A0A096NAV7_PAPAN Loading...

5-hydroxytryptamine receptor 6

G-protein coupled receptor for 5-hydroxytryptamine (serotonin), a biogenic hormone that functions as a neurotransmitter, a hormone and a mitogen. Also has a high affinity for tricyclic psychotropic drugs. Ligand binding causes a conformation change that triggers signaling via guanine nucleotide-binding proteins (G proteins) and modulates the activity of downstream effectors. HTR6 is coupled to G(s) G alpha proteins and mediates activation of adenylate cyclase activity. Controls pyramidal neurons migration during corticogenesis, through the regulation of CDK5 activity. Is an activator of mTOR signaling.

AlphaFold DB (A0A2K5M0S3), UniProt , Accession A0A096NAV7, Species PAPAN (Papio anubis, Olive baboon), Gene HTR6, Length 440 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
1M39.3Very low37.7Very low245 Ų245133.1 Ų133.1100%1.20781%0.813SS**  0101.60-79.617217600107.3
2V37.7Very low37.3Very low139 Ų139132.2 Ų132.284%0.84281%0.808SS**PPolyproline II helixtrans-88.3130.9175.8174.70000106.5
3P37.9Very low37.3Very low119 Ų119128.7 Ų128.777%0.77379%0.789SS**PPolyproline II helixtrans-78.4126.3173.5-2.419.7000109.7
4E38.3Very low37.4Very low182 Ų182126.9 Ų126.985%0.8579%0.793SS**PPolyproline II helixtrans-57.5137.8169.2-76.4-102.4116.100111.5G6E4-G6 PolarHBondContact O-N 3.3Å
5P39.5Very low37.9Very low119 Ų119128.6 Ų128.677%0.77378%0.779SS**PPolyproline II helixtrans-77.2120170.229.8-28.6000110
6G36.9Very low38.1Very low59 Ų59124.4 Ų124.461%0.60877%0.77SS**PPolyproline II helixtrans-60.6159.317400000113E4 T8E4-G6 PolarHBondContact O-N 3.3Å; G6-T8 PolarHBondContact O-N 3.26Å
7P38Very low38.1Very low132 Ų132123.6 Ų123.686%0.85778%0.778SS**PPolyproline II helixtrans-64.4126.7-171.425.8-32.4000111A9P7-A9 PolarHBondContact O-N 3.42Å
8T38.3Very low38.6Very low130 Ų130119.2 Ų119.280%0.79876%0.76SS**  trans-63.992169.239.90000109.6G6 N10G6-T8 PolarHBondContact O-N 3.26Å; T8-N10 PolarHBondContact O-N 2.9Å
9A36.3Very low38.9Very low87 Ų87118.8 Ų118.872%0.71976%0.759SS**  trans-70.475.8166.400000109.6P7 S11P7-A9 PolarHBondContact O-N 3.42Å; A9-S11 PolarHBondContact O-N 3.18Å
10N36.5Very low39.7Very low150 Ų150118 Ų11880%0.80275%0.754SS**  trans-72.663.7160.1-95.8-5.5000108.9T8 T12T8-N10 PolarHBondContact O-N 2.9Å; N10-T12 PolarHBondContact O-N 2.92Å
11S36.4Very low40.4Very low102 Ų102115.1 Ų115.171%0.71374%0.737SS**  trans-77.682.1164.554.50000107.9A9A9-S11 PolarHBondContact O-N 3.18Å
12T32.6Very low41.3Very low122 Ų122107.4 Ų107.475%0.74871%0.712SS**  trans-57.5124.5155.737.40000106.9N10 A14N10-T12 PolarHBondContact O-N 2.92Å; T12-A14 PolarHBondContact O-N 2.83Å; T12-A14 VanDerWaalsContact O-N 3.08Å
13P37Very low42.5Very low87 Ų87104.3 Ų104.357%0.56570%0.695SS**  trans-63.5119.917522.5-27.2000107.2W15P13-W15 VanDerWaalsContact C-N 3.31Å; P13-W15 PolarHBondContact O-N 2.98Å
14A38.1Very low43.5Very low103 Ų103102.2 Ų102.285%0.85170%0.696SS**  trans-6393.4174.800000108.6T12 G16T12-A14 PolarHBondContact O-N 2.83Å; T12-A14 VanDerWaalsContact O-N 3.08Å; A14-G16 PolarHBondContact O-N 2.99Å
15W45.9Very low44.7Very low153 Ų15394.9 Ų94.958%0.5867%0.668SS**  trans-66.9104.4167.6-64.895000106.6P13 A17 P177P13-W15 VanDerWaalsContact C-N 3.31Å; P13-W15 PolarHBondContact O-N 2.98Å; W15-A17 PolarHBondContact O-N 3.14Å; W15-P177 HydrophobicContact CE3-CB 4.32Å; W15-P177 HydrophobicContact CH2-CB 3.53Å; W15-P177 HydrophobicContact CZ2-CB 4.34Å; W15-P177 HydrophobicContact CZ3-CB 3.52Å
16G41.3Very low46.7Very low61 Ų6192.2 Ų92.263%0.62965%0.653SS**  trans-47.1107.3-173.500000112A14 G18A14-G16 PolarHBondContact O-N 2.99Å; G16-G18 PolarHBondContact O-N 3.26Å
17A37.8Very low49Very low111 Ų11192.1 Ų92.192%0.91765%0.652SS**  trans-72.742.7164.500000110.6W15W15-A17 PolarHBondContact O-N 3.14Å
18G46Very low51.4Low44 Ų4496.4 Ų96.445%0.45465%0.651SS.*  trans-82.7148168.600000109.1G16G16-G18 PolarHBondContact O-N 3.26Å
19P46Very low53.7Low113 Ų11393.5 Ų93.573%0.73463%0.633SS**  trans-50.5155.217121.9-31.7000110.4S21 R91P19-S21 VanDerWaalsContact C-N 3.35Å; P19-S21 PolarHBondContact O-N 3.48Å; P19-R91 PolarHBondContact O-NH2 3.31Å
20P53.7Low56.3Low102 Ų10290.6 Ų90.666%0.66261%0.609SS**  trans-54.3102.8174.221.6-30.6000108.7A22P20-A22 PolarHBondContact O-N 2.96Å
21S55.7Low58.9Low57 Ų5785.9 Ų85.940%0.39959%0.591SS.*  trans-39.1130167.849.60000108.7P19 Y89 R91P19-S21 VanDerWaalsContact C-N 3.35Å; P19-S21 PolarHBondContact O-N 3.48Å; S21-Y89 WeakPolarHBondContact O-CD1 3.32Å; S21-Y89 WeakPolarHBondContact O-CE1 3.46Å; S21-R91 PolarHBondContact OG-NE 3.43Å; S21-R91 PolarHBondContact OG-NH2 2.88Å
22A58.2Low61.5Low83 Ų8383.6 Ų83.669%0.68658%0.578SS**  trans-45.2142.7176.800000110.4P20 G24P20-A22 PolarHBondContact O-N 2.96Å; A22-G24 PolarHBondContact O-N 3.04Å; A22-G24 VanDerWaalsContact O-N 3.1Å
23P60.9Low64.4Low74 Ų7479 Ų7948%0.48155%0.549SS..  trans-53.3122.8179.620.3-30.5000109.5G25 Y89P23-G25 VanDerWaalsContact C-N 3.25Å; P23-Y89 HydrophobicContact CB-CE1 4.4Å
24G59Low67.1Low76 Ų7677.9 Ų77.978%0.78454%0.542SS*.  trans-76.4-18176.800000112.2A22 L88A22-G24 PolarHBondContact O-N 3.04Å; A22-G24 VanDerWaalsContact O-N 3.1Å; G24-L88 PolarHBondContact N-O 2.7Å
25G64.9Low69.8Low27 Ų2777.6 Ų77.628%0.27853%0.53SS..SBendtrans-77.6142175.300000113.2P23 L88P23-G25 VanDerWaalsContact C-N 3.25Å; G25-L88 PolarHBondContact N-O 3.02Å
26S81Confident72Confident63 Ų6372.3 Ų72.344%0.44151%0.514SS..  trans-60.9139.9174.371.90000111.1W28 V29 A30S26-W28 PolarHBondContact O-N 3.21Å; S26-V29 WeakPolarHBondContact O-CB 3.25Å; S26-V29 PolarHBondContact O-N 3.43Å; S26-V29 VanDerWaalsContact OG-CG2 3.28Å; S26-V29 WeakPolarHBondContact OG-CG2 3.29Å; S26-V29 PolarHBondContact OG-N 2.84Å; S26-A30 PolarHBondContact O-N 2.86Å
27G85.2Confident74.6Confident57 Ų5770.4 Ų70.459%0.58849%0.49SS*.Hα-helixtrans-56.1-27178.900000113.6A30 A31G27-A30 PolarHBondContact O-N 3.09Å; G27-A31 WeakPolarHBondContact O-CB 3.33Å; G27-A31 PolarHBondContact O-N 3.16Å
28W87.8Confident77.4Confident222 Ų22268 Ų6884%0.84147%0.47SS*.Hα-helixtrans-65.8-39.4173.7-64.4106.8000113.2S26 A31 A32S26-W28 PolarHBondContact O-N 3.21Å; W28-A31 PolarHBondContact O-N 3.19Å; W28-A32 WeakPolarHBondContact O-CB 3.4Å; W28-A32 PolarHBondContact O-N 3.29Å
29V87.9Confident79.7Confident70 Ų7070.3 Ų70.342%0.42447%0.471SS..Hα-helixtrans-66.3-44.1175.4171.30000110.1S26 A31 A32 L33 L88S26-V29 WeakPolarHBondContact O-CB 3.25Å; S26-V29 PolarHBondContact O-N 3.43Å; S26-V29 VanDerWaalsContact OG-CG2 3.28Å; S26-V29 WeakPolarHBondContact OG-CG2 3.29Å; S26-V29 PolarHBondContact OG-N 2.84Å; V29-A31 PolarHBondContact O-N 3.24Å; V29-A32 PolarHBondContact O-N 3.06Å; V29-L33 HydrophobicContact CG1-CD1 3.98Å; V29-L33 HydrophobicContact CG1-CG 4.36Å; V29-L33 VanDerWaalsContact O-CG 3.31Å; V29-L33 WeakPolarHBondContact O-CG 3.46Å; V29-L33 PolarHBondContact O-N 2.9Å; V29-L88 HydrophobicContact CG1-CD2 4.26Å
30A89.7Confident82Confident25 Ų2564.9 Ų64.921%0.20744%0.436CS..Hα-helixtrans-59.3-46.717600000111.8S26 G27 A32 L33 C34 L88S26-A30 PolarHBondContact O-N 2.86Å; G27-A30 PolarHBondContact O-N 3.09Å; A30-A32 PolarHBondContact O-N 3.29Å; A30-L33 PolarHBondContact O-N 3.47Å; A30-C34 WeakPolarHBondContact O-CB 3.37Å; A30-C34 PolarHBondContact O-N 3.41Å; A30-C34 PolarHBondContact O-SG 3.41Å; A30-C34 VanDerWaalsContact O-SG 3.36Å; A30-L88 HydrophobicContact CB-CD1 3.62Å; A30-L88 HydrophobicContact CB-CD2 3.89Å; A30-L88 HydrophobicContact CB-CG 4.43Å
31A91.8Very high84Confident51 Ų5160.8 Ų60.842%0.42141%0.41SS..Hα-helixtrans-60.9-44.3176.900000112.2G27 W28 V29 C34 V35G27-A31 WeakPolarHBondContact O-CB 3.33Å; G27-A31 PolarHBondContact O-N 3.16Å; W28-A31 PolarHBondContact O-N 3.19Å; V29-A31 PolarHBondContact O-N 3.24Å; A31-C34 PolarHBondContact O-N 3.19Å; A31-V35 WeakPolarHBondContact O-CG2 3.28Å; A31-V35 PolarHBondContact O-N 2.76Å
