 3.3Å; A34-N38 PolarHBondContact O-N 3.43Å; A34-N38 PolarHBondContact O-ND2 3.42Å; Q35-N38 PolarHBondContact O-N 3.44Å; W36-N38 VanDerWaalsContact C-N 3.34Å; W36-N38 PolarHBondContact O-N 3.33Å; N38-G41 WeakPolarHBondContact O-CA 3.47Å; N38-G41 PolarHBondContact O-N 3.42Å; N38-G41 VanDerWaalsContact O-N 3.16Å; N38-F42 VanDerWaalsContact O-CD2 3.3Å; N38-F42 WeakPolarHBondContact O-CD2 3.41Å; N38-F42 PolarHBondContact O-N 2.9Å; N38-Y177 HydrophobicContact CB-CD1 4.27Å; N38-Y177 HydrophobicContact CB-CE1 4.27Å; N38-M181 VanDerWaalsContact C-SD 3.57Å; N38-M181 HydrophobicContact CB-SD 3.86Å; N38-T233 PolarHBondContact ND2-OG1 3.02Å; N38-T233 VanDerWaalsContact ND2-OG1 3.17Å; N38-T233 PolarHBondContact OD1-N 3.48Å; N38-T233 PolarHBondContact OD1-O 2.82Å; N38-T233 PolarHBondContact OD1-OG1 3.09Å
39A93.9Very high87.9Confident4 Ų449.3 Ų49.33%0.03325%0.245CC..Hα-helixtrans-59.1-50.3175.500000112.1Q35 W36 G41 W43 M181 W184Q35-A39 VanDerWaalsContact O-CB 3.3Å; Q35-A39 WeakPolarHBondContact O-CB 2.99Å; Q35-A39 PolarHBondContact O-N 2.87Å; W36-A39 WeakPolarHBondContact O-CB 3.39Å; W36-A39 PolarHBondContact O-N 3.17Å; A39-G41 VanDerWaalsContact C-N 3.3Å; A39-G41 PolarHBondContact O-N 2.93Å; A39-W43 WeakPolarHBondContact O-CB 3.27Å; A39-W43 PolarHBondContact O-N 3.21Å; A39-M181 HydrophobicContact CB-CE 4.26Å; A39-M181 HydrophobicContact CB-SD 4.18Å; A39-M181 PolarHBondContact N-SD 3.28Å; A39-M181 VanDerWaalsContact N-SD 3.42Å; A39-W184 HydrophobicContact CB-CD2 3.75Å; A39-W184 HydrophobicContact CB-CE3 4.47Å; A39-W184 HydrophobicContact CB-CG 3.78Å; A39-W184 HydrophobicContact CB-CZ2 4.19Å; A39-W184 WeakPolarHBondContact O-CB 3.44Å
40M95.6Very high89.5Confident65 Ų6543.2 Ų43.232%0.3221%0.213SC..Hα-helixtrans-60.2-42172.4-73.7-17189.800112.1W36 K37 W43 I44 L231W36-M40 HydrophobicContact CD2-CG 4.08Å; W36-M40 HydrophobicContact CD2-SD 4.14Å; W36-M40 HydrophobicContact CE3-CG 4.04Å; W36-M40 HydrophobicContact CE3-SD 3.59Å; W36-M40 VanDerWaalsContact CE3-SD 3.59Å; W36-M40 HydrophobicContact CH2-CE 3.87Å; W36-M40 HydrophobicContact CH2-CG 3.94Å; W36-M40 HydrophobicContact CH2-SD 2.97Å; W36-M40 WeakPolarHBondContact CH2-SD 2.97Å; W36-M40 HydrophobicContact CZ2-CE 4.36Å; W36-M40 HydrophobicContact CZ2-CG 3.89Å; W36-M40 HydrophobicContact CZ2-SD 3.53Å; W36-M40 VanDerWaalsContact CZ2-SD 3.53Å; W36-M40 HydrophobicContact CZ3-CE 4.36Å; W36-M40 HydrophobicContact CZ3-CG 4.01Å; W36-M40 HydrophobicContact CZ3-SD 2.99Å; W36-M40 WeakPolarHBondContact CZ3-SD 3.29Å; W36-M40 PolarHBondContact O-N 3.08Å; K37-M40 PolarHBondContact O-N 2.79Å; M40-W43 PolarHBondContact O-N 3.45Å; M40-I44 WeakPolarHBondContact O-CG1 3.2Å; M40-I44 PolarHBondContact O-N 3.16Å; M40-L231 HydrophobicContact CB-CD2 3.98Å
41G95.6Very high90.9Very high0 Ų037.2 Ų37.20%018%0.18CC..Hα-helixtrans-55.5-55.8179.400000111.2K37 N38 A39 W43 I44 L45 S227K37-G41 PolarHBondContact O-N 2.87Å; N38-G41 WeakPolarHBondContact O-CA 3.47Å; N38-G41 PolarHBondContact O-N 3.42Å; N38-G41 VanDerWaalsContact O-N 3.16Å; A39-G41 VanDerWaalsContact C-N 3.3Å; A39-G41 PolarHBondContact O-N 2.93Å; G41-W43 VanDerWaalsContact C-N 3.31Å; G41-W43 PolarHBondContact O-N 3.28Å; G41-I44 PolarHBondContact O-N 3.45Å; G41-L45 WeakPolarHBondContact O-CB 3.43Å; G41-L45 VanDerWaalsContact O-CG 3.23Å; G41-L45 WeakPolarHBondContact O-CG 3.49Å; G41-L45 PolarHBondContact O-N 3.39Å; G41-S227 VanDerWaalsContact CA-OG 3.23Å; G41-S227 WeakPolarHBondContact CA-OG 3.43Å; G41-S227 PolarHBondContact O-OG 2.85Å
42F96.1Very high91.9Very high0 Ų036.2 Ų36.20%017%0.173CC..Hα-helixtrans-62.9-35.4177-83.6-73.2000113.1N38 L45 G46 L173 T174 Y177 M181 W184 W185 L232N38-F42 VanDerWaalsContact O-CD2 3.3Å; N38-F42 WeakPolarHBondContact O-CD2 3.41Å; N38-F42 PolarHBondContact O-N 2.9Å; F42-L45 PolarHBondContact O-N 2.86Å; F42-G46 PolarHBondContact O-N 2.99Å; F42-L173 HydrophobicContact CE1-CD2 4.29Å; F42-L173 HydrophobicContact CE1-CG 4.47Å; F42-L173 HydrophobicContact CZ-CD2 4.15Å; F42-L173 HydrophobicContact CZ-CG 4.15Å; F42-T174 HydrophobicContact CD1-CG2 4.01Å; F42-T174 HydrophobicContact CE1-CG2 3.59Å; F42-T174 HydrophobicContact CZ-CG2 4.16Å; F42-Y177 AromaticContact CE2-CD1 3.84Å; F42-Y177 HydrophobicContact CE2-CD1 3.84Å; F42-Y177 AromaticContact CE2-CD2 3.77Å; F42-Y177 HydrophobicContact CE2-CD2 3.77Å; F42-Y177 HydrophobicContact CE2-CE1 4.15Å; F42-Y177 HydrophobicContact CE2-CE2 4.1Å; F42-Y177 AromaticContact CE2-CG 3.63Å; F42-Y177 HydrophobicContact CE2-CG 3.63Å; F42-Y177 AromaticContact CZ-CD2 3.66Å; F42-Y177 HydrophobicContact CZ-CD2 3.66Å; F42-Y177 AromaticContact CZ-CE2 3.97Å; F42-Y177 HydrophobicContact CZ-CE2 3.97Å; F42-Y177 AromaticContact CZ-CG 3.98Å; F42-Y177 HydrophobicContact CZ-CG 3.98Å; F42-M181 HydrophobicContact CD2-CB 3.61Å; F42-M181 HydrophobicContact CD2-CG 3.73Å; F42-M181 HydrophobicContact CD2-SD 3.95Å; F42-M181 HydrophobicContact CE2-CB 3.89Å; F42-M181 HydrophobicContact CE2-CG 3.91Å; F42-M181 HydrophobicContact CG-CB 4.07Å; F42-W184 HydrophobicContact CB-CB 4.36Å; F42-W185 HydrophobicContact CB-CB 4.25Å; F42-W185 HydrophobicContact CD1-CB 4.26Å; F42-W185 WeakPolarHBondContact O-CA 3.44Å; F42-L232 HydrophobicContact CD2-CD2 3.95Å; F42-L232 HydrophobicContact CE2-CD2 3.57Å; F42-L232 HydrophobicContact CZ-CD2 4.14Å
43W97Very high92.4Very high72 Ų7232.9 Ų32.927%0.27316%0.157SC..Hα-helixtrans-64.7-46.4175.1-170.587.1000112.3A39 M40 G41 G46 L47 W184 S187 G188 L195A39-W43 WeakPolarHBondContact O-CB 3.27Å; A39-W43 PolarHBondContact O-N 3.21Å; M40-W43 PolarHBondContact O-N 3.45Å; G41-W43 VanDerWaalsContact C-N 3.31Å; G41-W43 PolarHBondContact O-N 3.28Å; W43-G46 PolarHBondContact O-N 3.42Å; W43-L47 HydrophobicContact CH2-CD2 3.89Å; W43-L47 HydrophobicContact CZ3-CD2 3.73Å; W43-L47 WeakPolarHBondContact O-CB 3.41Å; W43-L47 PolarHBondContact O-N 2.81Å; W43-W184 WeakPolarHBondContact CA-O 3.47Å; W43-W184 HydrophobicContact CB-CB 4.42Å; W43-W184 HydrophobicContact CB-CE3 4.05Å; W43-W184 HydrophobicContact CG-CE3 4.23Å; W43-S187 PolarHBondContact NE1-OG 3.22Å; W43-G188 WeakPolarHBondContact O-CA 3.38Å; W43-L195 HydrophobicContact CH2-CD1 4.42Å
44I97.3Very high92.7Very high33 Ų3331 Ų3117%0.16914%0.143CC..Hα-helixtrans-64.9-41.3176.4-66.5169.6000110.5M40 G41 L47 C48 L223 L231M40-I44 WeakPolarHBondContact O-CG1 3.2Å; M40-I44 PolarHBondContact O-N 3.16Å; G41-I44 PolarHBondContact O-N 3.45Å; I44-L47 PolarHBondContact O-N 3.4Å; I44-C48 WeakPolarHBondContact O-CB 3.47Å; I44-C48 PolarHBondContact O-N 3.45Å; I44-C48 PolarHBondContact O-SG 2.87Å; I44-L223 HydrophobicContact CG2-CB 4.37Å; I44-L231 HydrophobicContact CD1-CD2 3.83Å
45L97.3Very high92.8Very high0 Ų029.8 Ų29.80%013%0.133CC..Hα-helixtrans-60.7-47.1176.1-71.7177.7000111.2G41 F42 L47 C48 N49 F170 W185 L224 L232G41-L45 WeakPolarHBondContact O-CB 3.43Å; G41-L45 VanDerWaalsContact O-CG 3.23Å; G41-L45 WeakPolarHBondContact O-CG 3.49Å; G41-L45 PolarHBondContact O-N 3.39Å; F42-L45 PolarHBondContact O-N 2.86Å; L45-L47 VanDerWaalsContact C-N 3.32Å; L45-L47 PolarHBondContact O-N 3.13Å; L45-C48 PolarHBondContact O-N 2.71Å; L45-N49 WeakPolarHBondContact O-CB 3.3Å; L45-N49 PolarHBondContact O-N 3.09Å; L45-F170 HydrophobicContact CB-CD1 4.5Å; L45-F170 HydrophobicContact CB-CG 4.48Å; L45-F170 HydrophobicContact CD1-CD1 3.65Å; L45-F170 HydrophobicContact CD1-CE1 3.72Å; L45-F170 HydrophobicContact CD1-CG 4.34Å; L45-F170 HydrophobicContact CD1-CZ 4.48Å; L45-F170 HydrophobicContact CD2-CD1 4.36Å; L45-F170 HydrophobicContact CD2-CE1 3.68Å; L45-F170 HydrophobicContact CD2-CE2 4.35Å; L45-F170 HydrophobicContact CD2-CZ 3.69Å; L45-F170 HydrophobicContact CG-CD1 4.4Å; L45-F170 HydrophobicContact CG-CE1 4.19Å; L45-F170 HydrophobicContact CG-CZ 4.49Å; L45-W185 HydrophobicContact CB-CE3 4.07Å; L45-W185 HydrophobicContact CB-CZ3 3.8Å; L45-L224 HydrophobicContact CD2-CG 4.09Å; L45-L224 VanDerWaalsContact CD2-O 3.31Å; L45-L224 WeakPolarHBondContact CD2-O 3.49Å; L45-L232 HydrophobicContact CD1-CD1 3.36Å; L45-L232 HydrophobicContact CG-CD1 4.4Å
46G96.1Very high92.8Very high0 Ų025.4 Ų25.40%011%0.112CC..Hα-helixtrans-61.3-42.8177.400000112F42 W43 W185 G188 T189F42-G46 PolarHBondContact O-N 2.99Å; W43-G46 PolarHBondContact O-N 3.42Å; G46-W185 VanDerWaalsContact N-CE3 3.32Å; G46-G188 VanDerWaalsContact C-C 3.44Å; G46-T189 WeakPolarHBondContact O-CA 3.38Å; G46-T189 WeakPolarHBondContact O-CG2 3.39Å
47L96.1Very high92.1Very high24 Ų2420.8 Ų20.813%0.12610%0.099CC..Hα-helixtrans-60-55.1176177.866.5000111.5W43 I44 L45 F51 G188 A192 L195W43-L47 HydrophobicContact CH2-CD2 3.89Å; W43-L47 HydrophobicContact CZ3-CD2 3.73Å; W43-L47 WeakPolarHBondContact O-CB 3.41Å; W43-L47 PolarHBondContact O-N 2.81Å; I44-L47 PolarHBondContact O-N 3.4Å; L45-L47 VanDerWaalsContact C-N 3.32Å; L45-L47 PolarHBondContact O-N 3.13Å; L47-F51 WeakPolarHBondContact O-CB 3.38Å; L47-F51 PolarHBondContact O-N 3.32Å; L47-G188 VanDerWaalsContact CA-O 3.25Å; L47-G188 WeakPolarHBondContact CA-O 3.29Å; L47-G188 VanDerWaalsContact N-C 3.34Å; L47-G188 PolarHBondContact N-O 2.87Å; L47-A192 HydrophobicContact CD1-CB 4.16Å; L47-A192 VanDerWaalsContact O-CB 3.24Å; L47-A192 WeakPolarHBondContact O-CB 3.34Å; L47-L195 HydrophobicContact CD1-CB 4.28Å; L47-L195 HydrophobicContact CD1-CD1 3.79Å; L47-L195 HydrophobicContact CD2-CD1 4.14Å
48C96.7Very high91.1Very high3 Ų318.8 Ų18.82%0.0210%0.096CC..Hα-helixtrans-72.4-31.7-172.6-650000113.2I44 L45 N50 F51 V220 L224I44-C48 WeakPolarHBondContact O-CB 3.47Å; I44-C48 PolarHBondContact O-N 3.45Å; I44-C48 PolarHBondContact O-SG 2.87Å; L45-C48 PolarHBondContact O-N 2.71Å; C48-N50 PolarHBondContact O-N 2.53Å; C48-F51 PolarHBondContact O-N 2.81Å; C48-V220 HydrophobicContact CB-CG1 3.73Å; C48-L224 HydrophobicContact CB-CB 3.7Å; C48-L224 HydrophobicContact CB-CD1 3.97Å; C48-L224 HydrophobicContact CB-CG 4.3Å
49N95.9Very high89.9Confident0 Ų018.2 Ų18.20%09%0.093CC..Hα-helixtrans-59-45.3-178.9-173.674.6000112.5L45 S163 G166 E167 F170 W185 L224L45-N49 WeakPolarHBondContact O-CB 3.3Å; L45-N49 PolarHBondContact O-N 3.09Å; N49-S163 PolarHBondContact ND2-O 2.95Å; N49-G166 VanDerWaalsContact OD1-C 3.3Å; N49-G166 WeakPolarHBondContact OD1-CA 3.49Å; N49-E167 PolarHBondContact ND2-N 3.25Å; N49-E167 PolarHBondContact OD1-N 3.3Å; N49-F170 HydrophobicContact CB-CD2 4.46Å; N49-F170 HydrophobicContact CB-CE2 4.43Å; N49-W185 HydrophobicContact CB-CH2 3.76Å; N49-W185 HydrophobicContact CB-CZ3 4.36Å; N49-L224 HydrophobicContact CB-CD1 4.48Å
50N91.4Very high88.6Confident22 Ų2218.7 Ų18.712%0.11810%0.097CC..Hα-helixtrans-92.5-6.2-175.7-68.65.7000112.7C48 Y53 V54 S163 A192C48-N50 PolarHBondContact O-N 2.53Å; N50-Y53 WeakPolarHBondContact O-CB 3.4Å; N50-Y53 PolarHBondContact O-N 3.38Å; N50-V54 WeakPolarHBondContact O-CG2 3.25Å; N50-V54 PolarHBondContact O-N 3.22Å; N50-V54 VanDerWaalsContact O-N 3.11Å; N50-S163 PolarHBondContact OD1-OG 2.87Å; N50-A192 HydrophobicContact CB-CB 3.73Å
51F92.4Very high86.9Confident16 Ų1619.8 Ų19.87%0.0710%0.101CC..Hα-helixtrans-67.5-45.3-172.4-165.3-80.2000112.6L47 C48 Y53 V54 V55 F140 L195 S199 M217 V220L47-F51 WeakPolarHBondContact O-CB 3.38Å; L47-F51 PolarHBondContact O-N 3.32Å; C48-F51 PolarHBondContact O-N 2.81Å; F51-Y53 VanDerWaalsContact C-N 3.29Å; F51-Y53 PolarHBondContact O-N 3.49Å; F51-V54 PolarHBondContact O-N 3.16Å; F51-V55 HydrophobicContact CD1-CG2 3.69Å; F51-V55 HydrophobicContact CE1-CG2 3.49Å; F51-V55 VanDerWaalsContact CE1-CG2 3.49Å; F51-V55 HydrophobicContact CZ-CG2 4.31Å; F51-V55 WeakPolarHBondContact O-CG2 3.43Å; F51-V55 PolarHBondContact O-N 2.77Å; F51-F140 HydrophobicContact CD1-CZ 4.31Å; F51-L195 HydrophobicContact CE2-CB 4.45Å; F51-S199 WeakPolarHBondContact CZ-OG 3.13Å; F51-M217 HydrophobicContact CE1-CE 4.44Å; F51-M217 HydrophobicContact CE1-CG 4.25Å; F51-M217 HydrophobicContact CE1-SD 3.71Å; F51-M217 HydrophobicContact CZ-SD 3.99Å; F51-V220 HydrophobicContact CB-CG1 3.74Å; F51-V220 HydrophobicContact CD1-CB 4.35Å; F51-V220 HydrophobicContact CD1-CG1 4.05Å; F51-V220 HydrophobicContact CD1-CG2 3.64Å; F51-V220 HydrophobicContact CD2-CG2 4.47Å; F51-V220 HydrophobicContact CE1-CG2 3.65Å; F51-V220 HydrophobicContact CE2-CG2 4.49Å; F51-V220 HydrophobicContact CG-CG1 3.96Å; F51-V220 HydrophobicContact CG-CG2 4.05Å; F51-V220 HydrophobicContact CZ-CG2 4.08Å
52S89.5Confident85.5Confident0 Ų022.8 Ų22.80%012%0.117CC..Hα-helixtrans-60.5-41.9177.9460000111.4V55 M56S52-V55 PolarHBondContact O-N 2.76Å; S52-M56 WeakPolarHBondContact O-CB 3Å; S52-M56 WeakPolarHBondContact O-CG 3.21Å; S52-M56 PolarHBondContact O-N 3.12Å
53Y85.2Confident83.9Confident23 Ų2324 Ų249%0.0912%0.123CC..Hα-helixtrans-56.8-52.4175.1176.2-94.3000111.8N50 F51 V55 M56 L57 L102 D105N50-Y53 WeakPolarHBondContact O-CB 3.4Å; N50-Y53 PolarHBondContact O-N 3.38Å; F51-Y53 VanDerWaalsContact C-N 3.29Å; F51-Y53 PolarHBondContact O-N 3.49Å; Y53-V55 PolarHBondContact O-N 3.08Å; Y53-M56 PolarHBondContact O-N 3.08Å; Y53-L57 PolarHBondContact O-N 3.16Å; Y53-L102 VanDerWaalsContact OH-CD1 3.25Å; Y53-L102 WeakPolarHBondContact OH-CD1 3.23Å; Y53-D105 WeakPolarHBondContact CD2-OD2 3.26Å; Y53-D105 HydrophobicContact CE2-CB 4.14Å; Y53-D105 WeakPolarHBondContact CE2-OD2 3.28Å
54V86.6Confident82.1Confident18 Ų1823.7 Ų23.711%0.10913%0.126CC..Hα-helixtrans-62.3-42.2-179.5173.30000112.3N50 F51 S58N50-V54 WeakPolarHBondContact O-CG2 3.25Å; N50-V54 PolarHBondContact O-N 3.22Å; N50-V54 VanDerWaalsContact O-N 3.11Å; F51-V54 PolarHBondContact O-N 3.16Å; V54-S58 PolarHBondContact O-N 3.43Å; V54-S58 VanDerWaalsContact O-N 3.11Å; V54-S58 PolarHBondContact O-OG 3.16Å
55V86.2Confident80.4Confident0 Ų028.4 Ų28.40%015%0.146CC..Hα-helixtrans-67.3-39.9178.7171.70000111.1F51 S52 Y53 S58 A59 F140 Y200 L214F51-V55 HydrophobicContact CD1-CG2 3.69Å; F51-V55 HydrophobicContact CE1-CG2 3.49Å; F51-V55 VanDerWaalsContact CE1-CG2 3.49Å; F51-V55 HydrophobicContact CZ-CG2 4.31Å; F51-V55 WeakPolarHBondContact O-CG2 3.43Å; F51-V55 PolarHBondContact O-N 2.77Å; S52-V55 PolarHBondContact O-N 2.76Å; Y53-V55 PolarHBondContact O-N 3.08Å; V55-S58 PolarHBondContact O-N 2.84Å; V55-A59 VanDerWaalsContact O-CB 3.24Å; V55-A59 WeakPolarHBondContact O-CB 3.49Å; V55-A59 PolarHBondContact O-N 3.39Å; V55-F140 HydrophobicContact CB-CE1 4.18Å; V55-F140 HydrophobicContact CG1-CE1 3.98Å; V55-Y200 HydrophobicContact CG1-CD2 3.77Å; V55-Y200 HydrophobicContact CG1-CE2 4.44Å; V55-Y200 HydrophobicContact CG1-CG 4.33Å; V55-L214 HydrophobicContact CG1-CD2 3.77Å
56M84.6Confident78.5Confident1 Ų136.4 Ų36.41%0.00518%0.177CC..Hα-helixtrans-64.4-42.2178-72-5513600112S52 Y53 S58 A59 A60 F140 V143 V156 A159 L214S52-M56 WeakPolarHBondContact O-CB 3Å; S52-M56 WeakPolarHBondContact O-CG 3.21Å; S52-M56 PolarHBondContact O-N 3.12Å; Y53-M56 PolarHBondContact O-N 3.08Å; M56-S58 VanDerWaalsContact C-N 3.28Å; M56-S58 PolarHBondContact O-N 3.36Å; M56-A59 PolarHBondContact O-N 3.32Å; M56-A60 WeakPolarHBondContact O-CB 3.33Å; M56-A60 PolarHBondContact O-N 2.67Å; M56-F140 HydrophobicContact CE-CD1 3.32Å; M56-F140 HydrophobicContact CE-CE1 3.6Å; M56-F140 HydrophobicContact CE-CG 4.28Å; M56-V143 HydrophobicContact CE-CB 4.35Å; M56-V143 HydrophobicContact CE-CG2 4.29Å; M56-V143 HydrophobicContact SD-CB 4.1Å; M56-V143 HydrophobicContact SD-CG1 4.19Å; M56-V143 HydrophobicContact SD-CG2 3.61Å; M56-V156 HydrophobicContact CB-CG2 4.35Å; M56-A159 HydrophobicContact CG-CB 3.82Å; M56-L214 HydrophobicContact CE-CD2 3.83Å
57L75.3Confident76.6Confident57 Ų5738.3 Ų38.330%0.29819%0.185SC..Hα-helixtrans-61.8-38.8175-166.970.5000111.8Y53 V101 L102Y53-L57 PolarHBondContact O-N 3.16Å; L57-V101 HydrophobicContact CD1-CG1 4.39Å; L57-L102 HydrophobicContact CD1-CD1 4.18Å; L57-L102 HydrophobicContact CD2-CD1 4.28Å
58S71.1Confident74.6Confident45 Ų4543.5 Ų43.532%0.31521%0.209SC..Hα-helixtrans-69.9-41.7177-56.70000112.2V54 V55 M56V54-S58 PolarHBondContact O-N 3.43Å; V54-S58 VanDerWaalsContact O-N 3.11Å; V54-S58 PolarHBondContact O-OG 3.16Å; V55-S58 PolarHBondContact O-N 2.84Å; M56-S58 VanDerWaalsContact C-N 3.28Å; M56-S58 PolarHBondContact O-N 3.36Å
59A69.1Low72.4Confident0 Ų046.6 Ų46.60%023%0.234CC..Hα-helixtrans-76.1-22.1-178.700000113.1V55 M56 H61 D62 I63 Y200V55-A59 VanDerWaalsContact O-CB 3.24Å; V55-A59 WeakPolarHBondContact O-CB 3.49Å; V55-A59 PolarHBondContact O-N 3.39Å; M56-A59 PolarHBondContact O-N 3.32Å; A59-H61 VanDerWaalsContact C-N 3.27Å; A59-H61 PolarHBondContact O-N 3.31Å; A59-D62 PolarHBondContact O-N 3.38Å; A59-I63 HydrophobicContact CB-CD1 3.91Å; A59-I63 WeakPolarHBondContact O-CD1 3.39Å; A59-I63 VanDerWaalsContact O-CG1 3.25Å; A59-I63 WeakPolarHBondContact O-CG1 3.49Å; A59-I63 PolarHBondContact O-N 2.76Å; A59-Y200 HydrophobicContact CB-CE1 4.26Å; A59-Y200 HydrophobicContact CB-CE2 3.89Å
60A65.5Low70.1Confident14 Ų1449.4 Ų49.412%0.11625%0.254CS..Hα-helixtrans-52.9-43.2-176.300000112.7M56 I63 L64 V101M56-A60 WeakPolarHBondContact O-CB 3.33Å; M56-A60 PolarHBondContact O-N 2.67Å; A60-I63 PolarHBondContact O-N 3.07Å; A60-L64 WeakPolarHBondContact O-CB 3.41Å; A60-L64 VanDerWaalsContact O-CG 3.22Å; A60-L64 WeakPolarHBondContact O-CG 3.39Å; A60-L64 PolarHBondContact O-N 2.96Å; A60-V101 HydrophobicContact CB-CG1 4.11Å
61H60.9Low67.7Low87 Ų8750.8 Ų50.840%0.40327%0.274SS..Hα-helixtrans-64.4-40.5177.8-79.498.4000113A59 K65A59-H61 VanDerWaalsContact C-N 3.27Å; A59-H61 PolarHBondContact O-N 3.31Å; H61-K65 WeakPolarHBondContact O-CB 3.39Å; H61-K65 VanDerWaalsContact O-CG 3.29Å; H61-K65 WeakPolarHBondContact O-CG 3.4Å; H61-K65 PolarHBondContact O-N 3.49Å
62D64.9Low65.2Low64 Ų6456.8 Ų56.834%0.34231%0.306SS..Hα-helixtrans-73.5-37-179-69-23.6000111.4A59 Y66A59-D62 PolarHBondContact O-N 3.38Å; D62-Y66 VanDerWaalsContact O-CB 3.25Å; D62-Y66 WeakPolarHBondContact O-CB 3.43Å; D62-Y66 PolarHBondContact O-N 2.9Å
63I63.3Low62.7Low25 Ų2565 Ų6513%0.12835%0.345CS..Hα-helixtrans-62.8-44.5175-65.8158.6000110.8A59 A60 K67 V143 S152A59-I63 HydrophobicContact CB-CD1 3.91Å; A59-I63 WeakPolarHBondContact O-CD1 3.39Å; A59-I63 VanDerWaalsContact O-CG1 3.25Å; A59-I63 WeakPolarHBondContact O-CG1 3.49Å; A59-I63 PolarHBondContact O-N 2.76Å; A60-I63 PolarHBondContact O-N 3.07Å; I63-K67 WeakPolarHBondContact O-CG 3.37Å; I63-K67 PolarHBondContact O-N 2.9Å; I63-V143 HydrophobicContact CD1-CG1 3.32Å; I63-V143 HydrophobicContact CG1-CG1 4.19Å; I63-S152 WeakPolarHBondContact CG2-OG 3.25Å
64L59.2Low60.4Low66 Ų6668.1 Ų68.135%0.34637%0.37SS..Hα-helixtrans-68.7-43.7179.5-69.8171000111.6A60 K67 Q68A60-L64 WeakPolarHBondContact O-CB 3.41Å; A60-L64 VanDerWaalsContact O-CG 3.22Å; A60-L64 WeakPolarHBondContact O-CG 3.39Å; A60-L64 PolarHBondContact O-N 2.96Å; L64-K67 PolarHBondContact O-N 3.09Å; L64-Q68 PolarHBondContact O-N 2.9Å
65K60.9Low58Low132 Ų13275.6 Ų75.657%0.57440%0.404SS*.Hα-helixtrans-65.5-45178.5-77.4179.2179.8179.50113.1H61 K67 Q68 A69H61-K65 WeakPolarHBondContact O-CB 3.39Å; H61-K65 VanDerWaalsContact O-CG 3.29Å; H61-K65 WeakPolarHBondContact O-CG 3.4Å; H61-K65 PolarHBondContact O-N 3.49Å; K65-K67 VanDerWaalsContact C-N 3.28Å; K65-K67 PolarHBondContact O-N 3.15Å; K65-Q68 PolarHBondContact O-N 3.37Å; K65-A69 PolarHBondContact O-N 3.29Å
66Y57.3Low55.5Low167 Ų16781.5 Ų81.566%0.65544%0.439SS*.Hα-helixtrans-59.8-40.8178.7-176.8-96.8000111.4D62 A69 S70D62-Y66 VanDerWaalsContact O-CB 3.25Å; D62-Y66 WeakPolarHBondContact O-CB 3.43Å; D62-Y66 PolarHBondContact O-N 2.9Å; Y66-A69 PolarHBondContact O-N 2.86Å; Y66-S70 PolarHBondContact O-N 3.39Å; Y66-S70 PolarHBondContact O-OG 2.88Å
67K55.9Low52.9Low41 Ų4190.2 Ų90.218%0.17848%0.48CS..Hα-helixtrans-78.2-30.5-179.4-70.9-179178170.30113.7I63 L64 K65 A69 S70 G71 S146 S148 S152I63-K67 WeakPolarHBondContact O-CG 3.37Å; I63-K67 PolarHBondContact O-N 2.9Å; L64-K67 PolarHBondContact O-N 3.09Å; K65-K67 VanDerWaalsContact C-N 3.28Å; K65-K67 PolarHBondContact O-N 3.15Å; K67-A69 VanDerWaalsContact C-N 3.34Å; K67-S70 PolarHBondContact O-N 3.23Å; K67-G71 PolarHBondContact O-N 3.09Å; K67-S146 WeakPolarHBondContact CE-O 3.2Å; K67-S146 PolarHBondContact NZ-O 2.87Å; K67-S146 PolarHBondContact NZ-OG 3.32Å; K67-S148 PolarHBondContact NZ-O 3.02Å; K67-S152 PolarHBondContact NZ-OG 3.2Å
68Q53.9Low51Low133 Ų13393 Ų9362%0.62150%0.501SS*.Hα-helixtrans-64.2-38.8168.1-85.9176.5-30.100111.8L64 K65 G71 N72L64-Q68 PolarHBondContact O-N 2.9Å; K65-Q68 PolarHBondContact O-N 3.37Å; Q68-G71 PolarHBondContact O-N 3.47Å; Q68-N72 PolarHBondContact O-N 2.86Å
69A52Low48.9Very low67 Ų6795.3 Ų95.355%0.55452%0.518SS*.Hα-helixtrans-67.9-37.2175.100000112.7K65 Y66 K67K65-A69 PolarHBondContact O-N 3.29Å; Y66-A69 PolarHBondContact O-N 2.86Å; K67-A69 VanDerWaalsContact C-N 3.34Å
70S45.9Very low47.3Very low60 Ų60101.5 Ų101.542%0.4256%0.558SS.*Hα-helixtrans-75.1-27.8174.8-66.70000114Y66 K67Y66-S70 PolarHBondContact O-N 3.39Å; Y66-S70 PolarHBondContact O-OG 2.88Å; K67-S70 PolarHBondContact O-N 3.23Å
71G42.2Very low45.6Very low51 Ų51106.1 Ų106.153%0.52659%0.585SS.*Hα-helixtrans-73.9-23.3176.800000114.5K67 Q68 Q73K67-G71 PolarHBondContact O-N 3.09Å; Q68-G71 PolarHBondContact O-N 3.47Å; G71-Q73 VanDerWaalsContact C-N 3.33Å; G71-Q73 PolarHBondContact O-N 2.83Å
72N39.1Very low44.3Very low141 Ų141107.6 Ų107.675%0.75460%0.602SS**THydrogen-bonded Turntrans-87.710.5179.2-86.32.6000114.4Q68 S74Q68-N72 PolarHBondContact O-N 2.86Å; N72-S74 PolarHBondContact O-N 2.86Å
73Q38Very low42.7Very low173 Ų173111.9 Ų111.981%0.80862%0.622SS**  trans-81.615.1176.4-75.7-170.8-10.400114.7G71G71-Q73 VanDerWaalsContact C-N 3.33Å; G71-Q73 PolarHBondContact O-N 2.83Å
74S37.5Very low41.1Very low89 Ų89117.1 Ų117.162%0.62266%0.655SS**SBendtrans-120.8109166.159.80000110.9N72N72-S74 PolarHBondContact O-N 2.86Å
75H34.2Very low40.1Very low175 Ų175120.3 Ų120.381%0.8167%0.668SS**SBendtrans87.6106.3166.8-70.5-86.4000119.5
76V33.8Very low39.1Very low124 Ų124122 Ų12275%0.75268%0.683SS**  trans67.1117.4142.5-172.30000116.7P78V76-P78 VanDerWaalsContact O-CD 3.28Å; V76-P78 WeakPolarHBondContact O-CD 3.49Å
77E31.6Very low38.2Very low183 Ų183117.4 Ų117.486%0.85568%0.676SS**  trans-48.8122.7159.8-76.6-178.2142.700110.4
78P33.8Very low37.6Very low115 Ų115120 Ų12075%0.74770%0.699SS**  trans-86.4121.2148.715.33.6000107.3V76V76-P78 VanDerWaalsContact O-CD 3.28Å; V76-P78 WeakPolarHBondContact O-CD 3.49Å
79S27.3Very low37.2Very low94 Ų94115.5 Ų115.566%0.65768%0.682SS**  trans-43.8155.2157.9-490000110.8T81S79-T81 PolarHBondContact O-N 3.48Å
80P36.8Very low37Very low130 Ų130119.2 Ų119.284%0.84468%0.682SS**  trans-65.495.5-176.727.3-33000109.7
81T28.2Very low37.4Very low111 Ų111118 Ų11868%0.68167%0.669SS**  trans-69.6128.8163.724.40000107.2S79 M83S79-T81 PolarHBondContact O-N 3.48Å; T81-M83 PolarHBondContact O-N 3.27Å
82P34.6Very low37.8Very low118 Ų118123.1 Ų123.177%0.76668%0.684SS**  trans-64.8109.3173.64.85.7000107T84P82-T84 PolarHBondContact O-N 3.46Å
83M30.8Very low38.6Very low154 Ų154118.8 Ų118.876%0.75967%0.665SS**  trans-64.9101.4167.7-73.6-175.8-11200107.3T81 H85T81-M83 PolarHBondContact O-N 3.27Å; M83-H85 PolarHBondContact O-N 3.17Å
84T30.8Very low39.5Very low136 Ų136115.1 Ų115.183%0.83465%0.651SS**  trans-64.982.5157.933.50000108P82 N86P82-T84 PolarHBondContact O-N 3.46Å; T84-N86 VanDerWaalsContact C-N 3.28Å; T84-N86 PolarHBondContact O-N 2.69Å
85H38.5Very low39.8Very low133 Ų133116.9 Ų116.962%0.61666%0.663SS**  trans-70.689.2161.1-90.5-84.1000108M83 S87M83-H85 PolarHBondContact O-N 3.17Å; H85-S87 PolarHBondContact ND1-OG 3.08Å; H85-S87 PolarHBondContact O-N 3.4Å; H85-S87 VanDerWaalsContact O-N 3.12Å
86N38.7Very low40.8Very low167 Ų167113.3 Ų113.389%0.89365%0.649SS**  trans-78.167.5149.9-90.9-1.6000107.6T84T84-N86 VanDerWaalsContact C-N 3.28Å; T84-N86 PolarHBondContact O-N 2.69Å
87S39.5Very low42Very low70 Ų70108 Ų10849%0.4962%0.617SS.*  trans-103.397.3168.4-61.90000106H85 S89H85-S87 PolarHBondContact ND1-OG 3.08Å; H85-S87 PolarHBondContact O-N 3.4Å; H85-S87 VanDerWaalsContact O-N 3.12Å; S87-S89 PolarHBondContact O-N 3.36Å; S87-S89 VanDerWaalsContact O-N 3.13Å
88S42Very low43.5Very low97 Ų9799.9 Ų99.968%0.67858%0.58SS**  trans-77.427.2176.362.80000112.2P439S88-P439 CarbonylContact O-C 3.47Å; S88-P439 VanDerWaalsContact O-CA 3.24Å; S88-P439 WeakPolarHBondContact O-CA 3.28Å
89S45.3Very low44.9Very low37 Ų3794.4 Ų94.426%0.25955%0.545SS..  trans-109.5140.5178.167.50000110S87 F91 C436S87-S89 PolarHBondContact O-N 3.36Å; S87-S89 VanDerWaalsContact O-N 3.13Å; S89-F91 PolarHBondContact O-N 3.01Å; S89-C436 WeakPolarHBondContact CB-O 3.34Å
90R48.6Very low46.8Very low145 Ų14591.8 Ų91.855%0.54753%0.529SS..SBendtrans-69.3-10.5-177.8-171.7175.8176.4-174.4-1.6113.9S367R90-S367 PolarHBondContact NH1-OG 3.4Å; R90-S367 VanDerWaalsContact NH1-OG 3.16Å; R90-S367 PolarHBondContact NH2-OG 3.26Å
91F54.8Low48.2Very low35 Ų3587.6 Ų87.615%0.15450%0.5CS..SBendtrans-118.8133.4-166.7-56.4-73.1000112.7S89 C93 L306 V364S89-F91 PolarHBondContact O-N 3.01Å; F91-C93 PolarHBondContact O-N 3.14Å; F91-L306 HydrophobicContact CB-CD2 4.08Å; F91-L306 HydrophobicContact CD1-CB 4.15Å; F91-L306 HydrophobicContact CD1-CD2 3.78Å; F91-L306 HydrophobicContact CE1-CB 4.07Å; F91-L306 HydrophobicContact CE1-CD2 4.39Å; F91-L306 HydrophobicContact CG-CD2 3.95Å; F91-V364 HydrophobicContact CZ-CG1 4.25Å
92D51.3Low50.2Low158 Ų15882.3 Ų82.385%0.84547%0.468SS*.  trans-77.794171.2-82.3-32.9000109.6
93C55.2Low52.2Low50 Ų5077.3 Ų77.334%0.33844%0.435SS..  trans-89130.2-177.7-63.50000112.6F91 C436F91-C93 PolarHBondContact O-N 3.14Å; C93-C436 HydrophobicContact CB-CB 4.02Å; C93-C436 WeakPolarHBondContact CB-SG 3.34Å; C93-C436 VanDerWaalsContact SG-CA 3.58Å; C93-C436 WeakPolarHBondContact SG-CB 3.34Å; C93-C436 CovalentContact SG-SG 2.03Å; C93-C436 PolarHBondContact SG-SG 3.48Å
94N56.5Low54.1Low97 Ų9772.2 Ų72.252%0.51942%0.417SS..  trans-76.7150.3171.9-75.6-44.2000111.5I96N94-I96 VanDerWaalsContact C-N 3.29Å; N94-I96 PolarHBondContact O-N 3.42Å
95S44.3Very low56.2Low125 Ų12565.8 Ų65.887%0.87438%0.378SS*.SBendtrans-72.6-17.1-178.157.10000114.7
96I54.7Low58.5Low100 Ų10059.8 Ų59.851%0.51335%0.35SS..SBendtrans-127.7116.5170.2-61174.9000106.1N94 A100 V101N94-I96 VanDerWaalsContact C-N 3.29Å; N94-I96 PolarHBondContact O-N 3.42Å; I96-A100 HydrophobicContact CG2-CB 4.46Å; I96-V101 HydrophobicContact CG2-CG2 4.44Å
97S59.9Low60.9Low14 Ų1454.8 Ų54.810%0.09832%0.323CS..  trans-66.6136.4177176.40000110.2A99 A100S97-A99 PolarHBondContact O-N 2.92Å; S97-A99 WeakPolarHBondContact OG-CB 3.44Å; S97-A99 PolarHBondContact OG-N 3.16Å; S97-A100 WeakPolarHBondContact O-CB 3.23Å; S97-A100 PolarHBondContact O-N 3.11Å
98T62.7Low63.4Low12 Ų1252.6 Ų52.67%0.07431%0.307CS..Hα-helixtrans-52.5-27.9173.1-58.50000112.2A100 V101 L102 E305T98-A100 VanDerWaalsContact C-N 3.33Å; T98-A100 PolarHBondContact O-N 2.85Å; T98-V101 PolarHBondContact O-N 3.36Å; T98-L102 PolarHBondContact O-N 3.5Å; T98-L102 VanDerWaalsContact O-N 3.1Å; T98-E305 VanDerWaalsContact CB-OE1 3.29Å; T98-E305 WeakPolarHBondContact CB-OE1 3.28Å; T98-E305 PolarHBondContact OG1-OE1 3.46Å
99A63.5Low65.8Low0 Ų048.2 Ų48.20%028%0.276CS..Hα-helixtrans-63-32.1174.100000113.9S97 L102 L103 A428 L429S97-A99 PolarHBondContact O-N 2.92Å; S97-A99 WeakPolarHBondContact OG-CB 3.44Å; S97-A99 PolarHBondContact OG-N 3.16Å; A99-L102 PolarHBondContact O-N 3.29Å; A99-L103 WeakPolarHBondContact O-CB 3.23Å; A99-L103 WeakPolarHBondContact O-CG 3.45Å; A99-L103 PolarHBondContact O-N 2.7Å; A99-A428 HydrophobicContact CB-CB 3.93Å; A99-L429 HydrophobicContact CB-CD2 3.98Å; A99-L429 HydrophobicContact CB-CG 4.25Å
100A66.5Low68.1Low39 Ų3947.4 Ų47.432%0.32227%0.269SS..Hα-helixtrans-70.8-39.317800000112I96 S97 T98 L103 A104 L429I96-A100 HydrophobicContact CG2-CB 4.46Å; S97-A100 WeakPolarHBondContact O-CB 3.23Å; S97-A100 PolarHBondContact O-N 3.11Å; T98-A100 VanDerWaalsContact C-N 3.33Å; T98-A100 PolarHBondContact O-N 2.85Å; A100-L103 PolarHBondContact O-N 3.35Å; A100-A104 PolarHBondContact O-N 2.81Å; A100-A104 VanDerWaalsContact O-N 3.14Å; A100-L429 HydrophobicContact CB-CD2 4.12Å
101V66.9Low70.2Confident41 Ų4144.3 Ų44.325%0.24827%0.266CS..Hα-helixtrans-65.3-42.8175178.70000109.9L57 A60 I96 T98 A104 D105L57-V101 HydrophobicContact CD1-CG1 4.39Å; A60-V101 HydrophobicContact CB-CG1 4.11Å; I96-V101 HydrophobicContact CG2-CG2 4.44Å; T98-V101 PolarHBondContact O-N 3.36Å; V101-A104 PolarHBondContact O-N 2.81Å; V101-D105 WeakPolarHBondContact O-CB 3.35Å; V101-D105 PolarHBondContact O-N 3.03Å; V101-D105 VanDerWaalsContact O-N 3.15Å
102L69.4Low72Confident1 Ų144.7 Ų44.71%0.00527%0.269CS..Hα-helixtrans-64.3-42.5175.6-16795.2000112.5Y53 L57 T98 A99 A104 D105 I106 Y297 Q301 I421Y53-L102 VanDerWaalsContact OH-CD1 3.25Å; Y53-L102 WeakPolarHBondContact OH-CD1 3.23Å; L57-L102 HydrophobicContact CD1-CD1 4.18Å; L57-L102 HydrophobicContact CD2-CD1 4.28Å; T98-L102 PolarHBondContact O-N 3.5Å; T98-L102 VanDerWaalsContact O-N 3.1Å; A99-L102 PolarHBondContact O-N 3.29Å; L102-A104 VanDerWaalsContact C-N 3.29Å; L102-A104 PolarHBondContact O-N 3.14Å; L102-D105 CarbonylContact O-C 3.55Å; L102-D105 WeakPolarHBondContact O-CA 3.31Å; L102-D105 PolarHBondContact O-N 3.19Å; L102-I106 HydrophobicContact CD2-CG2 4.46Å; L102-I106 WeakPolarHBondContact O-CG2 3.28Å; L102-I106 PolarHBondContact O-N 3.07Å; L102-Y297 HydrophobicContact CD1-CE1 4.49Å; L102-Y297 HydrophobicContact CD2-CD1 4.13Å; L102-Q301 VanDerWaalsContact CD2-CD 3.47Å; L102-Q301 VanDerWaalsContact CG-NE2 3.27Å; L102-I421 HydrophobicContact CD2-CG2 3.38Å
103L75.4Confident74.1Confident12 Ų1237.1 Ų37.16%0.06323%0.229CC..Hα-helixtrans-57.5-44.6177.2-84.9168.2000111.5A99 A100 D105 I106 L107 F426 L429A99-L103 WeakPolarHBondContact O-CB 3.23Å; A99-L103 WeakPolarHBondContact O-CG 3.45Å; A99-L103 PolarHBondContact O-N 2.7Å; A100-L103 PolarHBondContact O-N 3.35Å; L103-D105 PolarHBondContact O-N 2.54Å; L103-I106 PolarHBondContact O-N 2.98Å; L103-L107 HydrophobicContact CB-CD1 4.46Å; L103-L107 HydrophobicContact CD2-CD1 4.46Å; L103-L107 HydrophobicContact CD2-CG 4.41Å; L103-L107 VanDerWaalsContact O-CB 3.29Å; L103-L107 WeakPolarHBondContact O-CB 3.27Å; L103-L107 WeakPolarHBondContact O-CD1 3.45Å; L103-L107 WeakPolarHBondContact O-CG 3.12Å; L103-L107 PolarHBondContact O-N 3.45Å; L103-F426 HydrophobicContact CD1-CD1 4.19Å; L103-F426 HydrophobicContact CD1-CE1 4.44Å; L103-F426 HydrophobicContact CD1-CG 4.37Å; L103-F426 HydrophobicContact CD2-CD1 4.38Å; L103-F426 HydrophobicContact CD2-CD2 3.67Å; L103-F426 HydrophobicContact CD2-CE1 4.43Å; L103-F426 HydrophobicContact CD2-CE2 3.72Å; L103-F426 HydrophobicContact CD2-CG 4Å; L103-F426 HydrophobicContact CD2-CZ 4.1Å; L103-L429 HydrophobicContact CD1-CD1 3.6Å; L103-L429 HydrophobicContact CD1-CG 4.33Å
104A71.4Confident75.8Confident48 Ų4838.3 Ų38.340%0.39723%0.232SC..Hα-helixtrans-61.2-30.1175.600000112.7A100 V101 L102 P108A100-A104 PolarHBondContact O-N 2.81Å; A100-A104 VanDerWaalsContact O-N 3.14Å; V101-A104 PolarHBondContact O-N 2.81Å; L102-A104 VanDerWaalsContact C-N 3.29Å; L102-A104 PolarHBondContact O-N 3.14Å; A104-P108 VanDerWaalsContact O-CD 3.28Å; A104-P108 WeakPolarHBondContact O-CD 3.46Å
105D76Confident77.4Confident1 Ų138.9 Ų38.91%0.00523%0.234CC..Hα-helixtrans-89.6-24.5-178.4-161.626.1000113.6Y53 V101 L102 L103 V156 S160Y53-D105 WeakPolarHBondContact CD2-OD2 3.26Å; Y53-D105 HydrophobicContact CE2-CB 4.14Å; Y53-D105 WeakPolarHBondContact CE2-OD2 3.28Å; V101-D105 WeakPolarHBondContact O-CB 3.35Å; V101-D105 PolarHBondContact O-N 3.03Å; V101-D105 VanDerWaalsContact O-N 3.15Å; L102-D105 CarbonylContact O-C 3.55Å; L102-D105 WeakPolarHBondContact O-CA 3.31Å; L102-D105 PolarHBondContact O-N 3.19Å; L103-D105 PolarHBondContact O-N 2.54Å; D105-V156 HydrophobicContact CB-CG1 3.96Å; D105-V156 VanDerWaalsContact OD1-CG1 3.23Å; D105-V156 WeakPolarHBondContact OD1-CG1 3.45Å; D105-S160 WeakPolarHBondContact O-CB 3.26Å; D105-S160 PolarHBondContact O-OG 2.75Å
106I85.9Confident79.5Confident7 Ų733 Ų334%0.03619%0.193CC..Hα-helixtrans-97.9-29.5-178.6-160.968.3000113.3L102 L103 T109 L110 T418 I421L102-I106 HydrophobicContact CD2-CG2 4.46Å; L102-I106 WeakPolarHBondContact O-CG2 3.28Å; L102-I106 PolarHBondContact O-N 3.07Å; L103-I106 PolarHBondContact O-N 2.98Å; I106-T109 WeakPolarHBondContact O-CB 3.27Å; I106-T109 PolarHBondContact O-N 3.33Å; I106-L110 PolarHBondContact O-N 2.88Å; I106-T418 HydrophobicContact CD1-CG2 3.84Å; I106-T418 HydrophobicContact CG1-CG2 3.67Å; I106-I421 HydrophobicContact CB-CG2 4.18Å; I106-I421 HydrophobicContact CD1-CB 4.37Å; I106-I421 HydrophobicContact CD1-CD1 4.08Å; I106-I421 HydrophobicContact CD1-CG2 4Å; I106-I421 HydrophobicContact CG1-CB 4.03Å; I106-I421 HydrophobicContact CG1-CG2 3.63Å; I106-I421 HydrophobicContact CG2-CG2 4.31Å
107L89.3Confident80.8Confident61 Ų6128.7 Ų28.732%0.31917%0.171SC..Hα-helixtrans-61.3-40.9-177.3-74.3173.2000114L103 T109 L110 V111 F426L103-L107 HydrophobicContact CB-CD1 4.46Å; L103-L107 HydrophobicContact CD2-CD1 4.46Å; L103-L107 HydrophobicContact CD2-CG 4.41Å; L103-L107 VanDerWaalsContact O-CB 3.29Å; L103-L107 WeakPolarHBondContact O-CB 3.27Å; L103-L107 WeakPolarHBondContact O-CD1 3.45Å; L103-L107 WeakPolarHBondContact O-CG 3.12Å; L103-L107 PolarHBondContact O-N 3.45Å; L107-T109 VanDerWaalsContact C-N 3.3Å; L107-T109 PolarHBondContact O-N 3.22Å; L107-L110 HydrophobicContact CD2-CD2 4.37Å; L107-L110 WeakPolarHBondContact O-CB 3.46Å; L107-L110 PolarHBondContact O-N 3.38Å; L107-L110 VanDerWaalsContact O-N 3.15Å; L107-V111 WeakPolarHBondContact O-CG2 3.48Å; L107-V111 PolarHBondContact O-N 2.9Å; L107-F426 HydrophobicContact CD1-CZ 4.34Å; L107-F426 HydrophobicContact CD2-CE2 3.98Å; L107-F426 HydrophobicContact CD2-CZ 4.31Å
108P91.7Very high81.9Confident25 Ų2534.3 Ų34.316%0.16219%0.194CC..Hα-helixtrans-61-41.3175.4-20.131.4000111.7A104 L110 V111 I112 V157 S160 I161A104-P108 VanDerWaalsContact O-CD 3.28Å; A104-P108 WeakPolarHBondContact O-CD 3.46Å; P108-L110 PolarHBondContact O-N 3.22Å; P108-V111 PolarHBondContact O-N 2.62Å; P108-I112 WeakPolarHBondContact O-CG1 3.42Å; P108-I112 PolarHBondContact O-N 2.92Å; P108-I112 VanDerWaalsContact O-N 3.12Å; P108-V157 HydrophobicContact CB-CG1 4.32Å; P108-V157 HydrophobicContact CG-CG1 4.07Å; P108-V157 HydrophobicContact CG-CG2 4.36Å; P108-S160 WeakPolarHBondContact CB-OG 3.25Å; P108-I161 HydrophobicContact CB-CG1 3.93Å
109T92.3Very high82.7Confident4 Ų435.2 Ų35.23%0.02521%0.206CC..Hα-helixtrans-58.9-44.9172.8-66.30000111.4I106 L107 V111 I112 K113 S160 T418I106-T109 WeakPolarHBondContact O-CB 3.27Å; I106-T109 PolarHBondContact O-N 3.33Å; L107-T109 VanDerWaalsContact C-N 3.3Å; L107-T109 PolarHBondContact O-N 3.22Å; T109-V111 VanDerWaalsContact C-N 3.32Å; T109-V111 PolarHBondContact O-N 3.08Å; T109-I112 PolarHBondContact O-N 3.31Å; T109-I112 VanDerWaalsContact O-N 3.16Å; T109-K113 HydrophobicContact CG2-CD 4.23Å; T109-K113 HydrophobicContact CG2-CG 4.14Å; T109-K113 WeakPolarHBondContact O-CG 3.36Å; T109-K113 PolarHBondContact O-N 3.02Å; T109-S160 PolarHBondContact N-OG 3.04Å; T109-S160 VanDerWaalsContact N-OG 3.16Å; T109-S160 PolarHBondContact OG1-O 3.39Å; T109-S160 PolarHBondContact OG1-OG 3.42Å; T109-T418 HydrophobicContact CG2-CG2 3.79Å
110L93.3Very high83.6Confident21 Ų2136.2 Ų36.211%0.1121%0.211CC..Hα-helixtrans-58.8-44.7179.3-176.961.7000111.8I106 L107 P108 I112 K113 L114 T418 L419I106-L110 PolarHBondContact O-N 2.88Å; L107-L110 HydrophobicContact CD2-CD2 4.37Å; L107-L110 WeakPolarHBondContact O-CB 3.46Å; L107-L110 PolarHBondContact O-N 3.38Å; L107-L110 VanDerWaalsContact O-N 3.15Å; P108-L110 PolarHBondContact O-N 3.22Å; L110-I112 VanDerWaalsContact C-N 3.34Å; L110-I112 PolarHBondContact O-N 2.92Å; L110-K113 PolarHBondContact O-N 3.46Å; L110-L114 HydrophobicContact CD1-CD1 4.12Å; L110-L114 HydrophobicContact CD1-CG 4.14Å; L110-L114 HydrophobicContact CD2-CD1 4.49Å; L110-L114 HydrophobicContact CG-CD1 3.88Å; L110-L114 HydrophobicContact CG-CG 4.32Å; L110-L114 WeakPolarHBondContact O-CB 3.42Å; L110-L114 VanDerWaalsContact O-CG 3.25Å; L110-L114 WeakPolarHBondContact O-CG 3.4Å; L110-L114 PolarHBondContact O-N 3.15Å; L110-T418 HydrophobicContact CB-CG2 3.67Å; L110-T418 HydrophobicContact CD1-CG2 4.03Å; L110-T418 HydrophobicContact CG-CG2 4.45Å; L110-L419 HydrophobicContact CD1-CB 4.28Å
111V93.6Very high84.1Confident79 Ų7936.7 Ų36.748%0.47921%0.207SC..Hα-helixtrans-60.4-45.5177.6173.80000110.6L107 P108 T109 L114 L115L107-V111 WeakPolarHBondContact O-CG2 3.48Å; L107-V111 PolarHBondContact O-N 2.9Å; P108-V111 PolarHBondContact O-N 2.62Å; T109-V111 VanDerWaalsContact C-N 3.32Å; T109-V111 PolarHBondContact O-N 3.08Å; V111-L114 PolarHBondContact O-N 3.01Å; V111-L115 HydrophobicContact CG1-CD1 3.78Å; V111-L115 HydrophobicContact CG1-CG 4.4Å; V111-L115 WeakPolarHBondContact O-CB 3.28Å; V111-L115 VanDerWaalsContact O-CG 3.26Å; V111-L115 WeakPolarHBondContact O-CG 3.3Å; V111-L115 PolarHBondContact O-N 2.94Å
112I92.9Very high84.7Confident43 Ų4340.6 Ų40.622%0.22123%0.225CC..Hα-helixtrans-61.2-48177.4-65.8-65.3000111.3P108 T109 L110 L114 L115 A116 I161 L165P108-I112 WeakPolarHBondContact O-CG1 3.42Å; P108-I112 PolarHBondContact O-N 2.92Å; P108-I112 VanDerWaalsContact O-N 3.12Å; T109-I112 PolarHBondContact O-N 3.31Å; T109-I112 VanDerWaalsContact O-N 3.16Å; L110-I112 VanDerWaalsContact C-N 3.34Å; L110-I112 PolarHBondContact O-N 2.92Å; I112-L114 VanDerWaalsContact C-N 3.33Å; I112-L114 PolarHBondContact O-N 3.49Å; I112-L115 PolarHBondContact O-N 3.28Å; I112-A116 WeakPolarHBondContact O-CB 3.26Å; I112-A116 PolarHBondContact O-N 2.71Å; I112-I161 HydrophobicContact CD1-CG2 4.23Å; I112-I161 HydrophobicContact CG1-CG2 4.26Å; I112-L165 HydrophobicContact CG2-CB 4.29Å
113K93.6Very high85.3Confident0 Ų045.1 Ų45.10%025%0.249CC..Hα-helixtrans-65.2-35-179.5-63.3-158.2-174-172.20112.6T109 L110 P117 E167 V168 C414 I415 D417 T418T109-K113 HydrophobicContact CG2-CD 4.23Å; T109-K113 HydrophobicContact CG2-CG 4.14Å; T109-K113 WeakPolarHBondContact O-CG 3.36Å; T109-K113 PolarHBondContact O-N 3.02Å; L110-K113 PolarHBondContact O-N 3.46Å; K113-P117 WeakPolarHBondContact O-CD 3.37Å; K113-E167 WeakPolarHBondContact CE-OE2 3.07Å; K113-E167 VanDerWaalsContact NZ-CD 3.26Å; K113-E167 IonicContact NZ-OE1 3.85Å; K113-E167 IonicContact NZ-OE2 2.71Å; K113-E167 PolarHBondContact NZ-OE2 3.12Å; K113-V168 HydrophobicContact CB-CG2 4.34Å; K113-V168 HydrophobicContact CD-CG2 4.34Å; K113-V168 HydrophobicContact CG-CG2 3.75Å; K113-C414 HydrophobicContact CD-CB 4.35Å; K113-C414 WeakPolarHBondContact CD-O 3.16Å; K113-C414 VanDerWaalsContact CD-SG 3.57Å; K113-C414 VanDerWaalsContact CE-SG 3.5Å; K113-C414 PolarHBondContact NZ-O 3.34Å; K113-C414 PolarHBondContact NZ-SG 3.07Å; K113-I415 HydrophobicContact CB-CG1 4.25Å; K113-I415 WeakPolarHBondContact O-CG1 3.3Å; K113-D417 VanDerWaalsContact NZ-CG 3.32Å; K113-D417 IonicContact NZ-OD1 2.74Å; K113-D417 PolarHBondContact NZ-OD1 3.15Å; K113-D417 IonicContact NZ-OD2 3.09Å; K113-D417 PolarHBondContact NZ-OD2 3.35Å; K113-D417 VanDerWaalsContact NZ-OD2 3.09Å; K113-T418 VanDerWaalsContact CD-OG1 3.29Å; K113-T418 WeakPolarHBondContact CD-OG1 3.43Å; K113-T418 WeakPolarHBondContact CE-OG1 3.44Å; K113-T418 PolarHBondContact NZ-OG1 3.15Å; K113-T418 VanDerWaalsContact NZ-OG1 3.11Å
114L91.9Very high85.9Confident75 Ų7546.3 Ų46.339%0.39326%0.257SS..Hα-helixtrans-70.1-37.1175.4-73.9173000112.5L110 V111 I112 F118 I415L110-L114 HydrophobicContact CD1-CD1 4.12Å; L110-L114 HydrophobicContact CD1-CG 4.14Å; L110-L114 HydrophobicContact CD2-CD1 4.49Å; L110-L114 HydrophobicContact CG-CD1 3.88Å; L110-L114 HydrophobicContact CG-CG 4.32Å; L110-L114 WeakPolarHBondContact O-CB 3.42Å; L110-L114 VanDerWaalsContact O-CG 3.25Å; L110-L114 WeakPolarHBondContact O-CG 3.4Å; L110-L114 PolarHBondContact O-N 3.15Å; V111-L114 PolarHBondContact O-N 3.01Å; I112-L114 VanDerWaalsContact C-N 3.33Å; I112-L114 PolarHBondContact O-N 3.49Å; L114-F118 VanDerWaalsContact O-CD2 3.25Å; L114-F118 WeakPolarHBondContact O-CD2 3.47Å; L114-F118 WeakPolarHBondContact O-CE2 3.4Å; L114-I415 HydrophobicContact CD2-CD1 4.25Å; L114-I415 HydrophobicContact CD2-CG1 4.43Å; L114-I415 HydrophobicContact CD2-CG2 3.69Å
115L90.1Very high86.7Confident108 Ų10844.2 Ų44.257%0.56524%0.239SC*.Hα-helixtrans-80.5-25.5-179.7-67.7176.7000112.8V111 I112 F118V111-L115 HydrophobicContact CG1-CD1 3.78Å; V111-L115 HydrophobicContact CG1-CG 4.4Å; V111-L115 WeakPolarHBondContact O-CB 3.28Å; V111-L115 VanDerWaalsContact O-CG 3.26Å; V111-L115 WeakPolarHBondContact O-CG 3.3Å; V111-L115 PolarHBondContact O-N 2.94Å; I112-L115 PolarHBondContact O-N 3.28Å; L115-F118 PolarHBondContact O-N 2.92Å; L115-F118 VanDerWaalsContact O-N 3.09Å
116A87.9Confident87.4Confident2 Ų244.9 Ų44.92%0.01724%0.244CC..Hα-helixtrans-57.2-46.8-172.400000114.7I112 F118 G119 L120 V168I112-A116 WeakPolarHBondContact O-CB 3.26Å; I112-A116 PolarHBondContact O-N 2.71Å; A116-F118 PolarHBondContact O-N 3.09Å; A116-G119 PolarHBondContact O-N 3.4Å; A116-G119 VanDerWaalsContact O-N 3.16Å; A116-L120 HydrophobicContact CB-CB 3.93Å; A116-L120 HydrophobicContact CB-CD1 4.41Å; A116-L120 HydrophobicContact CB-CD2 4.15Å; A116-L120 HydrophobicContact CB-CG 4.4Å; A116-L120 VanDerWaalsContact O-CB 3.26Å; A116-L120 WeakPolarHBondContact O-CB 3.19Å; A116-L120 PolarHBondContact O-N 3.49Å; A116-V168 HydrophobicContact CB-CB 4.49Å; A116-V168 HydrophobicContact CB-CG1 3.66Å; A116-V168 HydrophobicContact CB-CG2 4.31Å
117P83.1Confident87.6Confident9 Ų946.1 Ų46.16%0.05825%0.252CS..Hα-helixtrans-62.6-12.8179.9-22.733.4000114.6K113 R275 F408 E411 I415K113-P117 WeakPolarHBondContact O-CD 3.37Å; P117-R275 PolarHBondContact O-NH1 3.31Å; P117-F408 HydrophobicContact CB-CD2 4.27Å; P117-F408 HydrophobicContact CB-CE2 3.73Å; P117-E411 HydrophobicContact CG-CB 4.4Å; P117-I415 HydrophobicContact CG-CD1 4.16Å
118F82.3Confident87.8Confident133 Ų13343.6 Ų43.658%0.58324%0.239SC*.Hα-helixtrans-94.5-24-179.5-60.6-76.1000113.8L114 L115 A116 H121 F272L114-F118 VanDerWaalsContact O-CD2 3.25Å; L114-F118 WeakPolarHBondContact O-CD2 3.47Å; L114-F118 WeakPolarHBondContact O-CE2 3.4Å; L115-F118 PolarHBondContact O-N 2.92Å; L115-F118 VanDerWaalsContact O-N 3.09Å; A116-F118 PolarHBondContact O-N 3.09Å; F118-H121 PolarHBondContact O-CE1 3.45Å; F118-F272 HydrophobicContact CE1-CE2 4.27Å
119G78.4Confident87.9Confident30 Ų3042.4 Ų42.431%0.30923%0.231SC..Hα-helixtrans-152.2-13.6-171.100000116.4A116 H121 L122A116-G119 PolarHBondContact O-N 3.4Å; A116-G119 VanDerWaalsContact O-N 3.16Å; G119-H121 VanDerWaalsContact C-N 3.34Å; G119-H121 PolarHBondContact O-N 3.38Å; G119-L122 WeakPolarHBondContact O-CB 3.49Å; G119-L122 PolarHBondContact O-N 2.74Å
120L82.8Confident88.1Confident21 Ų2145.9 Ų45.911%0.1125%0.249CC..G310 helixtrans-66-40.3-177.3-147.983.7000111.1A116 L122 L123 R128 L165 V168A116-L120 HydrophobicContact CB-CB 3.93Å; A116-L120 HydrophobicContact CB-CD1 4.41Å; A116-L120 HydrophobicContact CB-CD2 4.15Å; A116-L120 HydrophobicContact CB-CG 4.4Å; A116-L120 VanDerWaalsContact O-CB 3.26Å; A116-L120 WeakPolarHBondContact O-CB 3.19Å; A116-L120 PolarHBondContact O-N 3.49Å; L120-L122 PolarHBondContact O-N 3.38Å; L120-L123 PolarHBondContact O-N 3.04Å; L120-R128 PolarHBondContact O-NE 3.23Å; L120-R128 PolarHBondContact O-NH2 3.14Å; L120-L165 HydrophobicContact CD1-CD1 3.69Å; L120-L165 HydrophobicContact CD2-CD1 4.35Å; L120-V168 HydrophobicContact CD2-CB 4.3Å; L120-V168 HydrophobicContact CD2-CG1 3.61Å
121H77.9Confident88.2Confident50 Ų5047.6 Ų47.623%0.23126%0.26CS..G310 helixtrans-49.5-2617669.4-70.7000114.6F118 G119 L123 R275F118-H121 PolarHBondContact O-CE1 3.45Å; G119-H121 VanDerWaalsContact C-N 3.34Å; G119-H121 PolarHBondContact O-N 3.38Å; H121-L123 VanDerWaalsContact C-N 3.3Å; H121-L123 PolarHBondContact O-N 2.86Å; H121-R275 PolarHBondContact NE2-NH2 3.46Å
122L79.2Confident88.3Confident122 Ų12243.9 Ų43.964%0.63924%0.238SC*.G310 helixtrans-75.1-17.4178.9-59.1175.4000113.5G119 L120G119-L122 WeakPolarHBondContact O-CB 3.49Å; G119-L122 PolarHBondContact O-N 2.74Å; L120-L122 PolarHBondContact O-N 3.38Å
123L82.3Confident88.5Confident97 Ų9741.9 Ų41.951%0.50823%0.228SC..SBendtrans-98.5134.3-179.1-65.6174.1000110.1L120 H121 R128L120-L123 PolarHBondContact O-N 3.04Å; H121-L123 VanDerWaalsContact C-N 3.3Å; H121-L123 PolarHBondContact O-N 2.86Å; L123-R128 HydrophobicContact CB-CG 4.19Å; L123-R128 PolarHBondContact O-NE 2.92Å; L123-R128 PolarHBondContact O-NH2 2.78Å
124P87.4Confident88.7Confident36 Ų3645.9 Ų45.923%0.23425%0.252CS..  trans-60.9158.5172.2-22.232.7000112.3S126 P127 R128 Q252P124-S126 PolarHBondContact O-N 2.94Å; P124-P127 HydrophobicContact CB-CG 4.41Å; P124-P127 WeakPolarHBondContact O-CD 3.39Å; P124-R128 WeakPolarHBondContact O-CG 3.42Å; P124-Q252 HydrophobicContact CB-CB 4.15Å; P124-Q252 HydrophobicContact CG-CB 4.23Å
125Y88.6Confident88.9Confident4 Ų445.6 Ų45.62%0.01625%0.248CC..Hα-helixtrans-65.2-41-177-77.6-92.5000113.3R128 V129 T169 S172 L173 F176 Y228 A249 E407Y125-R128 WeakPolarHBondContact O-CB 3.29Å; Y125-R128 PolarHBondContact O-N 3.28Å; Y125-R128 VanDerWaalsContact O-N 3.07Å; Y125-V129 WeakPolarHBondContact O-CG2 3.1Å; Y125-V129 PolarHBondContact O-N 3.37Å; Y125-T169 HydrophobicContact CD1-CG2 3.64Å; Y125-T169 HydrophobicContact CE1-CG2 4.18Å; Y125-T169 VanDerWaalsContact CE1-O 3.28Å; Y125-T169 WeakPolarHBondContact CE1-O 3.28Å; Y125-S172 WeakPolarHBondContact OH-CB 3.34Å; Y125-L173 HydrophobicContact CD1-CB 4.06Å; Y125-L173 HydrophobicContact CD1-CD1 3.93Å; Y125-L173 HydrophobicContact CD1-CG 4.49Å; Y125-L173 HydrophobicContact CE1-CB 3.77Å; Y125-L173 HydrophobicContact CE1-CD1 4.11Å; Y125-L173 HydrophobicContact CG-CD1 4.18Å; Y125-F176 AromaticContact CE2-CE2 3.87Å; Y125-F176 HydrophobicContact CE2-CE2 3.87Å; Y125-F176 AromaticContact CZ-CE2 3.89Å; Y125-Y228 WeakPolarHBondContact CB-OH 3.33Å; Y125-A249 WeakPolarHBondContact CD2-O 3.27Å; Y125-E407 PolarHBondContact OH-OE1 3.31Å
126S90.3Very high89.2Confident15 Ų1540.5 Ų40.511%0.10522%0.221CC..Hα-helixtrans-57.1-48.3-176.7-62.60000113.8P124 V129 L130 Y228 A250P124-S126 PolarHBondContact O-N 2.94Å; S126-V129 PolarHBondContact O-N 3.35Å; S126-L130 WeakPolarHBondContact O-CB 3.35Å; S126-L130 PolarHBondContact O-N 2.94Å; S126-Y228 PolarHBondContact N-OH 3.24Å; S126-A250 PolarHBondContact OG-O 2.95Å
127P90.6Very high89.6Confident33 Ų3341.5 Ų41.521%0.21423%0.229CC..Hα-helixtrans-58.5-42.6171.2-26.333.3000114.2P124 V129 L130 V131P124-P127 HydrophobicContact CB-CG 4.41Å; P124-P127 WeakPolarHBondContact O-CD 3.39Å; P127-V129 VanDerWaalsContact C-N 3.33Å; P127-V129 PolarHBondContact O-N 3.43Å; P127-L130 PolarHBondContact O-N 2.96Å; P127-V131 WeakPolarHBondContact O-CG2 3.41Å; P127-V131 PolarHBondContact O-N 3.32Å
128R93Very high90.2Very high8 Ų842 Ų423%0.0324%0.236CC..Hα-helixtrans-58.5-48178.9-60.5175.5-161.3-176.516.4110.3L120 L123 P124 Y125 V131 T132 T169 E411L120-R128 PolarHBondContact O-NE 3.23Å; L120-R128 PolarHBondContact O-NH2 3.14Å; L123-R128 HydrophobicContact CB-CG 4.19Å; L123-R128 PolarHBondContact O-NE 2.92Å; L123-R128 PolarHBondContact O-NH2 2.78Å; P124-R128 WeakPolarHBondContact O-CG 3.42Å; Y125-R128 WeakPolarHBondContact O-CB 3.29Å; Y125-R128 PolarHBondContact O-N 3.28Å; Y125-R128 VanDerWaalsContact O-N 3.07Å; R128-V131 PolarHBondContact O-N 3.42Å; R128-T132 PolarHBondContact O-N 2.81Å; R128-T132 PolarHBondContact O-OG1 3.2Å; R128-T169 HydrophobicContact CB-CG2 3.81Å; R128-E411 IonicContact NH1-OE1 3.55Å
129V94.6Very high90.8Very high0 Ų035.6 Ų35.60%021%0.208CC..Hα-helixtrans-65.8-39.8179.4176.70000112.2Y125 S126 P127 T132 G133 T169 F170 L224 L225 Y228Y125-V129 WeakPolarHBondContact O-CG2 3.1Å; Y125-V129 PolarHBondContact O-N 3.37Å; S126-V129 PolarHBondContact O-N 3.35Å; P127-V129 VanDerWaalsContact C-N 3.33Å; P127-V129 PolarHBondContact O-N 3.43Å; V129-T132 WeakPolarHBondContact O-CB 3.2Å; V129-T132 PolarHBondContact O-N 3.02Å; V129-G133 PolarHBondContact O-N 3.48Å; V129-T169 HydrophobicContact CG2-CG2 3.84Å; V129-F170 HydrophobicContact CB-CE1 4.46Å; V129-F170 HydrophobicContact CG1-CE1 4.13Å; V129-F170 HydrophobicContact CG1-CZ 4Å; V129-F170 HydrophobicContact CG2-CD1 4.41Å; V129-F170 HydrophobicContact CG2-CE1 3.51Å; V129-F170 HydrophobicContact CG2-CZ 3.93Å; V129-L224 HydrophobicContact CG1-CD2 4.03Å; V129-L225 HydrophobicContact CG1-CD2 4.12Å; V129-Y228 HydrophobicContact CB-CD1 4.16Å; V129-Y228 HydrophobicContact CB-CD2 4.47Å; V129-Y228 HydrophobicContact CB-CE1 4.36Å; V129-Y228 HydrophobicContact CB-CG 4.22Å; V129-Y228 HydrophobicContact CG1-CD1 3.9Å; V129-Y228 HydrophobicContact CG1-CD2 4.24Å; V129-Y228 HydrophobicContact CG1-CG 3.71Å; V129-Y228 HydrophobicContact CG2-CD1 4.31Å; V129-Y228 HydrophobicContact CG2-CD2 3.82Å; V129-Y228 HydrophobicContact CG2-CE1 4.31Å; V129-Y228 HydrophobicContact CG2-CE2 3.79Å; V129-Y228 HydrophobicContact CG2-CG 4.08Å
130L95.6Very high91.5Very high77 Ų7734.2 Ų34.240%0.40319%0.193SC..Hα-helixtrans-61.7-45.9175.7-175.867000111.3S126 P127 T132 G133 V134 L225S126-L130 WeakPolarHBondContact O-CB 3.35Å; S126-L130 PolarHBondContact O-N 2.94Å; P127-L130 PolarHBondContact O-N 2.96Å; L130-T132 VanDerWaalsContact C-N 3.35Å; L130-G133 PolarHBondContact O-N 2.97Å; L130-V134 WeakPolarHBondContact O-CG2 3.48Å; L130-V134 PolarHBondContact O-N 3.21Å; L130-L225 HydrophobicContact CD1-CD2 4.42Å
131V95.8Very high92.1Very high58 Ų5836.7 Ų36.735%0.35221%0.206SC..Hα-helixtrans-61.6-44.1176.3172.80000110.7P127 R128 G133 V134 F135 L165P127-V131 WeakPolarHBondContact O-CG2 3.41Å; P127-V131 PolarHBondContact O-N 3.32Å; R128-V131 PolarHBondContact O-N 3.42Å; V131-G133 PolarHBondContact O-N 3.43Å; V131-V134 PolarHBondContact O-N 3.28Å; V131-F135 HydrophobicContact CG1-CD1 4.39Å; V131-F135 HydrophobicContact CG1-CD2 4.1Å; V131-F135 HydrophobicContact CG1-CE1 4.21Å; V131-F135 HydrophobicContact CG1-CE2 3.89Å; V131-F135 HydrophobicContact CG1-CG 4.35Å; V131-F135 HydrophobicContact CG1-CZ 3.95Å; V131-F135 WeakPolarHBondContact O-CB 3.29Å; V131-F135 WeakPolarHBondContact O-CG 3.44Å; V131-F135 PolarHBondContact O-N 3Å; V131-L165 HydrophobicContact CB-CD2 3.99Å; V131-L165 HydrophobicContact CG1-CD2 3.64Å
132T96.3Very high92.8Very high0 Ų036.9 Ų36.90%021%0.208CC..Hα-helixtrans-54.2-50.2173.3-680000111.5R128 V129 L130 F135 S136 S162 L165 G166 F170 L224R128-T132 PolarHBondContact O-N 2.81Å; R128-T132 PolarHBondContact O-OG1 3.2Å; V129-T132 WeakPolarHBondContact O-CB 3.2Å; V129-T132 PolarHBondContact O-N 3.02Å; L130-T132 VanDerWaalsContact C-N 3.35Å; T132-F135 PolarHBondContact O-N 2.86Å; T132-S136 WeakPolarHBondContact O-CB 3.29Å; T132-S136 PolarHBondContact O-N 3.39Å; T132-S162 WeakPolarHBondContact CG2-O 3.44Å; T132-S162 PolarHBondContact O-OG 3.49Å; T132-L165 WeakPolarHBondContact OG1-CG 3.15Å; T132-G166 WeakPolarHBondContact OG1-CA 3.41Å; T132-G166 PolarHBondContact OG1-N 3.32Å; T132-F170 HydrophobicContact CG2-CE2 4.5Å; T132-L224 HydrophobicContact CG2-CD1 4.17Å; T132-L224 HydrophobicContact CG2-CD2 4.32Å
133G96.9Very high93.2Very high2 Ų231.3 Ų31.32%0.02118%0.179CC..Hα-helixtrans-64.2-42.4179.500000113.4V129 L130 V131 S136 A137 P221V129-G133 PolarHBondContact O-N 3.48Å; L130-G133 PolarHBondContact O-N 2.97Å; V131-G133 PolarHBondContact O-N 3.43Å; G133-S136 PolarHBondContact O-N 3.24Å; G133-A137 WeakPolarHBondContact O-CB 3.37Å; G133-A137 PolarHBondContact O-N 2.62Å; G133-P221 WeakPolarHBondContact O-CB 3.43Å
134V97.3Very high93.6Very high83 Ų8327.2 Ų27.250%0.50316%0.16SC..Hα-helixtrans-64.2-43.6177.6170.10000111.2L130 V131 A137 G138L130-V134 WeakPolarHBondContact O-CG2 3.48Å; L130-V134 PolarHBondContact O-N 3.21Å; V131-V134 PolarHBondContact O-N 3.28Å; V134-A137 PolarHBondContact O-N 3.25Å; V134-G138 PolarHBondContact O-N 3.13Å
135F96.8Very high93.7Very high69 Ų6930.3 Ų30.330%0.30317%0.17SC..Hα-helixtrans-68.7-36.9177.9-75.36.8000111.9V131 T132 G138 S139 L158 I161V131-F135 HydrophobicContact CG1-CD1 4.39Å; V131-F135 HydrophobicContact CG1-CD2 4.1Å; V131-F135 HydrophobicContact CG1-CE1 4.21Å; V131-F135 HydrophobicContact CG1-CE2 3.89Å; V131-F135 HydrophobicContact CG1-CG 4.35Å; V131-F135 HydrophobicContact CG1-CZ 3.95Å; V131-F135 WeakPolarHBondContact O-CB 3.29Å; V131-F135 WeakPolarHBondContact O-CG 3.44Å; V131-F135 PolarHBondContact O-N 3Å; T132-F135 PolarHBondContact O-N 2.86Å; F135-G138 PolarHBondContact O-N 3.47Å; F135-S139 WeakPolarHBondContact O-CB 3.25Å; F135-S139 PolarHBondContact O-N 2.94Å; F135-L158 HydrophobicContact CD1-CD2 4.31Å; F135-L158 HydrophobicContact CD2-CD2 4.25Å; F135-L158 HydrophobicContact CG-CD2 4.13Å; F135-I161 HydrophobicContact CD2-CB 4.16Å; F135-I161 HydrophobicContact CD2-CG2 3.6Å; F135-I161 HydrophobicContact CE2-CG2 3.7Å
136S96.3Very high93.5Very high1 Ų130.7 Ų30.71%0.00717%0.173CC..Hα-helixtrans-61.7-48.8172.8-177.10000111.1T132 G133 G138 S139 F140 S162T132-S136 WeakPolarHBondContact O-CB 3.29Å; T132-S136 PolarHBondContact O-N 3.39Å; G133-S136 PolarHBondContact O-N 3.24Å; S136-G138 PolarHBondContact O-N 2.94Å; S136-S139 WeakPolarHBondContact O-CB 3.37Å; S136-S139 PolarHBondContact O-N 3.4Å; S136-S139 PolarHBondContact O-OG 3.33Å; S136-F140 WeakPolarHBondContact O-CD2 3.45Å; S136-F140 PolarHBondContact O-N 3.45Å; S136-S162 WeakPolarHBondContact CB-OG 3.47Å; S136-S162 PolarHBondContact N-OG 2.65Å
137A96.8Very high93.1Very high23 Ų2338.3 Ų38.319%0.1921%0.207CC..Hα-helixtrans-62-43.7175.700000112.5G133 V134 S139 F140 I141 L218 P221G133-A137 WeakPolarHBondContact O-CB 3.37Å; G133-A137 PolarHBondContact O-N 2.62Å; V134-A137 PolarHBondContact O-N 3.25Å; A137-S139 VanDerWaalsContact C-N 3.28Å; A137-S139 PolarHBondContact O-N 3.32Å; A137-F140 PolarHBondContact O-N 3.31Å; A137-I141 WeakPolarHBondContact O-CG1 3.47Å; A137-I141 PolarHBondContact O-N 2.92Å; A137-I141 VanDerWaalsContact O-N 3.09Å; A137-L218 HydrophobicContact CB-CD2 3.89Å; A137-P221 HydrophobicContact CB-CB 4.11Å; A137-P221 HydrophobicContact CB-CG 3.83Å
138G95.6Very high92.4Very high19 Ų1939.2 Ų39.220%0.19621%0.214CC..Hα-helixtrans-58.7-38.8176.500000112.4V134 F135 S136 I141 L142V134-G138 PolarHBondContact O-N 3.13Å; F135-G138 PolarHBondContact O-N 3.47Å; S136-G138 PolarHBondContact O-N 2.94Å; G138-I141 PolarHBondContact O-N 2.57Å; G138-L142 VanDerWaalsContact O-CB 3.29Å; G138-L142 WeakPolarHBondContact O-CB 3.38Å; G138-L142 WeakPolarHBondContact O-CG 3.35Å; G138-L142 PolarHBondContact O-N 3.08Å
139S94.4Very high91.6Very high0 Ų042.2 Ų42.20%023%0.233CC..Hα-helixtrans-59.3-50.8176.576.90000112.1F135 S136 A137 I141 L142 V143 G155F135-S139 WeakPolarHBondContact O-CB 3.25Å; F135-S139 PolarHBondContact O-N 2.94Å; S136-S139 WeakPolarHBondContact O-CB 3.37Å; S136-S139 PolarHBondContact O-N 3.4Å; S136-S139 PolarHBondContact O-OG 3.33Å; A137-S139 VanDerWaalsContact C-N 3.28Å; A137-S139 PolarHBondContact O-N 3.32Å; S139-I141 PolarHBondContact O-N 2.85Å; S139-L142 PolarHBondContact O-N 3.41Å; S139-V143 WeakPolarHBondContact O-CG2 3.41Å; S139-V143 PolarHBondContact O-N 3.38Å; S139-V143 VanDerWaalsContact O-N 3.08Å; S139-G155 WeakPolarHBondContact CB-O 3.49Å
140F93.5Very high90.9Very high0 Ų051.9 Ų51.90%027%0.27CS..Hα-helixtrans-63-44.2179.4-69.9-58.1000112.1F51 V55 M56 S136 A137 A144 L214 M217 L218F51-F140 HydrophobicContact CD1-CZ 4.31Å; V55-F140 HydrophobicContact CB-CE1 4.18Å; V55-F140 HydrophobicContact CG1-CE1 3.98Å; M56-F140 HydrophobicContact CE-CD1 3.32Å; M56-F140 HydrophobicContact CE-CE1 3.6Å; M56-F140 HydrophobicContact CE-CG 4.28Å; S136-F140 WeakPolarHBondContact O-CD2 3.45Å; S136-F140 PolarHBondContact O-N 3.45Å; A137-F140 PolarHBondContact O-N 3.31Å; F140-A144 WeakPolarHBondContact O-CB 3.38Å; F140-A144 PolarHBondContact O-N 2.92Å; F140-L214 HydrophobicContact CD1-CD2 4.09Å; F140-L214 HydrophobicContact CE1-CD2 4.48Å; F140-M217 HydrophobicContact CD1-CB 4.05Å; F140-M217 HydrophobicContact CD2-CB 4.43Å; F140-M217 HydrophobicContact CE1-CB 3.79Å; F140-M217 HydrophobicContact CE1-CG 4.39Å; F140-M217 HydrophobicContact CE2-CB 4.16Å; F140-M217 HydrophobicContact CG-CB 4.37Å; F140-M217 HydrophobicContact CZ-CB 3.82Å; F140-L218 HydrophobicContact CB-CD2 4.17Å
141I94.7Very high90.4Very high73 Ų7351.2 Ų51.237%0.37427%0.266SS..Hα-helixtrans-63.6-49.3179.9-67.8165.9000110.6A137 G138 S139 V143 A144 F145 L218A137-I141 WeakPolarHBondContact O-CG1 3.47Å; A137-I141 PolarHBondContact O-N 2.92Å; A137-I141 VanDerWaalsContact O-N 3.09Å; G138-I141 PolarHBondContact O-N 2.57Å; S139-I141 PolarHBondContact O-N 2.85Å; I141-V143 VanDerWaalsContact C-N 3.34Å; I141-V143 PolarHBondContact O-N 3.37Å; I141-A144 PolarHBondContact O-N 3.07Å; I141-F145 HydrophobicContact CG2-CD2 3.94Å; I141-F145 HydrophobicContact CG2-CE2 4.23Å; I141-F145 VanDerWaalsContact O-CD2 3.29Å; I141-F145 WeakPolarHBondContact O-CD2 3.37Å; I141-F145 PolarHBondContact O-N 3.43Å; I141-L218 HydrophobicContact CD1-CD1 4.4Å; I141-L218 HydrophobicContact CD1-CD2 4.21Å; I141-L218 HydrophobicContact CG1-CD1 4.1Å; I141-L218 HydrophobicContact CG1-CD2 4.05Å
142L92.1Very high89.7Confident54 Ų5448.8 Ų48.828%0.28325%0.252SS..Hα-helixtrans-61.4-43.7-177.9-79.9165.1000111.6G138 S139 S146 L151 L158G138-L142 VanDerWaalsContact O-CB 3.29Å; G138-L142 WeakPolarHBondContact O-CB 3.38Å; G138-L142 WeakPolarHBondContact O-CG 3.35Å; G138-L142 PolarHBondContact O-N 3.08Å; S139-L142 PolarHBondContact O-N 3.41Å; L142-S146 WeakPolarHBondContact O-CA 3.07Å; L142-S146 WeakPolarHBondContact O-CB 3.43Å; L142-S146 PolarHBondContact O-N 3.18Å; L142-L151 HydrophobicContact CD2-CD1 3.55Å; L142-L151 HydrophobicContact CD2-CG 4.18Å; L142-L158 HydrophobicContact CD1-CD1 3.32Å
143V89.3Confident89.1Confident5 Ų552.5 Ų52.53%0.0327%0.271CS..Hα-helixtrans-69.5-41.9178.3-178.90000111.4M56 I63 S139 I141 F145 S146 L214M56-V143 HydrophobicContact CE-CB 4.35Å; M56-V143 HydrophobicContact CE-CG2 4.29Å; M56-V143 HydrophobicContact SD-CB 4.1Å; M56-V143 HydrophobicContact SD-CG1 4.19Å; M56-V143 HydrophobicContact SD-CG2 3.61Å; I63-V143 HydrophobicContact CD1-CG1 3.32Å; I63-V143 HydrophobicContact CG1-CG1 4.19Å; S139-V143 WeakPolarHBondContact O-CG2 3.41Å; S139-V143 PolarHBondContact O-N 3.38Å; S139-V143 VanDerWaalsContact O-N 3.08Å; I141-V143 VanDerWaalsContact C-N 3.34Å; I141-V143 PolarHBondContact O-N 3.37Å; V143-F145 VanDerWaalsContact C-N 3.29Å; V143-F145 PolarHBondContact O-N 3.09Å; V143-S146 WeakPolarHBondContact O-CB 3.24Å; V143-S146 PolarHBondContact O-N 3.16Å; V143-S146 VanDerWaalsContact O-N 3.1Å; V143-S146 PolarHBondContact O-OG 2.97Å; V143-L214 HydrophobicContact CB-CD1 4.06Å; V143-L214 HydrophobicContact CG1-CD1 3.55Å
144A89.9Confident88.6Confident12 Ų1255.3 Ų55.310%0.09929%0.291CS..Hα-helixtrans-58.8-39.3179.100000112.8F140 I141 Q211 L214 L215F140-A144 WeakPolarHBondContact O-CB 3.38Å; F140-A144 PolarHBondContact O-N 2.92Å; I141-A144 PolarHBondContact O-N 3.07Å; A144-Q211 HydrophobicContact CB-CG 4.24Å; A144-Q211 WeakPolarHBondContact O-CG 3.28Å; A144-L214 HydrophobicContact CB-CB 3.99Å; A144-L214 HydrophobicContact CB-CD1 4.45Å; A144-L215 HydrophobicContact CB-CD2 3.92Å; A144-L215 HydrophobicContact CB-CG 3.9Å
145F89.6Confident88.3Confident100 Ų10051.4 Ų51.444%0.43927%0.267SS..THydrogen-bonded Turntrans-98.113.2178.3-64.1-72.3000113.5I141 V143 H147 L215I141-F145 HydrophobicContact CG2-CD2 3.94Å; I141-F145 HydrophobicContact CG2-CE2 4.23Å; I141-F145 VanDerWaalsContact O-CD2 3.29Å; I141-F145 WeakPolarHBondContact O-CD2 3.37Å; I141-F145 PolarHBondContact O-N 3.43Å; V143-F145 VanDerWaalsContact C-N 3.29Å; V143-F145 PolarHBondContact O-N 3.09Å; F145-H147 PolarHBondContact O-CD2 2.91Å; F145-H147 PolarHBondContact O-N 3.38Å; F145-L215 HydrophobicContact CE2-CD1 4.43Å; F145-L215 HydrophobicContact CE2-CD2 3.79Å; F145-L215 HydrophobicContact CZ-CD1 4.04Å; F145-L215 HydrophobicContact CZ-CD2 4.21Å
146S84.6Confident87.8Confident13 Ų1348.9 Ų48.99%0.09126%0.257CS..  trans-73.6113.9-174.2630000112.3K67 L142 V143 S152K67-S146 WeakPolarHBondContact CE-O 3.2Å; K67-S146 PolarHBondContact NZ-O 2.87Å; K67-S146 PolarHBondContact NZ-OG 3.32Å; L142-S146 WeakPolarHBondContact O-CA 3.07Å; L142-S146 WeakPolarHBondContact O-CB 3.43Å; L142-S146 PolarHBondContact O-N 3.18Å; V143-S146 WeakPolarHBondContact O-CB 3.24Å; V143-S146 PolarHBondContact O-N 3.16Å; V143-S146 VanDerWaalsContact O-N 3.1Å; V143-S146 PolarHBondContact O-OG 2.97Å; S146-S152 WeakPolarHBondContact CB-OG 3.35Å; S146-S152 PolarHBondContact OG-OG 3.1Å
147H80.7Confident87.6Confident174 Ų17451.5 Ų51.581%0.80627%0.273SS*.  trans-92.6-20.8171.5-63.3-68.9000113.4F145F145-H147 PolarHBondContact O-CD2 2.91Å; F145-H147 PolarHBondContact O-N 3.38Å
148S77.8Confident87.4Confident53 Ų5352.3 Ų52.337%0.37127%0.274SS..SBendtrans-112.3157.7177.269.60000111.5K67 W150 L151 S152K67-S148 PolarHBondContact NZ-O 3.02Å; S148-W150 VanDerWaalsContact C-N 3.32Å; S148-L151 PolarHBondContact O-N 3.29Å; S148-L151 WeakPolarHBondContact OG-CB 3.3Å; S148-L151 PolarHBondContact OG-N 2.93Å; S148-S152 PolarHBondContact O-N 3.2Å; S148-S152 PolarHBondContact O-OG 3.27Å
149V75.9Confident87.3Confident71 Ų7151.4 Ų51.443%0.4326%0.264SS..Hα-helixtrans-63.9-41.3174.8176.40000110.5L151 S152 L153V149-L151 VanDerWaalsContact C-N 3.32Å; V149-L151 PolarHBondContact O-N 3.06Å; V149-S152 WeakPolarHBondContact O-CB 3.43Å; V149-S152 PolarHBondContact O-N 3.44Å; V149-S152 VanDerWaalsContact O-N 3.15Å; V149-L153 HydrophobicContact CG1-CD1 3.93Å; V149-L153 HydrophobicContact CG1-CG 4.21Å; V149-L153 WeakPolarHBondContact O-CG 2.9Å; V149-L153 PolarHBondContact O-N 2.93Å