32A91.6Very high85.9Confident55 Ų5561 Ų6146%0.45542%0.416SS..Hα-helixtrans-61.4-45.3178.100000112.2W28 V29 A30 V35 V36W28-A32 WeakPolarHBondContact O-CB 3.4Å; W28-A32 PolarHBondContact O-N 3.29Å; V29-A32 PolarHBondContact O-N 3.06Å; A30-A32 PolarHBondContact O-N 3.29Å; A32-V35 PolarHBondContact O-N 3.36Å; A32-V36 WeakPolarHBondContact O-CG2 3.21Å; A32-V36 PolarHBondContact O-N 2.91Å
33L92.1Very high87.5Confident26 Ų2658 Ų5814%0.13639%0.391CS..Hα-helixtrans-65-41.6178-65.2177000111.7V29 A30 V35 V36 I37 M84 W307V29-L33 HydrophobicContact CG1-CD1 3.98Å; V29-L33 HydrophobicContact CG1-CG 4.36Å; V29-L33 VanDerWaalsContact O-CG 3.31Å; V29-L33 WeakPolarHBondContact O-CG 3.46Å; V29-L33 PolarHBondContact O-N 2.9Å; A30-L33 PolarHBondContact O-N 3.47Å; L33-V35 VanDerWaalsContact C-N 3.32Å; L33-V35 PolarHBondContact O-N 2.95Å; L33-V36 PolarHBondContact O-N 3.26Å; L33-I37 VanDerWaalsContact O-CG1 3.26Å; L33-I37 WeakPolarHBondContact O-CG1 3.47Å; L33-I37 PolarHBondContact O-N 3.37Å; L33-M84 HydrophobicContact CB-CG 3.93Å; L33-M84 HydrophobicContact CB-SD 3.78Å; L33-M84 HydrophobicContact CD1-CB 4.38Å; L33-M84 HydrophobicContact CD1-CG 3.79Å; L33-W307 HydrophobicContact CB-CH2 4.3Å; L33-W307 HydrophobicContact CD1-CH2 4.31Å; L33-W307 HydrophobicContact CD1-CZ2 3.95Å; L33-W307 HydrophobicContact CD2-CD2 3.87Å; L33-W307 HydrophobicContact CD2-CE3 3.72Å; L33-W307 HydrophobicContact CD2-CH2 3.76Å; L33-W307 HydrophobicContact CD2-CZ2 3.89Å; L33-W307 HydrophobicContact CD2-CZ3 3.66Å; L33-W307 HydrophobicContact CG-CH2 4.34Å; L33-W307 HydrophobicContact CG-CZ2 4.4Å
34C94.3Very high89.2Confident62 Ų6254.5 Ų54.542%0.41937%0.368SS..Hα-helixtrans-58.8-41.7173.2-75.60000112.4A30 A31 I37 A38 M84A30-C34 WeakPolarHBondContact O-CB 3.37Å; A30-C34 PolarHBondContact O-N 3.41Å; A30-C34 PolarHBondContact O-SG 3.41Å; A30-C34 VanDerWaalsContact O-SG 3.36Å; A31-C34 PolarHBondContact O-N 3.19Å; C34-I37 PolarHBondContact O-N 2.88Å; C34-A38 WeakPolarHBondContact O-CB 3.41Å; C34-A38 PolarHBondContact O-N 3.35Å; C34-M84 VanDerWaalsContact SG-SD 3.66Å
35V94.3Very high90.9Very high98 Ų9853 Ų5359%0.59435%0.346SS*.Hα-helixtrans-63.7-43.8176.2169.70000111A31 A32 L33 I37 A38 L39A31-V35 WeakPolarHBondContact O-CG2 3.28Å; A31-V35 PolarHBondContact O-N 2.76Å; A32-V35 PolarHBondContact O-N 3.36Å; L33-V35 VanDerWaalsContact C-N 3.32Å; L33-V35 PolarHBondContact O-N 2.95Å; V35-I37 VanDerWaalsContact C-N 3.35Å; V35-I37 PolarHBondContact O-N 2.98Å; V35-A38 PolarHBondContact O-N 3.48Å; V35-L39 VanDerWaalsContact O-CB 3.23Å; V35-L39 WeakPolarHBondContact O-CB 3.49Å; V35-L39 PolarHBondContact O-N 2.84Å
36V93.2Very high92.2Very high42 Ų4254.9 Ų54.926%0.25535%0.349SS..Hα-helixtrans-61.4-43.6176.6171.40000111.2A32 L33 L39 T40A32-V36 WeakPolarHBondContact O-CG2 3.21Å; A32-V36 PolarHBondContact O-N 2.91Å; L33-V36 PolarHBondContact O-N 3.26Å; V36-L39 PolarHBondContact O-N 3.41Å; V36-T40 WeakPolarHBondContact O-CB 3.29Å; V36-T40 PolarHBondContact O-N 2.81Å; V36-T40 PolarHBondContact O-OG1 3.48Å
37I95.6Very high92.8Very high21 Ų2152.1 Ų52.111%0.10833%0.329CS..Hα-helixtrans-62-51177.6-70.4167.5000110.6L33 C34 V35 L39 T40 A41 G76 M80 P81 M84 W307L33-I37 VanDerWaalsContact O-CG1 3.26Å; L33-I37 WeakPolarHBondContact O-CG1 3.47Å; L33-I37 PolarHBondContact O-N 3.37Å; C34-I37 PolarHBondContact O-N 2.88Å; V35-I37 VanDerWaalsContact C-N 3.35Å; V35-I37 PolarHBondContact O-N 2.98Å; I37-L39 VanDerWaalsContact C-N 3.34Å; I37-L39 PolarHBondContact O-N 3.02Å; I37-T40 PolarHBondContact O-N 3.48Å; I37-A41 PolarHBondContact O-N 3.02Å; I37-G76 WeakPolarHBondContact CG2-O 3.25Å; I37-M80 HydrophobicContact CD1-CB 3.91Å; I37-M80 HydrophobicContact CG1-CB 3.6Å; I37-M80 HydrophobicContact CG1-CG 4.38Å; I37-M80 HydrophobicContact CG1-SD 3.88Å; I37-P81 HydrophobicContact CD1-CG 4.42Å; I37-P81 HydrophobicContact CG2-CG 4.41Å; I37-M84 HydrophobicContact CD1-CB 4.37Å; I37-M84 HydrophobicContact CD1-SD 4.02Å; I37-W307 HydrophobicContact CD1-CH2 4.49Å
38A95.7Very high93.2Very high61 Ų6150.8 Ų50.850%0.50431%0.309SS..Hα-helixtrans-61.6-42.6-179.900000111.7C34 V35 A41 A42C34-A38 WeakPolarHBondContact O-CB 3.41Å; C34-A38 PolarHBondContact O-N 3.35Å; V35-A38 PolarHBondContact O-N 3.48Å; A38-A41 PolarHBondContact O-N 3.5Å; A38-A42 WeakPolarHBondContact O-CB 3.38Å; A38-A42 PolarHBondContact O-N 3Å
39L94.4Very high93.4Very high91 Ų9143.5 Ų43.548%0.47629%0.288SS..Hα-helixtrans-62.6-46176.5-178.864.2000111.2V35 V36 I37 A41 A42 A43 T314V35-L39 VanDerWaalsContact O-CB 3.23Å; V35-L39 WeakPolarHBondContact O-CB 3.49Å; V35-L39 PolarHBondContact O-N 2.84Å; V36-L39 PolarHBondContact O-N 3.41Å; I37-L39 VanDerWaalsContact C-N 3.34Å; I37-L39 PolarHBondContact O-N 3.02Å; L39-A41 PolarHBondContact O-N 2.71Å; L39-A42 PolarHBondContact O-N 3.34Å; L39-A43 WeakPolarHBondContact O-CB 3.27Å; L39-A43 PolarHBondContact O-N 3.11Å; L39-T314 HydrophobicContact CD2-CG2 3.98Å; L39-T314 HydrophobicContact CG-CG2 4.23Å
40T94.9Very high93.5Very high0 Ų040.1 Ų40.10%027%0.268CS..Hα-helixtrans-57.7-49.9177.3-57.10000110.8V36 I37 N44 M80 T314V36-T40 WeakPolarHBondContact O-CB 3.29Å; V36-T40 PolarHBondContact O-N 2.81Å; V36-T40 PolarHBondContact O-OG1 3.48Å; I37-T40 PolarHBondContact O-N 3.48Å; T40-N44 WeakPolarHBondContact O-CB 3.24Å; T40-N44 PolarHBondContact O-N 3.05Å; T40-N44 VanDerWaalsContact O-N 3.13Å; T40-N44 PolarHBondContact O-ND2 3.34Å; T40-M80 HydrophobicContact CG2-CE 4.17Å; T40-T314 WeakPolarHBondContact OG1-CB 3.32Å; T40-T314 PolarHBondContact OG1-OG1 2.96Å
41A96Very high93.6Very high15 Ų1539.3 Ų39.312%0.12426%0.26CS..Hα-helixtrans-65.7-46.7-178.700000112.3I37 A38 L39 S45 L73 L77I37-A41 PolarHBondContact O-N 3.02Å; A38-A41 PolarHBondContact O-N 3.5Å; L39-A41 PolarHBondContact O-N 2.71Å; A41-S45 VanDerWaalsContact O-CB 3.22Å; A41-S45 WeakPolarHBondContact O-CB 3.29Å; A41-S45 PolarHBondContact O-N 3.18Å; A41-S45 PolarHBondContact O-OG 3.38Å; A41-L73 HydrophobicContact CB-CD1 3.98Å; A41-L77 HydrophobicContact CB-CD2 3.76Å; A41-L77 HydrophobicContact CB-CG 4.32Å
42A94.8Very high93.5Very high62 Ų6239.7 Ų39.751%0.51226%0.259SS..Hα-helixtrans-65-45.1-179.100000111.9A38 L39 S45 L46A38-A42 WeakPolarHBondContact O-CB 3.38Å; A38-A42 PolarHBondContact O-N 3Å; L39-A42 PolarHBondContact O-N 3.34Å; A42-S45 PolarHBondContact O-N 3.16Å; A42-L46 VanDerWaalsContact O-CB 3.28Å; A42-L46 WeakPolarHBondContact O-CB 3.45Å; A42-L46 PolarHBondContact O-N 3.12Å
43A93.2Very high93.3Very high20 Ų2040.3 Ų40.317%0.16526%0.257CS..Hα-helixtrans-69.3-43.2-176.500000112.3L39 L46 L47 P317L39-A43 WeakPolarHBondContact O-CB 3.27Å; L39-A43 PolarHBondContact O-N 3.11Å; A43-L46 PolarHBondContact O-N 3.46Å; A43-L47 PolarHBondContact O-N 3.42Å; A43-L47 VanDerWaalsContact O-N 3.14Å; A43-P317 HydrophobicContact CB-CB 3.55Å; A43-P317 HydrophobicContact CB-CG 3.9Å
44N95.6Very high93.1Very high0 Ų041 Ų410%026%0.26CS..Hα-helixtrans-65.3-43.4175.4-77.4-69.4000111.5T40 L46 L47 I48 F69 D72 L73 S313 P317T40-N44 WeakPolarHBondContact O-CB 3.24Å; T40-N44 PolarHBondContact O-N 3.05Å; T40-N44 VanDerWaalsContact O-N 3.13Å; T40-N44 PolarHBondContact O-ND2 3.34Å; N44-L46 PolarHBondContact O-N 2.98Å; N44-L47 PolarHBondContact O-N 3.37Å; N44-I48 VanDerWaalsContact O-CG1 3.3Å; N44-I48 WeakPolarHBondContact O-CG1 3.19Å; N44-I48 PolarHBondContact O-N 3.41Å; N44-F69 HydrophobicContact CB-CB 4.39Å; N44-F69 WeakPolarHBondContact OD1-CD1 3.5Å; N44-D72 WeakPolarHBondContact OD1-CB 3.49Å; N44-L73 HydrophobicContact CB-CB 4.21Å; N44-S313 PolarHBondContact ND2-O 2.91Å; N44-P317 HydrophobicContact CB-CG 4.35Å; N44-P317 VanDerWaalsContact CG-CG 3.46Å; N44-P317 VanDerWaalsContact OD1-CG 3.23Å; N44-P317 WeakPolarHBondContact OD1-CG 3.36Å
45S94.9Very high92.6Very high46 Ų4642.5 Ų42.532%0.32227%0.269SS..Hα-helixtrans-60.6-44.2176.2-59.40000112A41 A42 L47 I48 V49A41-S45 VanDerWaalsContact O-CB 3.22Å; A41-S45 WeakPolarHBondContact O-CB 3.29Å; A41-S45 PolarHBondContact O-N 3.18Å; A41-S45 PolarHBondContact O-OG 3.38Å; A42-S45 PolarHBondContact O-N 3.16Å; S45-L47 VanDerWaalsContact C-N 3.34Å; S45-L47 PolarHBondContact O-N 2.66Å; S45-I48 PolarHBondContact O-N 3.03Å; S45-V49 WeakPolarHBondContact O-CB 3.26Å; S45-V49 VanDerWaalsContact O-CG2 3.3Å; S45-V49 WeakPolarHBondContact O-CG2 3.45Å; S45-V49 PolarHBondContact O-N 3.42Å