150W79.4Confident87.2Confident203 Ų20351.4 Ų51.477%0.76926%0.264SS*.Hα-helixtrans-55.8-44.8177.1-66109.3000112.6S148 S152 L153 S154S148-W150 VanDerWaalsContact C-N 3.32Å; W150-S152 PolarHBondContact O-N 2.98Å; W150-L153 PolarHBondContact O-N 3.45Å; W150-S154 PolarHBondContact O-N 3.1Å; W150-S154 PolarHBondContact O-OG 3.14Å
151L84.4Confident87.2Confident63 Ų6353.2 Ų53.233%0.3327%0.274SS..Hα-helixtrans-68.2-35.4179.6-165.263.4000112.2L142 S148 V149 G155L142-L151 HydrophobicContact CD2-CD1 3.55Å; L142-L151 HydrophobicContact CD2-CG 4.18Å; S148-L151 PolarHBondContact O-N 3.29Å; S148-L151 WeakPolarHBondContact OG-CB 3.3Å; S148-L151 PolarHBondContact OG-N 2.93Å; V149-L151 VanDerWaalsContact C-N 3.32Å; V149-L151 PolarHBondContact O-N 3.06Å; L151-G155 PolarHBondContact O-N 2.92Å
152S82.2Confident87.3Confident6 Ų649.8 Ų49.84%0.04226%0.256CS..Hα-helixtrans-63.9-46.5172-53.60000111.4I63 K67 S146 S148 V149 W150 S154 G155 V156I63-S152 WeakPolarHBondContact CG2-OG 3.25Å; K67-S152 PolarHBondContact NZ-OG 3.2Å; S146-S152 WeakPolarHBondContact CB-OG 3.35Å; S146-S152 PolarHBondContact OG-OG 3.1Å; S148-S152 PolarHBondContact O-N 3.2Å; S148-S152 PolarHBondContact O-OG 3.27Å; V149-S152 WeakPolarHBondContact O-CB 3.43Å; V149-S152 PolarHBondContact O-N 3.44Å; V149-S152 VanDerWaalsContact O-N 3.15Å; W150-S152 PolarHBondContact O-N 2.98Å; S152-S154 PolarHBondContact O-N 3.06Å; S152-G155 PolarHBondContact O-N 3.16Å; S152-G155 VanDerWaalsContact O-N 3.13Å; S152-V156 WeakPolarHBondContact O-CG2 3.12Å; S152-V156 PolarHBondContact O-N 3.24Å; S152-V156 VanDerWaalsContact O-N 3.07Å
153L82.3Confident87.4Confident79 Ų7947.6 Ų47.641%0.41425%0.245SC..Hα-helixtrans-64.1-38.7178.5-70.1175.2000112V149 W150 G155 V156 V157V149-L153 HydrophobicContact CG1-CD1 3.93Å; V149-L153 HydrophobicContact CG1-CG 4.21Å; V149-L153 WeakPolarHBondContact O-CG 2.9Å; V149-L153 PolarHBondContact O-N 2.93Å; W150-L153 PolarHBondContact O-N 3.45Å; L153-G155 VanDerWaalsContact C-N 3.26Å; L153-G155 PolarHBondContact O-N 3.02Å; L153-V156 WeakPolarHBondContact O-CB 3.28Å; L153-V156 PolarHBondContact O-N 3.26Å; L153-V157 WeakPolarHBondContact O-CG2 3.31Å; L153-V157 PolarHBondContact O-N 3.25Å
154S87.4Confident87.6Confident61 Ų6147.3 Ų47.343%0.42724%0.244SC..Hα-helixtrans-59.7-38.4172.8-60.70000112W150 S152 V157 L158W150-S154 PolarHBondContact O-N 3.1Å; W150-S154 PolarHBondContact O-OG 3.14Å; S152-S154 PolarHBondContact O-N 3.06Å; S154-V157 PolarHBondContact O-N 3.11Å; S154-L158 WeakPolarHBondContact O-CG 3.42Å; S154-L158 PolarHBondContact O-N 3.33Å
155G90.4Very high87.9Confident0 Ų047.6 Ų47.60%024%0.244CC..Hα-helixtrans-63.5-43.4173.400000112.8S139 L151 S152 L153 V157 L158 A159S139-G155 WeakPolarHBondContact CB-O 3.49Å; L151-G155 PolarHBondContact O-N 2.92Å; S152-G155 PolarHBondContact O-N 3.16Å; S152-G155 VanDerWaalsContact O-N 3.13Å; L153-G155 VanDerWaalsContact C-N 3.26Å; L153-G155 PolarHBondContact O-N 3.02Å; G155-V157 PolarHBondContact O-N 3.25Å; G155-L158 PolarHBondContact O-N 3.27Å; G155-A159 PolarHBondContact O-N 3.45Å
156V87.5Confident88.2Confident17 Ų1742.9 Ų42.910%0.10322%0.223CC..Hα-helixtrans-59-46.9174177.70000110.9M56 D105 S152 L153 L158 A159 S160M56-V156 HydrophobicContact CB-CG2 4.35Å; D105-V156 HydrophobicContact CB-CG1 3.96Å; D105-V156 VanDerWaalsContact OD1-CG1 3.23Å; D105-V156 WeakPolarHBondContact OD1-CG1 3.45Å; S152-V156 WeakPolarHBondContact O-CG2 3.12Å; S152-V156 PolarHBondContact O-N 3.24Å; S152-V156 VanDerWaalsContact O-N 3.07Å; L153-V156 WeakPolarHBondContact O-CB 3.28Å; L153-V156 PolarHBondContact O-N 3.26Å; V156-L158 VanDerWaalsContact C-N 3.31Å; V156-L158 PolarHBondContact O-N 2.93Å; V156-A159 WeakPolarHBondContact O-CB 3.42Å; V156-A159 PolarHBondContact O-N 3.09Å; V156-A159 VanDerWaalsContact O-N 3.09Å; V156-S160 PolarHBondContact O-N 3.32Å
157V90.3Very high88.7Confident56 Ų5642.8 Ų42.834%0.33922%0.221SC..Hα-helixtrans-59.8-39.8177171.70000111.8P108 L153 S154 G155 S160 I161P108-V157 HydrophobicContact CB-CG1 4.32Å; P108-V157 HydrophobicContact CG-CG1 4.07Å; P108-V157 HydrophobicContact CG-CG2 4.36Å; L153-V157 WeakPolarHBondContact O-CG2 3.31Å; L153-V157 PolarHBondContact O-N 3.25Å; S154-V157 PolarHBondContact O-N 3.11Å; G155-V157 PolarHBondContact O-N 3.25Å; V157-S160 WeakPolarHBondContact O-CB 3.41Å; V157-S160 PolarHBondContact O-N 2.95Å; V157-I161 HydrophobicContact CG1-CD1 3.84Å; V157-I161 HydrophobicContact CG1-CG1 4.37Å; V157-I161 VanDerWaalsContact O-CG1 3.3Å; V157-I161 WeakPolarHBondContact O-CG1 3.34Å; V157-I161 PolarHBondContact O-N 3.31Å
158L93.6Very high89.3Confident39 Ų3934.5 Ų34.520%0.20418%0.182CC..Hα-helixtrans-66.3-37.8174.9-73.8177.4000112.9F135 L142 S154 G155 V156 S160 I161 S162F135-L158 HydrophobicContact CD1-CD2 4.31Å; F135-L158 HydrophobicContact CD2-CD2 4.25Å; F135-L158 HydrophobicContact CG-CD2 4.13Å; L142-L158 HydrophobicContact CD1-CD1 3.32Å; S154-L158 WeakPolarHBondContact O-CG 3.42Å; S154-L158 PolarHBondContact O-N 3.33Å; G155-L158 PolarHBondContact O-N 3.27Å; V156-L158 VanDerWaalsContact C-N 3.31Å; V156-L158 PolarHBondContact O-N 2.93Å; L158-S160 VanDerWaalsContact C-N 3.3Å; L158-I161 PolarHBondContact O-N 3.05Å; L158-S162 VanDerWaalsContact O-CB 3.27Å; L158-S162 WeakPolarHBondContact O-CB 3.32Å; L158-S162 PolarHBondContact O-N 3.24Å
159A93Very high90.1Very high0 Ų032 Ų320%017%0.165CC..Hα-helixtrans-61.6-42173.700000110.9M56 G155 V156 S162 S163M56-A159 HydrophobicContact CG-CB 3.82Å; G155-A159 PolarHBondContact O-N 3.45Å; V156-A159 WeakPolarHBondContact O-CB 3.42Å; V156-A159 PolarHBondContact O-N 3.09Å; V156-A159 VanDerWaalsContact O-N 3.09Å; A159-S162 PolarHBondContact O-N 3.07Å; A159-S163 WeakPolarHBondContact O-CB 3.44Å; A159-S163 PolarHBondContact O-N 3.02Å
160S92.8Very high91Very high0 Ų028.6 Ų28.60%014%0.144CC..Hα-helixtrans-61.5-51.8174.4-175.70000112.3D105 P108 T109 V156 V157 L158 S162 S163 G164D105-S160 WeakPolarHBondContact O-CB 3.26Å; D105-S160 PolarHBondContact O-OG 2.75Å; P108-S160 WeakPolarHBondContact CB-OG 3.25Å; T109-S160 PolarHBondContact N-OG 3.04Å; T109-S160 VanDerWaalsContact N-OG 3.16Å; T109-S160 PolarHBondContact OG1-O 3.39Å; T109-S160 PolarHBondContact OG1-OG 3.42Å; V156-S160 PolarHBondContact O-N 3.32Å; V157-S160 WeakPolarHBondContact O-CB 3.41Å; V157-S160 PolarHBondContact O-N 2.95Å; L158-S160 VanDerWaalsContact C-N 3.3Å; S160-S162 VanDerWaalsContact C-N 3.28Å; S160-S162 PolarHBondContact O-N 3.09Å; S160-S163 PolarHBondContact O-N 3.24Å; S160-G164 PolarHBondContact O-N 3.19Å
161I93.9Very high91.6Very high39 Ų3918.9 Ų18.920%0.211%0.108CC..Hα-helixtrans-59.8-42.1179.4-64165.1000110.6P108 I112 F135 V157 L158 L165P108-I161 HydrophobicContact CB-CG1 3.93Å; I112-I161 HydrophobicContact CD1-CG2 4.23Å; I112-I161 HydrophobicContact CG1-CG2 4.26Å; F135-I161 HydrophobicContact CD2-CB 4.16Å; F135-I161 HydrophobicContact CD2-CG2 3.6Å; F135-I161 HydrophobicContact CE2-CG2 3.7Å; V157-I161 HydrophobicContact CG1-CD1 3.84Å; V157-I161 HydrophobicContact CG1-CG1 4.37Å; V157-I161 VanDerWaalsContact O-CG1 3.3Å; V157-I161 WeakPolarHBondContact O-CG1 3.34Å; V157-I161 PolarHBondContact O-N 3.31Å; L158-I161 PolarHBondContact O-N 3.05Å; I161-L165 WeakPolarHBondContact O-CB 3.45Å; I161-L165 PolarHBondContact O-N 2.94Å
162S95.7Very high91.9Very high1 Ų115.9 Ų15.91%0.0079%0.092CC..Hα-helixtrans-58.8-52.6175.7178.20000111.7T132 S136 L158 A159 S160 G164 L165 G166T132-S162 WeakPolarHBondContact CG2-O 3.44Å; T132-S162 PolarHBondContact O-OG 3.49Å; S136-S162 WeakPolarHBondContact CB-OG 3.47Å; S136-S162 PolarHBondContact N-OG 2.65Å; L158-S162 VanDerWaalsContact O-CB 3.27Å; L158-S162 WeakPolarHBondContact O-CB 3.32Å; L158-S162 PolarHBondContact O-N 3.24Å; A159-S162 PolarHBondContact O-N 3.07Å; S160-S162 VanDerWaalsContact C-N 3.28Å; S160-S162 PolarHBondContact O-N 3.09Å; S162-G164 PolarHBondContact O-N 2.73Å; S162-L165 PolarHBondContact O-N 3.27Å; S162-G166 PolarHBondContact O-N 2.91Å
163S94.5Very high92.3Very high7 Ų715.7 Ų15.75%0.0499%0.09CC..Hα-helixtrans-59.5-44.7-179.9-171.60000111.7N49 N50 A159 S160 E167N49-S163 PolarHBondContact ND2-O 2.95Å; N50-S163 PolarHBondContact OD1-OG 2.87Å; A159-S163 WeakPolarHBondContact O-CB 3.44Å; A159-S163 PolarHBondContact O-N 3.02Å; S160-S163 PolarHBondContact O-N 3.24Å; S163-E167 VanDerWaalsContact O-CB 3.25Å; S163-E167 WeakPolarHBondContact O-CB 3.32Å; S163-E167 PolarHBondContact O-N 2.73Å
164G94.4Very high92.7Very high0 Ų012 Ų120%07%0.071CC..Hα-helixtrans-67-46.9179.100000113.6S160 S162 V168S160-G164 PolarHBondContact O-N 3.19Å; S162-G164 PolarHBondContact O-N 2.73Å; G164-V168 WeakPolarHBondContact O-CG2 3.44Å; G164-V168 PolarHBondContact O-N 3.21Å
165L95Very high92.8Very high18 Ų189.5 Ų9.59%0.0945%0.054CC..Hα-helixtrans-63.1-44.8177.8177.762.4000111.2I112 L120 V131 T132 I161 S162 T169I112-L165 HydrophobicContact CG2-CB 4.29Å; L120-L165 HydrophobicContact CD1-CD1 3.69Å; L120-L165 HydrophobicContact CD2-CD1 4.35Å; V131-L165 HydrophobicContact CB-CD2 3.99Å; V131-L165 HydrophobicContact CG1-CD2 3.64Å; T132-L165 WeakPolarHBondContact OG1-CG 3.15Å; I161-L165 WeakPolarHBondContact O-CB 3.45Å; I161-L165 PolarHBondContact O-N 2.94Å; S162-L165 PolarHBondContact O-N 3.27Å; L165-T169 VanDerWaalsContact O-CB 3.26Å; L165-T169 WeakPolarHBondContact O-CB 3.41Å; L165-T169 PolarHBondContact O-N 3.47Å; L165-T169 PolarHBondContact O-OG1 2.98Å
166G95.5Very high92.7Very high0 Ų012.2 Ų12.20%07%0.066CC..Hα-helixtrans-68.8-41.8-179.700000112.1N49 T132 S162 V168 T169 F170N49-G166 VanDerWaalsContact OD1-C 3.3Å; N49-G166 WeakPolarHBondContact OD1-CA 3.49Å; T132-G166 WeakPolarHBondContact OG1-CA 3.41Å; T132-G166 PolarHBondContact OG1-N 3.32Å; S162-G166 PolarHBondContact O-N 2.91Å; G166-V168 PolarHBondContact O-N 2.92Å; G166-T169 PolarHBondContact O-N 2.81Å; G166-F170 VanDerWaalsContact C-CD2 3.47Å; G166-F170 WeakPolarHBondContact O-CB 3.15Å; G166-F170 WeakPolarHBondContact O-CD2 3.31Å; G166-F170 VanDerWaalsContact O-CG 3.3Å; G166-F170 WeakPolarHBondContact O-CG 3.5Å; G166-F170 PolarHBondContact O-N 3.31Å
167E94.9Very high92.7Very high11 Ų1112 Ų125%0.0516%0.063CC..Hα-helixtrans-61.3-46.3178.8-178.8164.8-153.600112.2N49 K113 S163 L171 W185 Y390N49-E167 PolarHBondContact ND2-N 3.25Å; N49-E167 PolarHBondContact OD1-N 3.3Å; K113-E167 WeakPolarHBondContact CE-OE2 3.07Å; K113-E167 VanDerWaalsContact NZ-CD 3.26Å; K113-E167 IonicContact NZ-OE1 3.85Å; K113-E167 IonicContact NZ-OE2 2.71Å; K113-E167 PolarHBondContact NZ-OE2 3.12Å; S163-E167 VanDerWaalsContact O-CB 3.25Å; S163-E167 WeakPolarHBondContact O-CB 3.32Å; S163-E167 PolarHBondContact O-N 2.73Å; E167-L171 HydrophobicContact CG-CD1 3.7Å; E167-L171 HydrophobicContact CG-CG 4.42Å; E167-L171 VanDerWaalsContact O-CB 3.28Å; E167-L171 WeakPolarHBondContact O-CB 3.26Å; E167-L171 WeakPolarHBondContact O-CG 3.44Å; E167-L171 PolarHBondContact O-N 3.33Å; E167-W185 HydrophobicContact CB-CZ2 4.37Å; E167-W185 HydrophobicContact CG-CZ2 4.14Å; E167-Y390 WeakPolarHBondContact OE1-CE2 3.33Å; E167-Y390 PolarHBondContact OE1-OH 3.42Å
168V94.3Very high92.6Very high0 Ų012.9 Ų12.90%07%0.07CC..Hα-helixtrans-58.7-51.1173.7177.80000109.9K113 A116 L120 G164 G166 F170 L171 S172 E411K113-V168 HydrophobicContact CB-CG2 4.34Å; K113-V168 HydrophobicContact CD-CG2 4.34Å; K113-V168 HydrophobicContact CG-CG2 3.75Å; A116-V168 HydrophobicContact CB-CB 4.49Å; A116-V168 HydrophobicContact CB-CG1 3.66Å; A116-V168 HydrophobicContact CB-CG2 4.31Å; L120-V168 HydrophobicContact CD2-CB 4.3Å; L120-V168 HydrophobicContact CD2-CG1 3.61Å; G164-V168 WeakPolarHBondContact O-CG2 3.44Å; G164-V168 PolarHBondContact O-N 3.21Å; G166-V168 PolarHBondContact O-N 2.92Å; V168-F170 PolarHBondContact O-N 2.87Å; V168-L171 PolarHBondContact O-N 3.34Å; V168-S172 WeakPolarHBondContact O-CB 3.41Å; V168-S172 PolarHBondContact O-N 3.44Å; V168-S172 PolarHBondContact O-OG 3.05Å; V168-E411 HydrophobicContact CG1-CB 4.31Å; V168-E411 HydrophobicContact CG1-CG 3.82Å
169T94.4Very high92.2Very high0 Ų012.2 Ų12.20%07%0.069CC..Hα-helixtrans-58.9-47.6-177.8-60.20000112.4Y125 R128 V129 L165 G166 L173Y125-T169 HydrophobicContact CD1-CG2 3.64Å; Y125-T169 HydrophobicContact CE1-CG2 4.18Å; Y125-T169 VanDerWaalsContact CE1-O 3.28Å; Y125-T169 WeakPolarHBondContact CE1-O 3.28Å; R128-T169 HydrophobicContact CB-CG2 3.81Å; V129-T169 HydrophobicContact CG2-CG2 3.84Å; L165-T169 VanDerWaalsContact O-CB 3.26Å; L165-T169 WeakPolarHBondContact O-CB 3.41Å; L165-T169 PolarHBondContact O-N 3.47Å; L165-T169 PolarHBondContact O-OG1 2.98Å; G166-T169 PolarHBondContact O-N 2.81Å; T169-L173 WeakPolarHBondContact O-CB 3.12Å; T169-L173 PolarHBondContact O-N 2.77Å
170F94.8Very high92Very high0 Ų013.8 Ų13.80%08%0.081CC..Hα-helixtrans-76.1-34-174.9-61.8-53000112.3L45 N49 V129 T132 G166 V168 L173 T174 W185 L224 Y228L45-F170 HydrophobicContact CB-CD1 4.5Å; L45-F170 HydrophobicContact CB-CG 4.48Å; L45-F170 HydrophobicContact CD1-CD1 3.65Å; L45-F170 HydrophobicContact CD1-CE1 3.72Å; L45-F170 HydrophobicContact CD1-CG 4.34Å; L45-F170 HydrophobicContact CD1-CZ 4.48Å; L45-F170 HydrophobicContact CD2-CD1 4.36Å; L45-F170 HydrophobicContact CD2-CE1 3.68Å; L45-F170 HydrophobicContact CD2-CE2 4.35Å; L45-F170 HydrophobicContact CD2-CZ 3.69Å; L45-F170 HydrophobicContact CG-CD1 4.4Å; L45-F170 HydrophobicContact CG-CE1 4.19Å; L45-F170 HydrophobicContact CG-CZ 4.49Å; N49-F170 HydrophobicContact CB-CD2 4.46Å; N49-F170 HydrophobicContact CB-CE2 4.43Å; V129-F170 HydrophobicContact CB-CE1 4.46Å; V129-F170 HydrophobicContact CG1-CE1 4.13Å; V129-F170 HydrophobicContact CG1-CZ 4Å; V129-F170 HydrophobicContact CG2-CD1 4.41Å; V129-F170 HydrophobicContact CG2-CE1 3.51Å; V129-F170 HydrophobicContact CG2-CZ 3.93Å; T132-F170 HydrophobicContact CG2-CE2 4.5Å; G166-F170 VanDerWaalsContact C-CD2 3.47Å; G166-F170 WeakPolarHBondContact O-CB 3.15Å; G166-F170 WeakPolarHBondContact O-CD2 3.31Å; G166-F170 VanDerWaalsContact O-CG 3.3Å; G166-F170 WeakPolarHBondContact O-CG 3.5Å; G166-F170 PolarHBondContact O-N 3.31Å; V168-F170 PolarHBondContact O-N 2.87Å; F170-L173 HydrophobicContact CD1-CD2 4.5Å; F170-L173 WeakPolarHBondContact O-CB 3.38Å; F170-L173 PolarHBondContact O-N 2.88Å; F170-T174 WeakPolarHBondContact O-CG2 3.26Å; F170-T174 PolarHBondContact O-N 2.68Å; F170-T174 VanDerWaalsContact O-N 3.08Å; F170-W185 HydrophobicContact CB-CD2 4.33Å; F170-W185 HydrophobicContact CB-CE3 3.72Å; F170-W185 HydrophobicContact CB-CH2 3.54Å; F170-W185 HydrophobicContact CB-CZ2 4.14Å; F170-W185 HydrophobicContact CB-CZ3 3.26Å; F170-W185 AromaticContact CD2-CH2 3.46Å; F170-W185 HydrophobicContact CD2-CH2 3.46Å; F170-W185 VanDerWaalsContact CD2-CH2 3.46Å; F170-W185 AromaticContact CD2-CZ3 3.4Å; F170-W185 HydrophobicContact CD2-CZ3 3.4Å; F170-W185 HydrophobicContact CE2-CZ3 4.41Å; F170-W185 HydrophobicContact CG-CE3 4.35Å; F170-W185 AromaticContact CG-CH2 3.9Å; F170-W185 HydrophobicContact CG-CH2 3.9Å; F170-W185 AromaticContact CG-CZ3 3.55Å; F170-W185 HydrophobicContact CG-CZ3 3.55Å; F170-L224 HydrophobicContact CE2-CD1 4.24Å; F170-L224 HydrophobicContact CE2-CG 4.5Å; F170-L224 HydrophobicContact CZ-CD1 4.47Å; F170-L224 HydrophobicContact CZ-CD2 4.07Å; F170-L224 HydrophobicContact CZ-CG 4.27Å; F170-Y228 HydrophobicContact CE1-CD2 4.23Å
171L92.4Very high92Very high0 Ų014.2 Ų14.20%08%0.083CC..Hα-helixtrans-65.9-43.8171.4-77.2169.2000111.5E167 V168 L173 T174 Y394 C414E167-L171 HydrophobicContact CG-CD1 3.7Å; E167-L171 HydrophobicContact CG-CG 4.42Å; E167-L171 VanDerWaalsContact O-CB 3.28Å; E167-L171 WeakPolarHBondContact O-CB 3.26Å; E167-L171 WeakPolarHBondContact O-CG 3.44Å; E167-L171 PolarHBondContact O-N 3.33Å; V168-L171 PolarHBondContact O-N 3.34Å; L171-L173 VanDerWaalsContact C-N 3.27Å; L171-L173 PolarHBondContact O-N 3.39Å; L171-T174 WeakPolarHBondContact O-CB 3.19Å; L171-T174 PolarHBondContact O-N 3.11Å; L171-T174 VanDerWaalsContact O-N 3.13Å; L171-T174 PolarHBondContact O-OG1 3.22Å; L171-Y394 HydrophobicContact CD1-CD1 4.22Å; L171-Y394 HydrophobicContact CD1-CE1 3.54Å; L171-Y394 HydrophobicContact CD1-CE2 4.35Å; L171-Y394 HydrophobicContact CD2-CD1 3.89Å; L171-Y394 HydrophobicContact CD2-CD2 4.46Å; L171-Y394 HydrophobicContact CD2-CE1 4.08Å; L171-Y394 HydrophobicContact CD2-CG 4.08Å; L171-Y394 HydrophobicContact CG-CE1 4.37Å; L171-C414 HydrophobicContact CD1-CB 4.27Å
172S91Very high92Very high0 Ų012.4 Ų12.40%07%0.074CC..Hα-helixtrans-57.6-43171.7-55.30000111.3Y125 V168 T174 A175 E411Y125-S172 WeakPolarHBondContact OH-CB 3.34Å; V168-S172 WeakPolarHBondContact O-CB 3.41Å; V168-S172 PolarHBondContact O-N 3.44Å; V168-S172 PolarHBondContact O-OG 3.05Å; S172-T174 PolarHBondContact O-N 2.82Å; S172-A175 WeakPolarHBondContact O-CB 3.28Å; S172-A175 PolarHBondContact O-N 2.79Å; S172-E411 VanDerWaalsContact OG-CD 3.28Å; S172-E411 WeakPolarHBondContact OG-CG 3.49Å; S172-E411 PolarHBondContact OG-OE1 3.11Å
173L90.8Very high91.9Very high1 Ų112.6 Ų12.61%0.0058%0.076CC..Hα-helixtrans-60.6-33.6178.5-172.966.2000111.9F42 Y125 T169 F170 L171 A175 F176 Y177 Y228 L232F42-L173 HydrophobicContact CE1-CD2 4.29Å; F42-L173 HydrophobicContact CE1-CG 4.47Å; F42-L173 HydrophobicContact CZ-CD2 4.15Å; F42-L173 HydrophobicContact CZ-CG 4.15Å; Y125-L173 HydrophobicContact CD1-CB 4.06Å; Y125-L173 HydrophobicContact CD1-CD1 3.93Å; Y125-L173 HydrophobicContact CD1-CG 4.49Å; Y125-L173 HydrophobicContact CE1-CB 3.77Å; Y125-L173 HydrophobicContact CE1-CD1 4.11Å; Y125-L173 HydrophobicContact CG-CD1 4.18Å; T169-L173 WeakPolarHBondContact O-CB 3.12Å; T169-L173 PolarHBondContact O-N 2.77Å; F170-L173 HydrophobicContact CD1-CD2 4.5Å; F170-L173 WeakPolarHBondContact O-CB 3.38Å; F170-L173 PolarHBondContact O-N 2.88Å; L171-L173 VanDerWaalsContact C-N 3.27Å; L171-L173 PolarHBondContact O-N 3.39Å; L173-A175 PolarHBondContact O-N 3.5Å; L173-A175 VanDerWaalsContact O-N 3.09Å; L173-F176 HydrophobicContact CD1-CD2 4.42Å; L173-F176 PolarHBondContact O-N 3.29Å; L173-Y177 HydrophobicContact CD1-CE2 4.11Å; L173-Y177 HydrophobicContact CG-CD2 4.44Å; L173-Y177 HydrophobicContact CG-CE2 3.96Å; L173-Y177 WeakPolarHBondContact O-CD2 3.21Å; L173-Y228 HydrophobicContact CD2-CD2 4.21Å; L173-Y228 HydrophobicContact CD2-CE2 3.81Å; L173-L232 HydrophobicContact CD2-CD1 4.48Å
174T90.9Very high91.9Very high3 Ų316.5 Ų16.52%0.0189%0.089CC..Hα-helixtrans-60.3-20.4175.470.20000113.1F42 F170 L171 S172 F176 Y177 I182F42-T174 HydrophobicContact CD1-CG2 4.01Å; F42-T174 HydrophobicContact CE1-CG2 3.59Å; F42-T174 HydrophobicContact CZ-CG2 4.16Å; F170-T174 WeakPolarHBondContact O-CG2 3.26Å; F170-T174 PolarHBondContact O-N 2.68Å; F170-T174 VanDerWaalsContact O-N 3.08Å; L171-T174 WeakPolarHBondContact O-CB 3.19Å; L171-T174 PolarHBondContact O-N 3.11Å; L171-T174 VanDerWaalsContact O-N 3.13Å; L171-T174 PolarHBondContact O-OG1 3.22Å; S172-T174 PolarHBondContact O-N 2.82Å; T174-F176 PolarHBondContact O-N 2.79Å; T174-F176 VanDerWaalsContact O-N 3.15Å; T174-Y177 PolarHBondContact O-N 3.42Å; T174-Y177 VanDerWaalsContact O-N 3.09Å; T174-Y177 VanDerWaalsContact O-O 3.09Å; T174-I182 HydrophobicContact CG2-CG1 4.09Å
175A88.6Confident92Very high7 Ų716.5 Ų16.56%0.0589%0.089CC..THydrogen-bonded Turntrans-63.9-14.8174.700000113.3S172 L173 R406 E407S172-A175 WeakPolarHBondContact O-CB 3.28Å; S172-A175 PolarHBondContact O-N 2.79Å; L173-A175 PolarHBondContact O-N 3.5Å; L173-A175 VanDerWaalsContact O-N 3.09Å; A175-R406 HydrophobicContact CB-CB 4.1Å; A175-R406 HydrophobicContact CB-CG 3.73Å; A175-R406 PolarHBondContact O-NE 2.87Å; A175-R406 PolarHBondContact O-NH2 3.31Å; A175-E407 HydrophobicContact CB-CB 4.2Å
176F87.8Confident92Very high57 Ų5715.7 Ų15.725%0.259%0.085CC..THydrogen-bonded Turntrans-102.1-0.9176.5-57.4-78.4000113.4Y125 L173 T174 P235 W268Y125-F176 AromaticContact CE2-CE2 3.87Å; Y125-F176 HydrophobicContact CE2-CE2 3.87Å; Y125-F176 AromaticContact CZ-CE2 3.89Å; L173-F176 HydrophobicContact CD1-CD2 4.42Å; L173-F176 PolarHBondContact O-N 3.29Å; T174-F176 PolarHBondContact O-N 2.79Å; T174-F176 VanDerWaalsContact O-N 3.15Å; F176-P235 HydrophobicContact CB-CG 4.23Å; F176-P235 WeakPolarHBondContact O-CB 3.46Å; F176-W268 HydrophobicContact CZ-CH2 4.45Å
177Y88.3Confident92Very high14 Ų1416.2 Ų16.26%0.0559%0.089CC..SBendtrans-119.1163.2-177.8-71.5-99.3000110.8N38 F42 L173 T174 S179 M181 L232 T233N38-Y177 HydrophobicContact CB-CD1 4.27Å; N38-Y177 HydrophobicContact CB-CE1 4.27Å; F42-Y177 AromaticContact CE2-CD1 3.84Å; F42-Y177 HydrophobicContact CE2-CD1 3.84Å; F42-Y177 AromaticContact CE2-CD2 3.77Å; F42-Y177 HydrophobicContact CE2-CD2 3.77Å; F42-Y177 HydrophobicContact CE2-CE1 4.15Å; F42-Y177 HydrophobicContact CE2-CE2 4.1Å; F42-Y177 AromaticContact CE2-CG 3.63Å; F42-Y177 HydrophobicContact CE2-CG 3.63Å; F42-Y177 AromaticContact CZ-CD2 3.66Å; F42-Y177 HydrophobicContact CZ-CD2 3.66Å; F42-Y177 AromaticContact CZ-CE2 3.97Å; F42-Y177 HydrophobicContact CZ-CE2 3.97Å; F42-Y177 AromaticContact CZ-CG 3.98Å; F42-Y177 HydrophobicContact CZ-CG 3.98Å; L173-Y177 HydrophobicContact CD1-CE2 4.11Å; L173-Y177 HydrophobicContact CG-CD2 4.44Å; L173-Y177 HydrophobicContact CG-CE2 3.96Å; L173-Y177 WeakPolarHBondContact O-CD2 3.21Å; T174-Y177 PolarHBondContact O-N 3.42Å; T174-Y177 VanDerWaalsContact O-N 3.09Å; T174-Y177 VanDerWaalsContact O-O 3.09Å; Y177-S179 PolarHBondContact O-N 3.13Å; Y177-M181 HydrophobicContact CD1-CG 4.47Å; Y177-M181 HydrophobicContact CG-CG 4.41Å; Y177-L232 HydrophobicContact CE1-CD2 3.85Å; Y177-L232 HydrophobicContact CE2-CD2 4.42Å; Y177-T233 WeakPolarHBondContact CE1-O 3.33Å; Y177-T233 PolarHBondContact OH-O 3.45Å; Y177-T233 VanDerWaalsContact OH-O 3.09Å
178P87.9Confident92Very high73 Ų7315.7 Ų15.747%0.4749%0.086SC..  trans-53.9139.1172.7-25.934.9000111.3A180 M181P178-A180 HydrophobicContact CB-CB 4.5Å; P178-A180 PolarHBondContact O-N 3.24Å; P178-M181 WeakPolarHBondContact O-CB 3.43Å; P178-M181 WeakPolarHBondContact O-CG 3.4Å; P178-M181 PolarHBondContact O-N 2.84Å
179S85.9Confident92Very high26 Ų2616 Ų1618%0.1829%0.088CC..THydrogen-bonded Turntrans-58.2-15.1-176.9-42.20000114Y177 M181 I182Y177-S179 PolarHBondContact O-N 3.13Å; S179-M181 PolarHBondContact O-N 3.18Å; S179-I182 WeakPolarHBondContact O-CB 3.43Å; S179-I182 PolarHBondContact O-N 2.81Å
180A88.1Confident91.9Very high32 Ų3216 Ų1626%0.2649%0.088SC..Hα-helixtrans-55-34167.500000113.5P178 I182 S183 Y339P178-A180 HydrophobicContact CB-CB 4.5Å; P178-A180 PolarHBondContact O-N 3.24Å; A180-I182 PolarHBondContact O-N 2.97Å; A180-S183 WeakPolarHBondContact O-CB 3.39Å; A180-S183 PolarHBondContact O-N 3.36Å; A180-S183 VanDerWaalsContact O-N 3.16Å; A180-Y339 VanDerWaalsContact CB-OH 3.27Å; A180-Y339 WeakPolarHBondContact CB-OH 3.43Å
181M92.6Very high91.8Very high9 Ų916.1 Ų16.14%0.0449%0.09CC..Hα-helixtrans-65.3-27.1-179.1-63.7-51.6117.600112.7N38 A39 F42 Y177 P178 S179 S183 W184 W185N38-M181 VanDerWaalsContact C-SD 3.57Å; N38-M181 HydrophobicContact CB-SD 3.86Å; A39-M181 HydrophobicContact CB-CE 4.26Å; A39-M181 HydrophobicContact CB-SD 4.18Å; A39-M181 PolarHBondContact N-SD 3.28Å; A39-M181 VanDerWaalsContact N-SD 3.42Å; F42-M181 HydrophobicContact CD2-CB 3.61Å; F42-M181 HydrophobicContact CD2-CG 3.73Å; F42-M181 HydrophobicContact CD2-SD 3.95Å; F42-M181 HydrophobicContact CE2-CB 3.89Å; F42-M181 HydrophobicContact CE2-CG 3.91Å; F42-M181 HydrophobicContact CG-CB 4.07Å; Y177-M181 HydrophobicContact CD1-CG 4.47Å; Y177-M181 HydrophobicContact CG-CG 4.41Å; P178-M181 WeakPolarHBondContact O-CB 3.43Å; P178-M181 WeakPolarHBondContact O-CG 3.4Å; P178-M181 PolarHBondContact O-N 2.84Å; S179-M181 PolarHBondContact O-N 3.18Å; M181-S183 VanDerWaalsContact C-N 3.26Å; M181-S183 PolarHBondContact O-N 3.42Å; M181-W184 PolarHBondContact O-N 3.38Å; M181-W184 VanDerWaalsContact O-N 3.12Å; M181-W185 WeakPolarHBondContact O-CB 3.46Å; M181-W185 PolarHBondContact O-N 2.77Å
182I93.3Very high91.7Very high1 Ų116.1 Ų16.11%0.0059%0.09CC..Hα-helixtrans-61.3-38175.7-61.8170.6000110.6T174 S179 A180 W184 S186 A398 M410T174-I182 HydrophobicContact CG2-CG1 4.09Å; S179-I182 WeakPolarHBondContact O-CB 3.43Å; S179-I182 PolarHBondContact O-N 2.81Å; A180-I182 PolarHBondContact O-N 2.97Å; I182-W184 VanDerWaalsContact C-N 3.35Å; I182-S186 WeakPolarHBondContact O-CB 3.32Å; I182-S186 PolarHBondContact O-N 2.85Å; I182-A398 HydrophobicContact CD1-CB 3.3Å; I182-M410 HydrophobicContact CD1-CE 3.92Å
183S93.4Very high91.5Very high5 Ų516.3 Ų16.34%0.0359%0.091CC..Hα-helixtrans-64.5-40.2175.6-167.80000112A180 M181 S187 L338A180-S183 WeakPolarHBondContact O-CB 3.39Å; A180-S183 PolarHBondContact O-N 3.36Å; A180-S183 VanDerWaalsContact O-N 3.16Å; M181-S183 VanDerWaalsContact C-N 3.26Å; M181-S183 PolarHBondContact O-N 3.42Å; S183-S187 VanDerWaalsContact O-CB 3.25Å; S183-S187 WeakPolarHBondContact O-CB 3.5Å; S183-S187 PolarHBondContact O-N 3.36Å; S183-L338 WeakPolarHBondContact OG-CB 3.39Å
184W95.5Very high91.4Very high90 Ų9018.3 Ų18.334%0.34110%0.102SC..Hα-helixtrans-71.2-45.1-179.4-73.7100.6000111.6A39 F42 W43 M181 I182 S186 S187 G188A39-W184 HydrophobicContact CB-CD2 3.75Å; A39-W184 HydrophobicContact CB-CE3 4.47Å; A39-W184 HydrophobicContact CB-CG 3.78Å; A39-W184 HydrophobicContact CB-CZ2 4.19Å; A39-W184 WeakPolarHBondContact O-CB 3.44Å; F42-W184 HydrophobicContact CB-CB 4.36Å; W43-W184 WeakPolarHBondContact CA-O 3.47Å; W43-W184 HydrophobicContact CB-CB 4.42Å; W43-W184 HydrophobicContact CB-CE3 4.05Å; W43-W184 HydrophobicContact CG-CE3 4.23Å; M181-W184 PolarHBondContact O-N 3.38Å; M181-W184 VanDerWaalsContact O-N 3.12Å; I182-W184 VanDerWaalsContact C-N 3.35Å; W184-S186 PolarHBondContact O-N 2.96Å; W184-S187 PolarHBondContact O-N 3Å; W184-G188 PolarHBondContact O-N 3.42Å
185W95.8Very high91.4Very high0 Ų021.9 Ų21.90%012%0.12CC..Hα-helixtrans-54.7-50.3169.9166.4-97.2000111.7F42 L45 G46 N49 E167 F170 M181 S187 G188 T189 Y390F42-W185 HydrophobicContact CB-CB 4.25Å; F42-W185 HydrophobicContact CD1-CB 4.26Å; F42-W185 WeakPolarHBondContact O-CA 3.44Å; L45-W185 HydrophobicContact CB-CE3 4.07Å; L45-W185 HydrophobicContact CB-CZ3 3.8Å; G46-W185 VanDerWaalsContact N-CE3 3.32Å; N49-W185 HydrophobicContact CB-CH2 3.76Å; N49-W185 HydrophobicContact CB-CZ3 4.36Å; E167-W185 HydrophobicContact CB-CZ2 4.37Å; E167-W185 HydrophobicContact CG-CZ2 4.14Å; F170-W185 HydrophobicContact CB-CD2 4.33Å; F170-W185 HydrophobicContact CB-CE3 3.72Å; F170-W185 HydrophobicContact CB-CH2 3.54Å; F170-W185 HydrophobicContact CB-CZ2 4.14Å; F170-W185 HydrophobicContact CB-CZ3 3.26Å; F170-W185 AromaticContact CD2-CH2 3.46Å; F170-W185 HydrophobicContact CD2-CH2 3.46Å; F170-W185 VanDerWaalsContact CD2-CH2 3.46Å; F170-W185 AromaticContact CD2-CZ3 3.4Å; F170-W185 HydrophobicContact CD2-CZ3 3.4Å; F170-W185 HydrophobicContact CE2-CZ3 4.41Å; F170-W185 HydrophobicContact CG-CE3 4.35Å; F170-W185 AromaticContact CG-CH2 3.9Å; F170-W185 HydrophobicContact CG-CH2 3.9Å; F170-W185 AromaticContact CG-CZ3 3.55Å; F170-W185 HydrophobicContact CG-CZ3 3.55Å; M181-W185 WeakPolarHBondContact O-CB 3.46Å; M181-W185 PolarHBondContact O-N 2.77Å; W185-S187 PolarHBondContact O-N 3.45Å; W185-G188 PolarHBondContact O-N 3.41Å; W185-T189 HydrophobicContact CD2-CG2 4.29Å; W185-T189 HydrophobicContact CH2-CG2 4.25Å; W185-T189 HydrophobicContact CZ2-CG2 3.69Å; W185-T189 WeakPolarHBondContact O-CG2 3.47Å; W185-T189 PolarHBondContact O-N 3.49Å; W185-T189 PolarHBondContact O-OG1 3.41Å; W185-Y390 PolarHBondContact NE1-OH 3.43Å
186S94.9Very high91.3Very high0 Ų021.5 Ų21.50%012%0.118CC..Hα-helixtrans-64.2-42.7-179.8-169.40000112I182 W184 G188 T189 G190 R335 Y390 V391I182-S186 WeakPolarHBondContact O-CB 3.32Å; I182-S186 PolarHBondContact O-N 2.85Å; W184-S186 PolarHBondContact O-N 2.96Å; S186-G188 VanDerWaalsContact C-N 3.34Å; S186-G188 PolarHBondContact O-N 3.21Å; S186-T189 WeakPolarHBondContact CA-OG1 3.06Å; S186-T189 PolarHBondContact O-N 2.91Å; S186-T189 PolarHBondContact O-OG1 3.17Å; S186-G190 PolarHBondContact O-N 2.69Å; S186-R335 WeakPolarHBondContact O-CB 3.2Å; S186-R335 WeakPolarHBondContact O-CD 3.22Å; S186-R335 WeakPolarHBondContact OG-CB 2.88Å; S186-R335 WeakPolarHBondContact OG-CD 3.42Å; S186-R335 WeakPolarHBondContact OG-CG 3.47Å; S186-Y390 WeakPolarHBondContact OG-CD1 3.33Å; S186-Y390 WeakPolarHBondContact OG-CE1 3.32Å; S186-V391 WeakPolarHBondContact OG-CB 3.43Å
187S95.5Very high90.9Very high12 Ų1220.7 Ų20.78%0.08412%0.119CC..Hα-helixtrans-59.8-44.6173.7178.80000111.6W43 S183 W184 W185 T189 G190 G191 F332 S336W43-S187 PolarHBondContact NE1-OG 3.22Å; S183-S187 VanDerWaalsContact O-CB 3.25Å; S183-S187 WeakPolarHBondContact O-CB 3.5Å; S183-S187 PolarHBondContact O-N 3.36Å; W184-S187 PolarHBondContact O-N 3Å; W185-S187 PolarHBondContact O-N 3.45Å; S187-T189 PolarHBondContact O-N 3.4Å; S187-G190 PolarHBondContact O-N 3.08Å; S187-G191 PolarHBondContact O-N 3.44Å; S187-F332 WeakPolarHBondContact O-CD2 3.38Å; S187-S336 WeakPolarHBondContact CB-OG 3.17Å; S187-S336 PolarHBondContact OG-OG 3.02Å
188G95.9Very high90.8Very high0 Ų024.2 Ų24.20%014%0.142CC..Hα-helixtrans-58.7-47.417700000112.7W43 G46 L47 W184 W185 S186 G190 G191 A192W43-G188 WeakPolarHBondContact O-CA 3.38Å; G46-G188 VanDerWaalsContact C-C 3.44Å; L47-G188 VanDerWaalsContact CA-O 3.25Å; L47-G188 WeakPolarHBondContact CA-O 3.29Å; L47-G188 VanDerWaalsContact N-C 3.34Å; L47-G188 PolarHBondContact N-O 2.87Å; W184-G188 PolarHBondContact O-N 3.42Å; W185-G188 PolarHBondContact O-N 3.41Å; S186-G188 VanDerWaalsContact C-N 3.34Å; S186-G188 PolarHBondContact O-N 3.21Å; G188-G190 VanDerWaalsContact C-N 3.32Å; G188-G190 PolarHBondContact O-N 2.9Å; G188-G191 CarbonylContact O-C 3.46Å; G188-G191 WeakPolarHBondContact O-CA 3.34Å; G188-G191 PolarHBondContact O-N 3.35Å; G188-A192 PolarHBondContact O-N 3.17Å
189T94.3Very high90.8Very high5 Ų522.3 Ų22.33%0.03113%0.13CC..Hα-helixtrans-63-34.5176.751.70000112.9G46 W185 S186 S187 A192 R335G46-T189 WeakPolarHBondContact O-CA 3.38Å; G46-T189 WeakPolarHBondContact O-CG2 3.39Å; W185-T189 HydrophobicContact CD2-CG2 4.29Å; W185-T189 HydrophobicContact CH2-CG2 4.25Å; W185-T189 HydrophobicContact CZ2-CG2 3.69Å; W185-T189 WeakPolarHBondContact O-CG2 3.47Å; W185-T189 PolarHBondContact O-N 3.49Å; W185-T189 PolarHBondContact O-OG1 3.41Å; S186-T189 WeakPolarHBondContact CA-OG1 3.06Å; S186-T189 PolarHBondContact O-N 2.91Å; S186-T189 PolarHBondContact O-OG1 3.17Å; S187-T189 PolarHBondContact O-N 3.4Å; T189-A192 WeakPolarHBondContact O-CB 3.46Å; T189-A192 PolarHBondContact O-N 3.44Å; T189-R335 PolarHBondContact OG1-NH1 3.46Å
190G91.2Very high90.8Very high1 Ų121.4 Ų21.41%0.0112%0.123CC..Hα-helixtrans-67.1-38.2169.400000112.6S186 S187 G188 A192 G193S186-G190 PolarHBondContact O-N 2.69Å; S187-G190 PolarHBondContact O-N 3.08Å; G188-G190 VanDerWaalsContact C-N 3.32Å; G188-G190 PolarHBondContact O-N 2.9Å; G190-A192 PolarHBondContact O-N 3.43Å; G190-G193 PolarHBondContact O-N 2.68Å
191G92.6Very high90.4Very high3 Ų323.1 Ų23.13%0.03113%0.127CC..Hα-helixtrans-62.4-30.8174.900000112.8S187 G188 G193 L194 L195S187-G191 PolarHBondContact O-N 3.44Å; G188-G191 CarbonylContact O-C 3.46Å; G188-G191 WeakPolarHBondContact O-CA 3.34Å; G188-G191 PolarHBondContact O-N 3.35Å; G191-G193 VanDerWaalsContact C-N 3.32Å; G191-G193 PolarHBondContact O-N 3.1Å; G191-L194 PolarHBondContact O-N 3.32Å; G191-L195 VanDerWaalsContact O-CB 3.29Å; G191-L195 WeakPolarHBondContact O-CB 3.38Å; G191-L195 WeakPolarHBondContact O-CG 3.28Å; G191-L195 PolarHBondContact O-N 2.88Å
192A92.3Very high90.1Very high0 Ų024.4 Ų24.40%014%0.142CC..Hα-helixtrans-61.2-39177.100000112.8L47 N50 G188 T189 G190 G196L47-A192 HydrophobicContact CD1-CB 4.16Å; L47-A192 VanDerWaalsContact O-CB 3.24Å; L47-A192 WeakPolarHBondContact O-CB 3.34Å; N50-A192 HydrophobicContact CB-CB 3.73Å; G188-A192 PolarHBondContact O-N 3.17Å; T189-A192 WeakPolarHBondContact O-CB 3.46Å; T189-A192 PolarHBondContact O-N 3.44Å; G190-A192 PolarHBondContact O-N 3.43Å; A192-G196 WeakPolarHBondContact O-CA 3.19Å; A192-G196 PolarHBondContact O-N 3.19Å
193G85.9Confident89.9Confident3 Ų326.8 Ų26.83%0.03116%0.155CC..Hα-helixtrans-61.2-47.2176.400000112.4G190 G191 S197G190-G193 PolarHBondContact O-N 2.68Å; G191-G193 VanDerWaalsContact C-N 3.32Å; G191-G193 PolarHBondContact O-N 3.1Å; G193-S197 WeakPolarHBondContact O-CB 2.84Å; G193-S197 PolarHBondContact O-N 2.79Å; G193-S197 PolarHBondContact O-OG 3.46Å
194L87.8Confident89.4Confident43 Ų4328.9 Ų28.923%0.22517%0.165CC..Hα-helixtrans-74-52.3-179.2-170.467.6000112G191 S197 V198G191-L194 PolarHBondContact O-N 3.32Å; L194-S197 PolarHBondContact O-OG 3.27Å; L194-S197 VanDerWaalsContact O-OG 3.11Å; L194-V198 WeakPolarHBondContact O-CB 3.2Å; L194-V198 WeakPolarHBondContact O-CG2 3.46Å; L194-V198 PolarHBondContact O-N 3.12Å; L194-V198 VanDerWaalsContact O-N 3.13Å
195L90.9Very high88.9Confident78 Ų7831.5 Ų31.541%0.40818%0.181SC..Hα-helixtrans-71.2-37.6-176.1-66.2179.3000112.1W43 L47 F51 G191 S199W43-L195 HydrophobicContact CH2-CD1 4.42Å; L47-L195 HydrophobicContact CD1-CB 4.28Å; L47-L195 HydrophobicContact CD1-CD1 3.79Å; L47-L195 HydrophobicContact CD2-CD1 4.14Å; F51-L195 HydrophobicContact CE2-CB 4.45Å; G191-L195 VanDerWaalsContact O-CB 3.29Å; G191-L195 WeakPolarHBondContact O-CB 3.38Å; G191-L195 WeakPolarHBondContact O-CG 3.28Å; G191-L195 PolarHBondContact O-N 2.88Å; L195-S199 WeakPolarHBondContact O-CB 3.49Å; L195-S199 PolarHBondContact O-N 3.4Å; L195-S199 PolarHBondContact O-OG 2.8Å
196G86.8Confident88.6Confident0 Ų035.1 Ų35.10%021%0.211CC..Hα-helixtrans-62.5-51178.300000111.8A192 S199 Y200A192-G196 WeakPolarHBondContact O-CA 3.19Å; A192-G196 PolarHBondContact O-N 3.19Å; G196-S199 PolarHBondContact O-N 3.42Å; G196-S199 PolarHBondContact O-OG 3.5Å; G196-Y200 PolarHBondContact O-N 2.91Å
197S79.8Confident88.3Confident40 Ų4038.3 Ų38.328%0.2824%0.244SC..Hα-helixtrans-64-45179.658.80000112.7G193 L194 L201G193-S197 WeakPolarHBondContact O-CB 2.84Å; G193-S197 PolarHBondContact O-N 2.79Å; G193-S197 PolarHBondContact O-OG 3.46Å; L194-S197 PolarHBondContact O-OG 3.27Å; L194-S197 VanDerWaalsContact O-OG 3.11Å; S197-L201 WeakPolarHBondContact O-CB 3.45Å; S197-L201 PolarHBondContact O-N 2.98Å
198V85.5Confident87.9Confident87 Ų8740.7 Ų40.753%0.52726%0.255SS..Hα-helixtrans-66.4-40.5178.1172.40000111.7L194 G202L194-V198 WeakPolarHBondContact O-CB 3.2Å; L194-V198 WeakPolarHBondContact O-CG2 3.46Å; L194-V198 PolarHBondContact O-N 3.12Å; L194-V198 VanDerWaalsContact O-N 3.13Å; V198-G202 WeakPolarHBondContact O-CA 3.34Å; V198-G202 PolarHBondContact O-N 2.99Å
199S89.3Confident87.5Confident33 Ų3342.9 Ų42.923%0.23127%0.271CS..Hα-helixtrans-64.6-43.9-178.769.90000112.6F51 L195 G196 L203 M217F51-S199 WeakPolarHBondContact CZ-OG 3.13Å; L195-S199 WeakPolarHBondContact O-CB 3.49Å; L195-S199 PolarHBondContact O-N 3.4Å; L195-S199 PolarHBondContact O-OG 2.8Å; G196-S199 PolarHBondContact O-N 3.42Å; G196-S199 PolarHBondContact O-OG 3.5Å; S199-L203 WeakPolarHBondContact O-CB 3.03Å; S199-L203 VanDerWaalsContact O-CG 3.32Å; S199-L203 WeakPolarHBondContact O-CG 3.33Å; S199-L203 PolarHBondContact O-N 3.28Å; S199-L203 VanDerWaalsContact O-N 3.08Å; S199-M217 VanDerWaalsContact OG-CE 3.28Å; S199-M217 WeakPolarHBondContact OG-CE 3.34Å
200Y84.8Confident87Confident7 Ų745.3 Ų45.33%0.02729%0.287CS..Hα-helixtrans-65.5-50.8180-178.8-97.1000110V55 A59 G196 G202 L203 I204 T213 L214V55-Y200 HydrophobicContact CG1-CD2 3.77Å; V55-Y200 HydrophobicContact CG1-CE2 4.44Å; V55-Y200 HydrophobicContact CG1-CG 4.33Å; A59-Y200 HydrophobicContact CB-CE1 4.26Å; A59-Y200 HydrophobicContact CB-CE2 3.89Å; G196-Y200 PolarHBondContact O-N 2.91Å; Y200-G202 PolarHBondContact O-N 3.19Å; Y200-L203 PolarHBondContact O-N 3.17Å; Y200-I204 HydrophobicContact CD1-CG1 4.36Å; Y200-I204 HydrophobicContact CE1-CG1 4.03Å; Y200-I204 VanDerWaalsContact O-CG1 3.28Å; Y200-I204 WeakPolarHBondContact O-CG1 3.25Å; Y200-I204 PolarHBondContact O-N 3.26Å; Y200-I204 VanDerWaalsContact O-N 3.1Å; Y200-T213 HydrophobicContact CD2-CG2 3.55Å; Y200-T213 HydrophobicContact CE2-CG2 3.83Å; Y200-T213 HydrophobicContact CG-CG2 4.36Å; Y200-L214 HydrophobicContact CD2-CD2 4.45Å; Y200-L214 HydrophobicContact CE2-CD2 4.06Å; Y200-L214 HydrophobicContact CE2-CG 4.36Å
201L81.3Confident86.8Confident69 Ų6948.9 Ų48.936%0.36130%0.303SS..Hα-helixtrans-62.9-41.9179.3-177.761.7000112.1S197 L203 I204 Q205S197-L201 WeakPolarHBondContact O-CB 3.45Å; S197-L201 PolarHBondContact O-N 2.98Å; L201-L203 PolarHBondContact O-N 3.2Å; L201-I204 PolarHBondContact O-N 2.65Å; L201-Q205 HydrophobicContact CD1-CG 4.28Å; L201-Q205 HydrophobicContact CG-CG 4.42Å; L201-Q205 WeakPolarHBondContact O-CB 3.26Å; L201-Q205 VanDerWaalsContact O-CG 3.32Å; L201-Q205 WeakPolarHBondContact O-CG 3.41Å; L201-Q205 PolarHBondContact O-N 3.34Å
202G85.9Confident86.7Confident35 Ų3554.2 Ų54.236%0.36133%0.327SS..Hα-helixtrans-62.4-41.4-179.900000112.5V198 Y200 Q205 A206V198-G202 WeakPolarHBondContact O-CA 3.34Å; V198-G202 PolarHBondContact O-N 2.99Å; Y200-G202 PolarHBondContact O-N 3.19Å; G202-Q205 PolarHBondContact O-N 3.48Å; G202-A206 WeakPolarHBondContact O-CB 3.49Å; G202-A206 PolarHBondContact O-N 3.42Å
203L88.3Confident86.6Confident52 Ų5254.2 Ų54.227%0.27233%0.327SS..Hα-helixtrans-69.8-39176.8-71.1173.2000112.4S199 Y200 L201 A206 G207 L208 T213 S216 M217S199-L203 WeakPolarHBondContact O-CB 3.03Å; S199-L203 VanDerWaalsContact O-CG 3.32Å; S199-L203 WeakPolarHBondContact O-CG 3.33Å; S199-L203 PolarHBondContact O-N 3.28Å; S199-L203 VanDerWaalsContact O-N 3.08Å; Y200-L203 PolarHBondContact O-N 3.17Å; L201-L203 PolarHBondContact O-N 3.2Å; L203-A206 PolarHBondContact O-N 3.43Å; L203-G207 PolarHBondContact O-N 2.9Å; L203-L208 HydrophobicContact CB-CD2 4.47Å; L203-L208 HydrophobicContact CD2-CD2 4.19Å; L203-L208 WeakPolarHBondContact O-CB 3.32Å; L203-L208 PolarHBondContact O-N 2.95Å; L203-L208 VanDerWaalsContact O-N 3.12Å; L203-T213 HydrophobicContact CB-CG2 3.76Å; L203-T213 HydrophobicContact CD1-CG2 3.96Å; L203-S216 WeakPolarHBondContact CD1-OG 3.49Å; L203-M217 HydrophobicContact CD1-CE 3.48Å; L203-M217 VanDerWaalsContact CD1-CE 3.48Å; L203-M217 HydrophobicContact CD1-SD 4.37Å
204I83.7Confident86.8Confident48 Ų4854.2 Ų54.225%0.24633%0.326CS..Hα-helixtrans-62.3-44.3173-66.2-69.4000110.7Y200 L201 A206 G207 P210 T213Y200-I204 HydrophobicContact CD1-CG1 4.36Å; Y200-I204 HydrophobicContact CE1-CG1 4.03Å; Y200-I204 VanDerWaalsContact O-CG1 3.28Å; Y200-I204 WeakPolarHBondContact O-CG1 3.25Å; Y200-I204 PolarHBondContact O-N 3.26Å; Y200-I204 VanDerWaalsContact O-N 3.1Å; L201-I204 PolarHBondContact O-N 2.65Å; I204-A206 VanDerWaalsContact C-N 3.29Å; I204-A206 PolarHBondContact O-N 3.33Å; I204-G207 PolarHBondContact O-N 3.38Å; I204-P210 HydrophobicContact CD1-CB 4.32Å; I204-P210 HydrophobicContact CD1-CG 3.98Å; I204-T213 HydrophobicContact CG1-CG2 4.45Å
205Q85Confident87.1Confident145 Ų14554.4 Ų54.468%0.67833%0.327SS*.Hα-helixtrans-66.5-29.8176.4-73.8-17717.400113L201 G202 G207L201-Q205 HydrophobicContact CD1-CG 4.28Å; L201-Q205 HydrophobicContact CG-CG 4.42Å; L201-Q205 WeakPolarHBondContact O-CB 3.26Å; L201-Q205 VanDerWaalsContact O-CG 3.32Å; L201-Q205 WeakPolarHBondContact O-CG 3.41Å; L201-Q205 PolarHBondContact O-N 3.34Å; G202-Q205 PolarHBondContact O-N 3.48Å; Q205-G207 PolarHBondContact O-N 2.92Å
206A89.4Confident87.2Confident76 Ų7653.2 Ų53.263%0.62833%0.325SS*.THydrogen-bonded Turntrans-71.2-1.5171.200000113.3G202 L203 I204 L208G202-A206 WeakPolarHBondContact O-CB 3.49Å; G202-A206 PolarHBondContact O-N 3.42Å; L203-A206 PolarHBondContact O-N 3.43Å; I204-A206 VanDerWaalsContact C-N 3.29Å; I204-A206 PolarHBondContact O-N 3.33Å; A206-L208 HydrophobicContact CB-CD1 4.21Å
207G87.3Confident87.5Confident67 Ų6753.6 Ų53.669%0.69133%0.327SS*.THydrogen-bonded Turntrans93.68.8174.300000114.7L203 I204 Q205L203-G207 PolarHBondContact O-N 2.9Å; I204-G207 PolarHBondContact O-N 3.38Å; Q205-G207 PolarHBondContact O-N 2.92Å
208L88.1Confident88.2Confident62 Ų6254 Ų5433%0.32533%0.326SS..  trans-73.3142.8173.6-78.272.4000109.9L203 A206 H212 T213L203-L208 HydrophobicContact CB-CD2 4.47Å; L203-L208 HydrophobicContact CD2-CD2 4.19Å; L203-L208 WeakPolarHBondContact O-CB 3.32Å; L203-L208 PolarHBondContact O-N 2.95Å; L203-L208 VanDerWaalsContact O-N 3.12Å; A206-L208 HydrophobicContact CB-CD1 4.21Å; L208-H212 HydrophobicContact CD2-CB 4.48Å; L208-T213 WeakPolarHBondContact CB-OG1 3.42Å
209S86.8Confident88.7Confident46 Ų4653.7 Ų53.732%0.32232%0.324SS..  trans-68.7157.2170.477.70000110.8Q211 H212 T213S209-Q211 PolarHBondContact O-N 3.46Å; S209-H212 PolarHBondContact O-N 3.26Å; S209-H212 PolarHBondContact OG-N 3.43Å; S209-H212 PolarHBondContact OG-ND1 3.33Å; S209-T213 WeakPolarHBondContact O-CB 3.28Å; S209-T213 PolarHBondContact O-N 2.93Å; S209-T213 PolarHBondContact O-OG1 3.33Å
210P83.8Confident89.1Confident56 Ų5652.5 Ų52.536%0.36432%0.316SS..Hα-helixtrans-53.3-39175.8-27.634.2000113.1I204 T213 L214I204-P210 HydrophobicContact CD1-CB 4.32Å; I204-P210 HydrophobicContact CD1-CG 3.98Å; P210-T213 PolarHBondContact O-N 2.94Å; P210-L214 VanDerWaalsContact O-CG 3.28Å; P210-L214 WeakPolarHBondContact O-CG 3.32Å; P210-L214 PolarHBondContact O-N 2.88Å
211Q88.2Confident89.7Confident76 Ų7652.4 Ų52.436%0.35532%0.315SS..Hα-helixtrans-61.5-52.9176.7178.1177.614.300112.1A144 S209 T213 L214 L215A144-Q211 HydrophobicContact CB-CG 4.24Å; A144-Q211 WeakPolarHBondContact O-CG 3.28Å; S209-Q211 PolarHBondContact O-N 3.46Å; Q211-T213 VanDerWaalsContact C-N 3.28Å; Q211-T213 PolarHBondContact O-N 3.31Å; Q211-L214 PolarHBondContact O-N 3.37Å; Q211-L215 HydrophobicContact CG-CD1 4.2Å; Q211-L215 WeakPolarHBondContact O-CG 3.37Å; Q211-L215 PolarHBondContact O-N 3.34Å
212H89.3Confident90.4Very high115 Ų11553.6 Ų53.653%0.53233%0.326SS..Hα-helixtrans-65.2-35.5179.4-67.4101.8000111.8L208 S209 L215 S216L208-H212 HydrophobicContact CD2-CB 4.48Å; S209-H212 PolarHBondContact O-N 3.26Å; S209-H212 PolarHBondContact OG-N 3.43Å; S209-H212 PolarHBondContact OG-ND1 3.33Å; H212-L215 PolarHBondContact O-N 2.96Å; H212-S216 WeakPolarHBondContact O-CB 3.48Å; H212-S216 PolarHBondContact O-N 3.37Å
213T90.4Very high91Very high0 Ų055.9 Ų55.90%033%0.329CS..Hα-helixtrans-60-51.9175-60.80000110.5Y200 L203 I204 L208 S209 P210 Q211 L215 S216 M217Y200-T213 HydrophobicContact CD2-CG2 3.55Å; Y200-T213 HydrophobicContact CE2-CG2 3.83Å; Y200-T213 HydrophobicContact CG-CG2 4.36Å; L203-T213 HydrophobicContact CB-CG2 3.76Å; L203-T213 HydrophobicContact CD1-CG2 3.96Å; I204-T213 HydrophobicContact CG1-CG2 4.45Å; L208-T213 WeakPolarHBondContact CB-OG1 3.42Å; S209-T213 WeakPolarHBondContact O-CB 3.28Å; S209-T213 PolarHBondContact O-N 2.93Å; S209-T213 PolarHBondContact O-OG1 3.33Å; P210-T213 PolarHBondContact O-N 2.94Å; Q211-T213 VanDerWaalsContact C-N 3.28Å; Q211-T213 PolarHBondContact O-N 3.31Å; T213-L215 PolarHBondContact O-N 2.92Å; T213-S216 PolarHBondContact O-N 3.41Å; T213-S216 PolarHBondContact O-OG 3.29Å; T213-M217 HydrophobicContact CG2-CE 4.26Å; T213-M217 WeakPolarHBondContact O-CG 3.18Å; T213-M217 PolarHBondContact O-N 3.49Å
214L90.6Very high91.4Very high3 Ų353.4 Ų53.42%0.01632%0.316CS..Hα-helixtrans-63.2-38.9178.4-68.6172.9000112.8V55 M56 F140 V143 A144 Y200 P210 Q211 S216 M217V55-L214 HydrophobicContact CG1-CD2 3.77Å; M56-L214 HydrophobicContact CE-CD2 3.83Å; F140-L214 HydrophobicContact CD1-CD2 4.09Å; F140-L214 HydrophobicContact CE1-CD2 4.48Å; V143-L214 HydrophobicContact CB-CD1 4.06Å; V143-L214 HydrophobicContact CG1-CD1 3.55Å; A144-L214 HydrophobicContact CB-CB 3.99Å; A144-L214 HydrophobicContact CB-CD1 4.45Å; Y200-L214 HydrophobicContact CD2-CD2 4.45Å; Y200-L214 HydrophobicContact CE2-CD2 4.06Å; Y200-L214 HydrophobicContact CE2-CG 4.36Å; P210-L214 VanDerWaalsContact O-CG 3.28Å; P210-L214 WeakPolarHBondContact O-CG 3.32Å; P210-L214 PolarHBondContact O-N 2.88Å; Q211-L214 PolarHBondContact O-N 3.37Å; L214-S216 VanDerWaalsContact C-N 3.33Å; L214-S216 PolarHBondContact O-N 2.89Å; L214-M217 WeakPolarHBondContact O-CB 3.44Å; L214-M217 PolarHBondContact O-N 2.98Å
215L93.3Very high92Very high48 Ų4853 Ų5325%0.25131%0.314SS..Hα-helixtrans-64.8-36.9175.4-70174.3000112.3A144 F145 Q211 H212 T213 M217 L218A144-L215 HydrophobicContact CB-CD2 3.92Å; A144-L215 HydrophobicContact CB-CG 3.9Å; F145-L215 HydrophobicContact CE2-CD1 4.43Å; F145-L215 HydrophobicContact CE2-CD2 3.79Å; F145-L215 HydrophobicContact CZ-CD1 4.04Å; F145-L215 HydrophobicContact CZ-CD2 4.21Å; Q211-L215 HydrophobicContact CG-CD1 4.2Å; Q211-L215 WeakPolarHBondContact O-CG 3.37Å; Q211-L215 PolarHBondContact O-N 3.34Å; H212-L215 PolarHBondContact O-N 2.96Å; T213-L215 PolarHBondContact O-N 2.92Å; L215-M217 PolarHBondContact O-N 2.98Å; L215-L218 HydrophobicContact CD2-CD1 4.31Å; L215-L218 VanDerWaalsContact O-CB 3.3Å; L215-L218 WeakPolarHBondContact O-CB 3.44Å; L215-L218 WeakPolarHBondContact O-CG 3.49Å; L215-L218 PolarHBondContact O-N 3.5Å
216S93.3Very high92.5Very high52 Ų5247.7 Ų47.736%0.36430%0.295SS..Hα-helixtrans-64.5-28.1175.776.10000112.7L203 H212 T213 L214 L218 V219L203-S216 WeakPolarHBondContact CD1-OG 3.49Å; H212-S216 WeakPolarHBondContact O-CB 3.48Å; H212-S216 PolarHBondContact O-N 3.37Å; T213-S216 PolarHBondContact O-N 3.41Å; T213-S216 PolarHBondContact O-OG 3.29Å; L214-S216 VanDerWaalsContact C-N 3.33Å; L214-S216 PolarHBondContact O-N 2.89Å; S216-L218 PolarHBondContact O-N 2.97Å; S216-V219 PolarHBondContact O-N 3.15Å
217M93.3Very high92.8Very high9 Ų944.2 Ų44.24%0.04427%0.267CS..THydrogen-bonded Turntrans-71.2-4.8176.6-59-52.6-176.900113.7F51 F140 S199 L203 T213 L214 L215 V219 V220 P221F51-M217 HydrophobicContact CE1-CE 4.44Å; F51-M217 HydrophobicContact CE1-CG 4.25Å; F51-M217 HydrophobicContact CE1-SD 3.71Å; F51-M217 HydrophobicContact CZ-SD 3.99Å; F140-M217 HydrophobicContact CD1-CB 4.05Å; F140-M217 HydrophobicContact CD2-CB 4.43Å; F140-M217 HydrophobicContact CE1-CB 3.79Å; F140-M217 HydrophobicContact CE1-CG 4.39Å; F140-M217 HydrophobicContact CE2-CB 4.16Å; F140-M217 HydrophobicContact CG-CB 4.37Å; F140-M217 HydrophobicContact CZ-CB 3.82Å; S199-M217 VanDerWaalsContact OG-CE 3.28Å; S199-M217 WeakPolarHBondContact OG-CE 3.34Å; L203-M217 HydrophobicContact CD1-CE 3.48Å; L203-M217 VanDerWaalsContact CD1-CE 3.48Å; L203-M217 HydrophobicContact CD1-SD 4.37Å; T213-M217 HydrophobicContact CG2-CE 4.26Å; T213-M217 WeakPolarHBondContact O-CG 3.18Å; T213-M217 PolarHBondContact O-N 3.49Å; L214-M217 WeakPolarHBondContact O-CB 3.44Å; L214-M217 PolarHBondContact O-N 2.98Å; L215-M217 PolarHBondContact O-N 2.98Å; M217-V219 PolarHBondContact O-N 3.38Å; M217-V219 VanDerWaalsContact O-N 3.09Å; M217-V220 VanDerWaalsContact O-CB 3.25Å; M217-V220 WeakPolarHBondContact O-CB 3.4Å; M217-V220 WeakPolarHBondContact O-CG2 3.4Å; M217-V220 PolarHBondContact O-N 3.38Å; M217-P221 WeakPolarHBondContact O-CD 3.4Å
218L95.6Very high93.1Very high49 Ų4941.4 Ų41.426%0.25724%0.235SC..THydrogen-bonded Turntrans-60.8-15.5171-74.5173.8000113.6A137 F140 I141 L215 S216 V220 P221 V222A137-L218 HydrophobicContact CB-CD2 3.89Å; F140-L218 HydrophobicContact CB-CD2 4.17Å; I141-L218 HydrophobicContact CD1-CD1 4.4Å; I141-L218 HydrophobicContact CD1-CD2 4.21Å; I141-L218 HydrophobicContact CG1-CD1 4.1Å; I141-L218 HydrophobicContact CG1-CD2 4.05Å; L215-L218 HydrophobicContact CD2-CD1 4.31Å; L215-L218 VanDerWaalsContact O-CB 3.3Å; L215-L218 WeakPolarHBondContact O-CB 3.44Å; L215-L218 WeakPolarHBondContact O-CG 3.49Å; L215-L218 PolarHBondContact O-N 3.5Å; S216-L218 PolarHBondContact O-N 2.97Å; L218-V220 PolarHBondContact O-N 3.26Å; L218-P221 HydrophobicContact CD2-CG 4.35Å; L218-P221 VanDerWaalsContact O-CD 3.27Å; L218-P221 WeakPolarHBondContact O-CD 3.46Å; L218-P221 VanDerWaalsContact O-CG 3.31Å; L218-P221 WeakPolarHBondContact O-CG 3.44Å; L218-V222 WeakPolarHBondContact O-CG2 3.27Å
219V96.3Very high93.4Very high80 Ų8042.7 Ų42.749%0.48524%0.238SC..Hα-helixtrans-58.1-31.6168.570.40000112.1S216 M217 V222 L223S216-V219 PolarHBondContact O-N 3.15Å; M217-V219 PolarHBondContact O-N 3.38Å; M217-V219 VanDerWaalsContact O-N 3.09Å; V219-V222 PolarHBondContact O-N 3.14Å; V219-L223 HydrophobicContact CG2-CD1 4Å; V219-L223 HydrophobicContact CG2-CG 4.17Å; V219-L223 WeakPolarHBondContact O-CB 3.31Å; V219-L223 VanDerWaalsContact O-CG 3.26Å; V219-L223 WeakPolarHBondContact O-CG 3.36Å; V219-L223 PolarHBondContact O-N 3.05Å
220V96.4Very high93.6Very high8 Ų847.5 Ų47.55%0.04826%0.259CS..Hα-helixtrans-65.5-54.8-175.8176.30000113.1C48 F51 M217 L218 V222 L223 L224C48-V220 HydrophobicContact CB-CG1 3.73Å; F51-V220 HydrophobicContact CB-CG1 3.74Å; F51-V220 HydrophobicContact CD1-CB 4.35Å; F51-V220 HydrophobicContact CD1-CG1 4.05Å; F51-V220 HydrophobicContact CD1-CG2 3.64Å; F51-V220 HydrophobicContact CD2-CG2 4.47Å; F51-V220 HydrophobicContact CE1-CG2 3.65Å; F51-V220 HydrophobicContact CE2-CG2 4.49Å; F51-V220 HydrophobicContact CG-CG1 3.96Å; F51-V220 HydrophobicContact CG-CG2 4.05Å; F51-V220 HydrophobicContact CZ-CG2 4.08Å; M217-V220 VanDerWaalsContact O-CB 3.25Å; M217-V220 WeakPolarHBondContact O-CB 3.4Å; M217-V220 WeakPolarHBondContact O-CG2 3.4Å; M217-V220 PolarHBondContact O-N 3.38Å; L218-V220 PolarHBondContact O-N 3.26Å; V220-V222 PolarHBondContact O-N 3.35Å; V220-L223 PolarHBondContact O-N 3.01Å; V220-L223 VanDerWaalsContact O-N 3.16Å; V220-L224 PolarHBondContact O-N 2.88Å
221P96.8Very high93.9Very high4 Ų446.8 Ų46.83%0.02625%0.253CS..Hα-helixtrans-62.6-31.2175.821.9-33.2000112.6G133 A137 M217 L218 L224 L225G133-P221 WeakPolarHBondContact O-CB 3.43Å; A137-P221 HydrophobicContact CB-CB 4.11Å; A137-P221 HydrophobicContact CB-CG 3.83Å; M217-P221 WeakPolarHBondContact O-CD 3.4Å; L218-P221 HydrophobicContact CD2-CG 4.35Å; L218-P221 VanDerWaalsContact O-CD 3.27Å; L218-P221 WeakPolarHBondContact O-CD 3.46Å; L218-P221 VanDerWaalsContact O-CG 3.31Å; L218-P221 WeakPolarHBondContact O-CG 3.44Å; P221-L224 PolarHBondContact O-N 3.06Å; P221-L225 WeakPolarHBondContact O-CG 3.41Å; P221-L225 PolarHBondContact O-N 3.18Å
222V97.3Very high94Very high95 Ų9543.4 Ų43.458%0.57624%0.237SC*.Hα-helixtrans-65.3-44.9173.5174.50000110.9L218 V219 V220 L224 L225 A226L218-V222 WeakPolarHBondContact O-CG2 3.27Å; V219-V222 PolarHBondContact O-N 3.14Å; V220-V222 PolarHBondContact O-N 3.35Å; V222-L224 VanDerWaalsContact C-N 3.34Å; V222-L224 PolarHBondContact O-N 3.27Å; V222-L225 PolarHBondContact O-N 3.28Å; V222-A226 VanDerWaalsContact O-CB 3.26Å; V222-A226 WeakPolarHBondContact O-CB 3.48Å; V222-A226 PolarHBondContact O-N 2.81Å
223L97.1Very high93.7Very high82 Ų8239.9 Ų39.943%0.42922%0.223SC..Hα-helixtrans-63.7-38.1175.8-73.6173.2000112.2I44 V219 V220 A226 S227I44-L223 HydrophobicContact CG2-CB 4.37Å; V219-L223 HydrophobicContact CG2-CD1 4Å; V219-L223 HydrophobicContact CG2-CG 4.17Å; V219-L223 WeakPolarHBondContact O-CB 3.31Å; V219-L223 VanDerWaalsContact O-CG 3.26Å; V219-L223 WeakPolarHBondContact O-CG 3.36Å; V219-L223 PolarHBondContact O-N 3.05Å; V220-L223 PolarHBondContact O-N 3.01Å; V220-L223 VanDerWaalsContact O-N 3.16Å; L223-A226 PolarHBondContact O-N 3.47Å; L223-S227 VanDerWaalsContact O-CB 3.23Å; L223-S227 WeakPolarHBondContact O-CB 3.32Å; L223-S227 PolarHBondContact O-N 2.8Å
224L97.1Very high92.6Very high0 Ų041.4 Ų41.40%023%0.234CC..Hα-helixtrans-58.5-51.5173.9-176.2147.3000111.2L45 C48 N49 V129 T132 F170 V220 P221 V222 S227 Y228L45-L224 HydrophobicContact CD2-CG 4.09Å; L45-L224 VanDerWaalsContact CD2-O 3.31Å; L45-L224 WeakPolarHBondContact CD2-O 3.49Å; C48-L224 HydrophobicContact CB-CB 3.7Å; C48-L224 HydrophobicContact CB-CD1 3.97Å; C48-L224 HydrophobicContact CB-CG 4.3Å; N49-L224 HydrophobicContact CB-CD1 4.48Å; V129-L224 HydrophobicContact CG1-CD2 4.03Å; T132-L224 HydrophobicContact CG2-CD1 4.17Å; T132-L224 HydrophobicContact CG2-CD2 4.32Å; F170-L224 HydrophobicContact CE2-CD1 4.24Å; F170-L224 HydrophobicContact CE2-CG 4.5Å; F170-L224 HydrophobicContact CZ-CD1 4.47Å; F170-L224 HydrophobicContact CZ-CD2 4.07Å; F170-L224 HydrophobicContact CZ-CG 4.27Å; V220-L224 PolarHBondContact O-N 2.88Å; P221-L224 PolarHBondContact O-N 3.06Å; V222-L224 VanDerWaalsContact C-N 3.34Å; V222-L224 PolarHBondContact O-N 3.27Å; L224-S227 PolarHBondContact O-N 2.93Å; L224-Y228 PolarHBondContact O-N 3.45Å; L224-Y228 VanDerWaalsContact O-N 3.17Å
225L96.7Very high91.2Very high39 Ų3942.5 Ų42.520%0.20424%0.242CC..Hα-helixtrans-65.7-43.6179.4-65.9174.9000111.6V129 L130 P221 V222 S227 Y228 F229V129-L225 HydrophobicContact CG1-CD2 4.12Å; L130-L225 HydrophobicContact CD1-CD2 4.42Å; P221-L225 WeakPolarHBondContact O-CG 3.41Å; P221-L225 PolarHBondContact O-N 3.18Å; V222-L225 PolarHBondContact O-N 3.28Å; L225-S227 VanDerWaalsContact C-N 3.31Å; L225-S227 PolarHBondContact O-N 3.45Å; L225-Y228 PolarHBondContact O-N 3.16Å; L225-F229 HydrophobicContact CB-CD2 4.43Å; L225-F229 HydrophobicContact CD2-CE2 4.15Å; L225-F229 VanDerWaalsContact O-CD2 3.28Å; L225-F229 WeakPolarHBondContact O-CD2 3.48Å; L225-F229 PolarHBondContact O-N 2.87Å
226A95.9Very high89.3Confident34 Ų3448 Ų4828%0.28127%0.266SS..Hα-helixtrans-61.3-40.3176.800000111.6V222 L223 Y228 L230 L231V222-A226 VanDerWaalsContact O-CB 3.26Å; V222-A226 WeakPolarHBondContact O-CB 3.48Å; V222-A226 PolarHBondContact O-N 2.81Å; L223-A226 PolarHBondContact O-N 3.47Å; A226-Y228 VanDerWaalsContact C-N 3.34Å; A226-Y228 PolarHBondContact O-N 2.93Å; A226-L230 HydrophobicContact CB-CD1 4.18Å; A226-L230 WeakPolarHBondContact O-CA 3.3Å; A226-L230 WeakPolarHBondContact O-CB 3.38Å; A226-L230 PolarHBondContact O-N 3.13Å; A226-L231 PolarHBondContact O-N 2.94Å
227S95.5Very high87.2Confident4 Ų448.3 Ų48.33%0.02827%0.266CS..Iπ-helixtrans-60.4-45.1176.7-171.60000111.5G41 L223 L224 L225 L231 L232G41-S227 VanDerWaalsContact CA-OG 3.23Å; G41-S227 WeakPolarHBondContact CA-OG 3.43Å; G41-S227 PolarHBondContact O-OG 2.85Å; L223-S227 VanDerWaalsContact O-CB 3.23Å; L223-S227 WeakPolarHBondContact O-CB 3.32Å; L223-S227 PolarHBondContact O-N 2.8Å; L224-S227 PolarHBondContact O-N 2.93Å; L225-S227 VanDerWaalsContact C-N 3.31Å; L225-S227 PolarHBondContact O-N 3.45Å; S227-L231 WeakPolarHBondContact O-CB 3.5Å; S227-L231 PolarHBondContact O-N 3.41Å; S227-L232 PolarHBondContact O-N 2.83Å
228Y94.5Very high85Confident8 Ų857.7 Ų57.73%0.03131%0.31CS..Iπ-helixtrans-69.1-50178.7-176.7-97.8000113.8Y125 S126 V129 F170 L173 L224 L225 A226 L232 A250Y125-Y228 WeakPolarHBondContact CB-OH 3.33Å; S126-Y228 PolarHBondContact N-OH 3.24Å; V129-Y228 HydrophobicContact CB-CD1 4.16Å; V129-Y228 HydrophobicContact CB-CD2 4.47Å; V129-Y228 HydrophobicContact CB-CE1 4.36Å; V129-Y228 HydrophobicContact CB-CG 4.22Å; V129-Y228 HydrophobicContact CG1-CD1 3.9Å; V129-Y228 HydrophobicContact CG1-CD2 4.24Å; V129-Y228 HydrophobicContact CG1-CG 3.71Å; V129-Y228 HydrophobicContact CG2-CD1 4.31Å; V129-Y228 HydrophobicContact CG2-CD2 3.82Å; V129-Y228 HydrophobicContact CG2-CE1 4.31Å; V129-Y228 HydrophobicContact CG2-CE2 3.79Å; V129-Y228 HydrophobicContact CG2-CG 4.08Å; F170-Y228 HydrophobicContact CE1-CD2 4.23Å; L173-Y228 HydrophobicContact CD2-CD2 4.21Å; L173-Y228 HydrophobicContact CD2-CE2 3.81Å; L224-Y228 PolarHBondContact O-N 3.45Å; L224-Y228 VanDerWaalsContact O-N 3.17Å; L225-Y228 PolarHBondContact O-N 3.16Å; A226-Y228 VanDerWaalsContact C-N 3.34Å; A226-Y228 PolarHBondContact O-N 2.93Å; Y228-L232 HydrophobicContact CD2-CD1 4.06Å; Y228-A250 PolarHBondContact OH-O 3.29Å
229F92.8Very high82.4Confident88 Ų8861 Ų6139%0.38633%0.328SS..Iπ-helixtrans-83.5-28.8-171.9-72.5-69.4000113.8L225L225-F229 HydrophobicContact CB-CD2 4.43Å; L225-F229 HydrophobicContact CD2-CE2 4.15Å; L225-F229 VanDerWaalsContact O-CD2 3.28Å; L225-F229 WeakPolarHBondContact O-CD2 3.48Å; L225-F229 PolarHBondContact O-N 2.87Å
230L91.9Very high79.9Confident147 Ų14762.2 Ų62.277%0.7734%0.338SS*.Iπ-helixtrans-112.6-34.2-171.9-50.6177.4000113.5A226A226-L230 HydrophobicContact CB-CD1 4.18Å; A226-L230 WeakPolarHBondContact O-CA 3.3Å; A226-L230 WeakPolarHBondContact O-CB 3.38Å; A226-L230 PolarHBondContact O-N 3.13Å
231L90.4Very high77.3Confident42 Ų4265.3 Ų65.322%0.2237%0.371CS..Iπ-helixtrans-95.7-43.4-171.8-172.759.3000113K37 M40 I44 A226 S227 T233K37-L231 HydrophobicContact CB-CD1 4.29Å; K37-L231 HydrophobicContact CG-CD1 4.32Å; M40-L231 HydrophobicContact CB-CD2 3.98Å; I44-L231 HydrophobicContact CD1-CD2 3.83Å; A226-L231 PolarHBondContact O-N 2.94Å; S227-L231 WeakPolarHBondContact O-CB 3.5Å; S227-L231 PolarHBondContact O-N 3.41Å; L231-T233 PolarHBondContact O-N 3.31Å
232L89Confident74.8Confident4 Ų466.1 Ų66.12%0.02138%0.38CS..  trans-62.9132.5174.4-88.3150.7000110.4F42 L45 L173 Y177 S227 Y228 R251F42-L232 HydrophobicContact CD2-CD2 3.95Å; F42-L232 HydrophobicContact CE2-CD2 3.57Å; F42-L232 HydrophobicContact CZ-CD2 4.14Å; L45-L232 HydrophobicContact CD1-CD1 3.36Å; L45-L232 HydrophobicContact CG-CD1 4.4Å; L173-L232 HydrophobicContact CD2-CD1 4.48Å; Y177-L232 HydrophobicContact CE1-CD2 3.85Å; Y177-L232 HydrophobicContact CE2-CD2 4.42Å; S227-L232 PolarHBondContact O-N 2.83Å; Y228-L232 HydrophobicContact CD2-CD1 4.06Å; L232-R251 PolarHBondContact O-NH2 3.31Å
233T83.3Confident72.1Confident41 Ų4167.8 Ų67.825%0.25238%0.379SS..  trans-106.3136.817547.20000108.6K37 N38 Y177 L231K37-T233 HydrophobicContact CD-CG2 4.31Å; N38-T233 PolarHBondContact ND2-OG1 3.02Å; N38-T233 VanDerWaalsContact ND2-OG1 3.17Å; N38-T233 PolarHBondContact OD1-N 3.48Å; N38-T233 PolarHBondContact OD1-O 2.82Å; N38-T233 PolarHBondContact OD1-OG1 3.09Å; Y177-T233 WeakPolarHBondContact CE1-O 3.33Å; Y177-T233 PolarHBondContact OH-O 3.45Å; Y177-T233 VanDerWaalsContact OH-O 3.09Å; L231-T233 PolarHBondContact O-N 3.31Å
234S67.3Low69.6Low32 Ų3270.1 Ų70.122%0.22439%0.392CS..PPolyproline II helixtrans-52.2137.9177.8-85.80000109.9E236S234-E236 PolarHBondContact O-N 3.43Å
235P62.3Low67.2Low27 Ų2775 Ų7518%0.17542%0.416CS..PPolyproline II helixtrans-60.3124.9175.724.2-30.4000108.8F176 P237F176-P235 HydrophobicContact CB-CG 4.23Å; F176-P235 WeakPolarHBondContact O-CB 3.46Å; P235-P237 WeakPolarHBondContact O-CD 3.28Å
236E52.2Low64.8Low164 Ų16474.6 Ų74.677%0.76642%0.418SS*.PPolyproline II helixtrans-69.9121.1176.2-158161.3-166.500107.8S234 Q238S234-E236 PolarHBondContact O-N 3.43Å; E236-Q238 PolarHBondContact O-N 3.13Å
237P49Very low62.5Low57 Ų5778.4 Ų78.437%0.3743%0.429SS..PPolyproline II helixtrans-68.8132.9-171.520.3-25.1000110.2P235 D239 K243P235-P237 WeakPolarHBondContact O-CD 3.28Å; P237-D239 PolarHBondContact O-N 3.06Å; P237-K243 HydrophobicContact CG-CG 3.79Å
238Q47Very low60.4Low206 Ų20681.1 Ų81.196%0.96345%0.446SS*.SBendtrans-68.9-7.3171.5-71.1-178.2-7.800112.5E236E236-Q238 PolarHBondContact O-N 3.13Å
239D42.8Very low58.4Low119 Ų11981.9 Ų81.964%0.63645%0.454SS*.SBendtrans-136.5131.7-177.5-132.3-19.4000112.3P237 G241 G242P237-D239 PolarHBondContact O-N 3.06Å; D239-G241 PolarHBondContact O-N 3.02Å; D239-G241 VanDerWaalsContact O-N 3.08Å; D239-G242 PolarHBondContact O-N 3.38Å
240P41.9Very low56.4Low106 Ų10678.1 Ų78.169%0.68844%0.439SS*.THydrogen-bonded Turntrans-64.2-16.1-174.3-20.631.5000115.6
241G42.9Very low54.6Low72 Ų7275.8 Ų75.874%0.74242%0.42SS*.THydrogen-bonded Turntrans-89.3-12.7-178.300000115.7D239D239-G241 PolarHBondContact O-N 3.02Å; D239-G241 VanDerWaalsContact O-N 3.08Å
242G43.8Very low52.3Low21 Ų2178.3 Ų78.322%0.21643%0.431CS..  trans-95.86.6-177.500000115D239 D244 E245 A246D239-G242 PolarHBondContact O-N 3.38Å; G242-D244 VanDerWaalsContact C-N 3.28Å; G242-D244 PolarHBondContact O-N 2.65Å; G242-E245 PolarHBondContact O-N 3.12Å; G242-E245 VanDerWaalsContact O-N 3.13Å; G242-A246 PolarHBondContact O-N 3.28Å
243K40.3Very low49.7Very low130 Ų13083.1 Ų83.157%0.56546%0.462SS*.Hα-helixtrans-55.9-41.2-176.2-78.8-177.3172.7-177.60112.7P237 E247P237-K243 HydrophobicContact CG-CG 3.79Å; K243-E247 WeakPolarHBondContact O-CB 3.44Å
244D45.7Very low47.7Very low131 Ų13188.1 Ų88.170%0.70149%0.487SS*.Hα-helixtrans-78.2-21.4-178-64.3-29.4000112.3G242 T248G242-D244 VanDerWaalsContact C-N 3.28Å; G242-D244 PolarHBondContact O-N 2.65Å; D244-T248 WeakPolarHBondContact O-CB 3.43Å; D244-T248 PolarHBondContact O-N 3.23Å; D244-T248 PolarHBondContact O-OG1 2.92Å
245E46.7Very low46.6Very low104 Ų10493.8 Ų93.849%0.48651%0.513SS..Hα-helixtrans-91.7-46.1-168.5-64.7-177.3166.600113.5G242 T248 A249G242-E245 PolarHBondContact O-N 3.12Å; G242-E245 VanDerWaalsContact O-N 3.13Å; E245-T248 PolarHBondContact O-N 3.1Å; E245-A249 WeakPolarHBondContact O-CB 3.39Å; E245-A249 PolarHBondContact O-N 3.33Å
246A46.7Very low45.2Very low30 Ų3095.7 Ų95.725%0.24854%0.537CS..Hα-helixtrans-71.1-34.8179.500000112.2G242 A250G242-A246 PolarHBondContact O-N 3.28Å; A246-A250 WeakPolarHBondContact O-CB 3.46Å; A246-A250 PolarHBondContact O-N 3.38Å
247E47.3Very low44.4Very low113 Ų11394.3 Ų94.353%0.52854%0.54SS..Hα-helixtrans-72.7-37176.7-151.3170-165.200111.3K243 R251K243-E247 WeakPolarHBondContact O-CB 3.44Å; E247-R251 PolarHBondContact O-N 3.48Å; E247-R251 VanDerWaalsContact O-N 3.08Å
248T50.3Low43.8Very low62 Ų62100.3 Ų100.338%0.3856%0.563SS.*Hα-helixtrans-68.4-42.4175.3-66.40000112.4D244 E245 Q252D244-T248 WeakPolarHBondContact O-CB 3.43Å; D244-T248 PolarHBondContact O-N 3.23Å; D244-T248 PolarHBondContact O-OG1 2.92Å; E245-T248 PolarHBondContact O-N 3.1Å; T248-Q252 HydrophobicContact CG2-CG 3.75Å; T248-Q252 VanDerWaalsContact CG2-NE2 3.28Å; T248-Q252 VanDerWaalsContact O-CB 3.31Å; T248-Q252 WeakPolarHBondContact O-CB 3.44Å; T248-Q252 WeakPolarHBondContact O-CG 3.48Å; T248-Q252 PolarHBondContact O-N 3.01Å; T248-Q252 VanDerWaalsContact O-N 3.14Å