46L92.9Very high92Very high66 Ų6642 Ų4235%0.34627%0.274SS..Hα-helixtrans-59.1-43.8177.7177.162.8000111.7A42 A43 N44 V49 L50 L331A42-L46 VanDerWaalsContact O-CB 3.28Å; A42-L46 WeakPolarHBondContact O-CB 3.45Å; A42-L46 PolarHBondContact O-N 3.12Å; A43-L46 PolarHBondContact O-N 3.46Å; N44-L46 PolarHBondContact O-N 2.98Å; L46-V49 PolarHBondContact O-N 2.87Å; L46-L50 VanDerWaalsContact O-CB 3.27Å; L46-L50 WeakPolarHBondContact O-CB 3.34Å; L46-L50 PolarHBondContact O-N 2.8Å; L46-L331 HydrophobicContact CD2-CD1 4Å
47L92.1Very high91.5Very high4 Ų440.3 Ų40.32%0.02126%0.264CS..Hα-helixtrans-70.2-37.2179.4-69.8-173.8000113.1A43 N44 S45 L50 I51 F69 P317 P321 F327A43-L47 PolarHBondContact O-N 3.42Å; A43-L47 VanDerWaalsContact O-N 3.14Å; N44-L47 PolarHBondContact O-N 3.37Å; S45-L47 VanDerWaalsContact C-N 3.34Å; S45-L47 PolarHBondContact O-N 2.66Å; L47-L50 HydrophobicContact CD2-CD2 4.25Å; L47-L50 PolarHBondContact O-N 3.05Å; L47-I51 WeakPolarHBondContact O-CG1 3.25Å; L47-I51 PolarHBondContact O-N 3.2Å; L47-F69 HydrophobicContact CB-CD2 3.79Å; L47-F69 HydrophobicContact CB-CE2 3.7Å; L47-F69 HydrophobicContact CB-CG 4.33Å; L47-F69 HydrophobicContact CB-CZ 4.17Å; L47-F69 HydrophobicContact CD1-CD1 4.35Å; L47-F69 HydrophobicContact CD1-CE1 3.71Å; L47-F69 HydrophobicContact CD1-CE2 3.9Å; L47-F69 HydrophobicContact CD1-CZ 3.47Å; L47-F69 VanDerWaalsContact CD1-CZ 3.47Å; L47-F69 HydrophobicContact CG-CE2 4.45Å; L47-F69 HydrophobicContact CG-CZ 4.47Å; L47-P317 HydrophobicContact CD1-CB 3.57Å; L47-P317 HydrophobicContact CD1-CG 4.18Å; L47-P317 HydrophobicContact CG-CB 4.34Å; L47-P321 HydrophobicContact CD2-CG 4.09Å; L47-F327 HydrophobicContact CD2-CD1 4.19Å
48I93.9Very high90.9Very high30 Ų3047.2 Ų47.215%0.15429%0.289CS..Hα-helixtrans-59.8-51.5172-66.6165.1000109.5N44 S45 L50 I51 C52 F69 L73N44-I48 VanDerWaalsContact O-CG1 3.3Å; N44-I48 WeakPolarHBondContact O-CG1 3.19Å; N44-I48 PolarHBondContact O-N 3.41Å; S45-I48 PolarHBondContact O-N 3.03Å; I48-L50 VanDerWaalsContact C-N 3.3Å; I48-L50 PolarHBondContact O-N 3.43Å; I48-I51 PolarHBondContact O-N 3.4Å; I48-C52 VanDerWaalsContact O-CB 3.32Å; I48-C52 WeakPolarHBondContact O-CB 3.39Å; I48-C52 PolarHBondContact O-N 3.3Å; I48-C52 PolarHBondContact O-SG 2.96Å; I48-F69 HydrophobicContact CD1-CB 3.88Å; I48-F69 HydrophobicContact CG1-CB 3.58Å; I48-F69 HydrophobicContact CG1-CD2 4.43Å; I48-F69 HydrophobicContact CG1-CG 4.47Å; I48-L73 HydrophobicContact CD1-CD2 4.29Å
49V92.4Very high90.4Very high68 Ų6847.8 Ų47.841%0.41228%0.283SS..Hα-helixtrans-58.9-42177.7171.30000110.9S45 L46 I51 C52 T53S45-V49 WeakPolarHBondContact O-CB 3.26Å; S45-V49 VanDerWaalsContact O-CG2 3.3Å; S45-V49 WeakPolarHBondContact O-CG2 3.45Å; S45-V49 PolarHBondContact O-N 3.42Å; L46-V49 PolarHBondContact O-N 2.87Å; V49-I51 PolarHBondContact O-N 3.39Å; V49-C52 PolarHBondContact O-N 3.06Å; V49-T53 HydrophobicContact CG1-CG2 3.88Å; V49-T53 VanDerWaalsContact O-CB 3.29Å; V49-T53 WeakPolarHBondContact O-CB 3.47Å; V49-T53 WeakPolarHBondContact O-CG2 3.44Å; V49-T53 PolarHBondContact O-N 3.25Å; V49-T53 PolarHBondContact O-OG1 3.46Å
50L90.3Very high90Very high0 Ų045 Ų450%027%0.27CS..Hα-helixtrans-61.8-45.5179.8-173.265.4000112.2L46 L47 I48 T53 Q54 L57 F327 A330 L331 F334L46-L50 VanDerWaalsContact O-CB 3.27Å; L46-L50 WeakPolarHBondContact O-CB 3.34Å; L46-L50 PolarHBondContact O-N 2.8Å; L47-L50 HydrophobicContact CD2-CD2 4.25Å; L47-L50 PolarHBondContact O-N 3.05Å; I48-L50 VanDerWaalsContact C-N 3.3Å; I48-L50 PolarHBondContact O-N 3.43Å; L50-T53 PolarHBondContact O-OG1 3.49Å; L50-Q54 HydrophobicContact CD1-CG 3.99Å; L50-Q54 VanDerWaalsContact O-CB 3.26Å; L50-Q54 WeakPolarHBondContact O-CB 3.37Å; L50-Q54 VanDerWaalsContact O-CG 3.24Å; L50-Q54 WeakPolarHBondContact O-CG 3.26Å; L50-Q54 PolarHBondContact O-N 2.92Å; L50-Q54 VanDerWaalsContact O-N 3.11Å; L50-L57 HydrophobicContact CD2-CD1 4.49Å; L50-L57 HydrophobicContact CG-CD1 4.06Å; L50-F327 HydrophobicContact CD2-CD1 4.35Å; L50-A330 HydrophobicContact CD1-CB 3.92Å; L50-A330 HydrophobicContact CD2-CB 3.98Å; L50-A330 HydrophobicContact CG-CB 4.06Å; L50-L331 HydrophobicContact CD2-CB 4.26Å; L50-F334 HydrophobicContact CD1-CB 4.16Å; L50-F334 HydrophobicContact CD1-CD2 3.62Å; L50-F334 HydrophobicContact CD1-CE2 4.24Å; L50-F334 HydrophobicContact CD1-CG 4.02Å
51I91.1Very high89.6Confident7 Ų745.3 Ų45.34%0.03627%0.272CS..Hα-helixtrans-67.3-43.7177.4-64.3167.5000110.5L47 I48 V49 T53 N62 L65 V66 F69 F327L47-I51 WeakPolarHBondContact O-CG1 3.25Å; L47-I51 PolarHBondContact O-N 3.2Å; I48-I51 PolarHBondContact O-N 3.4Å; V49-I51 PolarHBondContact O-N 3.39Å; I51-T53 VanDerWaalsContact C-N 3.35Å; I51-T53 PolarHBondContact O-N 3.41Å; I51-N62 HydrophobicContact CG2-CB 4.12Å; I51-L65 HydrophobicContact CD1-CB 4.15Å; I51-V66 HydrophobicContact CB-CG2 4.06Å; I51-V66 HydrophobicContact CD1-CG2 3.8Å; I51-V66 HydrophobicContact CG2-CG2 3.72Å; I51-F69 HydrophobicContact CD1-CD2 4.2Å; I51-F69 HydrophobicContact CD1-CE2 3.86Å; I51-F327 HydrophobicContact CD1-CE1 3.72Å; I51-F327 HydrophobicContact CD1-CZ 3.63Å; I51-F327 HydrophobicContact CG1-CE1 3.59Å; I51-F327 HydrophobicContact CG1-CZ 3.74Å
52C89.8Confident89.3Confident60 Ų6045 Ų4541%0.40527%0.269SS..Hα-helixtrans-67-35.9-178.5-71.80000111.9I48 V49 R58I48-C52 VanDerWaalsContact O-CB 3.32Å; I48-C52 WeakPolarHBondContact O-CB 3.39Å; I48-C52 PolarHBondContact O-N 3.3Å; I48-C52 PolarHBondContact O-SG 2.96Å; V49-C52 PolarHBondContact O-N 3.06Å; C52-R58 VanDerWaalsContact O-CZ 3.23Å; C52-R58 PolarHBondContact O-NE 3.21Å; C52-R58 PolarHBondContact O-NH2 3.21Å
53T88.7Confident89.1Confident67 Ų6746.6 Ų46.641%0.41126%0.264SS..Hα-helixtrans-84.1-30.7-177.354.90000113.4V49 L50 I51 P55V49-T53 HydrophobicContact CG1-CG2 3.88Å; V49-T53 VanDerWaalsContact O-CB 3.29Å; V49-T53 WeakPolarHBondContact O-CB 3.47Å; V49-T53 WeakPolarHBondContact O-CG2 3.44Å; V49-T53 PolarHBondContact O-N 3.25Å; V49-T53 PolarHBondContact O-OG1 3.46Å; L50-T53 PolarHBondContact O-OG1 3.49Å; I51-T53 VanDerWaalsContact C-N 3.35Å; I51-T53 PolarHBondContact O-N 3.41Å; T53-P55 VanDerWaalsContact O-CD 3.29Å; T53-P55 WeakPolarHBondContact O-CD 3.16Å
54Q87.1Confident89.1Confident42 Ų4245.8 Ų45.820%0.19626%0.257CS..  trans-93.4109.9-175-64.9-69.2-34.200111.5L50 A56 L57 A330L50-Q54 HydrophobicContact CD1-CG 3.99Å; L50-Q54 VanDerWaalsContact O-CB 3.26Å; L50-Q54 WeakPolarHBondContact O-CB 3.37Å; L50-Q54 VanDerWaalsContact O-CG 3.24Å; L50-Q54 WeakPolarHBondContact O-CG 3.26Å; L50-Q54 PolarHBondContact O-N 2.92Å; L50-Q54 VanDerWaalsContact O-N 3.11Å; Q54-A56 PolarHBondContact O-N 2.88Å; Q54-A56 VanDerWaalsContact O-N 3.16Å; Q54-L57 HydrophobicContact CB-CB 4.26Å; Q54-L57 HydrophobicContact CB-CD1 4.06Å; Q54-L57 HydrophobicContact CB-CG 4.07Å; Q54-L57 HydrophobicContact CG-CD1 4.47Å; Q54-L57 PolarHBondContact O-N 3.23Å; Q54-A330 HydrophobicContact CG-CB 4.48Å
55P84.6Confident88.9Confident93 Ų9345.8 Ų45.860%0.60426%0.257SS*.G310 helixtrans-60-31178.6-22.734.8000112.6T53 L57 R58T53-P55 VanDerWaalsContact O-CD 3.29Å; T53-P55 WeakPolarHBondContact O-CD 3.16Å; P55-L57 PolarHBondContact O-N 2.81Å; P55-R58 PolarHBondContact O-N 3.04Å
56A81.3Confident88.9Confident86 Ų8645.4 Ų45.471%0.71125%0.252SS*.G310 helixtrans-61.9-21.5176.400000113.7Q54Q54-A56 PolarHBondContact O-N 2.88Å; Q54-A56 VanDerWaalsContact O-N 3.16Å
57L81.3Confident89.1Confident8 Ų842.7 Ų42.74%0.04224%0.239CC..G310 helixtrans-100.1-1.9176.9-63-179.9000112.6L50 Q54 P55 N59 N62 D326 A330L50-L57 HydrophobicContact CD2-CD1 4.49Å; L50-L57 HydrophobicContact CG-CD1 4.06Å; Q54-L57 HydrophobicContact CB-CB 4.26Å; Q54-L57 HydrophobicContact CB-CD1 4.06Å; Q54-L57 HydrophobicContact CB-CG 4.07Å; Q54-L57 HydrophobicContact CG-CD1 4.47Å; Q54-L57 PolarHBondContact O-N 3.23Å; P55-L57 PolarHBondContact O-N 2.81Å; L57-N59 VanDerWaalsContact C-N 3.34Å; L57-N59 PolarHBondContact O-N 2.9Å; L57-N62 WeakPolarHBondContact O-CB 3.48Å; L57-N62 PolarHBondContact O-ND2 3.02Å; L57-D326 HydrophobicContact CD2-CB 4.02Å; L57-A330 HydrophobicContact CD1-CB 3.65Å; L57-A330 HydrophobicContact CG-CB 4.36Å
58R83.8Confident89.2Confident166 Ų16642.5 Ų42.563%0.62624%0.238SC*.  trans-82.779.2179.8-66.7-177.5-177.4174.8-2.7110.8C52 P55C52-R58 VanDerWaalsContact O-CZ 3.23Å; C52-R58 PolarHBondContact O-NE 3.21Å; C52-R58 PolarHBondContact O-NH2 3.21Å; P55-R58 PolarHBondContact O-N 3.04Å
59N85.4Confident89.3Confident72 Ų7241 Ų4139%0.38523%0.231SC..SBendtrans-121163.5174.870.940.2000111.3L57 S61 N62 F63L57-N59 VanDerWaalsContact C-N 3.34Å; L57-N59 PolarHBondContact O-N 2.9Å; N59-S61 VanDerWaalsContact C-N 3.27Å; N59-S61 PolarHBondContact O-N 3.45Å; N59-S61 WeakPolarHBondContact OD1-CB 3.28Å; N59-S61 PolarHBondContact OD1-N 2.91Å; N59-S61 VanDerWaalsContact OD1-N 3.13Å; N59-N62 PolarHBondContact ND2-ND2 3.03Å; N59-N62 PolarHBondContact O-N 3.44Å; N59-N62 VanDerWaalsContact O-N 3.12Å; N59-N62 WeakPolarHBondContact OD1-CB 3.35Å; N59-N62 PolarHBondContact OD1-N 3.32Å; N59-N62 PolarHBondContact OD1-OD1 3.28Å; N59-F63 WeakPolarHBondContact O-CD2 3.41Å
60T85.5Confident89.5Confident32 Ų3240.2 Ų40.220%0.19623%0.226CC..Hα-helixtrans-59-35.5-177.2-43.30000113.3N62 F63 M138 A143T60-N62 VanDerWaalsContact C-N 3.31Å; T60-N62 PolarHBondContact O-N 3.35Å; T60-F63 PolarHBondContact O-N 3.14Å; T60-M138 HydrophobicContact CG2-CE 4.36Å; T60-M138 HydrophobicContact CG2-CG 3.94Å; T60-A143 HydrophobicContact CG2-CB 3.72Å
61S86.1Confident89.7Confident7 Ų740.2 Ų40.25%0.04923%0.226CC..Hα-helixtrans-67.8-32.3179.8-1740000111.8N59 F63 F64 D123 R124N59-S61 VanDerWaalsContact C-N 3.27Å; N59-S61 PolarHBondContact O-N 3.45Å; N59-S61 WeakPolarHBondContact OD1-CB 3.28Å; N59-S61 PolarHBondContact OD1-N 2.91Å; N59-S61 VanDerWaalsContact OD1-N 3.13Å; S61-F63 VanDerWaalsContact C-N 3.28Å; S61-F63 PolarHBondContact O-N 3.44Å; S61-F64 PolarHBondContact O-N 3.42Å; S61-D123 WeakPolarHBondContact CB-OD2 3.3Å; S61-D123 PolarHBondContact OG-OD2 3.49Å; S61-R124 VanDerWaalsContact OG-CZ 3.23Å; S61-R124 PolarHBondContact OG-NH1 2.98Å; S61-R124 PolarHBondContact OG-NH2 2.92Å
62N89.8Confident90Very high9 Ų939.9 Ų39.95%0.04822%0.224CC..Hα-helixtrans-76-12.8-178.4-71.1-0.6000113I51 L57 N59 T60 F64 L65 V66I51-N62 HydrophobicContact CG2-CB 4.12Å; L57-N62 WeakPolarHBondContact O-CB 3.48Å; L57-N62 PolarHBondContact O-ND2 3.02Å; N59-N62 PolarHBondContact ND2-ND2 3.03Å; N59-N62 PolarHBondContact O-N 3.44Å; N59-N62 VanDerWaalsContact O-N 3.12Å; N59-N62 WeakPolarHBondContact OD1-CB 3.35Å; N59-N62 PolarHBondContact OD1-N 3.32Å; N59-N62 PolarHBondContact OD1-OD1 3.28Å; T60-N62 VanDerWaalsContact C-N 3.31Å; T60-N62 PolarHBondContact O-N 3.35Å; N62-F64 VanDerWaalsContact C-N 3.31Å; N62-F64 PolarHBondContact O-N 2.83Å; N62-L65 PolarHBondContact O-N 3.36Å; N62-L65 WeakPolarHBondContact OD1-CD1 3.32Å; N62-V66 WeakPolarHBondContact O-CG2 3.44Å; N62-V66 PolarHBondContact O-N 3.3Å
63F91.5Very high90.3Very high95 Ų9538.6 Ų38.642%0.41721%0.213SC..Hα-helixtrans-61.9-39.8168.4-78-96.4000111.7N59 T60 S61 L65 V66 S67N59-F63 WeakPolarHBondContact O-CD2 3.41Å; T60-F63 PolarHBondContact O-N 3.14Å; S61-F63 VanDerWaalsContact C-N 3.28Å; S61-F63 PolarHBondContact O-N 3.44Å; F63-L65 VanDerWaalsContact C-N 3.31Å; F63-L65 PolarHBondContact O-N 2.66Å; F63-V66 PolarHBondContact O-N 2.81Å; F63-S67 PolarHBondContact O-N 3.44Å
64F93.3Very high90.7Very high3 Ų337.9 Ų37.91%0.01321%0.206CC..Hα-helixtrans-66.2-35176.2-60.1-61.9000112.2S61 N62 S67 L68 L119 I120 D123 M138 A143 L146 V147S61-F64 PolarHBondContact O-N 3.42Å; N62-F64 VanDerWaalsContact C-N 3.31Å; N62-F64 PolarHBondContact O-N 2.83Å; F64-S67 PolarHBondContact O-N 3.27Å; F64-L68 WeakPolarHBondContact O-CB 3.45Å; F64-L68 PolarHBondContact O-N 3.41Å; F64-L119 HydrophobicContact CD1-CB 3.87Å; F64-L119 HydrophobicContact CD1-CD1 4.12Å; F64-L119 HydrophobicContact CE1-CB 3.99Å; F64-L119 HydrophobicContact CE1-CD1 4.04Å; F64-L119 HydrophobicContact CE1-CG 4.45Å; F64-I120 HydrophobicContact CB-CD1 4.5Å; F64-I120 HydrophobicContact CB-CG1 3.65Å; F64-D123 HydrophobicContact CD2-CB 3.95Å; F64-D123 HydrophobicContact CE2-CB 3.8Å; F64-D123 WeakPolarHBondContact CE2-OD1 3.41Å; F64-M138 HydrophobicContact CE1-CE 4.46Å; F64-M138 HydrophobicContact CE2-CE 3.4Å; F64-M138 VanDerWaalsContact CE2-CE 3.4Å; F64-M138 HydrophobicContact CZ-CE 3.21Å; F64-A143 HydrophobicContact CZ-CB 4.22Å; F64-L146 HydrophobicContact CE1-CB 4.18Å; F64-L146 HydrophobicContact CE1-CD1 4.47Å; F64-L146 HydrophobicContact CZ-CD1 4.13Å; F64-V147 HydrophobicContact CD1-CG2 3.75Å; F64-V147 HydrophobicContact CE1-CG2 4.04Å
65L92.3Very high91.1Very high1 Ų135.9 Ų35.91%0.00520%0.196CC..Hα-helixtrans-67.5-44.1174.7-64.6179.4000111.7I51 N62 F63 S67 L68 F69 I120 Y320 F327I51-L65 HydrophobicContact CD1-CB 4.15Å; N62-L65 PolarHBondContact O-N 3.36Å; N62-L65 WeakPolarHBondContact OD1-CD1 3.32Å; F63-L65 VanDerWaalsContact C-N 3.31Å; F63-L65 PolarHBondContact O-N 2.66Å; L65-S67 VanDerWaalsContact C-N 3.31Å; L65-S67 PolarHBondContact O-N 3.27Å; L65-L68 WeakPolarHBondContact O-CB 3.43Å; L65-L68 PolarHBondContact O-N 2.91Å; L65-F69 HydrophobicContact CB-CD2 4.48Å; L65-F69 HydrophobicContact CB-CE2 3.93Å; L65-F69 HydrophobicContact CB-CZ 4.39Å; L65-F69 WeakPolarHBondContact O-CD2 3.44Å; L65-F69 VanDerWaalsContact O-CG 3.24Å; L65-F69 WeakPolarHBondContact O-CG 3.2Å; L65-F69 PolarHBondContact O-N 3.4Å; L65-I120 HydrophobicContact CD2-CD1 3.9Å; L65-I120 HydrophobicContact CD2-CG1 4.46Å; L65-Y320 HydrophobicContact CD2-CD1 3.93Å; L65-Y320 HydrophobicContact CD2-CE1 3.3Å; L65-Y320 HydrophobicContact CD2-CE2 4.13Å; L65-Y320 VanDerWaalsContact CD2-CZ 3.42Å; L65-F327 HydrophobicContact CD1-CE2 3.58Å; L65-F327 HydrophobicContact CD1-CZ 3.56Å
66V94.5Very high91.6Very high37 Ų3731.4 Ų31.422%0.22417%0.167CC..Hα-helixtrans-60.5-43.4175.3172.20000110.6I51 N62 F63 F69 T70I51-V66 HydrophobicContact CB-CG2 4.06Å; I51-V66 HydrophobicContact CD1-CG2 3.8Å; I51-V66 HydrophobicContact CG2-CG2 3.72Å; N62-V66 WeakPolarHBondContact O-CG2 3.44Å; N62-V66 PolarHBondContact O-N 3.3Å; F63-V66 PolarHBondContact O-N 2.81Å; V66-F69 PolarHBondContact O-N 2.75Å; V66-T70 WeakPolarHBondContact O-CB 3.35Å; V66-T70 PolarHBondContact O-N 3.13Å; V66-T70 PolarHBondContact O-OG1 3.12Å
67S95.8Very high92.3Very high9 Ų932.2 Ų32.26%0.06316%0.159CC..Hα-helixtrans-59.9-45.9174.9-177.20000112.1F63 F64 L65 T70 S71 N116 V147 W151F63-S67 PolarHBondContact O-N 3.44Å; F64-S67 PolarHBondContact O-N 3.27Å; L65-S67 VanDerWaalsContact C-N 3.31Å; L65-S67 PolarHBondContact O-N 3.27Å; S67-T70 WeakPolarHBondContact O-CB 3.45Å; S67-T70 PolarHBondContact O-N 3.09Å; S67-S71 PolarHBondContact O-N 3.27Å; S67-S71 PolarHBondContact O-OG 2.97Å; S67-N116 VanDerWaalsContact CB-OD1 3.26Å; S67-N116 WeakPolarHBondContact CB-OD1 3.43Å; S67-N116 VanDerWaalsContact OG-CG 3.25Å; S67-N116 PolarHBondContact OG-ND2 3.3Å; S67-N116 PolarHBondContact OG-OD1 3.26Å; S67-V147 VanDerWaalsContact OG-CG1 3.28Å; S67-V147 WeakPolarHBondContact OG-CG1 3.4Å; S67-W151 PolarHBondContact OG-NE1 3.23Å
68L94.4Very high92.9Very high0 Ų034.5 Ų34.50%017%0.173CC..Hα-helixtrans-57.9-52.6175.9179.769.4000111.8F64 L65 T70 S71 D72 S113 N116 L117 I120 Y320F64-L68 WeakPolarHBondContact O-CB 3.45Å; F64-L68 PolarHBondContact O-N 3.41Å; L65-L68 WeakPolarHBondContact O-CB 3.43Å; L65-L68 PolarHBondContact O-N 2.91Å; L68-T70 PolarHBondContact O-N 3Å; L68-S71 PolarHBondContact O-N 3.11Å; L68-S71 VanDerWaalsContact O-N 3.14Å; L68-S71 PolarHBondContact O-OG 2.96Å; L68-D72 PolarHBondContact O-N 3.4Å; L68-S113 WeakPolarHBondContact CD1-OG 3.5Å; L68-N116 HydrophobicContact CB-CB 4.14Å; L68-N116 HydrophobicContact CD1-CB 4.01Å; L68-L117 HydrophobicContact CD1-CD2 4.05Å; L68-L117 HydrophobicContact CD1-CG 3.94Å; L68-L117 HydrophobicContact CD2-CD2 3.88Å; L68-I120 HydrophobicContact CB-CD1 4.11Å; L68-I120 HydrophobicContact CD2-CD1 3.71Å; L68-I120 HydrophobicContact CG-CD1 4.42Å; L68-Y320 HydrophobicContact CD2-CE2 3.76Å; L68-Y320 WeakPolarHBondContact CD2-OH 3.29Å