249A53Low43.1Very low24 Ų2496.8 Ų96.820%0.19856%0.556CS.*Hα-helixtrans-67.9-43-179.900000112.6Y125 E245Y125-A249 WeakPolarHBondContact CD2-O 3.27Å; E245-A249 WeakPolarHBondContact O-CB 3.39Å; E245-A249 PolarHBondContact O-N 3.33Å
250A51.6Low42.8Very low8 Ų897.1 Ų97.17%0.06657%0.565CS.*Hα-helixtrans-78.4-28.3-177.800000113.6S126 Y228 A246S126-A250 PolarHBondContact OG-O 2.95Å; Y228-A250 PolarHBondContact OH-O 3.29Å; A246-A250 WeakPolarHBondContact O-CB 3.46Å; A246-A250 PolarHBondContact O-N 3.38Å
251R53.5Low42.3Very low99 Ų99101 Ų10137%0.37457%0.574SS.*Hα-helixtrans-134.915.9-167-72.1-171.9168-179.4-3.5116.8L232 E247 P253L232-R251 PolarHBondContact O-NH2 3.31Å; E247-R251 PolarHBondContact O-N 3.48Å; E247-R251 VanDerWaalsContact O-N 3.08Å; R251-P253 VanDerWaalsContact O-CD 3.28Å; R251-P253 WeakPolarHBondContact O-CD 3.44Å
252Q41.1Very low42Very low95 Ų95103.2 Ų103.244%0.44458%0.577SS.*  trans-47.1116.2178.3-114.9178.31.100112.5P124 T248P124-Q252 HydrophobicContact CB-CB 4.15Å; P124-Q252 HydrophobicContact CG-CB 4.23Å; T248-Q252 HydrophobicContact CG2-CG 3.75Å; T248-Q252 VanDerWaalsContact CG2-NE2 3.28Å; T248-Q252 VanDerWaalsContact O-CB 3.31Å; T248-Q252 WeakPolarHBondContact O-CB 3.44Å; T248-Q252 WeakPolarHBondContact O-CG 3.48Å; T248-Q252 PolarHBondContact O-N 3.01Å; T248-Q252 VanDerWaalsContact O-N 3.14Å
253P35.5Very low41.2Very low105 Ų105111.5 Ų111.568%0.68261%0.608SS**  trans-73.8146.9177.87.60.9000111.2R251 I255R251-P253 VanDerWaalsContact O-CD 3.28Å; R251-P253 WeakPolarHBondContact O-CD 3.44Å; P253-I255 PolarHBondContact O-N 2.88Å; P253-I255 VanDerWaalsContact O-N 3.14Å
254L40.7Very low41.1Very low146 Ų146110.6 Ų110.676%0.76462%0.615SS**SBendtrans-65-11.7-178.3-88.2150.9000114.8
255I43.7Very low40.7Very low150 Ų150112.3 Ų112.377%0.76962%0.624SS**  trans-145.6110.7176.5-65.3178.3000108.2P253P253-I255 PolarHBondContact O-N 2.88Å; P253-I255 VanDerWaalsContact O-N 3.14Å
256G33Very low40Very low67 Ų67111.3 Ų111.369%0.69163%0.629SS**  trans-138.4107.5170.500000108.9E258G256-E258 VanDerWaalsContact C-N 3.3Å; G256-E258 PolarHBondContact O-N 3.39Å; G256-E258 VanDerWaalsContact O-N 3.07Å
257T36.3Very low39.9Very low135 Ų135114.2 Ų114.283%0.82865%0.647SS**  trans-80.368.7-177.6-45.20000110.5
258E37.1Very low39.9Very low183 Ų183115.7 Ų115.786%0.85565%0.648SS**  trans-139.1122.4164.9-67.8-167.2175.500109.9G256G256-E258 VanDerWaalsContact C-N 3.3Å; G256-E258 PolarHBondContact O-N 3.39Å; G256-E258 VanDerWaalsContact O-N 3.07Å
259T31.5Very low40.2Very low132 Ų132119 Ų11981%0.8166%0.663SS**  trans-57127.3176.839.10000110.3E261T259-E261 PolarHBondContact O-N 2.98Å; T259-E261 VanDerWaalsContact O-N 3.11Å
260P37.1Very low40.7Very low127 Ų127118.9 Ų118.983%0.82566%0.66SS**  trans-72.9109.3175.1-1.916.8000108.7S262P260-S262 PolarHBondContact O-N 2.8Å
261E30Very low42Very low188 Ų188122.2 Ų122.288%0.87968%0.68SS**  trans-61.9121.7157.8-79.4-169.7153.300108.3T259 K263T259-E261 PolarHBondContact O-N 2.98Å; T259-E261 VanDerWaalsContact O-N 3.11Å; E261-K263 PolarHBondContact O-N 3.06Å; E261-K263 VanDerWaalsContact O-N 3.16Å
262S36.5Very low43.2Very low117 Ų117124.1 Ų124.182%0.81869%0.692SS**  trans-56.7110.8177.553.10000111.9P260P260-S262 PolarHBondContact O-N 2.8Å
263K28.4Very low45.1Very low196 Ų196127.2 Ų127.285%0.85271%0.706SS**  trans-111127.9152.9-82.9-177179.4173.90109.4E261E261-K263 PolarHBondContact O-N 3.06Å; E261-K263 VanDerWaalsContact O-N 3.16Å
264P38.6Very low47.5Very low111 Ų111124.9 Ų124.972%0.72169%0.686SS**  trans-78.9145.4-176.633-32.1000110.7
265D36.1Very low49.5Very low166 Ų166119.7 Ų119.789%0.88866%0.656SS**  trans62.780.7163.9-58.8-24.8000118.2
266S33Very low51.6Low83 Ų83118.5 Ų118.558%0.5864%0.642SS**  trans-136.19415739.30000112
267S43.7Very low54.2Low92 Ų92120 Ų12064%0.64364%0.638SS**SBend57.761.2126.4680000122.4
268W47.2Very low56.7Low144 Ų144114.7 Ų114.755%0.54561%0.605SS.*  trans-140.5-15.1163.2-73.290.5000117.2F176 L270F176-W268 HydrophobicContact CZ-CH2 4.45Å; W268-L270 PolarHBondContact O-N 3.11Å
269D55.9Low59.2Low130 Ų130108.5 Ų108.570%0.69558%0.576SS**  trans-90.888.1175.2-77.1-35.7000111.3P271D269-P271 WeakPolarHBondContact O-CD 3.34Å; D269-P271 VanDerWaalsContact O-N 3.16Å
270L64.9Low62Low23 Ų23107.8 Ų107.812%0.1256%0.561CS.*  trans-58.5116.2162.8-71.6171.7000108.3W268 E274 R275 K404 H405W268-L270 PolarHBondContact O-N 3.11Å; L270-E274 VanDerWaalsContact CD2-CD 3.41Å; L270-E274 HydrophobicContact CD2-CG 4.1Å; L270-E274 VanDerWaalsContact CD2-OE2 3.29Å; L270-E274 WeakPolarHBondContact CD2-OE2 3.49Å; L270-R275 HydrophobicContact CB-CG 3.79Å; L270-R275 PolarHBondContact O-NE 2.92Å; L270-K404 HydrophobicContact CD2-CD 4.34Å; L270-K404 HydrophobicContact CD2-CG 4.48Å; L270-H405 WeakPolarHBondContact CD1-ND1 3.48Å; L270-H405 WeakPolarHBondContact CD2-CE1 3.41Å
271P78.1Confident64.5Low77 Ų77103.7 Ų103.750%0.554%0.542SS..  trans-56.2145.8176.119.4-29.7000110.1D269 Q273 E274 R275D269-P271 WeakPolarHBondContact O-CD 3.34Å; D269-P271 VanDerWaalsContact O-N 3.16Å; P271-Q273 PolarHBondContact O-N 3.44Å; P271-E274 WeakPolarHBondContact CD-OE2 3.23Å; P271-E274 HydrophobicContact CG-CB 4.1Å; P271-E274 WeakPolarHBondContact O-CB 3.39Å; P271-E274 PolarHBondContact O-N 3.35Å; P271-R275 PolarHBondContact O-N 3.01Å; P271-R275 VanDerWaalsContact O-N 3.17Å
272F79.8Confident67.5Low140 Ų14095.1 Ų95.161%0.61450%0.502SS*.Hα-helixtrans-51.1-33.2-176-179.1-97.7000113.4F118 R275 W276F118-F272 HydrophobicContact CE1-CE2 4.27Å; F272-R275 PolarHBondContact O-N 3.28Å; F272-W276 WeakPolarHBondContact O-CB 3.23Å; F272-W276 PolarHBondContact O-N 3.12Å
273Q80.8Confident70.2Confident160 Ų16092.4 Ų92.475%0.74848%0.478SS*.Hα-helixtrans-65.3-38.7176.1-68.7-177.4-14.500113.3P271 T277P271-Q273 PolarHBondContact O-N 3.44Å; Q273-T277 PolarHBondContact O-N 3.49Å; Q273-T277 PolarHBondContact O-OG1 3.02Å
274E84.7Confident73.3Confident56 Ų5688.3 Ų88.326%0.26246%0.462SS..Hα-helixtrans-69.4-44.7176.7-164.9173-177.400109.6L270 P271 W276 T277 V278 K404 H405L270-E274 VanDerWaalsContact CD2-CD 3.41Å; L270-E274 HydrophobicContact CD2-CG 4.1Å; L270-E274 VanDerWaalsContact CD2-OE2 3.29Å; L270-E274 WeakPolarHBondContact CD2-OE2 3.49Å; P271-E274 WeakPolarHBondContact CD-OE2 3.23Å; P271-E274 HydrophobicContact CG-CB 4.1Å; P271-E274 WeakPolarHBondContact O-CB 3.39Å; P271-E274 PolarHBondContact O-N 3.35Å; E274-W276 VanDerWaalsContact C-N 3.34Å; E274-W276 PolarHBondContact O-N 2.95Å; E274-T277 WeakPolarHBondContact O-CB 3.46Å; E274-T277 PolarHBondContact O-N 2.9Å; E274-T277 VanDerWaalsContact O-N 3.11Å; E274-V278 WeakPolarHBondContact O-CG2 3.35Å; E274-V278 PolarHBondContact O-N 2.83Å; E274-K404 IonicContact OE1-NZ 2.78Å; E274-K404 PolarHBondContact OE1-NZ 2.8Å; E274-K404 IonicContact OE2-NZ 3.51Å; E274-H405 IonicContact OE1-CE1 3.05Å; E274-H405 PolarHBondContact OE1-CE1 3.33Å; E274-H405 IonicContact OE1-NE2 3.44Å; E274-H405 PolarHBondContact OE1-NE2 2.73Å
275R84.3Confident75.9Confident36 Ų3683.6 Ų83.614%0.13643%0.43CS..Hα-helixtrans-56.1-45.9173.5-66.3-175.7-175-177.30.2112.2P117 H121 L270 P271 F272 T277 V278 F279 F408P117-R275 PolarHBondContact O-NH1 3.31Å; H121-R275 PolarHBondContact NE2-NH2 3.46Å; L270-R275 HydrophobicContact CB-CG 3.79Å; L270-R275 PolarHBondContact O-NE 2.92Å; P271-R275 PolarHBondContact O-N 3.01Å; P271-R275 VanDerWaalsContact O-N 3.17Å; F272-R275 PolarHBondContact O-N 3.28Å; R275-T277 VanDerWaalsContact C-N 3.32Å; R275-T277 PolarHBondContact O-N 3.38Å; R275-V278 PolarHBondContact O-N 3.09Å; R275-F279 WeakPolarHBondContact O-CB 3.41Å; R275-F279 PolarHBondContact O-N 2.74Å; R275-F408 HydrophobicContact CB-CE1 4.11Å; R275-F408 HydrophobicContact CB-CE2 4.04Å; R275-F408 HydrophobicContact CB-CZ 3.69Å; R275-F408 HydrophobicContact CG-CD2 4.39Å; R275-F408 HydrophobicContact CG-CE2 4.07Å; R275-F408 HydrophobicContact CG-CZ 4.19Å; R275-F408 WeakPolarHBondContact O-CE1 3.49Å
276W86.5Confident78.7Confident126 Ų12676.3 Ų76.348%0.47739%0.391SS..Hα-helixtrans-65.2-35177.9-177.3-119.6000113F272 E274 F279 K280F272-W276 WeakPolarHBondContact O-CB 3.23Å; F272-W276 PolarHBondContact O-N 3.12Å; E274-W276 VanDerWaalsContact C-N 3.34Å; E274-W276 PolarHBondContact O-N 2.95Å; W276-F279 AromaticContact CE3-CD1 3.97Å; W276-F279 HydrophobicContact CE3-CD1 3.97Å; W276-F279 HydrophobicContact CH2-CD1 4.43Å; W276-F279 AromaticContact CZ3-CD1 3.7Å; W276-F279 HydrophobicContact CZ3-CD1 3.7Å; W276-F279 HydrophobicContact CZ3-CE1 4.04Å; W276-F279 PolarHBondContact O-N 3.44Å; W276-K280 WeakPolarHBondContact O-CB 3.42Å; W276-K280 WeakPolarHBondContact O-CG 3.2Å; W276-K280 PolarHBondContact O-N 3.22Å
277T88.4Confident81.7Confident97 Ų9776.8 Ų76.860%0.59539%0.386SS*.Hα-helixtrans-68-44.3176.9-57.40000111Q273 E274 R275 K280 G281Q273-T277 PolarHBondContact O-N 3.49Å; Q273-T277 PolarHBondContact O-OG1 3.02Å; E274-T277 WeakPolarHBondContact O-CB 3.46Å; E274-T277 PolarHBondContact O-N 2.9Å; E274-T277 VanDerWaalsContact O-N 3.11Å; R275-T277 VanDerWaalsContact C-N 3.32Å; R275-T277 PolarHBondContact O-N 3.38Å; T277-K280 PolarHBondContact O-N 3.25Å; T277-G281 PolarHBondContact O-N 2.92Å; T277-G281 VanDerWaalsContact O-N 3.09Å
278V88.3Confident84.2Confident24 Ų2473 Ų7315%0.14536%0.359CS..Hα-helixtrans-60.7-47.9173175.40000110.4E274 R275 K280 G281 L282 H405 F408 A409E274-V278 WeakPolarHBondContact O-CG2 3.35Å; E274-V278 PolarHBondContact O-N 2.83Å; R275-V278 PolarHBondContact O-N 3.09Å; V278-K280 VanDerWaalsContact C-N 3.32Å; V278-K280 PolarHBondContact O-N 3.29Å; V278-G281 WeakPolarHBondContact O-CA 3.4Å; V278-G281 PolarHBondContact O-N 3.37Å; V278-L282 HydrophobicContact CG1-CD1 4.04Å; V278-L282 HydrophobicContact CG1-CG 4.46Å; V278-L282 WeakPolarHBondContact O-CG 2.9Å; V278-L282 PolarHBondContact O-N 2.85Å; V278-H405 HydrophobicContact CG1-CB 4.37Å; V278-H405 HydrophobicContact CG2-CB 4.12Å; V278-F408 HydrophobicContact CB-CD1 4.28Å; V278-F408 HydrophobicContact CB-CE1 4.18Å; V278-F408 HydrophobicContact CG1-CD1 3.93Å; V278-F408 HydrophobicContact CG1-CE1 4.13Å; V278-A409 HydrophobicContact CG1-CB 4.36Å
279F89.5Confident86.6Confident54 Ų5466.1 Ų66.124%0.23733%0.333CS..Hα-helixtrans-56.4-44.2178-177.1-95.4000112.6R275 W276 G281 L282 L283 I286 A412R275-F279 WeakPolarHBondContact O-CB 3.41Å; R275-F279 PolarHBondContact O-N 2.74Å; W276-F279 AromaticContact CE3-CD1 3.97Å; W276-F279 HydrophobicContact CE3-CD1 3.97Å; W276-F279 HydrophobicContact CH2-CD1 4.43Å; W276-F279 AromaticContact CZ3-CD1 3.7Å; W276-F279 HydrophobicContact CZ3-CD1 3.7Å; W276-F279 HydrophobicContact CZ3-CE1 4.04Å; W276-F279 PolarHBondContact O-N 3.44Å; F279-G281 VanDerWaalsContact C-N 3.31Å; F279-G281 PolarHBondContact O-N 3.17Å; F279-L282 PolarHBondContact O-N 2.98Å; F279-L282 VanDerWaalsContact O-N 3.1Å; F279-L283 HydrophobicContact CE1-CD2 3.9Å; F279-L283 HydrophobicContact CZ-CD2 4.27Å; F279-L283 PolarHBondContact O-N 2.71Å; F279-I286 HydrophobicContact CD2-CD1 4.21Å; F279-I286 HydrophobicContact CE2-CD1 3.72Å; F279-I286 HydrophobicContact CZ-CD1 4.14Å; F279-A412 HydrophobicContact CD2-CB 4.05Å
280K90.8Very high88.6Confident116 Ų11660.7 Ų60.750%0.50431%0.305SS..Hα-helixtrans-59.5-41.2174.2-82.7176.5165.91740112.5W276 T277 V278 L282 L283W276-K280 WeakPolarHBondContact O-CB 3.42Å; W276-K280 WeakPolarHBondContact O-CG 3.2Å; W276-K280 PolarHBondContact O-N 3.22Å; T277-K280 PolarHBondContact O-N 3.25Å; V278-K280 VanDerWaalsContact C-N 3.32Å; V278-K280 PolarHBondContact O-N 3.29Å; K280-L282 VanDerWaalsContact C-N 3.27Å; K280-L282 PolarHBondContact O-N 3.24Å; K280-L283 WeakPolarHBondContact O-CB 3.45Å; K280-L283 PolarHBondContact O-N 3.15Å
281G90.1Very high90.1Very high41 Ų4163.1 Ų63.142%0.42332%0.317SS..Hα-helixtrans-59.1-40173.500000111.9T277 V278 F279 L283 H284T277-G281 PolarHBondContact O-N 2.92Å; T277-G281 VanDerWaalsContact O-N 3.09Å; V278-G281 WeakPolarHBondContact O-CA 3.4Å; V278-G281 PolarHBondContact O-N 3.37Å; F279-G281 VanDerWaalsContact C-N 3.31Å; F279-G281 PolarHBondContact O-N 3.17Å; G281-L283 VanDerWaalsContact C-N 3.28Å; G281-L283 PolarHBondContact O-N 3.46Å; G281-H284 PolarHBondContact O-CD2 3.46Å; G281-H284 PolarHBondContact O-NE2 3.07Å
282L92.8Very high91Very high8 Ų859.4 Ų59.44%0.04229%0.293CS..Hα-helixtrans-74.2-11.8-179-62.9169.1000114.5V278 F279 K280 H284 Y285 I286 V397 A409 A412V278-L282 HydrophobicContact CG1-CD1 4.04Å; V278-L282 HydrophobicContact CG1-CG 4.46Å; V278-L282 WeakPolarHBondContact O-CG 2.9Å; V278-L282 PolarHBondContact O-N 2.85Å; F279-L282 PolarHBondContact O-N 2.98Å; F279-L282 VanDerWaalsContact O-N 3.1Å; K280-L282 VanDerWaalsContact C-N 3.27Å; K280-L282 PolarHBondContact O-N 3.24Å; L282-H284 PolarHBondContact O-N 3.11Å; L282-H284 VanDerWaalsContact O-N 3.13Å; L282-Y285 HydrophobicContact CD2-CD2 4.47Å; L282-Y285 WeakPolarHBondContact O-CA 3.44Å; L282-Y285 WeakPolarHBondContact O-CB 3.45Å; L282-Y285 PolarHBondContact O-N 3.02Å; L282-I286 HydrophobicContact CB-CD1 3.9Å; L282-I286 HydrophobicContact CB-CG1 4.33Å; L282-I286 WeakPolarHBondContact O-CG1 3.39Å; L282-I286 PolarHBondContact O-N 3.11Å; L282-V397 HydrophobicContact CD2-CG1 4Å; L282-V397 HydrophobicContact CD2-CG2 3.99Å; L282-A409 HydrophobicContact CD1-CB 3.66Å; L282-A409 HydrophobicContact CD2-CB 4.13Å; L282-A409 HydrophobicContact CG-CB 4.47Å; L282-A412 HydrophobicContact CD1-CB 4.09Å
283L92.9Very high91.8Very high60 Ų6053 Ų5331%0.31427%0.265SS..Hα-helixtrans-58-30.9-177.1-74.8175.8000113.4F279 K280 G281 Y285 I286 I287F279-L283 HydrophobicContact CE1-CD2 3.9Å; F279-L283 HydrophobicContact CZ-CD2 4.27Å; F279-L283 PolarHBondContact O-N 2.71Å; K280-L283 WeakPolarHBondContact O-CB 3.45Å; K280-L283 PolarHBondContact O-N 3.15Å; G281-L283 VanDerWaalsContact C-N 3.28Å; G281-L283 PolarHBondContact O-N 3.46Å; L283-Y285 PolarHBondContact O-N 2.87Å; L283-I286 PolarHBondContact O-N 3.17Å; L283-I287 HydrophobicContact CB-CD1 4.26Å; L283-I287 WeakPolarHBondContact O-CB 3.44Å; L283-I287 WeakPolarHBondContact O-CG1 3.4Å; L283-I287 PolarHBondContact O-N 3.27Å
284H93.3Very high92.5Very high111 Ų11147.1 Ų47.151%0.51424%0.237SC..Hα-helixtrans-70.3-14.2176.570.274.2000113.7G281 L282 P288G281-H284 PolarHBondContact O-CD2 3.46Å; G281-H284 PolarHBondContact O-NE2 3.07Å; L282-H284 PolarHBondContact O-N 3.11Å; L282-H284 VanDerWaalsContact O-N 3.13Å; H284-P288 VanDerWaalsContact O-CD 3.23Å; H284-P288 WeakPolarHBondContact O-CD 3.43Å; H284-P288 VanDerWaalsContact O-CG 3.23Å; H284-P288 WeakPolarHBondContact O-CG 3.3Å
285Y93.9Very high93Very high12 Ų1244.4 Ų44.45%0.04722%0.224CC..Hα-helixtrans-96.6-43.8168.9-72.3-54.9000111.7L282 L283 P288 L289 I346 T393 N396 V397 E400L282-Y285 HydrophobicContact CD2-CD2 4.47Å; L282-Y285 WeakPolarHBondContact O-CA 3.44Å; L282-Y285 WeakPolarHBondContact O-CB 3.45Å; L282-Y285 PolarHBondContact O-N 3.02Å; L283-Y285 PolarHBondContact O-N 2.87Å; Y285-P288 WeakPolarHBondContact O-CD 3.36Å; Y285-L289 VanDerWaalsContact O-CB 3.3Å; Y285-L289 WeakPolarHBondContact O-CB 3.48Å; Y285-L289 PolarHBondContact O-N 3.43Å; Y285-L289 VanDerWaalsContact O-N 3.12Å; Y285-I346 HydrophobicContact CD1-CG1 4Å; Y285-I346 HydrophobicContact CE1-CG1 4.14Å; Y285-T393 HydrophobicContact CD1-CG2 4.31Å; Y285-T393 HydrophobicContact CG-CG2 4.29Å; Y285-N396 HydrophobicContact CE1-CB 3.81Å; Y285-V397 HydrophobicContact CD2-CG2 3.59Å; Y285-V397 HydrophobicContact CE2-CG2 4.09Å; Y285-V397 HydrophobicContact CG-CG2 3.99Å; Y285-E400 WeakPolarHBondContact CE2-OE2 3.45Å; Y285-E400 PolarHBondContact OH-OE1 3.13Å; Y285-E400 PolarHBondContact OH-OE2 3.19Å
286I94.3Very high93.5Very high12 Ų1242.8 Ų42.86%0.06222%0.218CC..Hα-helixtrans-60.8-50.3-178-66.8170.8000111F279 L282 L283 L289 V290 S416F279-I286 HydrophobicContact CD2-CD1 4.21Å; F279-I286 HydrophobicContact CE2-CD1 3.72Å; F279-I286 HydrophobicContact CZ-CD1 4.14Å; L282-I286 HydrophobicContact CB-CD1 3.9Å; L282-I286 HydrophobicContact CB-CG1 4.33Å; L282-I286 WeakPolarHBondContact O-CG1 3.39Å; L282-I286 PolarHBondContact O-N 3.11Å; L283-I286 PolarHBondContact O-N 3.17Å; I286-L289 PolarHBondContact O-N 3.43Å; I286-V290 HydrophobicContact CG2-CG2 4.13Å; I286-V290 VanDerWaalsContact O-CG2 3.24Å; I286-V290 WeakPolarHBondContact O-CG2 3.24Å; I286-V290 PolarHBondContact O-N 2.9Å; I286-S416 WeakPolarHBondContact CA-OG 3.41Å; I286-S416 WeakPolarHBondContact CG1-OG 3.31Å; I286-S416 WeakPolarHBondContact CG2-OG 3.36Å
287I96.1Very high93.7Very high93 Ų9338.7 Ų38.748%0.47720%0.203SC..Hα-helixtrans-62.6-51.1-174.8-65.3166.9000111.5L283 L289 V290 L291L283-I287 HydrophobicContact CB-CD1 4.26Å; L283-I287 WeakPolarHBondContact O-CB 3.44Å; L283-I287 WeakPolarHBondContact O-CG1 3.4Å; L283-I287 PolarHBondContact O-N 3.27Å; I287-L289 VanDerWaalsContact C-N 3.3Å; I287-L289 PolarHBondContact O-N 3.06Å; I287-V290 PolarHBondContact O-N 3.25Å; I287-L291 HydrophobicContact CG2-CD1 4.24Å; I287-L291 WeakPolarHBondContact O-CG 3.37Å; I287-L291 PolarHBondContact O-N 3.4Å
288P96.8Very high93.7Very high12 Ų1235 Ų358%0.07818%0.179CC..Hα-helixtrans-56.8-41.8173.7-30.939.8000113.7H284 Y285 L291 V292 I346 W347 A350H284-P288 VanDerWaalsContact O-CD 3.23Å; H284-P288 WeakPolarHBondContact O-CD 3.43Å; H284-P288 VanDerWaalsContact O-CG 3.23Å; H284-P288 WeakPolarHBondContact O-CG 3.3Å; Y285-P288 WeakPolarHBondContact O-CD 3.36Å; P288-L291 PolarHBondContact O-N 3.11Å; P288-V292 WeakPolarHBondContact O-CG2 3.28Å; P288-V292 PolarHBondContact O-N 3.29Å; P288-I346 HydrophobicContact CB-CB 4.32Å; P288-I346 HydrophobicContact CB-CG2 3.9Å; P288-W347 HydrophobicContact CG-CB 4.07Å; P288-A350 HydrophobicContact CB-CB 3.99Å
289L96.4Very high93.8Very high0 Ų033.9 Ų33.90%017%0.172CC..Hα-helixtrans-67.1-42.4-178.5-16961.8000111.6Y285 I286 I287 L291 V292 Y293 A389 T393Y285-L289 VanDerWaalsContact O-CB 3.3Å; Y285-L289 WeakPolarHBondContact O-CB 3.48Å; Y285-L289 PolarHBondContact O-N 3.43Å; Y285-L289 VanDerWaalsContact O-N 3.12Å; I286-L289 PolarHBondContact O-N 3.43Å; I287-L289 VanDerWaalsContact C-N 3.3Å; I287-L289 PolarHBondContact O-N 3.06Å; L289-L291 VanDerWaalsContact C-N 3.29Å; L289-L291 PolarHBondContact O-N 2.9Å; L289-V292 PolarHBondContact O-N 2.96Å; L289-Y293 HydrophobicContact CD1-CD2 3.76Å; L289-Y293 HydrophobicContact CD1-CE2 3.62Å; L289-Y293 HydrophobicContact CG-CD2 3.99Å; L289-Y293 HydrophobicContact CG-CE2 4.15Å; L289-Y293 WeakPolarHBondContact O-CD2 3.39Å; L289-Y293 PolarHBondContact O-N 3.42Å; L289-A389 HydrophobicContact CD1-CB 4.11Å; L289-T393 HydrophobicContact CD2-CG2 3.82Å
290V97.3Very high93.7Very high17 Ų1731.6 Ų31.610%0.10316%0.162CC..Hα-helixtrans-55.3-45.5171.4170.90000110.6I286 I287 F294 S416 L419 M423I286-V290 HydrophobicContact CG2-CG2 4.13Å; I286-V290 VanDerWaalsContact O-CG2 3.24Å; I286-V290 WeakPolarHBondContact O-CG2 3.24Å; I286-V290 PolarHBondContact O-N 2.9Å; I287-V290 PolarHBondContact O-N 3.25Å; V290-F294 WeakPolarHBondContact O-CB 3.49Å; V290-F294 PolarHBondContact O-N 3.42Å; V290-S416 VanDerWaalsContact CG2-O 3.29Å; V290-S416 WeakPolarHBondContact CG2-O 3.19Å; V290-L419 HydrophobicContact CG1-CG 4.5Å; V290-L419 HydrophobicContact CG2-CB 4.4Å; V290-L419 HydrophobicContact CG2-CD2 4.06Å; V290-L419 HydrophobicContact CG2-CG 4.47Å; V290-M423 HydrophobicContact CG1-SD 4.34Å
291L97.3Very high93Very high73 Ų7326.8 Ų26.838%0.38214%0.141SC..Hα-helixtrans-66.5-41.6-179.4-71.4174.3000112.8I287 P288 L289 A295 A350I287-L291 HydrophobicContact CG2-CD1 4.24Å; I287-L291 WeakPolarHBondContact O-CG 3.37Å; I287-L291 PolarHBondContact O-N 3.4Å; P288-L291 PolarHBondContact O-N 3.11Å; L289-L291 VanDerWaalsContact C-N 3.29Å; L289-L291 PolarHBondContact O-N 2.9Å; L291-A295 WeakPolarHBondContact O-CB 3.29Å; L291-A295 PolarHBondContact O-N 2.87Å; L291-A350 HydrophobicContact CB-CB 4.16Å
292V97.4Very high92.4Very high0 Ų025.2 Ų25.20%013%0.125CC..Hα-helixtrans-59.1-53.9175.21720000109.9P288 L289 F294 A295 E296 L349 A350 Q353 A389P288-V292 WeakPolarHBondContact O-CG2 3.28Å; P288-V292 PolarHBondContact O-N 3.29Å; L289-V292 PolarHBondContact O-N 2.96Å; V292-F294 VanDerWaalsContact C-N 3.34Å; V292-F294 PolarHBondContact O-N 3.16Å; V292-A295 PolarHBondContact O-N 2.91Å; V292-E296 WeakPolarHBondContact O-CB 3.37Å; V292-E296 PolarHBondContact O-N 3.42Å; V292-L349 HydrophobicContact CG2-CB 4.46Å; V292-A350 VanDerWaalsContact CG2-CA 3.44Å; V292-A350 HydrophobicContact CG2-CB 3.85Å; V292-Q353 HydrophobicContact CG1-CG 4.23Å; V292-Q353 HydrophobicContact CG2-CB 4.41Å; V292-A389 HydrophobicContact CB-CB 4.19Å; V292-A389 HydrophobicContact CG1-CB 3.84Å; V292-A389 HydrophobicContact CG2-CB 3.87Å
293Y95.6Very high91.9Very high4 Ų424.8 Ų24.82%0.01612%0.123CC..Hα-helixtrans-65-37-178.1-89.9-84.1000113L289 Y297 R335 Y390 D417 I421L289-Y293 HydrophobicContact CD1-CD2 3.76Å; L289-Y293 HydrophobicContact CD1-CE2 3.62Å; L289-Y293 HydrophobicContact CG-CD2 3.99Å; L289-Y293 HydrophobicContact CG-CE2 4.15Å; L289-Y293 WeakPolarHBondContact O-CD2 3.39Å; L289-Y293 PolarHBondContact O-N 3.42Å; Y293-Y297 HydrophobicContact CD1-CD2 4.04Å; Y293-Y297 AromaticContact CD1-CE2 3.72Å; Y293-Y297 HydrophobicContact CD1-CE2 3.72Å; Y293-Y297 AromaticContact CE1-CE2 3.99Å; Y293-Y297 HydrophobicContact CE1-CE2 3.99Å; Y293-Y297 WeakPolarHBondContact O-CB 3.35Å; Y293-Y297 WeakPolarHBondContact O-CD2 3.43Å; Y293-Y297 PolarHBondContact O-N 3.44Å; Y293-R335 PolarHBondContact OH-NH2 3.11Å; Y293-Y390 HydrophobicContact CE2-CD2 4.16Å; Y293-Y390 AromaticContact CZ-CD2 3.94Å; Y293-Y390 WeakPolarHBondContact OH-CD2 3.42Å; Y293-D417 HydrophobicContact CD1-CB 3.9Å; Y293-D417 HydrophobicContact CD2-CB 3.7Å; Y293-D417 HydrophobicContact CE1-CB 3.87Å; Y293-D417 HydrophobicContact CE2-CB 3.7Å; Y293-D417 HydrophobicContact CG-CB 3.8Å; Y293-I421 HydrophobicContact CD1-CD1 3.85Å; Y293-I421 HydrophobicContact CD1-CG1 3.82Å; Y293-I421 HydrophobicContact CE1-CD1 4.26Å
294F95.5Very high91.4Very high37 Ų3722 Ų2216%0.16211%0.109CC..Hα-helixtrans-58.2-55.9172169.9-99.8000111.1V290 V292 Y297 F298 L357 G420 M423 S424 L427V290-F294 WeakPolarHBondContact O-CB 3.49Å; V290-F294 PolarHBondContact O-N 3.42Å; V292-F294 VanDerWaalsContact C-N 3.34Å; V292-F294 PolarHBondContact O-N 3.16Å; F294-Y297 PolarHBondContact O-N 2.69Å; F294-F298 HydrophobicContact CE2-CD2 4.3Å; F294-F298 HydrophobicContact CZ-CD2 4.19Å; F294-F298 WeakPolarHBondContact O-CB 3.36Å; F294-F298 PolarHBondContact O-N 3.32Å; F294-L357 HydrophobicContact CE1-CD2 4.34Å; F294-G420 WeakPolarHBondContact CA-O 3.09Å; F294-M423 HydrophobicContact CD2-CB 3.93Å; F294-M423 HydrophobicContact CE2-CB 4.41Å; F294-S424 WeakPolarHBondContact O-CB 3.14Å; F294-L427 HydrophobicContact CE2-CD1 3.75Å; F294-L427 HydrophobicContact CZ-CD1 3.89Å
295A95.7Very high90.3Very high0 Ų018.2 Ų18.20%09%0.091CC..Hα-helixtrans-65.7-43.6-175.700000112L291 V292 F298 I299 Q353 L357L291-A295 WeakPolarHBondContact O-CB 3.29Å; L291-A295 PolarHBondContact O-N 2.87Å; V292-A295 PolarHBondContact O-N 2.91Å; A295-F298 PolarHBondContact O-N 2.81Å; A295-I299 WeakPolarHBondContact O-CD1 3.26Å; A295-I299 VanDerWaalsContact O-CG1 3.22Å; A295-I299 WeakPolarHBondContact O-CG1 3.36Å; A295-I299 PolarHBondContact O-N 2.97Å; A295-Q353 HydrophobicContact CB-CB 4.41Å; A295-Q353 HydrophobicContact CB-CG 3.7Å; A295-L357 HydrophobicContact CB-CB 4.13Å; A295-L357 HydrophobicContact CB-CD2 4.02Å
296E94.1Very high89.4Confident1 Ų118.5 Ų18.51%0.0059%0.093CC..Hα-helixtrans-53.8-57.2173.1179.8177.6102.600112.6V292 F298 I299 N300 Y327 Q353 E382 G386V292-E296 WeakPolarHBondContact O-CB 3.37Å; V292-E296 PolarHBondContact O-N 3.42Å; E296-F298 PolarHBondContact O-N 3.41Å; E296-I299 WeakPolarHBondContact O-CB 3.35Å; E296-I299 PolarHBondContact O-N 2.94Å; E296-N300 PolarHBondContact O-N 3.34Å; E296-N300 PolarHBondContact O-ND2 3.22Å; E296-Y327 HydrophobicContact CG-CE2 3.71Å; E296-Y327 PolarHBondContact OE1-OH 3.31Å; E296-Q353 VanDerWaalsContact CA-NE2 3.32Å; E296-Q353 VanDerWaalsContact CB-NE2 3.34Å; E296-E382 WeakPolarHBondContact CG-OE1 3.22Å; E296-G386 WeakPolarHBondContact OE2-CA 3.18Å
297Y90.6Very high88.6Confident41 Ų4118.2 Ų18.216%0.1619%0.092CC..Hα-helixtrans-70.7-26.8-176.3-84.3-109000112L102 Y293 F294 N300 Q301 I421 S424L102-Y297 HydrophobicContact CD1-CE1 4.49Å; L102-Y297 HydrophobicContact CD2-CD1 4.13Å; Y293-Y297 HydrophobicContact CD1-CD2 4.04Å; Y293-Y297 AromaticContact CD1-CE2 3.72Å; Y293-Y297 HydrophobicContact CD1-CE2 3.72Å; Y293-Y297 AromaticContact CE1-CE2 3.99Å; Y293-Y297 HydrophobicContact CE1-CE2 3.99Å; Y293-Y297 WeakPolarHBondContact O-CB 3.35Å; Y293-Y297 WeakPolarHBondContact O-CD2 3.43Å; Y293-Y297 PolarHBondContact O-N 3.44Å; F294-Y297 PolarHBondContact O-N 2.69Å; Y297-N300 PolarHBondContact O-N 3.44Å; Y297-Q301 WeakPolarHBondContact O-CB 3.38Å; Y297-Q301 WeakPolarHBondContact O-CG 3.24Å; Y297-Q301 PolarHBondContact O-N 3.39Å; Y297-I421 HydrophobicContact CD1-CB 4.25Å; Y297-I421 HydrophobicContact CD1-CD1 4.49Å; Y297-I421 HydrophobicContact CD1-CG1 3.88Å; Y297-I421 HydrophobicContact CD1-CG2 3.54Å; Y297-I421 HydrophobicContact CD2-CD1 4.27Å; Y297-I421 HydrophobicContact CD2-CG1 3.58Å; Y297-I421 HydrophobicContact CE1-CD1 4.02Å; Y297-I421 HydrophobicContact CE1-CG1 3.92Å; Y297-I421 HydrophobicContact CE1-CG2 3.79Å; Y297-I421 HydrophobicContact CE2-CD1 3.76Å; Y297-I421 HydrophobicContact CE2-CG1 3.61Å; Y297-I421 HydrophobicContact CG-CB 4.28Å; Y297-I421 HydrophobicContact CG-CG1 3.71Å; Y297-I421 HydrophobicContact CG-CG2 4.03Å; Y297-S424 PolarHBondContact O-OG 3.47Å
298F90.4Very high87.9Confident20 Ų2017.7 Ų17.79%0.0889%0.086CC..Hα-helixtrans-69.5-37.9175.9-165.1-87000111.3F294 A295 E296 G302 L303 L357 S424 L427 A428 L431F294-F298 HydrophobicContact CE2-CD2 4.3Å; F294-F298 HydrophobicContact CZ-CD2 4.19Å; F294-F298 WeakPolarHBondContact O-CB 3.36Å; F294-F298 PolarHBondContact O-N 3.32Å; A295-F298 PolarHBondContact O-N 2.81Å; E296-F298 PolarHBondContact O-N 3.41Å; F298-G302 WeakPolarHBondContact O-CA 3.4Å; F298-G302 PolarHBondContact O-N 2.92Å; F298-L303 HydrophobicContact CD1-CG 4.47Å; F298-L303 HydrophobicContact CE1-CD2 4.42Å; F298-L303 PolarHBondContact O-N 3.3Å; F298-L357 HydrophobicContact CD1-CD1 3.51Å; F298-L357 HydrophobicContact CD1-CD2 4.37Å; F298-L357 HydrophobicContact CE1-CD1 4.16Å; F298-L357 HydrophobicContact CG-CD1 4.41Å; F298-S424 WeakPolarHBondContact CA-OG 3.22Å; F298-S424 WeakPolarHBondContact CB-OG 3.47Å; F298-S424 PolarHBondContact N-OG 2.92Å; F298-L427 HydrophobicContact CD2-CB 4.43Å; F298-L427 HydrophobicContact CE2-CB 3.87Å; F298-A428 HydrophobicContact CD2-CB 4.46Å; F298-A428 HydrophobicContact CE2-CB 4.44Å; F298-L431 HydrophobicContact CE1-CD2 3.48Å; F298-L431 VanDerWaalsContact CE1-CD2 3.48Å; F298-L431 HydrophobicContact CE2-CD2 4.39Å; F298-L431 HydrophobicContact CZ-CB 4.32Å; F298-L431 HydrophobicContact CZ-CD2 3.3Å; F298-L431 HydrophobicContact CZ-CG 4.36Å
299I90.4Very high87.1Confident0 Ų018.6 Ų18.60%09%0.089CC..Iπ-helixtrans-62-55.7169.8-68.8162.5000109.7A295 E296 Q301 L303 F304 L357 L360 E382A295-I299 WeakPolarHBondContact O-CD1 3.26Å; A295-I299 VanDerWaalsContact O-CG1 3.22Å; A295-I299 WeakPolarHBondContact O-CG1 3.36Å; A295-I299 PolarHBondContact O-N 2.97Å; E296-I299 WeakPolarHBondContact O-CB 3.35Å; E296-I299 PolarHBondContact O-N 2.94Å; I299-Q301 VanDerWaalsContact C-N 3.28Å; I299-Q301 PolarHBondContact O-N 2.95Å; I299-L303 HydrophobicContact CG1-CD1 4.4Å; I299-L303 PolarHBondContact O-N 2.61Å; I299-F304 HydrophobicContact CG2-CD1 3.76Å; I299-F304 HydrophobicContact CG2-CE1 3.18Å; I299-F304 HydrophobicContact CG2-CZ 3.76Å; I299-F304 WeakPolarHBondContact O-CD1 3.35Å; I299-F304 PolarHBondContact O-N 2.88Å; I299-L357 HydrophobicContact CD1-CB 4Å; I299-L357 HydrophobicContact CG1-CB 4.1Å; I299-L357 HydrophobicContact CG1-CD1 3.78Å; I299-L360 HydrophobicContact CB-CD1 4.42Å; I299-L360 HydrophobicContact CD1-CD1 4.11Å; I299-L360 HydrophobicContact CG1-CD1 4.07Å; I299-L360 HydrophobicContact CG2-CD1 3.48Å; I299-L360 VanDerWaalsContact CG2-CD1 3.48Å; I299-E382 HydrophobicContact CD1-CG 4.19Å; I299-E382 WeakPolarHBondContact CG2-OE2 3.3Å
300N86.4Confident86Confident5 Ų527.4 Ų27.43%0.02712%0.122CC..Iπ-helixtrans-58.7-35.5-174.1-79.2-55.5000114E296 Y297 F304 Y327 E382E296-N300 PolarHBondContact O-N 3.34Å; E296-N300 PolarHBondContact O-ND2 3.22Å; Y297-N300 PolarHBondContact O-N 3.44Å; N300-F304 HydrophobicContact CB-CD2 4.43Å; N300-F304 HydrophobicContact CB-CE2 4.41Å; N300-F304 WeakPolarHBondContact OD1-CE2 3.27Å; N300-F304 WeakPolarHBondContact OD1-CZ 3.22Å; N300-Y327 WeakPolarHBondContact ND2-CE2 3.47Å; N300-E382 PolarHBondContact ND2-OE1 2.96Å
301Q76.5Confident84.9Confident15 Ų1534.6 Ų34.67%0.0716%0.16CC..Iπ-helixtrans-113.5-28.9-171.1-58.8-1777.700114.1L102 Y297 I299L102-Q301 VanDerWaalsContact CD2-CD 3.47Å; L102-Q301 VanDerWaalsContact CG-NE2 3.27Å; Y297-Q301 WeakPolarHBondContact O-CB 3.38Å; Y297-Q301 WeakPolarHBondContact O-CG 3.24Å; Y297-Q301 PolarHBondContact O-N 3.39Å; I299-Q301 VanDerWaalsContact C-N 3.28Å; I299-Q301 PolarHBondContact O-N 2.95Å
302G76.9Confident84Confident8 Ų833.3 Ų33.38%0.08216%0.155CC..Iπ-helixtrans-90.2-35.2178.800000112.8F298 L306F298-G302 WeakPolarHBondContact O-CA 3.4Å; F298-G302 PolarHBondContact O-N 2.92Å; G302-L306 WeakPolarHBondContact O-CD1 3.42Å
303L82.5Confident83.2Confident0 Ų039 Ų390%020%0.195CC..Iπ-helixtrans-110.9-35.2-168.7-54.1-174.4000114.2F298 I299 E305 L306 L307 L357 L360 L361 V364 L431F298-L303 HydrophobicContact CD1-CG 4.47Å; F298-L303 HydrophobicContact CE1-CD2 4.42Å; F298-L303 PolarHBondContact O-N 3.3Å; I299-L303 HydrophobicContact CG1-CD1 4.4Å; I299-L303 PolarHBondContact O-N 2.61Å; L303-E305 VanDerWaalsContact C-N 3.32Å; L303-E305 PolarHBondContact O-N 3.26Å; L303-L306 WeakPolarHBondContact O-CA 3.19Å; L303-L306 WeakPolarHBondContact O-CB 3.4Å; L303-L306 PolarHBondContact O-N 3.37Å; L303-L307 HydrophobicContact CB-CD1 4.41Å; L303-L307 WeakPolarHBondContact O-CG 3.48Å; L303-L307 PolarHBondContact O-N 2.9Å; L303-L357 HydrophobicContact CD1-CD1 3.72Å; L303-L360 HydrophobicContact CD1-CB 4.08Å; L303-L361 HydrophobicContact CD1-CB 4.17Å; L303-L361 HydrophobicContact CD1-CD1 4.39Å; L303-L361 HydrophobicContact CD2-CD1 3.74Å; L303-V364 HydrophobicContact CB-CG2 4.43Å; L303-V364 HydrophobicContact CD2-CG2 4.3Å; L303-L431 HydrophobicContact CD2-CD2 4.11Å