69F95.7Very high93.5Very high0 Ų026.6 Ų26.60%014%0.144CC..Hα-helixtrans-63.2-29179-58.7-38.3000112.4N44 L47 I48 I51 L65 V66 L73 Y320N44-F69 HydrophobicContact CB-CB 4.39Å; N44-F69 WeakPolarHBondContact OD1-CD1 3.5Å; L47-F69 HydrophobicContact CB-CD2 3.79Å; L47-F69 HydrophobicContact CB-CE2 3.7Å; L47-F69 HydrophobicContact CB-CG 4.33Å; L47-F69 HydrophobicContact CB-CZ 4.17Å; L47-F69 HydrophobicContact CD1-CD1 4.35Å; L47-F69 HydrophobicContact CD1-CE1 3.71Å; L47-F69 HydrophobicContact CD1-CE2 3.9Å; L47-F69 HydrophobicContact CD1-CZ 3.47Å; L47-F69 VanDerWaalsContact CD1-CZ 3.47Å; L47-F69 HydrophobicContact CG-CE2 4.45Å; L47-F69 HydrophobicContact CG-CZ 4.47Å; I48-F69 HydrophobicContact CD1-CB 3.88Å; I48-F69 HydrophobicContact CG1-CB 3.58Å; I48-F69 HydrophobicContact CG1-CD2 4.43Å; I48-F69 HydrophobicContact CG1-CG 4.47Å; I51-F69 HydrophobicContact CD1-CD2 4.2Å; I51-F69 HydrophobicContact CD1-CE2 3.86Å; L65-F69 HydrophobicContact CB-CD2 4.48Å; L65-F69 HydrophobicContact CB-CE2 3.93Å; L65-F69 HydrophobicContact CB-CZ 4.39Å; L65-F69 WeakPolarHBondContact O-CD2 3.44Å; L65-F69 VanDerWaalsContact O-CG 3.24Å; L65-F69 WeakPolarHBondContact O-CG 3.2Å; L65-F69 PolarHBondContact O-N 3.4Å; V66-F69 PolarHBondContact O-N 2.75Å; F69-L73 WeakPolarHBondContact O-CB 3.24Å; F69-L73 PolarHBondContact O-N 3.1Å; F69-Y320 AromaticContact CE1-CD2 3.51Å; F69-Y320 HydrophobicContact CE1-CD2 3.51Å; F69-Y320 AromaticContact CE1-CE2 3.7Å; F69-Y320 HydrophobicContact CE1-CE2 3.7Å; F69-Y320 AromaticContact CZ-CD2 3.46Å; F69-Y320 HydrophobicContact CZ-CD2 3.46Å; F69-Y320 VanDerWaalsContact CZ-CD2 3.46Å; F69-Y320 AromaticContact CZ-CE2 3.89Å; F69-Y320 HydrophobicContact CZ-CE2 3.89Å; F69-Y320 HydrophobicContact CZ-CG 4.08Å
70T96.3Very high93.9Very high51 Ų5123.2 Ų23.231%0.31313%0.125SC..Hα-helixtrans-69.8-45.2174.5-57.10000110.8V66 S67 L68 L73 M74 W151V66-T70 WeakPolarHBondContact O-CB 3.35Å; V66-T70 PolarHBondContact O-N 3.13Å; V66-T70 PolarHBondContact O-OG1 3.12Å; S67-T70 WeakPolarHBondContact O-CB 3.45Å; S67-T70 PolarHBondContact O-N 3.09Å; L68-T70 PolarHBondContact O-N 3Å; T70-L73 PolarHBondContact O-N 3.43Å; T70-M74 WeakPolarHBondContact O-CG 3.48Å; T70-M74 PolarHBondContact O-N 3.19Å; T70-W151 HydrophobicContact CG2-CH2 4.46Å; T70-W151 HydrophobicContact CG2-CZ2 4.3Å
71S96.4Very high94.3Very high0 Ų023.5 Ų23.50%013%0.128CC..Hα-helixtrans-62.4-41.4173.350.80000112.4S67 L68 L73 M74 V75 S113S67-S71 PolarHBondContact O-N 3.27Å; S67-S71 PolarHBondContact O-OG 2.97Å; L68-S71 PolarHBondContact O-N 3.11Å; L68-S71 VanDerWaalsContact O-N 3.14Å; L68-S71 PolarHBondContact O-OG 2.96Å; S71-L73 PolarHBondContact O-N 2.95Å; S71-M74 WeakPolarHBondContact O-CB 3.29Å; S71-M74 PolarHBondContact O-N 3.17Å; S71-V75 WeakPolarHBondContact O-CG2 3.23Å; S71-V75 PolarHBondContact O-N 3.18Å; S71-S113 WeakPolarHBondContact OG-CA 3.36Å
72D95.9Very high94.6Very high0 Ų024.3 Ų24.30%013%0.133CC..Hα-helixtrans-67.7-35.5178.2-70.5-22.4000112.4N44 L68 M74 V75 G76 S113 S313 N316N44-D72 WeakPolarHBondContact OD1-CB 3.49Å; L68-D72 PolarHBondContact O-N 3.4Å; D72-M74 VanDerWaalsContact C-N 3.34Å; D72-V75 PolarHBondContact O-N 3.48Å; D72-G76 PolarHBondContact O-N 2.92Å; D72-S113 PolarHBondContact OD1-OG 3.45Å; D72-S313 WeakPolarHBondContact OD1-CB 3.31Å; D72-S313 PolarHBondContact OD1-OG 2.84Å; D72-N316 PolarHBondContact OD2-ND2 3.49Å
73L96.5Very high94.7Very high33 Ų3324.2 Ų24.217%0.17313%0.133CC..Hα-helixtrans-64.1-39.7171.4-177.562.2000111.2A41 N44 I48 F69 T70 S71 G76 L77A41-L73 HydrophobicContact CB-CD1 3.98Å; N44-L73 HydrophobicContact CB-CB 4.21Å; I48-L73 HydrophobicContact CD1-CD2 4.29Å; F69-L73 WeakPolarHBondContact O-CB 3.24Å; F69-L73 PolarHBondContact O-N 3.1Å; T70-L73 PolarHBondContact O-N 3.43Å; S71-L73 PolarHBondContact O-N 2.95Å; L73-G76 PolarHBondContact O-N 3.41Å; L73-L77 HydrophobicContact CD1-CD1 3.7Å; L73-L77 HydrophobicContact CD1-CG 3.95Å; L73-L77 HydrophobicContact CG-CD1 3.87Å; L73-L77 HydrophobicContact CG-CG 4.37Å; L73-L77 WeakPolarHBondContact O-CB 3.47Å; L73-L77 WeakPolarHBondContact O-CG 3.26Å; L73-L77 PolarHBondContact O-N 3.12Å
74M96.5Very high94.7Very high51 Ų5120.8 Ų20.825%0.25112%0.119SC..Hα-helixtrans-65-39173.6-69.9-176.669.300111.9T70 S71 D72 G76 L77 V78 V79 F105 M108 C109 W151T70-M74 WeakPolarHBondContact O-CG 3.48Å; T70-M74 PolarHBondContact O-N 3.19Å; S71-M74 WeakPolarHBondContact O-CB 3.29Å; S71-M74 PolarHBondContact O-N 3.17Å; D72-M74 VanDerWaalsContact C-N 3.34Å; M74-G76 VanDerWaalsContact C-N 3.33Å; M74-G76 PolarHBondContact O-N 3.42Å; M74-L77 PolarHBondContact O-N 2.89Å; M74-V78 WeakPolarHBondContact O-CA 3.47Å; M74-V78 VanDerWaalsContact O-CB 3.25Å; M74-V78 WeakPolarHBondContact O-CB 3.4Å; M74-V78 PolarHBondContact O-N 3.13Å; M74-V79 PolarHBondContact O-N 3.04Å; M74-F105 HydrophobicContact CE-CD1 4.47Å; M74-F105 HydrophobicContact CE-CE1 4.47Å; M74-M108 HydrophobicContact CE-CE 4.04Å; M74-C109 HydrophobicContact CB-CB 4.43Å; M74-W151 HydrophobicContact SD-CH2 3.57Å; M74-W151 VanDerWaalsContact SD-CH2 3.57Å; M74-W151 HydrophobicContact SD-CZ3 3.65Å
75V96.1Very high94.5Very high0 Ų023.1 Ų23.10%013%0.131CC..Iπ-helixtrans-58.3-47.9171.3176.40000110.1S71 D72 L77 V79 M80 C109 Y310S71-V75 WeakPolarHBondContact O-CG2 3.23Å; S71-V75 PolarHBondContact O-N 3.18Å; D72-V75 PolarHBondContact O-N 3.48Å; V75-L77 PolarHBondContact O-N 3.16Å; V75-V79 HydrophobicContact CG1-CB 4.37Å; V75-V79 WeakPolarHBondContact O-CB 3.33Å; V75-V79 PolarHBondContact O-N 2.98Å; V75-M80 HydrophobicContact CG1-CE 4.15Å; V75-M80 HydrophobicContact CG1-CG 4.26Å; V75-M80 WeakPolarHBondContact O-CG 3.23Å; V75-M80 PolarHBondContact O-N 3.2Å; V75-C109 HydrophobicContact CG2-CB 3.67Å; V75-Y310 HydrophobicContact CG1-CD1 4.08Å; V75-Y310 HydrophobicContact CG1-CG 4.45Å
76G95.3Very high94.2Very high0 Ų023.8 Ų23.80%014%0.135CC..Iπ-helixtrans-62.6-41.8179.600000114.6I37 D72 L73 M74 P81I37-G76 WeakPolarHBondContact CG2-O 3.25Å; D72-G76 PolarHBondContact O-N 2.92Å; L73-G76 PolarHBondContact O-N 3.41Å; M74-G76 VanDerWaalsContact C-N 3.33Å; M74-G76 PolarHBondContact O-N 3.42Å; G76-P81 WeakPolarHBondContact O-CD 3.38Å
77L95.8Very high93.7Very high102 Ų10223.9 Ų23.953%0.53414%0.14SC..Iπ-helixtrans-93.7-32.7-172.5-65.5-179.5000114.3A41 L73 M74 V75 P81A41-L77 HydrophobicContact CB-CD2 3.76Å; A41-L77 HydrophobicContact CB-CG 4.32Å; L73-L77 HydrophobicContact CD1-CD1 3.7Å; L73-L77 HydrophobicContact CD1-CG 3.95Å; L73-L77 HydrophobicContact CG-CD1 3.87Å; L73-L77 HydrophobicContact CG-CG 4.37Å; L73-L77 WeakPolarHBondContact O-CB 3.47Å; L73-L77 WeakPolarHBondContact O-CG 3.26Å; L73-L77 PolarHBondContact O-N 3.12Å; M74-L77 PolarHBondContact O-N 2.89Å; V75-L77 PolarHBondContact O-N 3.16Å; L77-P81 WeakPolarHBondContact O-CG 3.22Å
78V94.9Very high93.3Very high57 Ų5724.3 Ų24.335%0.34514%0.141SC..Iπ-helixtrans-104.5-36.5-172.7-1750000111.5M74 P82 F105M74-V78 WeakPolarHBondContact O-CA 3.47Å; M74-V78 VanDerWaalsContact O-CB 3.25Å; M74-V78 WeakPolarHBondContact O-CB 3.4Å; M74-V78 PolarHBondContact O-N 3.13Å; V78-P82 VanDerWaalsContact O-CD 3.29Å; V78-P82 WeakPolarHBondContact O-CD 3.08Å; V78-P82 WeakPolarHBondContact O-CG 3.35Å; V78-F105 HydrophobicContact CG1-CB 4.15Å; V78-F105 HydrophobicContact CG1-CD1 4.41Å; V78-F105 HydrophobicContact CG1-CG 4.15Å
79V95.1Very high92.7Very high0 Ų027.7 Ų27.70%015%0.154CC..Iπ-helixtrans-95.3-52.2-170.6179.70000112M74 V75 P82 A83 W102 D106 C109 Y310M74-V79 PolarHBondContact O-N 3.04Å; V75-V79 HydrophobicContact CG1-CB 4.37Å; V75-V79 WeakPolarHBondContact O-CB 3.33Å; V75-V79 PolarHBondContact O-N 2.98Å; V79-P82 WeakPolarHBondContact O-CD 3.35Å; V79-A83 WeakPolarHBondContact O-CB 3.24Å; V79-A83 PolarHBondContact O-N 3.37Å; V79-W102 PolarHBondContact O-NE1 3.45Å; V79-D106 HydrophobicContact CG1-CB 3.76Å; V79-D106 VanDerWaalsContact CG1-OD1 3.23Å; V79-D106 WeakPolarHBondContact CG1-OD1 3.21Å; V79-D106 HydrophobicContact CG2-CB 4.37Å; V79-C109 HydrophobicContact CG2-CB 4.1Å; V79-Y310 HydrophobicContact CG1-CE1 3.77Å; V79-Y310 HydrophobicContact CG1-CE2 4.29Å; V79-Y310 WeakPolarHBondContact CG1-OH 3.19Å