304F81.4Confident82.4Confident2 Ų240.9 Ų40.91%0.00921%0.205CC..THydrogen-bonded Turntrans-59.4-36.8-175.2-80.93.3000114.8I299 N300 L306 L307 Y320 Y323 V379 E382I299-F304 HydrophobicContact CG2-CD1 3.76Å; I299-F304 HydrophobicContact CG2-CE1 3.18Å; I299-F304 HydrophobicContact CG2-CZ 3.76Å; I299-F304 WeakPolarHBondContact O-CD1 3.35Å; I299-F304 PolarHBondContact O-N 2.88Å; N300-F304 HydrophobicContact CB-CD2 4.43Å; N300-F304 HydrophobicContact CB-CE2 4.41Å; N300-F304 WeakPolarHBondContact OD1-CE2 3.27Å; N300-F304 WeakPolarHBondContact OD1-CZ 3.22Å; F304-L306 PolarHBondContact O-N 3.41Å; F304-L307 HydrophobicContact CD1-CD1 4.19Å; F304-L307 PolarHBondContact O-N 2.81Å; F304-Y320 HydrophobicContact CB-CD2 4.21Å; F304-Y320 HydrophobicContact CB-CE2 4.13Å; F304-Y323 HydrophobicContact CB-CD2 4.33Å; F304-Y323 HydrophobicContact CD2-CD2 4.48Å; F304-Y323 HydrophobicContact CG-CD2 4.26Å; F304-V379 HydrophobicContact CE1-CG2 3.5Å; F304-V379 VanDerWaalsContact CE1-CG2 3.5Å; F304-V379 HydrophobicContact CE2-CG1 4.01Å; F304-V379 HydrophobicContact CE2-CG2 4.37Å; F304-V379 HydrophobicContact CZ-CB 4.08Å; F304-V379 HydrophobicContact CZ-CG1 3.58Å; F304-V379 HydrophobicContact CZ-CG2 3.4Å; F304-E382 WeakPolarHBondContact CZ-OE2 3.47Å
305E71.7Confident81.7Confident30 Ų3041.6 Ų41.614%0.1422%0.215CC..THydrogen-bonded Turntrans-64.4-27.7176.5-65.2-171.7171.400111.9T98 L303 H316 Y320T98-E305 VanDerWaalsContact CB-OE1 3.29Å; T98-E305 WeakPolarHBondContact CB-OE1 3.28Å; T98-E305 PolarHBondContact OG1-OE1 3.46Å; L303-E305 VanDerWaalsContact C-N 3.32Å; L303-E305 PolarHBondContact O-N 3.26Å; E305-H316 PolarHBondContact O-NE2 3.46Å; E305-Y320 HydrophobicContact CG-CD2 4.4Å; E305-Y320 HydrophobicContact CG-CE2 4.09Å
306L74.6Confident80.6Confident18 Ų1845 Ų459%0.09423%0.231CC..THydrogen-bonded Turntrans-89.9-24.8-176.9-53.8176.8000112.9F91 G302 L303 F304 F308 V364 L435F91-L306 HydrophobicContact CB-CD2 4.08Å; F91-L306 HydrophobicContact CD1-CB 4.15Å; F91-L306 HydrophobicContact CD1-CD2 3.78Å; F91-L306 HydrophobicContact CE1-CB 4.07Å; F91-L306 HydrophobicContact CE1-CD2 4.39Å; F91-L306 HydrophobicContact CG-CD2 3.95Å; G302-L306 WeakPolarHBondContact O-CD1 3.42Å; L303-L306 WeakPolarHBondContact O-CA 3.19Å; L303-L306 WeakPolarHBondContact O-CB 3.4Å; L303-L306 PolarHBondContact O-N 3.37Å; F304-L306 PolarHBondContact O-N 3.41Å; L306-F308 VanDerWaalsContact C-N 3.32Å; L306-F308 PolarHBondContact O-N 3.41Å; L306-V364 HydrophobicContact CB-CG1 4.37Å; L306-V364 HydrophobicContact CD1-CG1 4.28Å; L306-L435 HydrophobicContact CD1-CB 4.45Å; L306-L435 HydrophobicContact CD1-CD1 3.3Å; L306-L435 HydrophobicContact CD1-CG 4.45Å
307L78.3Confident79.4Confident7 Ų748 Ų484%0.03725%0.252CS..  trans-7776.9178.9-71.5171.1000111.4L303 F304 Y323 L360 V364L303-L307 HydrophobicContact CB-CD1 4.41Å; L303-L307 WeakPolarHBondContact O-CG 3.48Å; L303-L307 PolarHBondContact O-N 2.9Å; F304-L307 HydrophobicContact CD1-CD1 4.19Å; F304-L307 PolarHBondContact O-N 2.81Å; L307-Y323 HydrophobicContact CB-CE2 4.47Å; L307-Y323 WeakPolarHBondContact O-CE2 3.37Å; L307-Y323 PolarHBondContact O-OH 3.09Å; L307-L360 HydrophobicContact CD1-CD2 4.09Å; L307-V364 HydrophobicContact CD2-CG2 3.6Å; L307-V364 HydrophobicContact CG-CG2 3.93Å
308F79.8Confident78.6Confident81 Ų8150.1 Ų50.136%0.35526%0.263SS..  trans-110.6126.7-178.6178.8-130.4000113.9L306 R310 H316L306-F308 VanDerWaalsContact C-N 3.32Å; L306-F308 PolarHBondContact O-N 3.41Å; F308-R310 HydrophobicContact CD1-CG 3.85Å; F308-R310 HydrophobicContact CE1-CB 4.43Å; F308-R310 HydrophobicContact CE1-CG 3.37Å; F308-R310 HydrophobicContact CZ-CG 4.04Å; F308-H316 HydrophobicContact CD2-CB 3.93Å; F308-H316 AromaticContact CD2-CD2 3.48Å; F308-H316 VanDerWaalsContact CD2-CD2 3.48Å; F308-H316 WeakPolarHBondContact CD2-CD2 3.17Å; F308-H316 HydrophobicContact CE2-CB 3.73Å; F308-H316 AromaticContact CG-CD2 3.62Å; F308-H316 HydrophobicContact CZ-CB 4.24Å
309F80.8Confident78.3Confident31 Ų3149.2 Ų49.214%0.13626%0.259CS..  trans-104.6106176.3-70.5-98000111.2N311 T312 Q319 L369 I372 I375F309-N311 VanDerWaalsContact C-N 3.31Å; F309-N311 PolarHBondContact O-N 2.9Å; F309-T312 HydrophobicContact CB-CG2 3.95Å; F309-T312 PolarHBondContact O-OG1 3.42Å; F309-Q319 PolarHBondContact O-NE2 2.95Å; F309-L369 WeakPolarHBondContact CE1-O 3.41Å; F309-L369 HydrophobicContact CZ-CB 4.48Å; F309-I372 HydrophobicContact CB-CB 4.26Å; F309-I372 HydrophobicContact CD2-CB 4.24Å; F309-I372 HydrophobicContact CD2-CG1 4.26Å; F309-I372 HydrophobicContact CG-CB 4.08Å; F309-I375 HydrophobicContact CE2-CB 4.47Å; F309-I375 HydrophobicContact CE2-CD1 4.47Å; F309-I375 HydrophobicContact CE2-CG1 3.6Å; F309-I375 HydrophobicContact CZ-CD1 4.46Å; F309-I375 HydrophobicContact CZ-CG1 3.7Å
310R73.1Confident77.8Confident186 Ų18652 Ų5270%0.70227%0.27SS*.SBendtrans-67.1-27.9178.9-70.2179.7-177.1-173.41.3113.8F308 T312F308-R310 HydrophobicContact CD1-CG 3.85Å; F308-R310 HydrophobicContact CE1-CB 4.43Å; F308-R310 HydrophobicContact CE1-CG 3.37Å; F308-R310 HydrophobicContact CZ-CG 4.04Å; R310-T312 PolarHBondContact O-N 3.18Å; R310-T312 VanDerWaalsContact O-N 3.09Å
311N73.3Confident77.5Confident167 Ų16759 Ų5989%0.89330%0.296SS*.SBendtrans-86.240.3-174.5-68.7-14.6000113.2F309F309-N311 VanDerWaalsContact C-N 3.31Å; F309-N311 PolarHBondContact O-N 2.9Å
312T80.1Confident77.9Confident46 Ų4663.6 Ų63.628%0.28231%0.313SS..SBendtrans-136.1159.2-179.472.50000111F309 R310 L314 Q319 I372F309-T312 HydrophobicContact CB-CG2 3.95Å; F309-T312 PolarHBondContact O-OG1 3.42Å; R310-T312 PolarHBondContact O-N 3.18Å; R310-T312 VanDerWaalsContact O-N 3.09Å; T312-L314 PolarHBondContact O-N 3.21Å; T312-L314 PolarHBondContact OG1-N 3Å; T312-L314 PolarHBondContact OG1-O 2.9Å; T312-Q319 PolarHBondContact OG1-NE2 3.45Å; T312-I372 HydrophobicContact CG2-CB 4.1Å; T312-I372 HydrophobicContact CG2-CD1 4.33Å; T312-I372 HydrophobicContact CG2-CG2 3.76Å
313S79.4Confident78.4Confident121 Ų12163.3 Ų63.385%0.84631%0.309SS*.SBendtrans-73.8-2.4174.160.70000113.4
314L80.1Confident78.6Confident43 Ų4365.5 Ų65.523%0.22532%0.32CS..SBendtrans-96.1129.8-176.5-62.9176.4000110.3T312 Q318 Q319 I372 F376T312-L314 PolarHBondContact O-N 3.21Å; T312-L314 PolarHBondContact OG1-N 3Å; T312-L314 PolarHBondContact OG1-O 2.9Å; L314-Q318 HydrophobicContact CB-CB 4.3Å; L314-Q318 HydrophobicContact CD2-CB 4.34Å; L314-Q319 HydrophobicContact CB-CG 3.7Å; L314-Q319 HydrophobicContact CD1-CG 4.41Å; L314-Q319 PolarHBondContact O-NE2 3.31Å; L314-I372 HydrophobicContact CD1-CD1 4.25Å; L314-F376 HydrophobicContact CD1-CZ 4.05Å
315S79.1Confident78.8Confident51 Ų5169.8 Ų69.836%0.35734%0.341SS..  trans-65.1159.6170.973.10000111.2S317 Q318 Q319S315-S317 VanDerWaalsContact C-N 3.27Å; S315-S317 PolarHBondContact O-N 3.09Å; S315-S317 PolarHBondContact OG-OG 2.81Å; S315-S317 VanDerWaalsContact OG-OG 3.11Å; S315-Q318 WeakPolarHBondContact O-CB 3.49Å; S315-Q318 PolarHBondContact O-N 2.9Å; S315-Q318 VanDerWaalsContact OG-CG 3.26Å; S315-Q318 WeakPolarHBondContact OG-CG 3.43Å; S315-Q318 PolarHBondContact OG-N 3.22Å; S315-Q318 PolarHBondContact OG-OE1 3.4Å; S315-Q319 WeakPolarHBondContact O-CG 3.34Å; S315-Q319 PolarHBondContact O-N 3.34Å
316H72.7Confident79.8Confident72 Ų7270 Ų7033%0.33334%0.343SS..Hα-helixtrans-52.7-44.2176.9-179.4-113.7000112.7E305 F308 Q318 Q319 Y320E305-H316 PolarHBondContact O-NE2 3.46Å; F308-H316 HydrophobicContact CD2-CB 3.93Å; F308-H316 AromaticContact CD2-CD2 3.48Å; F308-H316 VanDerWaalsContact CD2-CD2 3.48Å; F308-H316 WeakPolarHBondContact CD2-CD2 3.17Å; F308-H316 HydrophobicContact CE2-CB 3.73Å; F308-H316 AromaticContact CG-CD2 3.62Å; F308-H316 HydrophobicContact CZ-CB 4.24Å; H316-Q318 VanDerWaalsContact C-N 3.35Å; H316-Q318 PolarHBondContact O-N 2.94Å; H316-Q319 PolarHBondContact O-N 2.93Å; H316-Y320 PolarHBondContact O-N 3.17Å; H316-Y320 VanDerWaalsContact O-N 3.09Å
317S69.7Low80.7Confident65 Ų6569.7 Ų69.746%0.45534%0.34SS..Hα-helixtrans-66.9-31.7176.659.70000113.8S315 R321S315-S317 VanDerWaalsContact C-N 3.27Å; S315-S317 PolarHBondContact O-N 3.09Å; S315-S317 PolarHBondContact OG-OG 2.81Å; S315-S317 VanDerWaalsContact OG-OG 3.11Å; S317-R321 VanDerWaalsContact O-CG 3.26Å; S317-R321 WeakPolarHBondContact O-CG 3.5Å; S317-R321 PolarHBondContact O-N 2.97Å
318Q74.8Confident81.3Confident85 Ų8571.1 Ų71.140%0.39735%0.347SS..Hα-helixtrans-72-40.3174.3-74.1171-25.200111.5L314 S315 H316 R321 W322L314-Q318 HydrophobicContact CB-CB 4.3Å; L314-Q318 HydrophobicContact CD2-CB 4.34Å; S315-Q318 WeakPolarHBondContact O-CB 3.49Å; S315-Q318 PolarHBondContact O-N 2.9Å; S315-Q318 VanDerWaalsContact OG-CG 3.26Å; S315-Q318 WeakPolarHBondContact OG-CG 3.43Å; S315-Q318 PolarHBondContact OG-N 3.22Å; S315-Q318 PolarHBondContact OG-OE1 3.4Å; H316-Q318 VanDerWaalsContact C-N 3.35Å; H316-Q318 PolarHBondContact O-N 2.94Å; Q318-R321 PolarHBondContact O-N 2.92Å; Q318-W322 VanDerWaalsContact O-CD1 3.26Å; Q318-W322 PolarHBondContact O-N 3.5Å
319Q82.6Confident82Confident1 Ų169.3 Ų69.31%0.00534%0.343CS..Hα-helixtrans-60.7-48.1176.7-65-178.728.600110.9F309 T312 L314 S315 H316 R321 W322 Y323 I372F309-Q319 PolarHBondContact O-NE2 2.95Å; T312-Q319 PolarHBondContact OG1-NE2 3.45Å; L314-Q319 HydrophobicContact CB-CG 3.7Å; L314-Q319 HydrophobicContact CD1-CG 4.41Å; L314-Q319 PolarHBondContact O-NE2 3.31Å; S315-Q319 WeakPolarHBondContact O-CG 3.34Å; S315-Q319 PolarHBondContact O-N 3.34Å; H316-Q319 PolarHBondContact O-N 2.93Å; Q319-R321 VanDerWaalsContact C-N 3.34Å; Q319-R321 PolarHBondContact O-N 3.38Å; Q319-W322 WeakPolarHBondContact O-CB 3.14Å; Q319-W322 PolarHBondContact O-N 3.28Å; Q319-W322 VanDerWaalsContact O-N 3.12Å; Q319-Y323 HydrophobicContact CB-CE2 4.37Å; Q319-Y323 VanDerWaalsContact O-CG 3.29Å; Q319-Y323 PolarHBondContact O-N 3.01Å; Q319-I372 HydrophobicContact CB-CD1 4.27Å; Q319-I372 HydrophobicContact CG-CD1 3.59Å
320Y80.6Confident82.7Confident59 Ų5967.9 Ų67.923%0.23134%0.336CS..Hα-helixtrans-58.1-43.2176.7-178.5-101.5000112.8F304 E305 H316 W322 Y323 Q324F304-Y320 HydrophobicContact CB-CD2 4.21Å; F304-Y320 HydrophobicContact CB-CE2 4.13Å; E305-Y320 HydrophobicContact CG-CD2 4.4Å; E305-Y320 HydrophobicContact CG-CE2 4.09Å; H316-Y320 PolarHBondContact O-N 3.17Å; H316-Y320 VanDerWaalsContact O-N 3.09Å; Y320-W322 VanDerWaalsContact C-N 3.34Å; Y320-W322 PolarHBondContact O-N 3.42Å; Y320-Y323 PolarHBondContact O-N 3.28Å; Y320-Q324 HydrophobicContact CD1-CG 4.37Å; Y320-Q324 HydrophobicContact CE1-CG 3.96Å; Y320-Q324 HydrophobicContact CE2-CG 4.48Å; Y320-Q324 WeakPolarHBondContact O-CG 3.35Å; Y320-Q324 PolarHBondContact O-N 2.86Å; Y320-Q324 PolarHBondContact OH-NE2 2.97Å
321R79.8Confident83.7Confident150 Ų15059.2 Ų59.257%0.56630%0.304SS*.Hα-helixtrans-62.7-39.4175.9-73.1171.1-177.7-176.6-0.1112.4S317 Q318 Q319 Q324 M325S317-R321 VanDerWaalsContact O-CG 3.26Å; S317-R321 WeakPolarHBondContact O-CG 3.5Å; S317-R321 PolarHBondContact O-N 2.97Å; Q318-R321 PolarHBondContact O-N 2.92Å; Q319-R321 VanDerWaalsContact C-N 3.34Å; Q319-R321 PolarHBondContact O-N 3.38Å; R321-Q324 PolarHBondContact O-N 3.38Å; R321-M325 WeakPolarHBondContact O-CB 3.29Å; R321-M325 PolarHBondContact O-N 3.06Å
322W84.9Confident84.8Confident113 Ų11354.2 Ų54.243%0.42827%0.274SS..Hα-helixtrans-66-41.2174.8-86112.9000112.2Q318 Q319 Y320 M325 L326 F376Q318-W322 VanDerWaalsContact O-CD1 3.26Å; Q318-W322 PolarHBondContact O-N 3.5Å; Q319-W322 WeakPolarHBondContact O-CB 3.14Å; Q319-W322 PolarHBondContact O-N 3.28Å; Q319-W322 VanDerWaalsContact O-N 3.12Å; Y320-W322 VanDerWaalsContact C-N 3.34Å; Y320-W322 PolarHBondContact O-N 3.42Å; W322-M325 HydrophobicContact CE3-SD 3.92Å; W322-M325 HydrophobicContact CH2-SD 4.25Å; W322-M325 HydrophobicContact CZ3-CE 4.28Å; W322-M325 HydrophobicContact CZ3-SD 3.57Å; W322-M325 VanDerWaalsContact CZ3-SD 3.57Å; W322-M325 PolarHBondContact O-N 3.43Å; W322-L326 WeakPolarHBondContact O-CB 3.43Å; W322-L326 VanDerWaalsContact O-CG 3.31Å; W322-L326 WeakPolarHBondContact O-CG 3.34Å; W322-L326 PolarHBondContact O-N 2.8Å; W322-F376 HydrophobicContact CB-CE1 3.83Å; W322-F376 HydrophobicContact CB-CZ 3.8Å; W322-F376 HydrophobicContact CG-CZ 4.2Å
323Y88.2Confident85.5Confident1 Ų155.4 Ų55.40%0.00428%0.281CS..Hα-helixtrans-57.3-51173.7-59-27.8000110.8F304 L307 Q319 Y320 M325 L326 Y327 I372 I375 F376 V379F304-Y323 HydrophobicContact CB-CD2 4.33Å; F304-Y323 HydrophobicContact CD2-CD2 4.48Å; F304-Y323 HydrophobicContact CG-CD2 4.26Å; L307-Y323 HydrophobicContact CB-CE2 4.47Å; L307-Y323 WeakPolarHBondContact O-CE2 3.37Å; L307-Y323 PolarHBondContact O-OH 3.09Å; Q319-Y323 HydrophobicContact CB-CE2 4.37Å; Q319-Y323 VanDerWaalsContact O-CG 3.29Å; Q319-Y323 PolarHBondContact O-N 3.01Å; Y320-Y323 PolarHBondContact O-N 3.28Å; Y323-M325 VanDerWaalsContact C-N 3.35Å; Y323-M325 PolarHBondContact O-N 2.96Å; Y323-L326 PolarHBondContact O-N 2.94Å; Y323-Y327 VanDerWaalsContact O-CB 3.24Å; Y323-Y327 WeakPolarHBondContact O-CB 3.45Å; Y323-Y327 PolarHBondContact O-N 3Å; Y323-I372 HydrophobicContact CE1-CG1 4.35Å; Y323-I375 HydrophobicContact CD1-CG2 4.13Å; Y323-I375 HydrophobicContact CE1-CB 4.4Å; Y323-I375 HydrophobicContact CE1-CG2 3.47Å; Y323-I375 VanDerWaalsContact CE1-CG2 3.47Å; Y323-F376 AromaticContact CD1-CD1 3.61Å; Y323-F376 HydrophobicContact CD1-CD1 3.61Å; Y323-F376 AromaticContact CD1-CE1 3.53Å; Y323-F376 HydrophobicContact CD1-CE1 3.53Å; Y323-F376 AromaticContact CE1-CD1 3.5Å; Y323-F376 HydrophobicContact CE1-CD1 3.5Å; Y323-F376 AromaticContact CE1-CE1 3.33Å; Y323-F376 HydrophobicContact CE1-CE1 3.33Å; Y323-V379 HydrophobicContact CD1-CG2 4.34Å; Y323-V379 WeakPolarHBondContact O-CG1 3.43Å
324Q85.1Confident86.3Confident47 Ų4749.9 Ų49.922%0.2224%0.243CC..Hα-helixtrans-59-43.3177.3-69.3-64.8-25.800112.5Y320 R321 Q328Y320-Q324 HydrophobicContact CD1-CG 4.37Å; Y320-Q324 HydrophobicContact CE1-CG 3.96Å; Y320-Q324 HydrophobicContact CE2-CG 4.48Å; Y320-Q324 WeakPolarHBondContact O-CG 3.35Å; Y320-Q324 PolarHBondContact O-N 2.86Å; Y320-Q324 PolarHBondContact OH-NE2 2.97Å; R321-Q324 PolarHBondContact O-N 3.38Å; Q324-Q328 WeakPolarHBondContact O-CB 3.12Å; Q324-Q328 WeakPolarHBondContact O-CG 3.34Å; Q324-Q328 PolarHBondContact O-N 3Å
325M87.1Confident87Confident92 Ų9248.8 Ų48.845%0.45324%0.236SC..Hα-helixtrans-64.1-46.1178.4-178.4-175.4172.700112.4R321 W322 Y323 Q328 T329R321-M325 WeakPolarHBondContact O-CB 3.29Å; R321-M325 PolarHBondContact O-N 3.06Å; W322-M325 HydrophobicContact CE3-SD 3.92Å; W322-M325 HydrophobicContact CH2-SD 4.25Å; W322-M325 HydrophobicContact CZ3-CE 4.28Å; W322-M325 HydrophobicContact CZ3-SD 3.57Å; W322-M325 VanDerWaalsContact CZ3-SD 3.57Å; W322-M325 PolarHBondContact O-N 3.43Å; Y323-M325 VanDerWaalsContact C-N 3.35Å; Y323-M325 PolarHBondContact O-N 2.96Å; M325-Q328 PolarHBondContact O-N 3.5Å; M325-T329 WeakPolarHBondContact O-CB 3.49Å; M325-T329 PolarHBondContact O-N 2.86Å; M325-T329 PolarHBondContact O-OG1 2.99Å
326L92.2Very high87.7Confident34 Ų3448.4 Ų48.418%0.17823%0.233CC..Hα-helixtrans-65.5-44.2179.9-73169.1000111.2W322 Y323 T329 G330 F376 V379 L380W322-L326 WeakPolarHBondContact O-CB 3.43Å; W322-L326 VanDerWaalsContact O-CG 3.31Å; W322-L326 WeakPolarHBondContact O-CG 3.34Å; W322-L326 PolarHBondContact O-N 2.8Å; Y323-L326 PolarHBondContact O-N 2.94Å; L326-T329 WeakPolarHBondContact O-CB 3.34Å; L326-T329 PolarHBondContact O-N 3.43Å; L326-G330 PolarHBondContact O-N 3.23Å; L326-F376 HydrophobicContact CD1-CB 3.43Å; L326-F376 VanDerWaalsContact CD1-CB 3.43Å; L326-F376 HydrophobicContact CD1-CD1 3.58Å; L326-F376 HydrophobicContact CD1-CD2 4.12Å; L326-F376 HydrophobicContact CD1-CE1 4.32Å; L326-F376 HydrophobicContact CD1-CG 3.45Å; L326-F376 VanDerWaalsContact CD1-CG 3.45Å; L326-V379 HydrophobicContact CB-CG1 4.25Å; L326-L380 VanDerWaalsContact O-CD1 3.26Å; L326-L380 WeakPolarHBondContact O-CD1 3.29Å
327Y92.7Very high88.6Confident12 Ų1246.3 Ų46.35%0.04723%0.227CC..Hα-helixtrans-54.3-55.4173.5165.8-107.9000111.1E296 N300 Y323 T329 G330 V331E296-Y327 HydrophobicContact CG-CE2 3.71Å; E296-Y327 PolarHBondContact OE1-OH 3.31Å; N300-Y327 WeakPolarHBondContact ND2-CE2 3.47Å; Y323-Y327 VanDerWaalsContact O-CB 3.24Å; Y323-Y327 WeakPolarHBondContact O-CB 3.45Å; Y323-Y327 PolarHBondContact O-N 3Å; Y327-T329 VanDerWaalsContact C-N 3.26Å; Y327-T329 PolarHBondContact O-N 3.37Å; Y327-G330 WeakPolarHBondContact O-CA 3.36Å; Y327-G330 PolarHBondContact O-N 3.27Å; Y327-V331 HydrophobicContact CD2-CG2 4.2Å; Y327-V331 HydrophobicContact CE1-CG2 4.23Å; Y327-V331 HydrophobicContact CE2-CG2 3.65Å; Y327-V331 WeakPolarHBondContact O-CG2 3.43Å; Y327-V331 PolarHBondContact O-N 2.83Å
328Q91.8Very high89.5Confident36 Ų3643.5 Ų43.517%0.16821%0.206CC..Hα-helixtrans-62.7-33.4-179.7-66.7-69.117.100112.7Q324 M325 V331 F332Q324-Q328 WeakPolarHBondContact O-CB 3.12Å; Q324-Q328 WeakPolarHBondContact O-CG 3.34Å; Q324-Q328 PolarHBondContact O-N 3Å; M325-Q328 PolarHBondContact O-N 3.5Å; Q328-V331 PolarHBondContact O-N 2.86Å; Q328-F332 WeakPolarHBondContact O-CB 3.38Å; Q328-F332 PolarHBondContact O-N 3.29Å
329T93.8Very high89.8Confident44 Ų4445.9 Ų45.927%0.2721%0.213SC..Hα-helixtrans-63.6-45.2173.6-58.40000110.8M325 L326 Y327 F332 V333 L380M325-T329 WeakPolarHBondContact O-CB 3.49Å; M325-T329 PolarHBondContact O-N 2.86Å; M325-T329 PolarHBondContact O-OG1 2.99Å; L326-T329 WeakPolarHBondContact O-CB 3.34Å; L326-T329 PolarHBondContact O-N 3.43Å; Y327-T329 VanDerWaalsContact C-N 3.26Å; Y327-T329 PolarHBondContact O-N 3.37Å; T329-F332 PolarHBondContact O-N 2.93Å; T329-V333 HydrophobicContact CG2-CG2 4.49Å; T329-V333 WeakPolarHBondContact O-CB 3.48Å; T329-V333 VanDerWaalsContact O-CG2 3.3Å; T329-V333 WeakPolarHBondContact O-CG2 3.44Å; T329-V333 PolarHBondContact O-N 3.09Å; T329-L380 HydrophobicContact CG2-CD1 4.38Å
330G95.4Very high89.9Confident0 Ų051.2 Ų51.20%025%0.249CC..Hα-helixtrans-60.5-45.1175.400000112.3L326 Y327 S334 G383 F384L326-G330 PolarHBondContact O-N 3.23Å; Y327-G330 WeakPolarHBondContact O-CA 3.36Å; Y327-G330 PolarHBondContact O-N 3.27Å; G330-S334 WeakPolarHBondContact O-CB 3.47Å; G330-S334 PolarHBondContact O-N 3.37Å; G330-S334 PolarHBondContact O-OG 3.43Å; G330-G383 CarbonylContact C-O 3.57Å; G330-F384 VanDerWaalsContact O-CD1 3.28Å; G330-F384 WeakPolarHBondContact O-CD1 3.45Å
331V95.1Very high90.2Very high5 Ų551.7 Ų51.73%0.0326%0.26CS..Hα-helixtrans-60.6-48.5176.6174.90000111Y327 Q328 V333 S334 R335 G383Y327-V331 HydrophobicContact CD2-CG2 4.2Å; Y327-V331 HydrophobicContact CE1-CG2 4.23Å; Y327-V331 HydrophobicContact CE2-CG2 3.65Å; Y327-V331 WeakPolarHBondContact O-CG2 3.43Å; Y327-V331 PolarHBondContact O-N 2.83Å; Q328-V331 PolarHBondContact O-N 2.86Å; V331-V333 PolarHBondContact O-N 3.26Å; V331-S334 PolarHBondContact O-N 3.24Å; V331-S334 PolarHBondContact O-OG 2.91Å; V331-S334 VanDerWaalsContact O-OG 3.07Å; V331-R335 HydrophobicContact CG1-CG 4.27Å; V331-R335 WeakPolarHBondContact O-CB 3.5Å; V331-R335 VanDerWaalsContact O-CG 3.29Å; V331-R335 WeakPolarHBondContact O-CG 3.22Å; V331-R335 PolarHBondContact O-N 3.19Å; V331-G383 VanDerWaalsContact CA-O 3.28Å; V331-G383 WeakPolarHBondContact CA-O 3.44Å; V331-G383 PolarHBondContact N-O 3.48Å
332F95.1Very high90.6Very high61 Ų6152.5 Ų52.527%0.26826%0.263SS..Hα-helixtrans-61.6-47-179.3175.1-115.4000112.6S187 Q328 T329 S336S187-F332 WeakPolarHBondContact O-CD2 3.38Å; Q328-F332 WeakPolarHBondContact O-CB 3.38Å; Q328-F332 PolarHBondContact O-N 3.29Å; T329-F332 PolarHBondContact O-N 2.93Å; F332-S336 WeakPolarHBondContact O-CB 3.46Å; F332-S336 PolarHBondContact O-N 3.42Å; F332-S336 VanDerWaalsContact O-N 3.09Å; F332-S336 PolarHBondContact O-OG 3.27Å
333V95.8Very high90.9Very high71 Ų7149.7 Ų49.743%0.4326%0.256SS..Hα-helixtrans-63.6-45.7179.9168.70000110.9T329 V331 S336 S337 F384T329-V333 HydrophobicContact CG2-CG2 4.49Å; T329-V333 WeakPolarHBondContact O-CB 3.48Å; T329-V333 VanDerWaalsContact O-CG2 3.3Å; T329-V333 WeakPolarHBondContact O-CG2 3.44Å; T329-V333 PolarHBondContact O-N 3.09Å; V331-V333 PolarHBondContact O-N 3.26Å; V333-S336 CarbonylContact O-C 3.59Å; V333-S336 PolarHBondContact O-N 2.99Å; V333-S337 PolarHBondContact O-N 3.43Å; V333-S337 VanDerWaalsContact O-N 3.16Å; V333-F384 HydrophobicContact CB-CD1 4.42Å; V333-F384 HydrophobicContact CB-CE1 3.82Å; V333-F384 HydrophobicContact CG1-CD1 4.36Å; V333-F384 HydrophobicContact CG1-CE1 3.68Å
334S95.4Very high90.9Very high5 Ų557.1 Ų57.14%0.03528%0.284CS..Hα-helixtrans-69.9-37.5-178.956.70000113.1G330 V331 S336 S337 G383 F384 G387 A388G330-S334 WeakPolarHBondContact O-CB 3.47Å; G330-S334 PolarHBondContact O-N 3.37Å; G330-S334 PolarHBondContact O-OG 3.43Å; V331-S334 PolarHBondContact O-N 3.24Å; V331-S334 PolarHBondContact O-OG 2.91Å; V331-S334 VanDerWaalsContact O-OG 3.07Å; S334-S336 PolarHBondContact O-N 3.31Å; S334-S337 WeakPolarHBondContact O-CB 3.45Å; S334-S337 PolarHBondContact O-N 3.24Å; S334-S337 VanDerWaalsContact O-N 3.08Å; S334-S337 PolarHBondContact O-OG 2.7Å; S334-G383 PolarHBondContact OG-O 3.27Å; S334-F384 WeakPolarHBondContact CB-O 3.48Å; S334-F384 PolarHBondContact OG-O 3.38Å; S334-G387 WeakPolarHBondContact OG-CA 3.18Å; S334-A388 PolarHBondContact OG-N 2.56Å
335R94.3Very high91.1Very high20 Ų2061.1 Ų61.18%0.07530%0.301CS..Hα-helixtrans-64.7-26.8171.8-72.4-172.1-177.7-160.4-1.4113.2S186 T189 Y293 V331 S337S186-R335 WeakPolarHBondContact O-CB 3.2Å; S186-R335 WeakPolarHBondContact O-CD 3.22Å; S186-R335 WeakPolarHBondContact OG-CB 2.88Å; S186-R335 WeakPolarHBondContact OG-CD 3.42Å; S186-R335 WeakPolarHBondContact OG-CG 3.47Å; T189-R335 PolarHBondContact OG1-NH1 3.46Å; Y293-R335 PolarHBondContact OH-NH2 3.11Å; V331-R335 HydrophobicContact CG1-CG 4.27Å; V331-R335 WeakPolarHBondContact O-CB 3.5Å; V331-R335 VanDerWaalsContact O-CG 3.29Å; V331-R335 WeakPolarHBondContact O-CG 3.22Å; V331-R335 PolarHBondContact O-N 3.19Å; R335-S337 VanDerWaalsContact C-N 3.33Å
336S94.1Very high91.4Very high43 Ų4356.9 Ų56.930%0.30128%0.28SS..THydrogen-bonded Turntrans-85.9-4.5175.5-52.90000113.3S187 F332 V333 S334S187-S336 WeakPolarHBondContact CB-OG 3.17Å; S187-S336 PolarHBondContact OG-OG 3.02Å; F332-S336 WeakPolarHBondContact O-CB 3.46Å; F332-S336 PolarHBondContact O-N 3.42Å; F332-S336 VanDerWaalsContact O-N 3.09Å; F332-S336 PolarHBondContact O-OG 3.27Å; V333-S336 CarbonylContact O-C 3.59Å; V333-S336 PolarHBondContact O-N 2.99Å; S334-S336 PolarHBondContact O-N 3.31Å
337S92.4Very high91.5Very high29 Ų2962.5 Ų62.520%0.20330%0.299CS..  trans-86.5-3.6-168.974.40000115.3V333 S334 R335 Y339 C340 C341V333-S337 PolarHBondContact O-N 3.43Å; V333-S337 VanDerWaalsContact O-N 3.16Å; S334-S337 WeakPolarHBondContact O-CB 3.45Å; S334-S337 PolarHBondContact O-N 3.24Å; S334-S337 VanDerWaalsContact O-N 3.08Å; S334-S337 PolarHBondContact O-OG 2.7Å; R335-S337 VanDerWaalsContact C-N 3.33Å; S337-Y339 PolarHBondContact O-N 3.11Å; S337-Y339 VanDerWaalsContact O-N 3.08Å; S337-C340 CarbonylContact O-C 3.36Å; S337-C340 WeakPolarHBondContact O-CA 3.16Å; S337-C340 WeakPolarHBondContact O-CB 3.24Å; S337-C340 PolarHBondContact O-N 2.9Å; S337-C341 PolarHBondContact O-N 3.42Å
338L87.8Confident91.7Very high5 Ų564.4 Ų64.43%0.02631%0.312CS..THydrogen-bonded Turntrans-57.9-31-170-167.970.9000114.4S183 C340 R342 V391 H395S183-L338 WeakPolarHBondContact OG-CB 3.39Å; L338-C340 VanDerWaalsContact C-N 3.34Å; L338-R342 HydrophobicContact CD1-CG 4.41Å; L338-R342 VanDerWaalsContact O-CG 3.25Å; L338-R342 WeakPolarHBondContact O-CG 3.41Å; L338-R342 PolarHBondContact O-NE 3.4Å; L338-V391 HydrophobicContact CB-CG2 4.03Å; L338-V391 HydrophobicContact CD1-CG1 4.38Å; L338-V391 HydrophobicContact CD1-CG2 4.17Å; L338-V391 HydrophobicContact CD2-CG2 4.06Å; L338-V391 HydrophobicContact CG-CG2 4.31Å; L338-H395 HydrophobicContact CD1-CB 3.9Å; L338-H395 HydrophobicContact CD2-CB 3.94Å
339Y82.7Confident91.9Very high136 Ų13663.1 Ų63.153%0.53331%0.306SS..THydrogen-bonded Turntrans-73.3-26174.3-72.7-81.5000113.3A180 S337A180-Y339 VanDerWaalsContact CB-OH 3.27Å; A180-Y339 WeakPolarHBondContact CB-OH 3.43Å; S337-Y339 PolarHBondContact O-N 3.11Å; S337-Y339 VanDerWaalsContact O-N 3.08Å
340C84Confident92Very high113 Ų11361.2 Ų61.276%0.76430%0.295SS*.THydrogen-bonded Turntrans-92-48-178.7-172.60000111.7S337 L338S337-C340 CarbonylContact O-C 3.36Å; S337-C340 WeakPolarHBondContact O-CA 3.16Å; S337-C340 WeakPolarHBondContact O-CB 3.24Å; S337-C340 PolarHBondContact O-N 2.9Å; L338-C340 VanDerWaalsContact C-N 3.34Å
341C85.9Confident92.1Very high68 Ų6866.5 Ų66.546%0.45932%0.322SS..  trans-133.3116.4-172.7-660000110.4S337S337-C341 PolarHBondContact O-N 3.42Å
342R88.9Confident92.2Very high167 Ų16769 Ų6963%0.6334%0.335SS*.  trans-108.2130.1173.6-62.8-174.7-171.5172.53.1110.4L338 N392L338-R342 HydrophobicContact CD1-CG 4.41Å; L338-R342 VanDerWaalsContact O-CG 3.25Å; L338-R342 WeakPolarHBondContact O-CG 3.41Å; L338-R342 PolarHBondContact O-NE 3.4Å; R342-N392 WeakPolarHBondContact CA-OD1 3.29Å
343I90.3Very high92.3Very high54 Ų5466 Ų6628%0.27732%0.322SS..  trans-120.4109.1-176.4-55.5178.7000108.3I346 L349 A388 N392 N396I343-I346 WeakPolarHBondContact O-CD1 3.41Å; I343-L349 HydrophobicContact CD1-CD1 4.16Å; I343-L349 HydrophobicContact CD1-CD2 4.02Å; I343-L349 HydrophobicContact CG2-CD1 4.22Å; I343-L349 HydrophobicContact CG2-CG 4.35Å; I343-A388 HydrophobicContact CD1-CB 4.37Å; I343-N392 HydrophobicContact CB-CB 4.46Å; I343-N392 PolarHBondContact N-OD1 3.14Å; I343-N392 WeakPolarHBondContact O-CB 3.47Å; I343-N396 PolarHBondContact O-ND2 3.5Å; I343-N396 VanDerWaalsContact O-ND2 3.14Å
344R88.1Confident92.3Very high158 Ų15864.8 Ų64.860%0.59632%0.316SS*.SBendtrans-77.3-37.3178.1-167.1172.1-175149.52.8112.4I346 E400R344-I346 PolarHBondContact O-N 2.86Å; R344-E400 IonicContact CZ-OE1 3.31Å; R344-E400 VanDerWaalsContact CZ-OE1 3.31Å; R344-E400 IonicContact NE-OE1 3.35Å; R344-E400 PolarHBondContact NE-OE1 3.34Å; R344-E400 IonicContact NH2-OE1 2.7Å; R344-E400 PolarHBondContact NH2-OE1 3.47Å
345F90.8Very high92.4Very high130 Ų13069.5 Ų69.557%0.5734%0.34SS*.  trans-91.877.7-172.9-60.7-67.8000112W347 V348F345-W347 AromaticContact CD1-NE1 3.66Å; F345-W347 AromaticContact CG-NE1 3.99Å; F345-W347 PolarHBondContact O-N 3.4Å; F345-V348 HydrophobicContact CB-CG2 3.98Å; F345-V348 WeakPolarHBondContact O-CB 3.42Å; F345-V348 PolarHBondContact O-N 3.25Å; F345-V348 VanDerWaalsContact O-N 3.1Å
346I92.9Very high92.5Very high3 Ų369.1 Ų69.12%0.01534%0.34CS..Hα-helixtrans-59.1-30.8-178-50.5-56.2000112.6Y285 P288 I343 R344 V348 L349 A350 A389 N392 T393Y285-I346 HydrophobicContact CD1-CG1 4Å; Y285-I346 HydrophobicContact CE1-CG1 4.14Å; P288-I346 HydrophobicContact CB-CB 4.32Å; P288-I346 HydrophobicContact CB-CG2 3.9Å; I343-I346 WeakPolarHBondContact O-CD1 3.41Å; R344-I346 PolarHBondContact O-N 2.86Å; I346-V348 PolarHBondContact O-N 3.16Å; I346-V348 VanDerWaalsContact O-N 3.15Å; I346-L349 WeakPolarHBondContact O-CB 3.19Å; I346-L349 PolarHBondContact O-N 3.48Å; I346-A350 PolarHBondContact O-N 3.15Å; I346-A350 VanDerWaalsContact O-N 3.16Å; I346-A389 HydrophobicContact CG2-CB 4.37Å; I346-N392 HydrophobicContact CD1-CB 3.52Å; I346-T393 WeakPolarHBondContact CG2-OG1 3.45Å
347W95.1Very high92.5Very high152 Ų15268.1 Ų68.158%0.57633%0.331SS*.Hα-helixtrans-58.7-27.5177.470-97000113.5P288 F345 A350 L351P288-W347 HydrophobicContact CG-CB 4.07Å; F345-W347 AromaticContact CD1-NE1 3.66Å; F345-W347 AromaticContact CG-NE1 3.99Å; F345-W347 PolarHBondContact O-N 3.4Å; W347-A350 PolarHBondContact O-N 2.51Å; W347-L351 HydrophobicContact CZ3-CD2 4.43Å; W347-L351 PolarHBondContact O-N 2.89Å
348V96.1Very high92.6Very high52 Ų5269.2 Ų69.232%0.31534%0.342SS..Hα-helixtrans-66.4-41.5174.9178.50000110.2F345 I346 A350 L351 L352F345-V348 HydrophobicContact CB-CG2 3.98Å; F345-V348 WeakPolarHBondContact O-CB 3.42Å; F345-V348 PolarHBondContact O-N 3.25Å; F345-V348 VanDerWaalsContact O-N 3.1Å; I346-V348 PolarHBondContact O-N 3.16Å; I346-V348 VanDerWaalsContact O-N 3.15Å; V348-A350 VanDerWaalsContact C-N 3.33Å; V348-A350 PolarHBondContact O-N 2.86Å; V348-L351 PolarHBondContact O-N 3.16Å; V348-L352 HydrophobicContact CG1-CD1 4.04Å; V348-L352 HydrophobicContact CG1-CG 4.45Å; V348-L352 VanDerWaalsContact O-CG 3.28Å; V348-L352 WeakPolarHBondContact O-CG 3.37Å; V348-L352 PolarHBondContact O-N 3.18Å
349L95.8Very high92.9Very high9 Ų971.5 Ų71.55%0.04736%0.356CS..Hα-helixtrans-64.4-40.2176.4-58.6177.6000111.1V292 I343 I346 L352 Q353 L385 A388 A389V292-L349 HydrophobicContact CG2-CB 4.46Å; I343-L349 HydrophobicContact CD1-CD1 4.16Å; I343-L349 HydrophobicContact CD1-CD2 4.02Å; I343-L349 HydrophobicContact CG2-CD1 4.22Å; I343-L349 HydrophobicContact CG2-CG 4.35Å; I346-L349 WeakPolarHBondContact O-CB 3.19Å; I346-L349 PolarHBondContact O-N 3.48Å; L349-L352 PolarHBondContact O-N 3.35Å; L349-Q353 WeakPolarHBondContact O-CB 3.26Å; L349-Q353 PolarHBondContact O-N 3.26Å; L349-L385 HydrophobicContact CD2-CD2 3.72Å; L349-A388 HydrophobicContact CD1-CB 4.06Å; L349-A389 HydrophobicContact CB-CB 4.3Å; L349-A389 HydrophobicContact CD1-CB 3.92Å
350A96.4Very high93.3Very high4 Ų465 Ų653%0.03333%0.331CS..Hα-helixtrans-60.9-44.8173.800000112.5P288 L291 V292 I346 W347 V348 Q353 C354P288-A350 HydrophobicContact CB-CB 3.99Å; L291-A350 HydrophobicContact CB-CB 4.16Å; V292-A350 VanDerWaalsContact CG2-CA 3.44Å; V292-A350 HydrophobicContact CG2-CB 3.85Å; I346-A350 PolarHBondContact O-N 3.15Å; I346-A350 VanDerWaalsContact O-N 3.16Å; W347-A350 PolarHBondContact O-N 2.51Å; V348-A350 VanDerWaalsContact C-N 3.33Å; V348-A350 PolarHBondContact O-N 2.86Å; A350-Q353 PolarHBondContact O-N 3.01Å; A350-C354 WeakPolarHBondContact O-CB 3.26Å; A350-C354 PolarHBondContact O-N 2.95Å; A350-C354 PolarHBondContact O-SG 3.37Å; A350-C354 VanDerWaalsContact O-SG 3.34Å
351L97.2Very high93.6Very high111 Ų11162 Ų6258%0.58131%0.307SS*.Hα-helixtrans-61.7-45.7176.9-179.166000111.6W347 V348 Q353 C354 L355W347-L351 HydrophobicContact CZ3-CD2 4.43Å; W347-L351 PolarHBondContact O-N 2.89Å; V348-L351 PolarHBondContact O-N 3.16Å; L351-Q353 VanDerWaalsContact C-N 3.33Å; L351-Q353 PolarHBondContact O-N 3.09Å; L351-C354 PolarHBondContact O-N 3.42Å; L351-L355 WeakPolarHBondContact O-CB 3.25Å; L351-L355 PolarHBondContact O-N 3.03Å
352L97.2Very high93.8Very high57 Ų5760.5 Ų60.530%0.29830%0.299SS..Hα-helixtrans-63.2-39.4177.8-69.5171.2000111.7V348 L349 L355 N356 L385V348-L352 HydrophobicContact CG1-CD1 4.04Å; V348-L352 HydrophobicContact CG1-CG 4.45Å; V348-L352 VanDerWaalsContact O-CG 3.28Å; V348-L352 WeakPolarHBondContact O-CG 3.37Å; V348-L352 PolarHBondContact O-N 3.18Å; L349-L352 PolarHBondContact O-N 3.35Å; L352-L355 PolarHBondContact O-N 3.12Å; L352-N356 WeakPolarHBondContact O-CB 3.26Å; L352-N356 PolarHBondContact O-N 2.9Å; L352-L385 HydrophobicContact CB-CD1 3.8Å; L352-L385 HydrophobicContact CB-CD2 4.07Å; L352-L385 HydrophobicContact CD1-CD2 4.08Å