80M94.9Very high91.8Very high0 Ų029.4 Ų29.40%017%0.172CC..Hα-helixtrans-63.7-38.1-174.6-68.8177.6175.200114.4I37 T40 V75 A83 M84 W307 Y310I37-M80 HydrophobicContact CD1-CB 3.91Å; I37-M80 HydrophobicContact CG1-CB 3.6Å; I37-M80 HydrophobicContact CG1-CG 4.38Å; I37-M80 HydrophobicContact CG1-SD 3.88Å; T40-M80 HydrophobicContact CG2-CE 4.17Å; V75-M80 HydrophobicContact CG1-CE 4.15Å; V75-M80 HydrophobicContact CG1-CG 4.26Å; V75-M80 WeakPolarHBondContact O-CG 3.23Å; V75-M80 PolarHBondContact O-N 3.2Å; M80-A83 WeakPolarHBondContact O-CB 3.15Å; M80-A83 PolarHBondContact O-N 2.78Å; M80-M84 WeakPolarHBondContact O-CB 3.3Å; M80-M84 PolarHBondContact O-N 3.26Å; M80-W307 HydrophobicContact CB-CH2 4.18Å; M80-W307 HydrophobicContact CB-CZ3 4.3Å; M80-W307 HydrophobicContact CG-CZ3 4.17Å; M80-W307 HydrophobicContact SD-CZ3 4.46Å; M80-Y310 WeakPolarHBondContact CE-O 2.9Å; M80-Y310 HydrophobicContact CG-CD2 4.21Å; M80-Y310 HydrophobicContact CG-CG 4.45Å
81P94.2Very high91Very high38 Ų3830.7 Ų30.725%0.24717%0.171CC..Hα-helixtrans-68.2-46.8-177.4-17.930.6000113.8I37 G76 L77 A83 M84 L85I37-P81 HydrophobicContact CD1-CG 4.42Å; I37-P81 HydrophobicContact CG2-CG 4.41Å; G76-P81 WeakPolarHBondContact O-CD 3.38Å; L77-P81 WeakPolarHBondContact O-CG 3.22Å; P81-A83 VanDerWaalsContact C-N 3.3Å; P81-A83 PolarHBondContact O-N 3.42Å; P81-M84 WeakPolarHBondContact O-CB 3.46Å; P81-M84 PolarHBondContact O-N 2.96Å; P81-L85 WeakPolarHBondContact O-CG 3.05Å; P81-L85 PolarHBondContact O-N 3.47Å
82P91.8Very high90.4Very high24 Ų2432.4 Ų32.416%0.15618%0.178CC..Hα-helixtrans-62.4-36.3171.1-22.634.1000112.8V78 V79 M84 L85 N86 W92 L94 W102V78-P82 VanDerWaalsContact O-CD 3.29Å; V78-P82 WeakPolarHBondContact O-CD 3.08Å; V78-P82 WeakPolarHBondContact O-CG 3.35Å; V79-P82 WeakPolarHBondContact O-CD 3.35Å; P82-M84 PolarHBondContact O-N 2.96Å; P82-L85 PolarHBondContact O-N 2.89Å; P82-N86 WeakPolarHBondContact O-CB 3.38Å; P82-N86 PolarHBondContact O-N 2.89Å; P82-W92 HydrophobicContact CB-CH2 4Å; P82-W92 HydrophobicContact CB-CZ3 4.24Å; P82-L94 HydrophobicContact CB-CD1 3.87Å; P82-L94 HydrophobicContact CG-CD1 4.3Å; P82-W102 HydrophobicContact CB-CD2 4.28Å; P82-W102 HydrophobicContact CB-CG 3.97Å; P82-W102 HydrophobicContact CG-CG 4.45Å
83A90.9Very high89.8Confident7 Ų735.2 Ų35.26%0.05820%0.195CC..Hα-helixtrans-60.8-43.6174.800000111.9V79 M80 P81 N86 A87 W102 W307 Y310V79-A83 WeakPolarHBondContact O-CB 3.24Å; V79-A83 PolarHBondContact O-N 3.37Å; M80-A83 WeakPolarHBondContact O-CB 3.15Å; M80-A83 PolarHBondContact O-N 2.78Å; P81-A83 VanDerWaalsContact C-N 3.3Å; P81-A83 PolarHBondContact O-N 3.42Å; A83-N86 PolarHBondContact O-N 3.38Å; A83-A87 WeakPolarHBondContact O-CB 3.35Å; A83-A87 PolarHBondContact O-N 3.47Å; A83-W102 HydrophobicContact CB-CZ2 3.75Å; A83-W307 HydrophobicContact CB-CZ2 4.2Å; A83-Y310 HydrophobicContact CB-CE2 3.96Å
84M91.4Very high89.2Confident24 Ų2436.6 Ų36.612%0.11820%0.202CC..Hα-helixtrans-61-45.3175.6178.7-174.374.800111.4L33 C34 I37 M80 P81 P82 A87 L88 W307L33-M84 HydrophobicContact CB-CG 3.93Å; L33-M84 HydrophobicContact CB-SD 3.78Å; L33-M84 HydrophobicContact CD1-CB 4.38Å; L33-M84 HydrophobicContact CD1-CG 3.79Å; C34-M84 VanDerWaalsContact SG-SD 3.66Å; I37-M84 HydrophobicContact CD1-CB 4.37Å; I37-M84 HydrophobicContact CD1-SD 4.02Å; M80-M84 WeakPolarHBondContact O-CB 3.3Å; M80-M84 PolarHBondContact O-N 3.26Å; P81-M84 WeakPolarHBondContact O-CB 3.46Å; P81-M84 PolarHBondContact O-N 2.96Å; P82-M84 PolarHBondContact O-N 2.96Å; M84-A87 PolarHBondContact O-N 3.43Å; M84-L88 HydrophobicContact CG-CD1 3.78Å; M84-L88 HydrophobicContact CG-CG 4.24Å; M84-L88 WeakPolarHBondContact O-CB 3.34Å; M84-L88 VanDerWaalsContact O-CG 3.29Å; M84-L88 WeakPolarHBondContact O-CG 3.41Å; M84-L88 PolarHBondContact O-N 3.48Å; M84-L88 HydrophobicContact SD-CD1 4.41Å; M84-W307 HydrophobicContact CB-CH2 4.09Å; M84-W307 HydrophobicContact CB-CZ2 4Å
85L89.4Confident88.6Confident52 Ų5237.2 Ų37.227%0.27222%0.216SC..Hα-helixtrans-62.1-44.6177-69173.6000111.5P81 P82 A87 L88 Y89 V93 L94P81-L85 WeakPolarHBondContact O-CG 3.05Å; P81-L85 PolarHBondContact O-N 3.47Å; P82-L85 PolarHBondContact O-N 2.89Å; L85-A87 VanDerWaalsContact C-N 3.3Å; L85-A87 PolarHBondContact O-N 3.43Å; L85-L88 PolarHBondContact O-N 3.25Å; L85-Y89 HydrophobicContact CD2-CD2 4.43Å; L85-Y89 HydrophobicContact CD2-CE2 4.03Å; L85-Y89 WeakPolarHBondContact O-CD2 3.24Å; L85-Y89 PolarHBondContact O-N 3.13Å; L85-Y89 VanDerWaalsContact O-N 3.09Å; L85-V93 HydrophobicContact CB-CG2 4.08Å; L85-L94 HydrophobicContact CD1-CD1 4.44Å; L85-L94 HydrophobicContact CD1-CG 4.49Å
86N86.3Confident87.5Confident14 Ų1447.7 Ų47.78%0.07526%0.255CS..Hα-helixtrans-60.6-40.2177.3-166.857.9000111.6P82 A83 G90 W92 C180P82-N86 WeakPolarHBondContact O-CB 3.38Å; P82-N86 PolarHBondContact O-N 2.89Å; A83-N86 PolarHBondContact O-N 3.38Å; N86-G90 WeakPolarHBondContact O-CA 3.43Å; N86-G90 PolarHBondContact O-N 3.25Å; N86-G90 VanDerWaalsContact O-N 3.1Å; N86-W92 HydrophobicContact CB-CE3 4.27Å; N86-C180 PolarHBondContact ND2-O 3.48Å
87A85.3Confident86.4Confident40 Ų4050.6 Ų50.633%0.33128%0.284SS..Hα-helixtrans-70.2-42177.600000113.3A83 M84 L85A83-A87 WeakPolarHBondContact O-CB 3.35Å; A83-A87 PolarHBondContact O-N 3.47Å; M84-A87 PolarHBondContact O-N 3.43Å; L85-A87 VanDerWaalsContact C-N 3.3Å; L85-A87 PolarHBondContact O-N 3.43Å
88L85.7Confident85.9Confident17 Ų1749.4 Ų49.49%0.08928%0.278CS..Hα-helixtrans-73.2-37.7-176.4-71.9175.6000113.6G24 G25 V29 A30 M84 L85G24-L88 PolarHBondContact N-O 2.7Å; G25-L88 PolarHBondContact N-O 3.02Å; V29-L88 HydrophobicContact CG1-CD2 4.26Å; A30-L88 HydrophobicContact CB-CD1 3.62Å; A30-L88 HydrophobicContact CB-CD2 3.89Å; A30-L88 HydrophobicContact CB-CG 4.43Å; M84-L88 HydrophobicContact CG-CD1 3.78Å; M84-L88 HydrophobicContact CG-CG 4.24Å; M84-L88 WeakPolarHBondContact O-CB 3.34Å; M84-L88 VanDerWaalsContact O-CG 3.29Å; M84-L88 WeakPolarHBondContact O-CG 3.41Å; M84-L88 PolarHBondContact O-N 3.48Å; M84-L88 HydrophobicContact SD-CD1 4.41Å; L85-L88 PolarHBondContact O-N 3.25Å
89Y83Confident85.5Confident71 Ų7148.1 Ų48.128%0.27827%0.271SS..Hα-helixtrans-89.8-12.8179.8-73.7-82.9000112.8S21 P23 L85 R91 V93S21-Y89 WeakPolarHBondContact O-CD1 3.32Å; S21-Y89 WeakPolarHBondContact O-CE1 3.46Å; P23-Y89 HydrophobicContact CB-CE1 4.4Å; L85-Y89 HydrophobicContact CD2-CD2 4.43Å; L85-Y89 HydrophobicContact CD2-CE2 4.03Å; L85-Y89 WeakPolarHBondContact O-CD2 3.24Å; L85-Y89 PolarHBondContact O-N 3.13Å; L85-Y89 VanDerWaalsContact O-N 3.09Å; Y89-R91 PolarHBondContact O-N 2.84Å; Y89-R91 VanDerWaalsContact O-N 3.12Å; Y89-V93 HydrophobicContact CD1-CG1 4.11Å; Y89-V93 HydrophobicContact CD2-CG1 4.03Å; Y89-V93 HydrophobicContact CD2-CG2 4.2Å; Y89-V93 HydrophobicContact CG-CG1 3.68Å
90G77.4Confident84.9Confident37 Ų3751.6 Ų51.638%0.38129%0.29SS..SBendtrans62.513.8-17400000113.4N86 Q179N86-G90 WeakPolarHBondContact O-CA 3.43Å; N86-G90 PolarHBondContact O-N 3.25Å; N86-G90 VanDerWaalsContact O-N 3.1Å; G90-Q179 WeakPolarHBondContact O-CG 3.39Å; G90-Q179 PolarHBondContact O-NE2 3.37Å
91R78.9Confident84.6Confident77 Ų7755.3 Ų55.329%0.29131%0.309SS..SBendtrans-154.7157.5179.362.1173.8173.8149.4-6.8110.8P19 S21 Y89 V93 G178P19-R91 PolarHBondContact O-NH2 3.31Å; S21-R91 PolarHBondContact OG-NE 3.43Å; S21-R91 PolarHBondContact OG-NH2 2.88Å; Y89-R91 PolarHBondContact O-N 2.84Å; Y89-R91 VanDerWaalsContact O-N 3.12Å; R91-V93 HydrophobicContact CG-CG1 4.22Å; R91-V93 PolarHBondContact O-N 2.6Å; R91-G178 CarbonylContact C-O 3.45Å; R91-G178 WeakPolarHBondContact CA-O 3.45Å; R91-G178 WeakPolarHBondContact CB-O 3.45Å