353Q97.1Very high93.8Very high0 Ų052.9 Ų52.90%027%0.271CS..Hα-helixtrans-67.7-42.1177.6-165.470.1-3.500111.9V292 A295 E296 L349 A350 L351 L355 N356 L357 L385V292-Q353 HydrophobicContact CG1-CG 4.23Å; V292-Q353 HydrophobicContact CG2-CB 4.41Å; A295-Q353 HydrophobicContact CB-CB 4.41Å; A295-Q353 HydrophobicContact CB-CG 3.7Å; E296-Q353 VanDerWaalsContact CA-NE2 3.32Å; E296-Q353 VanDerWaalsContact CB-NE2 3.34Å; L349-Q353 WeakPolarHBondContact O-CB 3.26Å; L349-Q353 PolarHBondContact O-N 3.26Å; A350-Q353 PolarHBondContact O-N 3.01Å; L351-Q353 VanDerWaalsContact C-N 3.33Å; L351-Q353 PolarHBondContact O-N 3.09Å; Q353-L355 VanDerWaalsContact C-N 3.34Å; Q353-L355 PolarHBondContact O-N 3.21Å; Q353-N356 WeakPolarHBondContact O-CB 3.26Å; Q353-N356 PolarHBondContact O-N 2.94Å; Q353-L357 PolarHBondContact O-N 3.09Å; Q353-L385 HydrophobicContact CB-CD1 4.31Å
354C96.8Very high93.6Very high45 Ų4550.7 Ų50.730%0.30426%0.26SS..Hα-helixtrans-64.3-38.2174-72.10000112.2A350 L351 N356 L357 A358A350-C354 WeakPolarHBondContact O-CB 3.26Å; A350-C354 PolarHBondContact O-N 2.95Å; A350-C354 PolarHBondContact O-SG 3.37Å; A350-C354 VanDerWaalsContact O-SG 3.34Å; L351-C354 PolarHBondContact O-N 3.42Å; C354-N356 VanDerWaalsContact C-N 3.33Å; C354-L357 PolarHBondContact O-N 2.89Å; C354-A358 PolarHBondContact O-N 3.44Å
355L96.6Very high93.4Very high104 Ų10447.5 Ų47.555%0.54525%0.251SS..Hα-helixtrans-62.8-43.1172.9179.264.2000110.8L351 L352 Q353 L357 A358 V359L351-L355 WeakPolarHBondContact O-CB 3.25Å; L351-L355 PolarHBondContact O-N 3.03Å; L352-L355 PolarHBondContact O-N 3.12Å; Q353-L355 VanDerWaalsContact C-N 3.34Å; Q353-L355 PolarHBondContact O-N 3.21Å; L355-L357 VanDerWaalsContact C-N 3.34Å; L355-L357 PolarHBondContact O-N 2.92Å; L355-A358 PolarHBondContact O-N 3.31Å; L355-V359 HydrophobicContact CD1-CG2 4.41Å; L355-V359 WeakPolarHBondContact O-CG2 3.37Å; L355-V359 PolarHBondContact O-N 3.33Å
356N95.6Very high93.2Very high11 Ų1147.6 Ų47.66%0.05926%0.256CS..Hα-helixtrans-59.2-45.8177-162.836.9000111.7L352 Q353 C354 A358 V359 L360 I378 E382L352-N356 WeakPolarHBondContact O-CB 3.26Å; L352-N356 PolarHBondContact O-N 2.9Å; Q353-N356 WeakPolarHBondContact O-CB 3.26Å; Q353-N356 PolarHBondContact O-N 2.94Å; C354-N356 VanDerWaalsContact C-N 3.33Å; N356-A358 PolarHBondContact O-N 2.9Å; N356-V359 PolarHBondContact O-N 2.99Å; N356-L360 PolarHBondContact O-N 3.22Å; N356-I378 WeakPolarHBondContact OD1-CG2 3.38Å; N356-E382 WeakPolarHBondContact ND2-CB 3.37Å
357L94.9Very high92.8Very high22 Ų2250 Ų5012%0.11527%0.273CS..Hα-helixtrans-57.7-47.1173.2169.361.5000111.6F294 A295 F298 I299 L303 Q353 C354 L355 V359 L360 L361F294-L357 HydrophobicContact CE1-CD2 4.34Å; A295-L357 HydrophobicContact CB-CB 4.13Å; A295-L357 HydrophobicContact CB-CD2 4.02Å; F298-L357 HydrophobicContact CD1-CD1 3.51Å; F298-L357 HydrophobicContact CD1-CD2 4.37Å; F298-L357 HydrophobicContact CE1-CD1 4.16Å; F298-L357 HydrophobicContact CG-CD1 4.41Å; I299-L357 HydrophobicContact CD1-CB 4Å; I299-L357 HydrophobicContact CG1-CB 4.1Å; I299-L357 HydrophobicContact CG1-CD1 3.78Å; L303-L357 HydrophobicContact CD1-CD1 3.72Å; Q353-L357 PolarHBondContact O-N 3.09Å; C354-L357 PolarHBondContact O-N 2.89Å; L355-L357 VanDerWaalsContact C-N 3.34Å; L355-L357 PolarHBondContact O-N 2.92Å; L357-V359 VanDerWaalsContact C-N 3.33Å; L357-V359 PolarHBondContact O-N 3.18Å; L357-L360 PolarHBondContact O-N 3.47Å; L357-L361 WeakPolarHBondContact O-CB 3.25Å; L357-L361 PolarHBondContact O-N 3.08Å
358A94.4Very high92.5Very high53 Ų5347.8 Ų47.844%0.43827%0.268SS..Hα-helixtrans-62.2-40.2-179.800000112.3C354 L355 N356 A362C354-A358 PolarHBondContact O-N 3.44Å; L355-A358 PolarHBondContact O-N 3.31Å; N356-A358 PolarHBondContact O-N 2.9Å; A358-A362 VanDerWaalsContact O-CB 3.3Å; A358-A362 WeakPolarHBondContact O-CB 3.25Å; A358-A362 PolarHBondContact O-N 3.31Å
359V93.3Very high92Very high53 Ų5346.5 Ų46.532%0.32126%0.259SS..Hα-helixtrans-64.8-49.3177.21700000111.1L355 N356 L357 A362 D363 F368L355-V359 HydrophobicContact CD1-CG2 4.41Å; L355-V359 WeakPolarHBondContact O-CG2 3.37Å; L355-V359 PolarHBondContact O-N 3.33Å; N356-V359 PolarHBondContact O-N 2.99Å; L357-V359 VanDerWaalsContact C-N 3.33Å; L357-V359 PolarHBondContact O-N 3.18Å; V359-A362 PolarHBondContact O-N 3.07Å; V359-D363 PolarHBondContact O-N 3.1Å; V359-F368 HydrophobicContact CG1-CZ 4.18Å
360L92Very high91.4Very high0 Ų051.4 Ų51.40%029%0.292CS..Hα-helixtrans-66.4-39179.1-71.6179000112.1I299 L303 L307 N356 L357 D363 V364 I375 I378I299-L360 HydrophobicContact CB-CD1 4.42Å; I299-L360 HydrophobicContact CD1-CD1 4.11Å; I299-L360 HydrophobicContact CG1-CD1 4.07Å; I299-L360 HydrophobicContact CG2-CD1 3.48Å; I299-L360 VanDerWaalsContact CG2-CD1 3.48Å; L303-L360 HydrophobicContact CD1-CB 4.08Å; L307-L360 HydrophobicContact CD1-CD2 4.09Å; N356-L360 PolarHBondContact O-N 3.22Å; L357-L360 PolarHBondContact O-N 3.47Å; L360-D363 PolarHBondContact O-N 3.06Å; L360-V364 WeakPolarHBondContact O-CG2 3.19Å; L360-V364 PolarHBondContact O-N 3.47Å; L360-I375 HydrophobicContact CD2-CD1 3.67Å; L360-I378 HydrophobicContact CD1-CG2 3.91Å; L360-I378 HydrophobicContact CD2-CD1 4.4Å; L360-I378 HydrophobicContact CD2-CG2 3.81Å; L360-I378 HydrophobicContact CG-CG2 3.98Å
361L90.1Very high91Very high50 Ų5053.1 Ų53.126%0.26230%0.303SS..Hα-helixtrans-62.7-44.5174.9-174.365.9000110.9L303 L357 D363 V364 F365 L431L303-L361 HydrophobicContact CD1-CB 4.17Å; L303-L361 HydrophobicContact CD1-CD1 4.39Å; L303-L361 HydrophobicContact CD2-CD1 3.74Å; L357-L361 WeakPolarHBondContact O-CB 3.25Å; L357-L361 PolarHBondContact O-N 3.08Å; L361-D363 VanDerWaalsContact C-N 3.27Å; L361-D363 PolarHBondContact O-N 3.32Å; L361-V364 PolarHBondContact O-N 3.3Å; L361-F365 HydrophobicContact CD1-CD2 4.42Å; L361-F365 HydrophobicContact CD1-CE2 3.77Å; L361-F365 HydrophobicContact CG-CD2 4.3Å; L361-F365 HydrophobicContact CG-CE2 3.93Å; L361-F365 WeakPolarHBondContact O-CD2 2.96Å; L361-F365 PolarHBondContact O-N 2.68Å; L361-L431 HydrophobicContact CD1-CD2 4.47Å
362A90.6Very high90.5Very high36 Ų3648.1 Ų48.130%0.29828%0.277SS..Hα-helixtrans-61.3-36.7174.400000111.9A358 V359 F365 L366 F368A358-A362 VanDerWaalsContact O-CB 3.3Å; A358-A362 WeakPolarHBondContact O-CB 3.25Å; A358-A362 PolarHBondContact O-N 3.31Å; V359-A362 PolarHBondContact O-N 3.07Å; A362-F365 PolarHBondContact O-N 3.02Å; A362-L366 VanDerWaalsContact O-CB 3.3Å; A362-L366 WeakPolarHBondContact O-CB 3.22Å; A362-L366 WeakPolarHBondContact O-CG 3.23Å; A362-L366 PolarHBondContact O-N 3.41Å; A362-F368 HydrophobicContact CB-CE1 4.27Å
363D88.7Confident90.2Very high6 Ų653.6 Ų53.63%0.03230%0.295CS..Hα-helixtrans-67.5-37.4176-171.357.9000112.6V359 L360 L361 F365 L366 S367 F368 L369V359-D363 PolarHBondContact O-N 3.1Å; L360-D363 PolarHBondContact O-N 3.06Å; L361-D363 VanDerWaalsContact C-N 3.27Å; L361-D363 PolarHBondContact O-N 3.32Å; D363-F365 PolarHBondContact O-N 3.06Å; D363-L366 PolarHBondContact O-N 2.8Å; D363-S367 WeakPolarHBondContact O-CA 3.48Å; D363-S367 PolarHBondContact O-N 2.92Å; D363-F368 HydrophobicContact CB-CD1 4.1Å; D363-F368 HydrophobicContact CB-CE1 3.67Å; D363-F368 HydrophobicContact CB-CZ 4.24Å; D363-F368 PolarHBondContact OD1-N 2.94Å; D363-L369 HydrophobicContact CB-CD1 3.95Å; D363-L369 HydrophobicContact CB-CG 4.25Å; D363-L369 WeakPolarHBondContact OD1-CB 3.35Å; D363-L369 WeakPolarHBondContact OD1-CG 3.26Å; D363-L369 PolarHBondContact OD1-N 3.19Å
364V85.4Confident89.9Confident9 Ų957.5 Ų57.56%0.05532%0.315CS..Hα-helixtrans-57.6-39.5173.1171.20000111.2F91 L303 L306 L307 L360 L361F91-V364 HydrophobicContact CZ-CG1 4.25Å; L303-V364 HydrophobicContact CB-CG2 4.43Å; L303-V364 HydrophobicContact CD2-CG2 4.3Å; L306-V364 HydrophobicContact CB-CG1 4.37Å; L306-V364 HydrophobicContact CD1-CG1 4.28Å; L307-V364 HydrophobicContact CD2-CG2 3.6Å; L307-V364 HydrophobicContact CG-CG2 3.93Å; L360-V364 WeakPolarHBondContact O-CG2 3.19Å; L360-V364 PolarHBondContact O-N 3.47Å; L361-V364 PolarHBondContact O-N 3.3Å
365F84Confident89.7Confident91 Ų9155.3 Ų55.340%0.39930%0.301SS..Hα-helixtrans-81.3-41.9179.3-71.6-69.5000114.1L361 A362 D363 L435L361-F365 HydrophobicContact CD1-CD2 4.42Å; L361-F365 HydrophobicContact CD1-CE2 3.77Å; L361-F365 HydrophobicContact CG-CD2 4.3Å; L361-F365 HydrophobicContact CG-CE2 3.93Å; L361-F365 WeakPolarHBondContact O-CD2 2.96Å; L361-F365 PolarHBondContact O-N 2.68Å; A362-F365 PolarHBondContact O-N 3.02Å; D363-F365 PolarHBondContact O-N 3.06Å; F365-L435 HydrophobicContact CE1-CD2 3.64Å; F365-L435 HydrophobicContact CZ-CD2 3.78Å
366L86.8Confident89.5Confident131 Ų13151.8 Ų51.869%0.68628%0.281SS*.Hα-helixtrans-100-18.7-170.1-58.9176.5000113.4A362 D363 F368A362-L366 VanDerWaalsContact O-CB 3.3Å; A362-L366 WeakPolarHBondContact O-CB 3.22Å; A362-L366 WeakPolarHBondContact O-CG 3.23Å; A362-L366 PolarHBondContact O-N 3.41Å; D363-L366 PolarHBondContact O-N 2.8Å; L366-F368 VanDerWaalsContact C-N 3.34Å; L366-F368 HydrophobicContact CB-CD1 4.21Å; L366-F368 PolarHBondContact O-N 3.4Å
367S84.4Confident89.4Confident54 Ų5454 Ų5438%0.37830%0.301SS..  trans48.850.5-176.3-550000112.9R90 D363R90-S367 PolarHBondContact NH1-OG 3.4Å; R90-S367 VanDerWaalsContact NH1-OG 3.16Å; R90-S367 PolarHBondContact NH2-OG 3.26Å; D363-S367 WeakPolarHBondContact O-CA 3.48Å; D363-S367 PolarHBondContact O-N 2.92Å
368F88.4Confident89.4Confident106 Ų10654.5 Ų54.547%0.46530%0.303SS..  trans-91.4-19.3-173.672.5-94.2000113V359 A362 D363 L366 P370V359-F368 HydrophobicContact CG1-CZ 4.18Å; A362-F368 HydrophobicContact CB-CE1 4.27Å; D363-F368 HydrophobicContact CB-CD1 4.1Å; D363-F368 HydrophobicContact CB-CE1 3.67Å; D363-F368 HydrophobicContact CB-CZ 4.24Å; D363-F368 PolarHBondContact OD1-N 2.94Å; L366-F368 VanDerWaalsContact C-N 3.34Å; L366-F368 HydrophobicContact CB-CD1 4.21Å; L366-F368 PolarHBondContact O-N 3.4Å; F368-P370 WeakPolarHBondContact O-CD 3.05Å
369L86.4Confident89.4Confident24 Ų2452 Ų5213%0.12628%0.282CS..  trans-74.1121.4177.3-70.1175.1000109.9F309 D363 L374 I375 I378F309-L369 WeakPolarHBondContact CE1-O 3.41Å; F309-L369 HydrophobicContact CZ-CB 4.48Å; D363-L369 HydrophobicContact CB-CD1 3.95Å; D363-L369 HydrophobicContact CB-CG 4.25Å; D363-L369 WeakPolarHBondContact OD1-CB 3.35Å; D363-L369 WeakPolarHBondContact OD1-CG 3.26Å; D363-L369 PolarHBondContact OD1-N 3.19Å; L369-L374 HydrophobicContact CD2-CD1 4.43Å; L369-I375 HydrophobicContact CD1-CD1 3.36Å; L369-I375 HydrophobicContact CD1-CG1 4.24Å; L369-I378 HydrophobicContact CD1-CD1 3.96Å
370P84Confident89.5Confident113 Ų11351.7 Ų51.773%0.73428%0.279SS*.  trans-85.4-12.8-170.732.2-37000114F368 L374F368-P370 WeakPolarHBondContact O-CD 3.05Å; P370-L374 HydrophobicContact CG-CD1 4.12Å
371S87.4Confident89.8Confident39 Ų3956 Ų5627%0.27330%0.296SS..  trans-144.1136.6-168.4-174.10000112.9Y373 L374S371-Y373 PolarHBondContact O-N 3.43Å; S371-Y373 WeakPolarHBondContact OG-CD2 3.39Å; S371-Y373 PolarHBondContact OG-N 3.31Å; S371-L374 WeakPolarHBondContact O-CB 3.41Å; S371-L374 PolarHBondContact O-N 2.93Å
372I87.2Confident90Very high6 Ų653.6 Ų53.63%0.03128%0.283CS..Hα-helixtrans-59.5-30.4173.6-167.2170.3000112.7F309 T312 L314 Q319 Y323 L374 I375 F376F309-I372 HydrophobicContact CB-CB 4.26Å; F309-I372 HydrophobicContact CD2-CB 4.24Å; F309-I372 HydrophobicContact CD2-CG1 4.26Å; F309-I372 HydrophobicContact CG-CB 4.08Å; T312-I372 HydrophobicContact CG2-CB 4.1Å; T312-I372 HydrophobicContact CG2-CD1 4.33Å; T312-I372 HydrophobicContact CG2-CG2 3.76Å; L314-I372 HydrophobicContact CD1-CD1 4.25Å; Q319-I372 HydrophobicContact CB-CD1 4.27Å; Q319-I372 HydrophobicContact CG-CD1 3.59Å; Y323-I372 HydrophobicContact CE1-CG1 4.35Å; I372-L374 VanDerWaalsContact C-N 3.26Å; I372-L374 PolarHBondContact O-N 3.41Å; I372-I375 WeakPolarHBondContact O-CB 3.44Å; I372-I375 PolarHBondContact O-N 2.99Å; I372-I375 VanDerWaalsContact O-N 3.14Å; I372-F376 HydrophobicContact CD1-CE1 3.86Å; I372-F376 HydrophobicContact CD1-CE2 4.41Å; I372-F376 HydrophobicContact CD1-CZ 3.65Å; I372-F376 HydrophobicContact CG1-CD1 4.16Å; I372-F376 HydrophobicContact CG1-CE1 3.73Å; I372-F376 HydrophobicContact CG1-CE2 4.28Å; I372-F376 HydrophobicContact CG1-CZ 3.79Å; I372-F376 WeakPolarHBondContact O-CG 3.25Å; I372-F376 PolarHBondContact O-N 3.33Å
373Y90.1Very high90.3Very high172 Ų17251.9 Ų51.968%0.67527%0.269SS*.Hα-helixtrans-68.1-28.1-179.2-60.6-69.5000112.4S371 F376 A377S371-Y373 PolarHBondContact O-N 3.43Å; S371-Y373 WeakPolarHBondContact OG-CD2 3.39Å; S371-Y373 PolarHBondContact OG-N 3.31Å; Y373-F376 HydrophobicContact CD1-CD2 4.03Å; Y373-F376 HydrophobicContact CD1-CE2 4.42Å; Y373-F376 PolarHBondContact O-N 2.84Å; Y373-A377 PolarHBondContact O-N 3.42Å
374L91.1Very high90.7Very high82 Ų8255.1 Ų55.143%0.42928%0.283SS..Hα-helixtrans-69.2-40.7172.7-67173.3000110.7L369 P370 S371 I372 A377 I378L369-L374 HydrophobicContact CD2-CD1 4.43Å; P370-L374 HydrophobicContact CG-CD1 4.12Å; S371-L374 WeakPolarHBondContact O-CB 3.41Å; S371-L374 PolarHBondContact O-N 2.93Å; I372-L374 VanDerWaalsContact C-N 3.26Å; I372-L374 PolarHBondContact O-N 3.41Å; L374-A377 PolarHBondContact O-N 2.95Å; L374-I378 WeakPolarHBondContact O-CG1 3.47Å; L374-I378 PolarHBondContact O-N 3.46Å
375I91.2Very high91.2Very high0 Ų055.1 Ų55.10%028%0.283CS..Hα-helixtrans-62.7-45.1172.8-65-69.6000110.4F309 Y323 L360 L369 I372 A377 I378 V379F309-I375 HydrophobicContact CE2-CB 4.47Å; F309-I375 HydrophobicContact CE2-CD1 4.47Å; F309-I375 HydrophobicContact CE2-CG1 3.6Å; F309-I375 HydrophobicContact CZ-CD1 4.46Å; F309-I375 HydrophobicContact CZ-CG1 3.7Å; Y323-I375 HydrophobicContact CD1-CG2 4.13Å; Y323-I375 HydrophobicContact CE1-CB 4.4Å; Y323-I375 HydrophobicContact CE1-CG2 3.47Å; Y323-I375 VanDerWaalsContact CE1-CG2 3.47Å; L360-I375 HydrophobicContact CD2-CD1 3.67Å; L369-I375 HydrophobicContact CD1-CD1 3.36Å; L369-I375 HydrophobicContact CD1-CG1 4.24Å; I372-I375 WeakPolarHBondContact O-CB 3.44Å; I372-I375 PolarHBondContact O-N 2.99Å; I372-I375 VanDerWaalsContact O-N 3.14Å; I375-A377 VanDerWaalsContact C-N 3.26Å; I375-A377 PolarHBondContact O-N 3.44Å; I375-I378 CarbonylContact O-C 3.57Å; I375-I378 PolarHBondContact O-N 2.97Å; I375-V379 HydrophobicContact CG2-CG2 3.94Å; I375-V379 WeakPolarHBondContact O-CB 3.4Å; I375-V379 VanDerWaalsContact O-CG2 3.27Å; I375-V379 WeakPolarHBondContact O-CG2 3.41Å; I375-V379 PolarHBondContact O-N 3.42Å
376F92.6Very high91.7Very high30 Ų3050.8 Ų50.813%0.13226%0.264CS..Hα-helixtrans-54.9-42.2174.9-73.2-9.1000112.6L314 W322 Y323 L326 I372 Y373 L380L314-F376 HydrophobicContact CD1-CZ 4.05Å; W322-F376 HydrophobicContact CB-CE1 3.83Å; W322-F376 HydrophobicContact CB-CZ 3.8Å; W322-F376 HydrophobicContact CG-CZ 4.2Å; Y323-F376 AromaticContact CD1-CD1 3.61Å; Y323-F376 HydrophobicContact CD1-CD1 3.61Å; Y323-F376 AromaticContact CD1-CE1 3.53Å; Y323-F376 HydrophobicContact CD1-CE1 3.53Å; Y323-F376 AromaticContact CE1-CD1 3.5Å; Y323-F376 HydrophobicContact CE1-CD1 3.5Å; Y323-F376 AromaticContact CE1-CE1 3.33Å; Y323-F376 HydrophobicContact CE1-CE1 3.33Å; L326-F376 HydrophobicContact CD1-CB 3.43Å; L326-F376 VanDerWaalsContact CD1-CB 3.43Å; L326-F376 HydrophobicContact CD1-CD1 3.58Å; L326-F376 HydrophobicContact CD1-CD2 4.12Å; L326-F376 HydrophobicContact CD1-CE1 4.32Å; L326-F376 HydrophobicContact CD1-CG 3.45Å; L326-F376 VanDerWaalsContact CD1-CG 3.45Å; I372-F376 HydrophobicContact CD1-CE1 3.86Å; I372-F376 HydrophobicContact CD1-CE2 4.41Å; I372-F376 HydrophobicContact CD1-CZ 3.65Å; I372-F376 HydrophobicContact CG1-CD1 4.16Å; I372-F376 HydrophobicContact CG1-CE1 3.73Å; I372-F376 HydrophobicContact CG1-CE2 4.28Å; I372-F376 HydrophobicContact CG1-CZ 3.79Å; I372-F376 WeakPolarHBondContact O-CG 3.25Å; I372-F376 PolarHBondContact O-N 3.33Å; Y373-F376 HydrophobicContact CD1-CD2 4.03Å; Y373-F376 HydrophobicContact CD1-CE2 4.42Å; Y373-F376 PolarHBondContact O-N 2.84Å; F376-L380 WeakPolarHBondContact O-CB 3.3Å; F376-L380 PolarHBondContact O-N 2.96Å
377A95.1Very high92.1Very high58 Ų5844.6 Ų44.648%0.47923%0.232SC..Hα-helixtrans-66.2-42.2175.100000112.3Y373 L374 I375 L380 Y381Y373-A377 PolarHBondContact O-N 3.42Å; L374-A377 PolarHBondContact O-N 2.95Å; I375-A377 VanDerWaalsContact C-N 3.26Å; I375-A377 PolarHBondContact O-N 3.44Å; A377-L380 PolarHBondContact O-N 3.04Å; A377-Y381 VanDerWaalsContact O-CB 3.32Å; A377-Y381 WeakPolarHBondContact O-CB 3.38Å; A377-Y381 PolarHBondContact O-N 3.07Å
378I94.6Very high92.7Very high31 Ų3142.4 Ų42.416%0.15922%0.217CC..Hα-helixtrans-63.4-42.2177.1-72.5162.4000111.6N356 L360 L369 L374 I375 Y381 E382N356-I378 WeakPolarHBondContact OD1-CG2 3.38Å; L360-I378 HydrophobicContact CD1-CG2 3.91Å; L360-I378 HydrophobicContact CD2-CD1 4.4Å; L360-I378 HydrophobicContact CD2-CG2 3.81Å; L360-I378 HydrophobicContact CG-CG2 3.98Å; L369-I378 HydrophobicContact CD1-CD1 3.96Å; L374-I378 WeakPolarHBondContact O-CG1 3.47Å; L374-I378 PolarHBondContact O-N 3.46Å; I375-I378 CarbonylContact O-C 3.57Å; I375-I378 PolarHBondContact O-N 2.97Å; I378-Y381 WeakPolarHBondContact O-CB 3.39Å; I378-Y381 PolarHBondContact O-N 3.37Å; I378-E382 WeakPolarHBondContact O-CB 3.35Å; I378-E382 PolarHBondContact O-N 3.02Å
379V93.9Very high93.1Very high0 Ų037.3 Ų37.30%020%0.195CC..Hα-helixtrans-68.8-39178.9172.10000111.5F304 Y323 L326 I375 Y381 E382 G383F304-V379 HydrophobicContact CE1-CG2 3.5Å; F304-V379 VanDerWaalsContact CE1-CG2 3.5Å; F304-V379 HydrophobicContact CE2-CG1 4.01Å; F304-V379 HydrophobicContact CE2-CG2 4.37Å; F304-V379 HydrophobicContact CZ-CB 4.08Å; F304-V379 HydrophobicContact CZ-CG1 3.58Å; F304-V379 HydrophobicContact CZ-CG2 3.4Å; Y323-V379 HydrophobicContact CD1-CG2 4.34Å; Y323-V379 WeakPolarHBondContact O-CG1 3.43Å; L326-V379 HydrophobicContact CB-CG1 4.25Å; I375-V379 HydrophobicContact CG2-CG2 3.94Å; I375-V379 WeakPolarHBondContact O-CB 3.4Å; I375-V379 VanDerWaalsContact O-CG2 3.27Å; I375-V379 WeakPolarHBondContact O-CG2 3.41Å; I375-V379 PolarHBondContact O-N 3.42Å; V379-Y381 VanDerWaalsContact C-N 3.32Å; V379-E382 WeakPolarHBondContact O-CB 3.22Å; V379-E382 PolarHBondContact O-N 2.81Å; V379-G383 PolarHBondContact O-N 3.27Å; V379-G383 VanDerWaalsContact O-N 3.13Å
380L95.9Very high93.5Very high48 Ų4836.2 Ų36.225%0.25119%0.189SC..Hα-helixtrans-63.5-41.5171.9-177.764.3000111.2L326 T329 F376 A377 G383 F384L326-L380 VanDerWaalsContact O-CD1 3.26Å; L326-L380 WeakPolarHBondContact O-CD1 3.29Å; T329-L380 HydrophobicContact CG2-CD1 4.38Å; F376-L380 WeakPolarHBondContact O-CB 3.3Å; F376-L380 PolarHBondContact O-N 2.96Å; A377-L380 PolarHBondContact O-N 3.04Å; L380-G383 PolarHBondContact O-N 2.95Å; L380-F384 HydrophobicContact CD1-CE1 4.46Å; L380-F384 HydrophobicContact CD1-CE2 4.4Å; L380-F384 HydrophobicContact CD1-CZ 4.05Å; L380-F384 HydrophobicContact CD2-CE2 4.16Å; L380-F384 HydrophobicContact CD2-CZ 4.19Å; L380-F384 HydrophobicContact CG-CD2 4.47Å; L380-F384 HydrophobicContact CG-CE2 3.77Å; L380-F384 HydrophobicContact CG-CZ 3.88Å; L380-F384 WeakPolarHBondContact O-CD2 3.42Å; L380-F384 PolarHBondContact O-N 3.3Å; L380-F384 VanDerWaalsContact O-N 3.09Å
381Y96.8Very high94Very high89 Ų8930.9 Ų30.935%0.34915%0.154SC..Hα-helixtrans-63.4-42.5176.2172.9-111.5000112.9A377 I378 V379 G383 F384 L385A377-Y381 VanDerWaalsContact O-CB 3.32Å; A377-Y381 WeakPolarHBondContact O-CB 3.38Å; A377-Y381 PolarHBondContact O-N 3.07Å; I378-Y381 WeakPolarHBondContact O-CB 3.39Å; I378-Y381 PolarHBondContact O-N 3.37Å; V379-Y381 VanDerWaalsContact C-N 3.32Å; Y381-G383 VanDerWaalsContact C-N 3.33Å; Y381-G383 PolarHBondContact O-N 3.22Å; Y381-F384 WeakPolarHBondContact O-CB 3.18Å; Y381-F384 PolarHBondContact O-N 2.84Å; Y381-F384 VanDerWaalsContact O-N 3.1Å; Y381-L385 HydrophobicContact CD1-CD1 4.12Å; Y381-L385 HydrophobicContact CE1-CD1 3.47Å; Y381-L385 VanDerWaalsContact CE1-CD1 3.47Å; Y381-L385 HydrophobicContact CE1-CG 4.15Å; Y381-L385 HydrophobicContact CE2-CD1 4.21Å; Y381-L385 HydrophobicContact CE2-CD2 4.05Å; Y381-L385 HydrophobicContact CE2-CG 4.03Å; Y381-L385 PolarHBondContact O-N 2.95Å
382E96.3Very high94.4Very high0 Ų029 Ų290%014%0.141CC..Hα-helixtrans-53.6-50.3172.1-175.8-149.5153.300111.1E296 I299 N300 F304 N356 I378 V379 F384 L385 G386E296-E382 WeakPolarHBondContact CG-OE1 3.22Å; I299-E382 HydrophobicContact CD1-CG 4.19Å; I299-E382 WeakPolarHBondContact CG2-OE2 3.3Å; N300-E382 PolarHBondContact ND2-OE1 2.96Å; F304-E382 WeakPolarHBondContact CZ-OE2 3.47Å; N356-E382 WeakPolarHBondContact ND2-CB 3.37Å; I378-E382 WeakPolarHBondContact O-CB 3.35Å; I378-E382 PolarHBondContact O-N 3.02Å; V379-E382 WeakPolarHBondContact O-CB 3.22Å; V379-E382 PolarHBondContact O-N 2.81Å; E382-F384 VanDerWaalsContact C-N 3.27Å; E382-F384 PolarHBondContact O-N 2.97Å; E382-L385 PolarHBondContact O-N 2.94Å; E382-L385 VanDerWaalsContact O-N 3.16Å; E382-G386 PolarHBondContact O-N 2.93Å
383G95.7Very high94.8Very high0 Ų028.7 Ų28.70%014%0.139CC..Hα-helixtrans-60.2-36177.100000112.8G330 V331 S334 V379 L380 Y381 G387G330-G383 CarbonylContact C-O 3.57Å; V331-G383 VanDerWaalsContact CA-O 3.28Å; V331-G383 WeakPolarHBondContact CA-O 3.44Å; V331-G383 PolarHBondContact N-O 3.48Å; S334-G383 PolarHBondContact OG-O 3.27Å; V379-G383 PolarHBondContact O-N 3.27Å; V379-G383 VanDerWaalsContact O-N 3.13Å; L380-G383 PolarHBondContact O-N 2.95Å; Y381-G383 VanDerWaalsContact C-N 3.33Å; Y381-G383 PolarHBondContact O-N 3.22Å; G383-G387 PolarHBondContact O-N 2.97Å; G383-G387 VanDerWaalsContact O-N 3.11Å
384F96.4Very high95Very high74 Ų7420.5 Ų20.533%0.32511%0.107SC..Hα-helixtrans-63.7-43.6174.8-68.2-42.1000112.7G330 V333 S334 L380 Y381 E382 A388G330-F384 VanDerWaalsContact O-CD1 3.28Å; G330-F384 WeakPolarHBondContact O-CD1 3.45Å; V333-F384 HydrophobicContact CB-CD1 4.42Å; V333-F384 HydrophobicContact CB-CE1 3.82Å; V333-F384 HydrophobicContact CG1-CD1 4.36Å; V333-F384 HydrophobicContact CG1-CE1 3.68Å; S334-F384 WeakPolarHBondContact CB-O 3.48Å; S334-F384 PolarHBondContact OG-O 3.38Å; L380-F384 HydrophobicContact CD1-CE1 4.46Å; L380-F384 HydrophobicContact CD1-CE2 4.4Å; L380-F384 HydrophobicContact CD1-CZ 4.05Å; L380-F384 HydrophobicContact CD2-CE2 4.16Å; L380-F384 HydrophobicContact CD2-CZ 4.19Å; L380-F384 HydrophobicContact CG-CD2 4.47Å; L380-F384 HydrophobicContact CG-CE2 3.77Å; L380-F384 HydrophobicContact CG-CZ 3.88Å; L380-F384 WeakPolarHBondContact O-CD2 3.42Å; L380-F384 PolarHBondContact O-N 3.3Å; L380-F384 VanDerWaalsContact O-N 3.09Å; Y381-F384 WeakPolarHBondContact O-CB 3.18Å; Y381-F384 PolarHBondContact O-N 2.84Å; Y381-F384 VanDerWaalsContact O-N 3.1Å; E382-F384 VanDerWaalsContact C-N 3.27Å; E382-F384 PolarHBondContact O-N 2.97Å; F384-A388 WeakPolarHBondContact O-CB 3.36Å; F384-A388 PolarHBondContact O-N 3.39Å
385L96.5Very high95.2Very high9 Ų917.1 Ų17.15%0.0479%0.089CC..Hα-helixtrans-64.2-44.6179.7-69.3179.6000111.3L349 L352 Q353 Y381 E382 A389L349-L385 HydrophobicContact CD2-CD2 3.72Å; L352-L385 HydrophobicContact CB-CD1 3.8Å; L352-L385 HydrophobicContact CB-CD2 4.07Å; L352-L385 HydrophobicContact CD1-CD2 4.08Å; Q353-L385 HydrophobicContact CB-CD1 4.31Å; Y381-L385 HydrophobicContact CD1-CD1 4.12Å; Y381-L385 HydrophobicContact CE1-CD1 3.47Å; Y381-L385 VanDerWaalsContact CE1-CD1 3.47Å; Y381-L385 HydrophobicContact CE1-CG 4.15Å; Y381-L385 HydrophobicContact CE2-CD1 4.21Å; Y381-L385 HydrophobicContact CE2-CD2 4.05Å; Y381-L385 HydrophobicContact CE2-CG 4.03Å; Y381-L385 PolarHBondContact O-N 2.95Å; E382-L385 PolarHBondContact O-N 2.94Å; E382-L385 VanDerWaalsContact O-N 3.16Å; L385-A389 VanDerWaalsContact O-CB 3.28Å; L385-A389 WeakPolarHBondContact O-CB 3.48Å; L385-A389 PolarHBondContact O-N 3.46Å
386G95.4Very high95.3Very high1 Ų117.7 Ų17.71%0.019%0.092CC..Hα-helixtrans-55.5-60.8176.200000114.7E296 E382 A388 A389 Y390E296-G386 WeakPolarHBondContact OE2-CA 3.18Å; E382-G386 PolarHBondContact O-N 2.93Å; G386-A388 VanDerWaalsContact C-N 3.32Å; G386-A388 PolarHBondContact O-N 3.4Å; G386-A389 PolarHBondContact O-N 2.92Å; G386-Y390 PolarHBondContact O-N 3.35Å
387G95.1Very high95.3Very high0 Ų016.3 Ų16.30%09%0.086CC..Hα-helixtrans-66.5-34.5-17800000112.8S334 G383 Y390 V391S334-G387 WeakPolarHBondContact OG-CA 3.18Å; G383-G387 PolarHBondContact O-N 2.97Å; G383-G387 VanDerWaalsContact O-N 3.11Å; G387-Y390 PolarHBondContact O-N 2.92Å; G387-V391 WeakPolarHBondContact O-CG1 3.46Å; G387-V391 PolarHBondContact O-N 2.98Å; G387-V391 VanDerWaalsContact O-N 3.09Å
388A96.1Very high95.1Very high8 Ų813.7 Ų13.77%0.0666%0.064CC..Hα-helixtrans-64.8-42.8173.800000111.6S334 I343 L349 F384 G386 N392S334-A388 PolarHBondContact OG-N 2.56Å; I343-A388 HydrophobicContact CD1-CB 4.37Å; L349-A388 HydrophobicContact CD1-CB 4.06Å; F384-A388 WeakPolarHBondContact O-CB 3.36Å; F384-A388 PolarHBondContact O-N 3.39Å; G386-A388 VanDerWaalsContact C-N 3.32Å; G386-A388 PolarHBondContact O-N 3.4Å; A388-N392 VanDerWaalsContact O-CB 3.27Å; A388-N392 WeakPolarHBondContact O-CB 3.3Å; A388-N392 PolarHBondContact O-N 3.15Å; A388-N392 VanDerWaalsContact O-N 3.08Å; A388-N392 PolarHBondContact O-ND2 3.38Å
389A96.6Very high94.9Very high0 Ų017 Ų170%08%0.082CC..Hα-helixtrans-63.1-43.7178.400000111.5L289 V292 I346 L349 L385 G386 T393L289-A389 HydrophobicContact CD1-CB 4.11Å; V292-A389 HydrophobicContact CB-CB 4.19Å; V292-A389 HydrophobicContact CG1-CB 3.84Å; V292-A389 HydrophobicContact CG2-CB 3.87Å; I346-A389 HydrophobicContact CG2-CB 4.37Å; L349-A389 HydrophobicContact CB-CB 4.3Å; L349-A389 HydrophobicContact CD1-CB 3.92Å; L385-A389 VanDerWaalsContact O-CB 3.28Å; L385-A389 WeakPolarHBondContact O-CB 3.48Å; L385-A389 PolarHBondContact O-N 3.46Å; G386-A389 PolarHBondContact O-N 2.92Å; A389-T393 WeakPolarHBondContact O-CB 3.02Å; A389-T393 PolarHBondContact O-N 3.36Å; A389-T393 PolarHBondContact O-OG1 3.1Å
390Y95.6Very high94.6Very high1 Ų120.9 Ų20.90%0.00410%0.1CC..Hα-helixtrans-58.8-61.7176.4-176.8-83.2000111.1E167 W185 S186 Y293 G386 G387 N392 T393 Y394E167-Y390 WeakPolarHBondContact OE1-CE2 3.33Å; E167-Y390 PolarHBondContact OE1-OH 3.42Å; W185-Y390 PolarHBondContact NE1-OH 3.43Å; S186-Y390 WeakPolarHBondContact OG-CD1 3.33Å; S186-Y390 WeakPolarHBondContact OG-CE1 3.32Å; Y293-Y390 HydrophobicContact CE2-CD2 4.16Å; Y293-Y390 AromaticContact CZ-CD2 3.94Å; Y293-Y390 WeakPolarHBondContact OH-CD2 3.42Å; G386-Y390 PolarHBondContact O-N 3.35Å; G387-Y390 PolarHBondContact O-N 2.92Å; Y390-N392 VanDerWaalsContact C-N 3.33Å; Y390-N392 PolarHBondContact O-N 3.27Å; Y390-T393 PolarHBondContact O-N 2.77Å; Y390-Y394 AromaticContact CD1-CD2 3.91Å; Y390-Y394 HydrophobicContact CD1-CD2 3.91Å; Y390-Y394 HydrophobicContact CD1-CE2 4.03Å; Y390-Y394 HydrophobicContact CD2-CD2 4.26Å; Y390-Y394 AromaticContact CD2-CE2 3.58Å; Y390-Y394 HydrophobicContact CD2-CE2 3.58Å; Y390-Y394 AromaticContact CE1-CD2 3.79Å; Y390-Y394 HydrophobicContact CE1-CD2 3.79Å; Y390-Y394 AromaticContact CE1-CE2 3.81Å; Y390-Y394 HydrophobicContact CE1-CE2 3.81Å; Y390-Y394 HydrophobicContact CE2-CD2 4.2Å; Y390-Y394 AromaticContact CE2-CE2 3.38Å; Y390-Y394 HydrophobicContact CE2-CE2 3.38Å; Y390-Y394 HydrophobicContact CG-CD2 4.16Å; Y390-Y394 AromaticContact CG-CE2 3.94Å; Y390-Y394 HydrophobicContact CG-CE2 3.94Å; Y390-Y394 AromaticContact CZ-CD2 3.95Å; Y390-Y394 AromaticContact CZ-CE2 3.49Å; Y390-Y394 VanDerWaalsContact CZ-CE2 3.49Å; Y390-Y394 WeakPolarHBondContact O-CD2 3.46Å; Y390-Y394 PolarHBondContact O-N 3.05Å
391V95.3Very high94.2Very high0 Ų019.8 Ų19.80%010%0.095CC..Hα-helixtrans-63.5-39.7-171.571.20000112.2S186 L338 G387 H395S186-V391 WeakPolarHBondContact OG-CB 3.43Å; L338-V391 HydrophobicContact CB-CG2 4.03Å; L338-V391 HydrophobicContact CD1-CG1 4.38Å; L338-V391 HydrophobicContact CD1-CG2 4.17Å; L338-V391 HydrophobicContact CD2-CG2 4.06Å; L338-V391 HydrophobicContact CG-CG2 4.31Å; G387-V391 WeakPolarHBondContact O-CG1 3.46Å; G387-V391 PolarHBondContact O-N 2.98Å; G387-V391 VanDerWaalsContact O-N 3.09Å; V391-H395 VanDerWaalsContact O-CB 3.26Å; V391-H395 WeakPolarHBondContact O-CB 3.48Å; V391-H395 PolarHBondContact O-N 3.39Å
392N95.6Very high93.7Very high0 Ų018.6 Ų18.60%010%0.1CC..Hα-helixtrans-72.9-32.6-179.8-74.1-82.6000112R342 I343 I346 A388 Y390 N396R342-N392 WeakPolarHBondContact CA-OD1 3.29Å; I343-N392 HydrophobicContact CB-CB 4.46Å; I343-N392 PolarHBondContact N-OD1 3.14Å; I343-N392 WeakPolarHBondContact O-CB 3.47Å; I346-N392 HydrophobicContact CD1-CB 3.52Å; A388-N392 VanDerWaalsContact O-CB 3.27Å; A388-N392 WeakPolarHBondContact O-CB 3.3Å; A388-N392 PolarHBondContact O-N 3.15Å; A388-N392 VanDerWaalsContact O-N 3.08Å; A388-N392 PolarHBondContact O-ND2 3.38Å; Y390-N392 VanDerWaalsContact C-N 3.33Å; Y390-N392 PolarHBondContact O-N 3.27Å; N392-N396 VanDerWaalsContact O-CB 3.27Å; N392-N396 WeakPolarHBondContact O-CB 3.28Å; N392-N396 PolarHBondContact O-N 3.37Å; N392-N396 PolarHBondContact O-ND2 3.42Å
393T95.4Very high92.9Very high0 Ų024.1 Ų24.10%013%0.13CC..Hα-helixtrans-61.9-54.2175.4-62.80000110.9Y285 L289 I346 A389 Y390 H395 N396 V397Y285-T393 HydrophobicContact CD1-CG2 4.31Å; Y285-T393 HydrophobicContact CG-CG2 4.29Å; L289-T393 HydrophobicContact CD2-CG2 3.82Å; I346-T393 WeakPolarHBondContact CG2-OG1 3.45Å; A389-T393 WeakPolarHBondContact O-CB 3.02Å; A389-T393 PolarHBondContact O-N 3.36Å; A389-T393 PolarHBondContact O-OG1 3.1Å; Y390-T393 PolarHBondContact O-N 2.77Å; T393-H395 VanDerWaalsContact C-N 3.31Å; T393-H395 PolarHBondContact O-N 3.06Å; T393-N396 PolarHBondContact O-N 3.01Å; T393-V397 HydrophobicContact CG2-CG2 4.36Å; T393-V397 WeakPolarHBondContact O-CB 3.29Å; T393-V397 VanDerWaalsContact O-CG2 3.26Å; T393-V397 WeakPolarHBondContact O-CG2 3.42Å; T393-V397 PolarHBondContact O-N 2.92Å
394Y94.7Very high92.1Very high0 Ų030.6 Ų30.60%016%0.158CC..Hα-helixtrans-64.7-37.6179.8-69-73.9000112.2L171 Y390 V397 A398 M410 A413 C414L171-Y394 HydrophobicContact CD1-CD1 4.22Å; L171-Y394 HydrophobicContact CD1-CE1 3.54Å; L171-Y394 HydrophobicContact CD1-CE2 4.35Å; L171-Y394 HydrophobicContact CD2-CD1 3.89Å; L171-Y394 HydrophobicContact CD2-CD2 4.46Å; L171-Y394 HydrophobicContact CD2-CE1 4.08Å; L171-Y394 HydrophobicContact CD2-CG 4.08Å; L171-Y394 HydrophobicContact CG-CE1 4.37Å; Y390-Y394 AromaticContact CD1-CD2 3.91Å; Y390-Y394 HydrophobicContact CD1-CD2 3.91Å; Y390-Y394 HydrophobicContact CD1-CE2 4.03Å; Y390-Y394 HydrophobicContact CD2-CD2 4.26Å; Y390-Y394 AromaticContact CD2-CE2 3.58Å; Y390-Y394 HydrophobicContact CD2-CE2 3.58Å; Y390-Y394 AromaticContact CE1-CD2 3.79Å; Y390-Y394 HydrophobicContact CE1-CD2 3.79Å; Y390-Y394 AromaticContact CE1-CE2 3.81Å; Y390-Y394 HydrophobicContact CE1-CE2 3.81Å; Y390-Y394 HydrophobicContact CE2-CD2 4.2Å; Y390-Y394 AromaticContact CE2-CE2 3.38Å; Y390-Y394 HydrophobicContact CE2-CE2 3.38Å; Y390-Y394 HydrophobicContact CG-CD2 4.16Å; Y390-Y394 AromaticContact CG-CE2 3.94Å; Y390-Y394 HydrophobicContact CG-CE2 3.94Å; Y390-Y394 AromaticContact CZ-CD2 3.95Å; Y390-Y394 AromaticContact CZ-CE2 3.49Å; Y390-Y394 VanDerWaalsContact CZ-CE2 3.49Å; Y390-Y394 WeakPolarHBondContact O-CD2 3.46Å; Y390-Y394 PolarHBondContact O-N 3.05Å; Y394-V397 PolarHBondContact O-N 3.49Å; Y394-A398 WeakPolarHBondContact O-CB 3.29Å; Y394-A398 PolarHBondContact O-N 2.94Å; Y394-M410 HydrophobicContact CD1-SD 3.88Å; Y394-M410 WeakPolarHBondContact O-CE 3.39Å; Y394-A413 HydrophobicContact CE1-CB 4.15Å; Y394-C414 VanDerWaalsContact OH-CA 3.32Å; Y394-C414 WeakPolarHBondContact OH-CA 3.46Å
395H94.1Very high91.6Very high10 Ų1028.4 Ų28.45%0.04615%0.148CC..Hα-helixtrans-63.1-45.6175.7-172.765.3000112.4L338 V391 T393 A398 L399L338-H395 HydrophobicContact CD1-CB 3.9Å; L338-H395 HydrophobicContact CD2-CB 3.94Å; V391-H395 VanDerWaalsContact O-CB 3.26Å; V391-H395 WeakPolarHBondContact O-CB 3.48Å; V391-H395 PolarHBondContact O-N 3.39Å; T393-H395 VanDerWaalsContact C-N 3.31Å; T393-H395 PolarHBondContact O-N 3.06Å; H395-A398 WeakPolarHBondContact O-CB 3.45Å; H395-A398 PolarHBondContact O-N 3.32Å; H395-L399 WeakPolarHBondContact NE2-CD1 3.29Å; H395-L399 WeakPolarHBondContact O-CG 3.47Å; H395-L399 PolarHBondContact O-N 2.69Å; H395-L399 VanDerWaalsContact O-N 3.16Å
396N93.4Very high91.1Very high13 Ų1329.8 Ų29.87%0.0715%0.153CC..Hα-helixtrans-66.1-41.1178.6-66.1-26.3000111.2Y285 I343 N392 T393 A398 L399 E400Y285-N396 HydrophobicContact CE1-CB 3.81Å; I343-N396 PolarHBondContact O-ND2 3.5Å; I343-N396 VanDerWaalsContact O-ND2 3.14Å; N392-N396 VanDerWaalsContact O-CB 3.27Å; N392-N396 WeakPolarHBondContact O-CB 3.28Å; N392-N396 PolarHBondContact O-N 3.37Å; N392-N396 PolarHBondContact O-ND2 3.42Å; T393-N396 PolarHBondContact O-N 3.01Å; N396-A398 VanDerWaalsContact C-N 3.28Å; N396-A398 PolarHBondContact O-N 3.24Å; N396-L399 PolarHBondContact O-N 2.82Å; N396-E400 WeakPolarHBondContact O-CB 3.37Å; N396-E400 WeakPolarHBondContact O-CG 3.22Å; N396-E400 PolarHBondContact O-N 3.06Å
397V93Very high90.8Very high0 Ų030.9 Ų30.90%016%0.158CC..Hα-helixtrans-59.3-39.4173.3171.30000111.1L282 Y285 T393 Y394 L399 T401 A409 M410L282-V397 HydrophobicContact CD2-CG1 4Å; L282-V397 HydrophobicContact CD2-CG2 3.99Å; Y285-V397 HydrophobicContact CD2-CG2 3.59Å; Y285-V397 HydrophobicContact CE2-CG2 4.09Å; Y285-V397 HydrophobicContact CG-CG2 3.99Å; T393-V397 HydrophobicContact CG2-CG2 4.36Å; T393-V397 WeakPolarHBondContact O-CB 3.29Å; T393-V397 VanDerWaalsContact O-CG2 3.26Å; T393-V397 WeakPolarHBondContact O-CG2 3.42Å; T393-V397 PolarHBondContact O-N 2.92Å; Y394-V397 PolarHBondContact O-N 3.49Å; V397-L399 VanDerWaalsContact C-N 3.32Å; V397-L399 PolarHBondContact O-N 3.38Å; V397-T401 WeakPolarHBondContact O-CB 3.5Å; V397-T401 PolarHBondContact O-N 3.48Å; V397-T401 VanDerWaalsContact O-N 3.15Å; V397-T401 PolarHBondContact O-OG1 2.88Å; V397-A409 HydrophobicContact CG1-CB 3.86Å; V397-M410 HydrophobicContact CB-CE 4.47Å; V397-M410 HydrophobicContact CG1-CE 4.16Å; V397-M410 HydrophobicContact CG1-SD 4.11Å
398A90.7Very high90.6Very high3 Ų332.1 Ų32.13%0.02516%0.163CC..Hα-helixtrans-65.2-34.4178.400000114I182 Y394 H395 N396 R406 M410I182-A398 HydrophobicContact CD1-CB 3.3Å; Y394-A398 WeakPolarHBondContact O-CB 3.29Å; Y394-A398 PolarHBondContact O-N 2.94Å; H395-A398 WeakPolarHBondContact O-CB 3.45Å; H395-A398 PolarHBondContact O-N 3.32Å; N396-A398 VanDerWaalsContact C-N 3.28Å; N396-A398 PolarHBondContact O-N 3.24Å; A398-R406 WeakPolarHBondContact O-CD 3.1Å; A398-M410 HydrophobicContact CB-CE 3.32Å
399L89.4Confident90.3Very high101 Ų10131.7 Ų31.753%0.52916%0.16SC..Hα-helixtrans-86.7-34.8-175.8-70.2178.7000112.5H395 N396 V397H395-L399 WeakPolarHBondContact NE2-CD1 3.29Å; H395-L399 WeakPolarHBondContact O-CG 3.47Å; H395-L399 PolarHBondContact O-N 2.69Å; H395-L399 VanDerWaalsContact O-N 3.16Å; N396-L399 PolarHBondContact O-N 2.82Å; V397-L399 VanDerWaalsContact C-N 3.32Å; V397-L399 PolarHBondContact O-N 3.38Å
400E88.6Confident90.1Very high82 Ų8231.7 Ų31.738%0.38316%0.16SC..Hα-helixtrans-91.6-18.3-174.6-65.6-175.6171.400113.2Y285 R344 N396Y285-E400 WeakPolarHBondContact CE2-OE2 3.45Å; Y285-E400 PolarHBondContact OH-OE1 3.13Å; Y285-E400 PolarHBondContact OH-OE2 3.19Å; R344-E400 IonicContact CZ-OE1 3.31Å; R344-E400 VanDerWaalsContact CZ-OE1 3.31Å; R344-E400 IonicContact NE-OE1 3.35Å; R344-E400 PolarHBondContact NE-OE1 3.34Å; R344-E400 IonicContact NH2-OE1 2.7Å; R344-E400 PolarHBondContact NH2-OE1 3.47Å; N396-E400 WeakPolarHBondContact O-CB 3.37Å; N396-E400 WeakPolarHBondContact O-CG 3.22Å; N396-E400 PolarHBondContact O-N 3.06Å
401T88.5Confident89.8Confident24 Ų2431.8 Ų31.815%0.14716%0.161CC..SBendtrans-90.6135.7178-47.70000110.6V397 H405 R406 A409V397-T401 WeakPolarHBondContact O-CB 3.5Å; V397-T401 PolarHBondContact O-N 3.48Å; V397-T401 VanDerWaalsContact O-N 3.15Å; V397-T401 PolarHBondContact O-OG1 2.88Å; T401-H405 HydrophobicContact CG2-CB 3.61Å; T401-R406 HydrophobicContact CG2-CB 4.45Å; T401-A409 HydrophobicContact CG2-CB 3.74Å
402S84.3Confident89.6Confident64 Ų6431.9 Ų31.945%0.44816%0.161SC..  trans-63.215217361.10000111.9K404 H405 R406S402-K404 PolarHBondContact O-N 2.9Å; S402-K404 VanDerWaalsContact O-N 3.14Å; S402-H405 PolarHBondContact O-N 3.32Å; S402-H405 PolarHBondContact OG-CD2 3.3Å; S402-R406 PolarHBondContact O-N 3.48Å
403D79.4Confident89.4Confident116 Ų11631.9 Ų31.962%0.6216%0.161SC*.Hα-helixtrans-55-38.1-176.7-63.9-50.5000112.5H405 R406D403-H405 PolarHBondContact O-N 3.2Å; D403-R406 PolarHBondContact O-N 2.83Å; D403-R406 IonicContact OD1-CZ 3.05Å; D403-R406 IonicContact OD1-NE 3.93Å; D403-R406 IonicContact OD1-NH1 3.07Å; D403-R406 PolarHBondContact OD1-NH1 3.16Å; D403-R406 IonicContact OD1-NH2 2.76Å; D403-R406 PolarHBondContact OD1-NH2 3.25Å
404K79.7Confident89.3Confident136 Ų13631.9 Ų31.959%0.59116%0.161SC*.Hα-helixtrans-57.6-32.2176.1-171.2-169.9177.5-154.80113.5L270 E274 S402L270-K404 HydrophobicContact CD2-CD 4.34Å; L270-K404 HydrophobicContact CD2-CG 4.48Å; E274-K404 IonicContact OE1-NZ 2.78Å; E274-K404 PolarHBondContact OE1-NZ 2.8Å; E274-K404 IonicContact OE2-NZ 3.51Å; S402-K404 PolarHBondContact O-N 2.9Å; S402-K404 VanDerWaalsContact O-N 3.14Å
405H86.2Confident89.2Confident28 Ų2832.9 Ų32.913%0.1317%0.166CC..Hα-helixtrans-109.3-7.9-175.4-58.6-44.4000113.3L270 E274 V278 T401 S402 D403 E407 F408 A409L270-H405 WeakPolarHBondContact CD1-ND1 3.48Å; L270-H405 WeakPolarHBondContact CD2-CE1 3.41Å; E274-H405 IonicContact OE1-CE1 3.05Å; E274-H405 PolarHBondContact OE1-CE1 3.33Å; E274-H405 IonicContact OE1-NE2 3.44Å; E274-H405 PolarHBondContact OE1-NE2 2.73Å; V278-H405 HydrophobicContact CG1-CB 4.37Å; V278-H405 HydrophobicContact CG2-CB 4.12Å; T401-H405 HydrophobicContact CG2-CB 3.61Å; S402-H405 PolarHBondContact O-N 3.32Å; S402-H405 PolarHBondContact OG-CD2 3.3Å; D403-H405 PolarHBondContact O-N 3.2Å; H405-E407 PolarHBondContact O-N 3.18Å; H405-F408 PolarHBondContact O-N 2.9Å; H405-A409 WeakPolarHBondContact O-CB 3.5Å; H405-A409 PolarHBondContact O-N 3.48Å
406R86.7Confident89.2Confident38 Ų3832.4 Ų32.414%0.14316%0.164CC..Hα-helixtrans-61.8-42.6-171-174.1165.962.2-154.8-7.2112.3A175 A398 T401 S402 D403 A409 M410A175-R406 HydrophobicContact CB-CB 4.1Å; A175-R406 HydrophobicContact CB-CG 3.73Å; A175-R406 PolarHBondContact O-NE 2.87Å; A175-R406 PolarHBondContact O-NH2 3.31Å; A398-R406 WeakPolarHBondContact O-CD 3.1Å; T401-R406 HydrophobicContact CG2-CB 4.45Å; S402-R406 PolarHBondContact O-N 3.48Å; D403-R406 PolarHBondContact O-N 2.83Å; D403-R406 IonicContact OD1-CZ 3.05Å; D403-R406 IonicContact OD1-NE 3.93Å; D403-R406 IonicContact OD1-NH1 3.07Å; D403-R406 PolarHBondContact OD1-NH1 3.16Å; D403-R406 IonicContact OD1-NH2 2.76Å; D403-R406 PolarHBondContact OD1-NH2 3.25Å; R406-A409 PolarHBondContact O-N 3.29Å; R406-M410 HydrophobicContact CG-CE 4.12Å; R406-M410 VanDerWaalsContact O-CG 3.29Å; R406-M410 WeakPolarHBondContact O-CG 3.45Å; R406-M410 PolarHBondContact O-N 3.3Å
407E88.6Confident89.1Confident25 Ų2532.1 Ų32.112%0.11716%0.162CC..Hα-helixtrans-57.3-55.8176.9-172.1-179.6-178.100111.3Y125 A175 H405 A409 M410 E411Y125-E407 PolarHBondContact OH-OE1 3.31Å; A175-E407 HydrophobicContact CB-CB 4.2Å; H405-E407 PolarHBondContact O-N 3.18Å; E407-A409 VanDerWaalsContact C-N 3.29Å; E407-A409 PolarHBondContact O-N 2.8Å; E407-M410 PolarHBondContact O-N 3.12Å; E407-E411 WeakPolarHBondContact O-CG 3.16Å; E407-E411 PolarHBondContact O-N 3.31Å; E407-E411 VanDerWaalsContact O-N 3.11Å
408F89.7Confident89.1Confident25 Ų2532.2 Ų32.211%0.1116%0.163CC..Hα-helixtrans-59-39.2177.1173.5-97000112.5P117 R275 V278 H405 E411 A412P117-F408 HydrophobicContact CB-CD2 4.27Å; P117-F408 HydrophobicContact CB-CE2 3.73Å; R275-F408 HydrophobicContact CB-CE1 4.11Å; R275-F408 HydrophobicContact CB-CE2 4.04Å; R275-F408 HydrophobicContact CB-CZ 3.69Å; R275-F408 HydrophobicContact CG-CD2 4.39Å; R275-F408 HydrophobicContact CG-CE2 4.07Å; R275-F408 HydrophobicContact CG-CZ 4.19Å; R275-F408 WeakPolarHBondContact O-CE1 3.49Å; V278-F408 HydrophobicContact CB-CD1 4.28Å; V278-F408 HydrophobicContact CB-CE1 4.18Å; V278-F408 HydrophobicContact CG1-CD1 3.93Å; V278-F408 HydrophobicContact CG1-CE1 4.13Å; H405-F408 PolarHBondContact O-N 2.9Å; F408-E411 PolarHBondContact O-N 3.4Å; F408-A412 HydrophobicContact CE1-CB 4.38Å; F408-A412 HydrophobicContact CZ-CB 4.47Å; F408-A412 WeakPolarHBondContact O-CB 3.25Å; F408-A412 PolarHBondContact O-N 2.88Å
409A91.2Very high89.2Confident0 Ų035 Ų350%018%0.177CC..Hα-helixtrans-66.2-38.2179.600000112.6V278 L282 V397 T401 H405 R406 E407 A413V278-A409 HydrophobicContact CG1-CB 4.36Å; L282-A409 HydrophobicContact CD1-CB 3.66Å; L282-A409 HydrophobicContact CD2-CB 4.13Å; L282-A409 HydrophobicContact CG-CB 4.47Å; V397-A409 HydrophobicContact CG1-CB 3.86Å; T401-A409 HydrophobicContact CG2-CB 3.74Å; H405-A409 WeakPolarHBondContact O-CB 3.5Å; H405-A409 PolarHBondContact O-N 3.48Å; R406-A409 PolarHBondContact O-N 3.29Å; E407-A409 VanDerWaalsContact C-N 3.29Å; E407-A409 PolarHBondContact O-N 2.8Å; A409-A413 VanDerWaalsContact O-CB 3.22Å; A409-A413 WeakPolarHBondContact O-CB 3.34Å; A409-A413 PolarHBondContact O-N 3.47Å
410M91.3Very high89.5Confident0 Ų030.1 Ų30.10%015%0.152CC..Hα-helixtrans-62.7-45.5172.6-69-58.4172.200111.5I182 Y394 V397 A398 R406 E407 C414I182-M410 HydrophobicContact CD1-CE 3.92Å; Y394-M410 HydrophobicContact CD1-SD 3.88Å; Y394-M410 WeakPolarHBondContact O-CE 3.39Å; V397-M410 HydrophobicContact CB-CE 4.47Å; V397-M410 HydrophobicContact CG1-CE 4.16Å; V397-M410 HydrophobicContact CG1-SD 4.11Å; A398-M410 HydrophobicContact CB-CE 3.32Å; R406-M410 HydrophobicContact CG-CE 4.12Å; R406-M410 VanDerWaalsContact O-CG 3.29Å; R406-M410 WeakPolarHBondContact O-CG 3.45Å; R406-M410 PolarHBondContact O-N 3.3Å; E407-M410 PolarHBondContact O-N 3.12Å; M410-C414 WeakPolarHBondContact O-CB 3.18Å; M410-C414 PolarHBondContact O-N 3.1Å; M410-C414 VanDerWaalsContact O-N 3.12Å
411E89.6Confident89.6Confident3 Ų326.6 Ų26.61%0.01414%0.135CC..Hα-helixtrans-60.8-48.1177.1-66.7-172.116900111.8P117 R128 V168 S172 E407 F408 C414P117-E411 HydrophobicContact CG-CB 4.4Å; R128-E411 IonicContact NH1-OE1 3.55Å; V168-E411 HydrophobicContact CG1-CB 4.31Å; V168-E411 HydrophobicContact CG1-CG 3.82Å; S172-E411 VanDerWaalsContact OG-CD 3.28Å; S172-E411 WeakPolarHBondContact OG-CG 3.49Å; S172-E411 PolarHBondContact OG-OE1 3.11Å; E407-E411 WeakPolarHBondContact O-CG 3.16Å; E407-E411 PolarHBondContact O-N 3.31Å; E407-E411 VanDerWaalsContact O-N 3.11Å; F408-E411 PolarHBondContact O-N 3.4Å; E411-C414 VanDerWaalsContact O-CB 3.22Å; E411-C414 WeakPolarHBondContact O-CB 3.4Å; E411-C414 PolarHBondContact O-N 3.01Å
412A91.3Very high89.8Confident1 Ų125.6 Ų25.61%0.00813%0.129CC..Hα-helixtrans-65.5-43.4-179.200000112.3F279 L282 F408 C414 I415F279-A412 HydrophobicContact CD2-CB 4.05Å; L282-A412 HydrophobicContact CD1-CB 4.09Å; F408-A412 HydrophobicContact CE1-CB 4.38Å; F408-A412 HydrophobicContact CZ-CB 4.47Å; F408-A412 WeakPolarHBondContact O-CB 3.25Å; F408-A412 PolarHBondContact O-N 2.88Å; A412-C414 PolarHBondContact O-N 2.9Å; A412-I415 PolarHBondContact O-N 3.49Å
413A92.4Very high90.1Very high0 Ų026.6 Ų26.60%013%0.128CC..Hα-helixtrans-62.4-29.4176.900000111.9Y394 A409 I415 S416Y394-A413 HydrophobicContact CE1-CB 4.15Å; A409-A413 VanDerWaalsContact O-CB 3.22Å; A409-A413 WeakPolarHBondContact O-CB 3.34Å; A409-A413 PolarHBondContact O-N 3.47Å; A413-I415 PolarHBondContact O-N 3.02Å; A413-S416 VanDerWaalsContact O-CB 3.28Å; A413-S416 WeakPolarHBondContact O-CB 3.16Å; A413-S416 PolarHBondContact O-N 3.49Å; A413-S416 VanDerWaalsContact O-N 3.15Å; A413-S416 PolarHBondContact O-OG 3.37Å
414C91.7Very high90.6Very high0 Ų021.1 Ų21.10%010%0.099CC..THydrogen-bonded Turntrans-62.8-21.5178.2-160.10000114.5K113 L171 Y394 M410 E411 A412 S416K113-C414 HydrophobicContact CD-CB 4.35Å; K113-C414 WeakPolarHBondContact CD-O 3.16Å; K113-C414 VanDerWaalsContact CD-SG 3.57Å; K113-C414 VanDerWaalsContact CE-SG 3.5Å; K113-C414 PolarHBondContact NZ-O 3.34Å; K113-C414 PolarHBondContact NZ-SG 3.07Å; L171-C414 HydrophobicContact CD1-CB 4.27Å; Y394-C414 VanDerWaalsContact OH-CA 3.32Å; Y394-C414 WeakPolarHBondContact OH-CA 3.46Å; M410-C414 WeakPolarHBondContact O-CB 3.18Å; M410-C414 PolarHBondContact O-N 3.1Å; M410-C414 VanDerWaalsContact O-N 3.12Å; E411-C414 VanDerWaalsContact O-CB 3.22Å; E411-C414 WeakPolarHBondContact O-CB 3.4Å; E411-C414 PolarHBondContact O-N 3.01Å; A412-C414 PolarHBondContact O-N 2.9Å; C414-S416 PolarHBondContact O-N 3.42Å
415I93.1Very high90.8Very high21 Ų2114.6 Ų14.611%0.1087%0.07CC..Hα-helixtrans-64-28.6176.1-64.4163.9000111.5K113 L114 P117 A412 A413 D417 L419K113-I415 HydrophobicContact CB-CG1 4.25Å; K113-I415 WeakPolarHBondContact O-CG1 3.3Å; L114-I415 HydrophobicContact CD2-CD1 4.25Å; L114-I415 HydrophobicContact CD2-CG1 4.43Å; L114-I415 HydrophobicContact CD2-CG2 3.69Å; P117-I415 HydrophobicContact CG-CD1 4.16Å; A412-I415 PolarHBondContact O-N 3.49Å; A413-I415 PolarHBondContact O-N 3.02Å; I415-D417 PolarHBondContact O-N 2.99Å; I415-L419 HydrophobicContact CG2-CB 4.46Å; I415-L419 VanDerWaalsContact O-CB 3.26Å; I415-L419 WeakPolarHBondContact O-CB 3.31Å; I415-L419 PolarHBondContact O-N 3.01Å
416S93.4Very high90.8Very high0 Ų018.9 Ų18.90%09%0.089CC..Hα-helixtrans-60.8-47.6-167.1-45.20000113.8I286 V290 A413 C414 G420I286-S416 WeakPolarHBondContact CA-OG 3.41Å; I286-S416 WeakPolarHBondContact CG1-OG 3.31Å; I286-S416 WeakPolarHBondContact CG2-OG 3.36Å; V290-S416 VanDerWaalsContact CG2-O 3.29Å; V290-S416 WeakPolarHBondContact CG2-O 3.19Å; A413-S416 VanDerWaalsContact O-CB 3.28Å; A413-S416 WeakPolarHBondContact O-CB 3.16Å; A413-S416 PolarHBondContact O-N 3.49Å; A413-S416 VanDerWaalsContact O-N 3.15Å; A413-S416 PolarHBondContact O-OG 3.37Å; C414-S416 PolarHBondContact O-N 3.42Å; S416-G420 PolarHBondContact O-N 3.35Å; S416-G420 VanDerWaalsContact O-N 3.11Å
417D92Very high90.8Very high7 Ų721.3 Ų21.34%0.03710%0.104CC..Hα-helixtrans-64.6-47.2-175.462.2-2.9000111.1K113 Y293 I415 L419 G420 I421K113-D417 VanDerWaalsContact NZ-CG 3.32Å; K113-D417 IonicContact NZ-OD1 2.74Å; K113-D417 PolarHBondContact NZ-OD1 3.15Å; K113-D417 IonicContact NZ-OD2 3.09Å; K113-D417 PolarHBondContact NZ-OD2 3.35Å; K113-D417 VanDerWaalsContact NZ-OD2 3.09Å; Y293-D417 HydrophobicContact CD1-CB 3.9Å; Y293-D417 HydrophobicContact CD2-CB 3.7Å; Y293-D417 HydrophobicContact CE1-CB 3.87Å; Y293-D417 HydrophobicContact CE2-CB 3.7Å; Y293-D417 HydrophobicContact CG-CB 3.8Å; I415-D417 PolarHBondContact O-N 2.99Å; D417-L419 VanDerWaalsContact C-N 3.35Å; D417-L419 PolarHBondContact O-N 3.37Å; D417-G420 PolarHBondContact O-N 3.46Å; D417-I421 WeakPolarHBondContact O-CG1 3.18Å; D417-I421 PolarHBondContact O-N 3.43Å
418T92.4Very high90.3Very high2 Ų220.1 Ų20.11%0.01210%0.099CC..Hα-helixtrans-73.3-34.2-172.8-52.70000110.2I106 T109 L110 K113 S422I106-T418 HydrophobicContact CD1-CG2 3.84Å; I106-T418 HydrophobicContact CG1-CG2 3.67Å; T109-T418 HydrophobicContact CG2-CG2 3.79Å; L110-T418 HydrophobicContact CB-CG2 3.67Å; L110-T418 HydrophobicContact CD1-CG2 4.03Å; L110-T418 HydrophobicContact CG-CG2 4.45Å; K113-T418 VanDerWaalsContact CD-OG1 3.29Å; K113-T418 WeakPolarHBondContact CD-OG1 3.43Å; K113-T418 WeakPolarHBondContact CE-OG1 3.44Å; K113-T418 PolarHBondContact NZ-OG1 3.15Å; K113-T418 VanDerWaalsContact NZ-OG1 3.11Å; T418-S422 VanDerWaalsContact O-CB 3.26Å; T418-S422 WeakPolarHBondContact O-CB 3.37Å; T418-S422 PolarHBondContact O-N 3.03Å; T418-S422 PolarHBondContact O-OG 3.49Å
419L94.6Very high89.7Confident61 Ų6121.5 Ų21.532%0.31911%0.107SC..Hα-helixtrans-63.1-47.6171.3-178.961.8000110.9L110 V290 I415 D417 S422 M423L110-L419 HydrophobicContact CD1-CB 4.28Å; V290-L419 HydrophobicContact CG1-CG 4.5Å; V290-L419 HydrophobicContact CG2-CB 4.4Å; V290-L419 HydrophobicContact CG2-CD2 4.06Å; V290-L419 HydrophobicContact CG2-CG 4.47Å; I415-L419 HydrophobicContact CG2-CB 4.46Å; I415-L419 VanDerWaalsContact O-CB 3.26Å; I415-L419 WeakPolarHBondContact O-CB 3.31Å; I415-L419 PolarHBondContact O-N 3.01Å; D417-L419 VanDerWaalsContact C-N 3.35Å; D417-L419 PolarHBondContact O-N 3.37Å; L419-S422 PolarHBondContact O-N 2.92Å; L419-M423 HydrophobicContact CD1-CG 4.39Å; L419-M423 HydrophobicContact CD1-SD 4.33Å; L419-M423 HydrophobicContact CG-SD 4.19Å; L419-M423 WeakPolarHBondContact O-CB 3.4Å; L419-M423 VanDerWaalsContact O-CG 3.3Å; L419-M423 WeakPolarHBondContact O-CG 3.44Å; L419-M423 PolarHBondContact O-N 3.49Å
420G94.4Very high89.1Confident0 Ų024.9 Ų24.90%013%0.129CC..Hα-helixtrans-59.4-47.9176.400000112.6F294 S416 D417 S422 M423 S424F294-G420 WeakPolarHBondContact CA-O 3.09Å; S416-G420 PolarHBondContact O-N 3.35Å; S416-G420 VanDerWaalsContact O-N 3.11Å; D417-G420 PolarHBondContact O-N 3.46Å; G420-S422 PolarHBondContact O-N 3.19Å; G420-M423 PolarHBondContact O-N 3.22Å; G420-S424 WeakPolarHBondContact O-CB 3.48Å; G420-S424 PolarHBondContact O-N 2.87Å
421I91.5Very high88.3Confident7 Ų726.4 Ų26.44%0.03614%0.137CC..Hα-helixtrans-59.8-45.6177.3-64164.9000111L102 I106 Y293 Y297 D417 S424 G425L102-I421 HydrophobicContact CD2-CG2 3.38Å; I106-I421 HydrophobicContact CB-CG2 4.18Å; I106-I421 HydrophobicContact CD1-CB 4.37Å; I106-I421 HydrophobicContact CD1-CD1 4.08Å; I106-I421 HydrophobicContact CD1-CG2 4Å; I106-I421 HydrophobicContact CG1-CB 4.03Å; I106-I421 HydrophobicContact CG1-CG2 3.63Å; I106-I421 HydrophobicContact CG2-CG2 4.31Å; Y293-I421 HydrophobicContact CD1-CD1 3.85Å; Y293-I421 HydrophobicContact CD1-CG1 3.82Å; Y293-I421 HydrophobicContact CE1-CD1 4.26Å; Y297-I421 HydrophobicContact CD1-CB 4.25Å; Y297-I421 HydrophobicContact CD1-CD1 4.49Å; Y297-I421 HydrophobicContact CD1-CG1 3.88Å; Y297-I421 HydrophobicContact CD1-CG2 3.54Å; Y297-I421 HydrophobicContact CD2-CD1 4.27Å; Y297-I421 HydrophobicContact CD2-CG1 3.58Å; Y297-I421 HydrophobicContact CE1-CD1 4.02Å; Y297-I421 HydrophobicContact CE1-CG1 3.92Å; Y297-I421 HydrophobicContact CE1-CG2 3.79Å; Y297-I421 HydrophobicContact CE2-CD1 3.76Å; Y297-I421 HydrophobicContact CE2-CG1 3.61Å; Y297-I421 HydrophobicContact CG-CB 4.28Å; Y297-I421 HydrophobicContact CG-CG1 3.71Å; Y297-I421 HydrophobicContact CG-CG2 4.03Å; D417-I421 WeakPolarHBondContact O-CG1 3.18Å; D417-I421 PolarHBondContact O-N 3.43Å; I421-S424 WeakPolarHBondContact O-CB 3.43Å; I421-S424 PolarHBondContact O-N 3.09Å; I421-G425 PolarHBondContact O-N 2.87Å
422S91.3Very high87.4Confident3 Ų327.2 Ų27.22%0.02114%0.141CC..Hα-helixtrans-64.5-45.7-179.6-59.20000111.4T418 L419 G420 S424 G425 F426T418-S422 VanDerWaalsContact O-CB 3.26Å; T418-S422 WeakPolarHBondContact O-CB 3.37Å; T418-S422 PolarHBondContact O-N 3.03Å; T418-S422 PolarHBondContact O-OG 3.49Å; L419-S422 PolarHBondContact O-N 2.92Å; G420-S422 PolarHBondContact O-N 3.19Å; S422-S424 VanDerWaalsContact C-N 3.27Å; S422-S424 PolarHBondContact O-N 3.36Å; S422-G425 PolarHBondContact O-N 3.19Å; S422-F426 WeakPolarHBondContact O-CD2 3.49Å; S422-F426 PolarHBondContact O-N 3.47Å
423M91.6Very high86.5Confident86 Ų8631.4 Ų31.442%0.42416%0.163SC..Hα-helixtrans-59.3-39.8176.1-73.9177.964.100111.9V290 F294 L419 G420 F426 L427V290-M423 HydrophobicContact CG1-SD 4.34Å; F294-M423 HydrophobicContact CD2-CB 3.93Å; F294-M423 HydrophobicContact CE2-CB 4.41Å; L419-M423 HydrophobicContact CD1-CG 4.39Å; L419-M423 HydrophobicContact CD1-SD 4.33Å; L419-M423 HydrophobicContact CG-SD 4.19Å; L419-M423 WeakPolarHBondContact O-CB 3.4Å; L419-M423 VanDerWaalsContact O-CG 3.3Å; L419-M423 WeakPolarHBondContact O-CG 3.44Å; L419-M423 PolarHBondContact O-N 3.49Å; G420-M423 PolarHBondContact O-N 3.22Å; M423-F426 PolarHBondContact O-N 3.39Å; M423-L427 PolarHBondContact O-N 3.4Å; M423-L427 VanDerWaalsContact O-N 3.1Å
424S89.7Confident85.7Confident0 Ų036.7 Ų36.70%019%0.186CC..Hα-helixtrans-61.9-51.4175.41710000111.6F294 Y297 F298 G420 I421 S422 F426 L427 A428F294-S424 WeakPolarHBondContact O-CB 3.14Å; Y297-S424 PolarHBondContact O-OG 3.47Å; F298-S424 WeakPolarHBondContact CA-OG 3.22Å; F298-S424 WeakPolarHBondContact CB-OG 3.47Å; F298-S424 PolarHBondContact N-OG 2.92Å; G420-S424 WeakPolarHBondContact O-CB 3.48Å; G420-S424 PolarHBondContact O-N 2.87Å; I421-S424 WeakPolarHBondContact O-CB 3.43Å; I421-S424 PolarHBondContact O-N 3.09Å; S422-S424 VanDerWaalsContact C-N 3.27Å; S422-S424 PolarHBondContact O-N 3.36Å; S424-F426 VanDerWaalsContact C-N 3.3Å; S424-F426 PolarHBondContact O-N 3.23Å; S424-L427 PolarHBondContact O-N 2.95Å; S424-L427 VanDerWaalsContact O-N 3.12Å; S424-A428 VanDerWaalsContact O-CB 3.31Å; S424-A428 WeakPolarHBondContact O-CB 3.48Å; S424-A428 PolarHBondContact O-N 3.33Å
425G84.7Confident84.7Confident0 Ų036.9 Ų36.90%019%0.187CC..Hα-helixtrans-56.5-42.7177.500000112.7I421 S422 L427 L429I421-G425 PolarHBondContact O-N 2.87Å; S422-G425 PolarHBondContact O-N 3.19Å; G425-L427 PolarHBondContact O-N 2.03Å; G425-L429 PolarHBondContact O-N 3.1Å
426F85.8Confident83.4Confident117 Ų11737.3 Ų37.351%0.51319%0.192SC..Hα-helixtrans-63.9-38.3177.2-84.7-67.1000113.3L103 L107 S422 M423 S424 P430L103-F426 HydrophobicContact CD1-CD1 4.19Å; L103-F426 HydrophobicContact CD1-CE1 4.44Å; L103-F426 HydrophobicContact CD1-CG 4.37Å; L103-F426 HydrophobicContact CD2-CD1 4.38Å; L103-F426 HydrophobicContact CD2-CD2 3.67Å; L103-F426 HydrophobicContact CD2-CE1 4.43Å; L103-F426 HydrophobicContact CD2-CE2 3.72Å; L103-F426 HydrophobicContact CD2-CG 4Å; L103-F426 HydrophobicContact CD2-CZ 4.1Å; L107-F426 HydrophobicContact CD1-CZ 4.34Å; L107-F426 HydrophobicContact CD2-CE2 3.98Å; L107-F426 HydrophobicContact CD2-CZ 4.31Å; S422-F426 WeakPolarHBondContact O-CD2 3.49Å; S422-F426 PolarHBondContact O-N 3.47Å; M423-F426 PolarHBondContact O-N 3.39Å; S424-F426 VanDerWaalsContact C-N 3.3Å; S424-F426 PolarHBondContact O-N 3.23Å; F426-P430 WeakPolarHBondContact O-CD 3Å
427L85.9Confident82.1Confident89 Ų8947.1 Ų47.147%0.46623%0.229SC..Hα-helixtrans-84.9-23.8-179.3-71.6178.2000113.3F294 F298 M423 S424 G425 L429 P430 L431F294-L427 HydrophobicContact CE2-CD1 3.75Å; F294-L427 HydrophobicContact CZ-CD1 3.89Å; F298-L427 HydrophobicContact CD2-CB 4.43Å; F298-L427 HydrophobicContact CE2-CB 3.87Å; M423-L427 PolarHBondContact O-N 3.4Å; M423-L427 VanDerWaalsContact O-N 3.1Å; S424-L427 PolarHBondContact O-N 2.95Å; S424-L427 VanDerWaalsContact O-N 3.12Å; G425-L427 PolarHBondContact O-N 2.03Å; L427-L429 VanDerWaalsContact C-N 3.34Å; L427-P430 VanDerWaalsContact O-CD 3.31Å; L427-P430 WeakPolarHBondContact O-CD 3.48Å; L427-P430 WeakPolarHBondContact O-CG 3.34Å; L427-L431 PolarHBondContact O-N 3.21Å
428A79.6Confident80.6Confident1 Ų151.2 Ų51.21%0.00825%0.246CC..Hα-helixtrans-67.8-33.8175.900000112A99 F298 S424 L431 H432A99-A428 HydrophobicContact CB-CB 3.93Å; F298-A428 HydrophobicContact CD2-CB 4.46Å; F298-A428 HydrophobicContact CE2-CB 4.44Å; S424-A428 VanDerWaalsContact O-CB 3.31Å; S424-A428 WeakPolarHBondContact O-CB 3.48Å; S424-A428 PolarHBondContact O-N 3.33Å; A428-L431 PolarHBondContact O-N 3.38Å; A428-H432 WeakPolarHBondContact O-CB 3.35Å; A428-H432 PolarHBondContact O-N 3.12Å
429L76Confident78.5Confident54 Ų5457.3 Ų57.328%0.28329%0.286SS..Hα-helixtrans-57.5-58.1177-70.1175.4000113.8A99 A100 L103 G425 L427 L431 H432 D433A99-L429 HydrophobicContact CB-CD2 3.98Å; A99-L429 HydrophobicContact CB-CG 4.25Å; A100-L429 HydrophobicContact CB-CD2 4.12Å; L103-L429 HydrophobicContact CD1-CD1 3.6Å; L103-L429 HydrophobicContact CD1-CG 4.33Å; G425-L429 PolarHBondContact O-N 3.1Å; L427-L429 VanDerWaalsContact C-N 3.34Å; L429-L431 VanDerWaalsContact C-N 3.28Å; L429-L431 PolarHBondContact O-N 3.37Å; L429-H432 PolarHBondContact O-N 3.27Å; L429-D433 PolarHBondContact O-N 3.13Å; L429-D433 VanDerWaalsContact O-N 3.1Å
430P79Confident77.7Confident71 Ų7157.1 Ų57.146%0.46128%0.284SS..Hα-helixtrans-67.1-29.4178.827-35.4000112.5F426 L427 F434F426-P430 WeakPolarHBondContact O-CD 3Å; L427-P430 VanDerWaalsContact O-CD 3.31Å; L427-P430 WeakPolarHBondContact O-CD 3.48Å; L427-P430 WeakPolarHBondContact O-CG 3.34Å; P430-F434 WeakPolarHBondContact O-CB 3.07Å; P430-F434 PolarHBondContact O-N 3.31Å
431L74.2Confident76.8Confident31 Ų3160.1 Ų60.116%0.16230%0.299CS..Hα-helixtrans-65-46.4174.4179.266.3000111F298 L303 L361 L427 A428 L429 D433 F434 L435F298-L431 HydrophobicContact CE1-CD2 3.48Å; F298-L431 VanDerWaalsContact CE1-CD2 3.48Å; F298-L431 HydrophobicContact CE2-CD2 4.39Å; F298-L431 HydrophobicContact CZ-CB 4.32Å; F298-L431 HydrophobicContact CZ-CD2 3.3Å; F298-L431 HydrophobicContact CZ-CG 4.36Å; L303-L431 HydrophobicContact CD2-CD2 4.11Å; L361-L431 HydrophobicContact CD1-CD2 4.47Å; L427-L431 PolarHBondContact O-N 3.21Å; A428-L431 PolarHBondContact O-N 3.38Å; L429-L431 VanDerWaalsContact C-N 3.28Å; L429-L431 PolarHBondContact O-N 3.37Å; L431-D433 VanDerWaalsContact C-N 3.34Å; L431-D433 PolarHBondContact O-N 3.47Å; L431-F434 WeakPolarHBondContact O-CB 3.39Å; L431-F434 PolarHBondContact O-N 3.48Å; L431-L435 HydrophobicContact CD1-CD1 3.82Å; L431-L435 HydrophobicContact CD1-CG 4.02Å; L431-L435 HydrophobicContact CD2-CD1 4.14Å; L431-L435 HydrophobicContact CG-CD1 3.7Å; L431-L435 HydrophobicContact CG-CG 4.26Å; L431-L435 WeakPolarHBondContact O-CB 3.24Å; L431-L435 WeakPolarHBondContact O-CG 3.32Å; L431-L435 PolarHBondContact O-N 3.22Å
432H70.1Confident76Confident20 Ų2063.1 Ų63.19%0.09331%0.314CS..Hα-helixtrans-57.9-48.2176.3178.6-87.2000110.5A428 L429 F434 L435 C436A428-H432 WeakPolarHBondContact O-CB 3.35Å; A428-H432 PolarHBondContact O-N 3.12Å; L429-H432 PolarHBondContact O-N 3.27Å; H432-F434 VanDerWaalsContact C-N 3.29Å; H432-F434 PolarHBondContact O-N 3.16Å; H432-L435 PolarHBondContact O-N 3.36Å; H432-C436 PolarHBondContact CE1-SG 2.76Å; H432-C436 WeakPolarHBondContact O-CB 3.07Å; H432-C436 PolarHBondContact O-N 2.86Å; H432-C436 PolarHBondContact O-SG 2.96Å
433D72.9Confident75.1Confident89 Ų8966.6 Ų66.648%0.47633%0.331SS..Hα-helixtrans-59.6-38.2176.5-78.8-3.4000113L429 L431 R437L429-D433 PolarHBondContact O-N 3.13Å; L429-D433 VanDerWaalsContact O-N 3.1Å; L431-D433 VanDerWaalsContact C-N 3.34Å; L431-D433 PolarHBondContact O-N 3.47Å; D433-R437 VanDerWaalsContact O-CG 3.28Å; D433-R437 WeakPolarHBondContact O-CG 3.49Å; D433-R437 PolarHBondContact O-N 3.05Å
434F76.3Confident74.1Confident112 Ų11265.4 Ų65.449%0.49133%0.325SS..Hα-helixtrans-66.5-47.4175.8176.1-98.2000111.8P430 L431 H432 R437 F438P430-F434 WeakPolarHBondContact O-CB 3.07Å; P430-F434 PolarHBondContact O-N 3.31Å; L431-F434 WeakPolarHBondContact O-CB 3.39Å; L431-F434 PolarHBondContact O-N 3.48Å; H432-F434 VanDerWaalsContact C-N 3.29Å; H432-F434 PolarHBondContact O-N 3.16Å; F434-R437 PolarHBondContact O-N 3.12Å; F434-F438 AromaticContact CE1-CD2 3.94Å; F434-F438 HydrophobicContact CE1-CD2 3.94Å; F434-F438 HydrophobicContact CE1-CE2 4.35Å; F434-F438 AromaticContact CZ-CD2 3.9Å; F434-F438 HydrophobicContact CZ-CD2 3.9Å; F434-F438 HydrophobicContact CZ-CE2 4.13Å; F434-F438 PolarHBondContact O-N 2.96Å; F434-F438 VanDerWaalsContact O-N 3.16Å
435L69.4Low73Confident3 Ų369.7 Ų69.72%0.01635%0.347CS..Hα-helixtrans-68.8-35.2-178.4-68.8173.3000112.3L306 F365 L431 H432 R437 F438L306-L435 HydrophobicContact CD1-CB 4.45Å; L306-L435 HydrophobicContact CD1-CD1 3.3Å; L306-L435 HydrophobicContact CD1-CG 4.45Å; F365-L435 HydrophobicContact CE1-CD2 3.64Å; F365-L435 HydrophobicContact CZ-CD2 3.78Å; L431-L435 HydrophobicContact CD1-CD1 3.82Å; L431-L435 HydrophobicContact CD1-CG 4.02Å; L431-L435 HydrophobicContact CD2-CD1 4.14Å; L431-L435 HydrophobicContact CG-CD1 3.7Å; L431-L435 HydrophobicContact CG-CG 4.26Å; L431-L435 WeakPolarHBondContact O-CB 3.24Å; L431-L435 WeakPolarHBondContact O-CG 3.32Å; L431-L435 PolarHBondContact O-N 3.22Å; H432-L435 PolarHBondContact O-N 3.36Å; L435-R437 PolarHBondContact O-N 3.32Å; L435-F438 WeakPolarHBondContact O-CB 3.28Å; L435-F438 PolarHBondContact O-N 3.03Å; L435-F438 VanDerWaalsContact O-N 3.09Å
436C66.6Low72.2Confident31 Ų3174.7 Ų74.721%0.20937%0.372CS..Hα-helixtrans-68.5-22.9174.7-64.60000113.2S89 C93 H432S89-C436 WeakPolarHBondContact CB-O 3.34Å; C93-C436 HydrophobicContact CB-CB 4.02Å; C93-C436 WeakPolarHBondContact CB-SG 3.34Å; C93-C436 VanDerWaalsContact SG-CA 3.58Å; C93-C436 WeakPolarHBondContact SG-CB 3.34Å; C93-C436 CovalentContact SG-SG 2.03Å; C93-C436 PolarHBondContact SG-SG 3.48Å; H432-C436 PolarHBondContact CE1-SG 2.76Å; H432-C436 WeakPolarHBondContact O-CB 3.07Å; H432-C436 PolarHBondContact O-N 2.86Å; H432-C436 PolarHBondContact O-SG 2.96Å
437R65.6Low71.2Confident206 Ų20671.5 Ų71.578%0.77736%0.361SS*.THydrogen-bonded Turntrans-90.3-7.5172.8-67.5175.9-167.9-179.57.4112.8D433 F434 L435D433-R437 VanDerWaalsContact O-CG 3.28Å; D433-R437 WeakPolarHBondContact O-CG 3.49Å; D433-R437 PolarHBondContact O-N 3.05Å; F434-R437 PolarHBondContact O-N 3.12Å; L435-R437 PolarHBondContact O-N 3.32Å
438F61Low69.9Low93 Ų9370 Ų7041%0.40835%0.352SS..  trans-78.5127.2-177.9-154.1-89.9000110F434 L435F434-F438 AromaticContact CE1-CD2 3.94Å; F434-F438 HydrophobicContact CE1-CD2 3.94Å; F434-F438 HydrophobicContact CE1-CE2 4.35Å; F434-F438 AromaticContact CZ-CD2 3.9Å; F434-F438 HydrophobicContact CZ-CD2 3.9Å; F434-F438 HydrophobicContact CZ-CE2 4.13Å; F434-F438 PolarHBondContact O-N 2.96Å; F434-F438 VanDerWaalsContact O-N 3.16Å; L435-F438 WeakPolarHBondContact O-CB 3.28Å; L435-F438 PolarHBondContact O-N 3.03Å; L435-F438 VanDerWaalsContact O-N 3.09Å
439P48.3Very low69Low129 Ų12976.3 Ų76.384%0.83838%0.383SS*.  trans-73.30-175.628.7-33.5000114.6S88S88-P439 CarbonylContact O-C 3.47Å; S88-P439 VanDerWaalsContact O-CA 3.24Å; S88-P439 WeakPolarHBondContact O-CA 3.28Å

Retrieved 439 of 439 residues in 185.9 ms (Link to these results)