92W83.6Confident84.4Confident37 Ų3754.8 Ų54.814%0.1430%0.302CS..  trans-74.7110.8174.3-171-104.3000110.2P82 N86 L94 A95 L98 C99 W102 G178 C180P82-W92 HydrophobicContact CB-CH2 4Å; P82-W92 HydrophobicContact CB-CZ3 4.24Å; N86-W92 HydrophobicContact CB-CE3 4.27Å; W92-L94 HydrophobicContact CD2-CB 4.43Å; W92-L94 HydrophobicContact CH2-CB 4.47Å; W92-L94 HydrophobicContact CH2-CD1 3.85Å; W92-L94 HydrophobicContact CZ2-CB 3.65Å; W92-L94 HydrophobicContact CZ2-CD1 3.81Å; W92-L94 HydrophobicContact CZ2-CG 4.33Å; W92-L94 HydrophobicContact CZ3-CD1 4.49Å; W92-L94 PolarHBondContact NE1-O 2.69Å; W92-L94 VanDerWaalsContact NE1-O 3.08Å; W92-A95 PolarHBondContact NE1-O 3.06Å; W92-L98 VanDerWaalsContact CZ2-C 3.48Å; W92-L98 HydrophobicContact CZ2-CB 3.99Å; W92-C99 HydrophobicContact CD2-CB 4.06Å; W92-C99 HydrophobicContact CG-CB 4.33Å; W92-C99 HydrophobicContact CZ2-CB 3.96Å; W92-W102 HydrophobicContact CE3-CE3 4.38Å; W92-W102 HydrophobicContact CH2-CB 3.79Å; W92-W102 AromaticContact CH2-CD2 3.78Å; W92-W102 HydrophobicContact CH2-CD2 3.78Å; W92-W102 AromaticContact CH2-CE3 3.66Å; W92-W102 HydrophobicContact CH2-CE3 3.66Å; W92-W102 AromaticContact CH2-CG 3.86Å; W92-W102 HydrophobicContact CH2-CG 3.86Å; W92-W102 HydrophobicContact CH2-CZ3 4.49Å; W92-W102 HydrophobicContact CZ2-CB 4.47Å; W92-W102 AromaticContact CZ3-CD2 3.81Å; W92-W102 HydrophobicContact CZ3-CD2 3.81Å; W92-W102 AromaticContact CZ3-CE3 3.42Å; W92-W102 HydrophobicContact CZ3-CE3 3.42Å; W92-W102 VanDerWaalsContact CZ3-CE3 3.42Å; W92-W102 HydrophobicContact CZ3-CG 4.37Å; W92-W102 AromaticContact CZ3-CZ3 3.82Å; W92-W102 HydrophobicContact CZ3-CZ3 3.82Å; W92-G178 PolarHBondContact N-O 2.96Å; W92-C180 HydrophobicContact CB-CB 3.81Å; W92-C180 HydrophobicContact CD2-CB 3.45Å; W92-C180 VanDerWaalsContact CD2-CB 3.45Å; W92-C180 HydrophobicContact CE3-CB 3.22Å; W92-C180 HydrophobicContact CG-CB 3.73Å; W92-C180 HydrophobicContact CZ3-CB 3.93Å
93V83.7Confident84.2Confident58 Ų5854.1 Ų54.135%0.35230%0.298SS..  trans-96.5-11.3-178.4-65.10000113.6L85 Y89 R91L85-V93 HydrophobicContact CB-CG2 4.08Å; Y89-V93 HydrophobicContact CD1-CG1 4.11Å; Y89-V93 HydrophobicContact CD2-CG1 4.03Å; Y89-V93 HydrophobicContact CD2-CG2 4.2Å; Y89-V93 HydrophobicContact CG-CG1 3.68Å; R91-V93 HydrophobicContact CG-CG1 4.22Å; R91-V93 PolarHBondContact O-N 2.6Å
94L84.3Confident84.2Confident63 Ų6354 Ų5433%0.3330%0.297SS..SBendtrans-85.1172.1178.1-67.4167.8000111P82 L85 W92 L98P82-L94 HydrophobicContact CB-CD1 3.87Å; P82-L94 HydrophobicContact CG-CD1 4.3Å; L85-L94 HydrophobicContact CD1-CD1 4.44Å; L85-L94 HydrophobicContact CD1-CG 4.49Å; W92-L94 HydrophobicContact CD2-CB 4.43Å; W92-L94 HydrophobicContact CH2-CB 4.47Å; W92-L94 HydrophobicContact CH2-CD1 3.85Å; W92-L94 HydrophobicContact CZ2-CB 3.65Å; W92-L94 HydrophobicContact CZ2-CD1 3.81Å; W92-L94 HydrophobicContact CZ2-CG 4.33Å; W92-L94 HydrophobicContact CZ3-CD1 4.49Å; W92-L94 PolarHBondContact NE1-O 2.69Å; W92-L94 VanDerWaalsContact NE1-O 3.08Å; L94-L98 HydrophobicContact CB-CB 4.48Å; L94-L98 HydrophobicContact CB-CD1 4.24Å
95A83Confident84.3Confident64 Ų6455.7 Ų55.753%0.52930%0.303SS..  trans-58149.2178.200000112.2W92 G97 L98W92-A95 PolarHBondContact NE1-O 3.06Å; A95-G97 PolarHBondContact O-N 3.36Å; A95-L98 HydrophobicContact CB-CD1 3.95Å; A95-L98 HydrophobicContact CB-CG 4.1Å; A95-L98 WeakPolarHBondContact O-CB 3.36Å; A95-L98 PolarHBondContact O-N 2.97Å
96R72.3Confident84.5Confident220 Ų22054.5 Ų54.583%0.8330%0.297SS*.Hα-helixtrans-57.2-43.5-175.5-173.1177.2178.9-178-0.8113.3L98 C99R96-L98 PolarHBondContact O-N 3.24Å; R96-C99 PolarHBondContact O-N 2.9Å
97G73.4Confident84.7Confident60 Ų6055.4 Ų55.462%0.61930%0.303SS*.Hα-helixtrans-66.4-22.3177.900000113.9A95 C99A95-G97 PolarHBondContact O-N 3.36Å; G97-C99 VanDerWaalsContact C-N 3.34Å
98L85.4Confident85.1Confident77 Ų7754.2 Ų54.240%0.40329%0.291SS..Hα-helixtrans-76.3-21.1178.8-64.1175.7000112.6W92 L94 A95 R96 L101 W102W92-L98 VanDerWaalsContact CZ2-C 3.48Å; W92-L98 HydrophobicContact CZ2-CB 3.99Å; L94-L98 HydrophobicContact CB-CB 4.48Å; L94-L98 HydrophobicContact CB-CD1 4.24Å; A95-L98 HydrophobicContact CB-CD1 3.95Å; A95-L98 HydrophobicContact CB-CG 4.1Å; A95-L98 WeakPolarHBondContact O-CB 3.36Å; A95-L98 PolarHBondContact O-N 2.97Å; R96-L98 PolarHBondContact O-N 3.24Å; L98-L101 HydrophobicContact CD2-CD2 4.28Å; L98-W102 WeakPolarHBondContact O-CB 3.44Å; L98-W102 PolarHBondContact O-N 3.5Å
99C85.1Confident85.6Confident30 Ų3053.4 Ų53.420%0.20329%0.287CS..Hα-helixtrans-64.3-55.6178.6167.30000111.2W92 R96 G97 L101 W102 T103 C180W92-C99 HydrophobicContact CD2-CB 4.06Å; W92-C99 HydrophobicContact CG-CB 4.33Å; W92-C99 HydrophobicContact CZ2-CB 3.96Å; R96-C99 PolarHBondContact O-N 2.9Å; G97-C99 VanDerWaalsContact C-N 3.34Å; C99-L101 VanDerWaalsContact C-N 3.3Å; C99-L101 PolarHBondContact O-N 3.45Å; C99-W102 PolarHBondContact O-N 2.96Å; C99-T103 PolarHBondContact O-N 3.47Å; C99-T103 PolarHBondContact O-OG1 3.27Å; C99-C180 WeakPolarHBondContact CA-SG 3.42Å; C99-C180 HydrophobicContact CB-CB 3.89Å; C99-C180 WeakPolarHBondContact CB-SG 3.49Å; C99-C180 WeakPolarHBondContact SG-CB 3.29Å; C99-C180 CovalentContact SG-SG 2.02Å; C99-C180 PolarHBondContact SG-SG 3.4Å
100L82.9Confident86Confident74 Ų7450.4 Ų50.439%0.38728%0.276SS..Hα-helixtrans-62.7-40.1179.3-173.268.9000111.4T103 A104 L162L100-T103 PolarHBondContact O-N 3.29Å; L100-A104 PolarHBondContact O-N 3.25Å; L100-L162 HydrophobicContact CD1-CB 4.2Å; L100-L162 HydrophobicContact CD1-CD2 3.88Å; L100-L162 HydrophobicContact CD1-CG 4Å
101L88.3Confident86.8Confident77 Ų7748.8 Ų48.840%0.40326%0.259SS..Hα-helixtrans-64.1-46.1177.6-173.961.4000111.7L98 C99 A104 F105 F159L98-L101 HydrophobicContact CD2-CD2 4.28Å; C99-L101 VanDerWaalsContact C-N 3.3Å; C99-L101 PolarHBondContact O-N 3.45Å; L101-A104 PolarHBondContact O-N 3.15Å; L101-F105 HydrophobicContact CD1-CD2 3.96Å; L101-F105 HydrophobicContact CD1-CE2 3.58Å; L101-F105 HydrophobicContact CD2-CE2 4.34Å; L101-F105 HydrophobicContact CG-CD2 3.89Å; L101-F105 HydrophobicContact CG-CE2 3.76Å; L101-F105 VanDerWaalsContact O-CD2 3.24Å; L101-F105 WeakPolarHBondContact O-CD2 3.25Å; L101-F105 PolarHBondContact O-N 3.37Å; L101-F159 HydrophobicContact CD1-CE1 4.14Å
102W91.3Very high87.6Confident28 Ų2845.1 Ų45.111%0.10625%0.245CC..Hα-helixtrans-60-47.1176.5164.866.6000111.2V79 P82 A83 W92 L98 C99 A104 F105 D106 C180V79-W102 PolarHBondContact O-NE1 3.45Å; P82-W102 HydrophobicContact CB-CD2 4.28Å; P82-W102 HydrophobicContact CB-CG 3.97Å; P82-W102 HydrophobicContact CG-CG 4.45Å; A83-W102 HydrophobicContact CB-CZ2 3.75Å; W92-W102 HydrophobicContact CE3-CE3 4.38Å; W92-W102 HydrophobicContact CH2-CB 3.79Å; W92-W102 AromaticContact CH2-CD2 3.78Å; W92-W102 HydrophobicContact CH2-CD2 3.78Å; W92-W102 AromaticContact CH2-CE3 3.66Å; W92-W102 HydrophobicContact CH2-CE3 3.66Å; W92-W102 AromaticContact CH2-CG 3.86Å; W92-W102 HydrophobicContact CH2-CG 3.86Å; W92-W102 HydrophobicContact CH2-CZ3 4.49Å; W92-W102 HydrophobicContact CZ2-CB 4.47Å; W92-W102 AromaticContact CZ3-CD2 3.81Å; W92-W102 HydrophobicContact CZ3-CD2 3.81Å; W92-W102 AromaticContact CZ3-CE3 3.42Å; W92-W102 HydrophobicContact CZ3-CE3 3.42Å; W92-W102 VanDerWaalsContact CZ3-CE3 3.42Å; W92-W102 HydrophobicContact CZ3-CG 4.37Å; W92-W102 AromaticContact CZ3-CZ3 3.82Å; W92-W102 HydrophobicContact CZ3-CZ3 3.82Å; L98-W102 WeakPolarHBondContact O-CB 3.44Å; L98-W102 PolarHBondContact O-N 3.5Å; C99-W102 PolarHBondContact O-N 2.96Å; W102-A104 VanDerWaalsContact C-N 3.29Å; W102-A104 PolarHBondContact O-N 3.37Å; W102-F105 CarbonylContact O-C 3.57Å; W102-F105 PolarHBondContact O-N 3.38Å; W102-F105 VanDerWaalsContact O-N 3.11Å; W102-D106 WeakPolarHBondContact O-CB 3.27Å; W102-D106 PolarHBondContact O-N 2.82Å; W102-C180 VanDerWaalsContact CE3-SG 3.57Å; W102-C180 HydrophobicContact CZ3-CB 4.18Å
103T87.4Confident88.1Confident10 Ų1043.3 Ų43.36%0.06124%0.238CC..Hα-helixtrans-59.4-40176.8-56.90000112.1C99 L100 D106 V107 L162 L182C99-T103 PolarHBondContact O-N 3.47Å; C99-T103 PolarHBondContact O-OG1 3.27Å; L100-T103 PolarHBondContact O-N 3.29Å; T103-D106 PolarHBondContact O-N 3.29Å; T103-V107 WeakPolarHBondContact O-CG2 3.41Å; T103-V107 PolarHBondContact O-N 3.01Å; T103-V107 VanDerWaalsContact O-N 3.07Å; T103-L162 HydrophobicContact CG2-CD2 4.05Å; T103-L182 HydrophobicContact CG2-CB 3.73Å; T103-L182 HydrophobicContact CG2-CD1 3.82Å; T103-L182 HydrophobicContact CG2-CD2 3.84Å; T103-L182 HydrophobicContact CG2-CG 3.98Å
104A90.5Very high88.5Confident4 Ų440.6 Ų40.63%0.03322%0.222CC..Hα-helixtrans-63.6-42.517500000112L100 L101 W102 M108 F159 L162L100-A104 PolarHBondContact O-N 3.25Å; L101-A104 PolarHBondContact O-N 3.15Å; W102-A104 VanDerWaalsContact C-N 3.29Å; W102-A104 PolarHBondContact O-N 3.37Å; A104-M108 VanDerWaalsContact O-CB 3.22Å; A104-M108 WeakPolarHBondContact O-CB 3.46Å; A104-M108 PolarHBondContact O-N 3.28Å; A104-F159 HydrophobicContact CB-CD1 3.9Å; A104-F159 HydrophobicContact CB-CD2 4.36Å; A104-F159 HydrophobicContact CB-CE1 3.73Å; A104-F159 HydrophobicContact CB-CE2 4.18Å; A104-F159 HydrophobicContact CB-CG 4.22Å; A104-F159 HydrophobicContact CB-CZ 3.88Å; A104-L162 HydrophobicContact CB-CD2 3.77Å
105F93.5Very high88.9Confident59 Ų5938.5 Ų38.526%0.25921%0.211SC..Hα-helixtrans-66.5-38.9175-85.6-70.1000112.8M74 V78 L101 W102 M108 C109 F159M74-F105 HydrophobicContact CE-CD1 4.47Å; M74-F105 HydrophobicContact CE-CE1 4.47Å; V78-F105 HydrophobicContact CG1-CB 4.15Å; V78-F105 HydrophobicContact CG1-CD1 4.41Å; V78-F105 HydrophobicContact CG1-CG 4.15Å; L101-F105 HydrophobicContact CD1-CD2 3.96Å; L101-F105 HydrophobicContact CD1-CE2 3.58Å; L101-F105 HydrophobicContact CD2-CE2 4.34Å; L101-F105 HydrophobicContact CG-CD2 3.89Å; L101-F105 HydrophobicContact CG-CE2 3.76Å; L101-F105 VanDerWaalsContact O-CD2 3.24Å; L101-F105 WeakPolarHBondContact O-CD2 3.25Å; L101-F105 PolarHBondContact O-N 3.37Å; W102-F105 CarbonylContact O-C 3.57Å; W102-F105 PolarHBondContact O-N 3.38Å; W102-F105 VanDerWaalsContact O-N 3.11Å; F105-M108 HydrophobicContact CD1-CE 3.53Å; F105-M108 HydrophobicContact CE1-CE 3.78Å; F105-M108 PolarHBondContact O-N 3.24Å; F105-C109 VanDerWaalsContact O-CB 3.32Å; F105-C109 WeakPolarHBondContact O-CB 3.43Å; F105-C109 PolarHBondContact O-N 2.94Å; F105-C109 PolarHBondContact O-SG 2.87Å; F105-F159 HydrophobicContact CD1-CZ 4.33Å; F105-F159 HydrophobicContact CD2-CZ 4.31Å; F105-F159 HydrophobicContact CE1-CZ 4.22Å; F105-F159 HydrophobicContact CE2-CZ 4.22Å; F105-F159 HydrophobicContact CG-CZ 4.35Å; F105-F159 HydrophobicContact CZ-CZ 4.16Å
106D92.7Very high89.5Confident27 Ų2735.4 Ų35.414%0.14419%0.186CC..Hα-helixtrans-58-58.2176.3-178.212.9000110.4V79 W102 T103 M108 C109 C110 Y310V79-D106 HydrophobicContact CG1-CB 3.76Å; V79-D106 VanDerWaalsContact CG1-OD1 3.23Å; V79-D106 WeakPolarHBondContact CG1-OD1 3.21Å; V79-D106 HydrophobicContact CG2-CB 4.37Å; W102-D106 WeakPolarHBondContact O-CB 3.27Å; W102-D106 PolarHBondContact O-N 2.82Å; T103-D106 PolarHBondContact O-N 3.29Å; D106-M108 VanDerWaalsContact C-N 3.27Å; D106-M108 PolarHBondContact O-N 3.31Å; D106-C109 PolarHBondContact O-N 3.38Å; D106-C110 VanDerWaalsContact O-CB 3.25Å; D106-C110 WeakPolarHBondContact O-CB 3.34Å; D106-C110 PolarHBondContact O-N 3.14Å; D106-C110 PolarHBondContact O-SG 3.08Å; D106-C110 PolarHBondContact OD1-SG 2.9Å; D106-Y310 VanDerWaalsContact OD1-CE1 3.31Å; D106-Y310 WeakPolarHBondContact OD1-CE1 3.31Å; D106-Y310 PolarHBondContact OD1-OH 2.91Å; D106-Y310 PolarHBondContact OD2-OH 3.3Å
107V90.6Very high90.3Very high33 Ų3325.9 Ų25.920%0.215%0.151CC..Hα-helixtrans-59.6-41.1179.5-177.60000110.6T103 S111 S158T103-V107 WeakPolarHBondContact O-CG2 3.41Å; T103-V107 PolarHBondContact O-N 3.01Å; T103-V107 VanDerWaalsContact O-N 3.07Å; V107-S111 WeakPolarHBondContact O-CB 3.41Å; V107-S111 PolarHBondContact O-N 3.4Å; V107-S111 PolarHBondContact O-OG 2.93Å; V107-S158 WeakPolarHBondContact CG1-OG 3.45Å
108M94.8Very high91.2Very high15 Ų1524.2 Ų24.27%0.07413%0.13CC..Hα-helixtrans-65-50.7179.4-178.2-169.269.100112.3M74 A104 F105 D106 C110 S111 A112 A154 A155 S158 F159M74-M108 HydrophobicContact CE-CE 4.04Å; A104-M108 VanDerWaalsContact O-CB 3.22Å; A104-M108 WeakPolarHBondContact O-CB 3.46Å; A104-M108 PolarHBondContact O-N 3.28Å; F105-M108 HydrophobicContact CD1-CE 3.53Å; F105-M108 HydrophobicContact CE1-CE 3.78Å; F105-M108 PolarHBondContact O-N 3.24Å; D106-M108 VanDerWaalsContact C-N 3.27Å; D106-M108 PolarHBondContact O-N 3.31Å; M108-C110 VanDerWaalsContact C-N 3.35Å; M108-C110 PolarHBondContact O-N 3.35Å; M108-S111 PolarHBondContact O-N 3.17Å; M108-A112 VanDerWaalsContact O-CB 3.27Å; M108-A112 WeakPolarHBondContact O-CB 3.48Å; M108-A112 PolarHBondContact O-N 3.44Å; M108-A154 HydrophobicContact CG-CB 4.23Å; M108-A155 HydrophobicContact CG-CB 4.3Å; M108-A155 HydrophobicContact SD-CB 3.84Å; M108-S158 WeakPolarHBondContact CA-OG 3.4Å; M108-S158 PolarHBondContact N-OG 3.39Å; M108-S158 VanDerWaalsContact N-OG 3.1Å; M108-F159 HydrophobicContact CB-CE2 4.09Å; M108-F159 HydrophobicContact CE-CE2 4.33Å; M108-F159 HydrophobicContact CG-CE2 4.35Å; M108-F159 HydrophobicContact SD-CD2 4.27Å; M108-F159 HydrophobicContact SD-CE2 3.6Å; M108-F159 VanDerWaalsContact SD-CE2 3.6Å
109C95.2Very high91.5Very high0 Ų021.7 Ų21.70%012%0.116CC..Hα-helixtrans-65.8-41.9-175.1-64.60000110.9M74 V75 V79 F105 D106 A112 S113M74-C109 HydrophobicContact CB-CB 4.43Å; V75-C109 HydrophobicContact CG2-CB 3.67Å; V79-C109 HydrophobicContact CG2-CB 4.1Å; F105-C109 VanDerWaalsContact O-CB 3.32Å; F105-C109 WeakPolarHBondContact O-CB 3.43Å; F105-C109 PolarHBondContact O-N 2.94Å; F105-C109 PolarHBondContact O-SG 2.87Å; D106-C109 PolarHBondContact O-N 3.38Å; C109-A112 PolarHBondContact O-N 3.08Å; C109-S113 PolarHBondContact O-N 3.33Å
110C92.6Very high91.7Very high8 Ų820.9 Ų20.95%0.05411%0.11CC..Hα-helixtrans-63.8-46.8175.6-67.30000111.4D106 M108 A112 S113 I114 W281D106-C110 VanDerWaalsContact O-CB 3.25Å; D106-C110 WeakPolarHBondContact O-CB 3.34Å; D106-C110 PolarHBondContact O-N 3.14Å; D106-C110 PolarHBondContact O-SG 3.08Å; D106-C110 PolarHBondContact OD1-SG 2.9Å; M108-C110 VanDerWaalsContact C-N 3.35Å; M108-C110 PolarHBondContact O-N 3.35Å; C110-A112 PolarHBondContact O-N 3.22Å; C110-S113 PolarHBondContact O-N 2.87Å; C110-I114 WeakPolarHBondContact O-CG1 3.39Å; C110-I114 PolarHBondContact O-N 3.39Å; C110-W281 HydrophobicContact CB-CH2 3.46Å; C110-W281 VanDerWaalsContact CB-CH2 3.46Å; C110-W281 HydrophobicContact CB-CZ2 4.05Å; C110-W281 HydrophobicContact CB-CZ3 4.32Å; C110-W281 VanDerWaalsContact SG-CH2 3.59Å
111S93.6Very high92Very high3 Ų317.9 Ų17.92%0.02110%0.095CC..Hα-helixtrans-62.8-40.3176.2-59.30000112.3V107 M108 I114 L115 T196V107-S111 WeakPolarHBondContact O-CB 3.41Å; V107-S111 PolarHBondContact O-N 3.4Å; V107-S111 PolarHBondContact O-OG 2.93Å; M108-S111 PolarHBondContact O-N 3.17Å; S111-I114 PolarHBondContact O-N 3.25Å; S111-L115 WeakPolarHBondContact O-CB 3.19Å; S111-L115 VanDerWaalsContact O-CG 3.32Å; S111-L115 WeakPolarHBondContact O-CG 3.48Å; S111-L115 PolarHBondContact O-N 3.4Å; S111-T196 WeakPolarHBondContact OG-CB 3.26Å; S111-T196 VanDerWaalsContact OG-CG2 3.28Å; S111-T196 WeakPolarHBondContact OG-CG2 3.32Å
112A95.6Very high92Very high0 Ų017.5 Ų17.50%09%0.093CC..Hα-helixtrans-62.4-42.3175.800000111.1M108 C109 C110 L115 N116 W151 A154M108-A112 VanDerWaalsContact O-CB 3.27Å; M108-A112 WeakPolarHBondContact O-CB 3.48Å; M108-A112 PolarHBondContact O-N 3.44Å; C109-A112 PolarHBondContact O-N 3.08Å; C110-A112 PolarHBondContact O-N 3.22Å; A112-L115 PolarHBondContact O-N 3.11Å; A112-N116 WeakPolarHBondContact O-CB 3.39Å; A112-N116 PolarHBondContact O-N 3.38Å; A112-N116 PolarHBondContact O-ND2 3Å; A112-W151 HydrophobicContact CB-CD2 4.31Å; A112-W151 HydrophobicContact CB-CE3 4.13Å; A112-W151 HydrophobicContact CB-CH2 4.48Å; A112-W151 HydrophobicContact CB-CZ3 4.22Å; A112-A154 HydrophobicContact CB-CB 3.97Å
113S93.8Very high91.9Very high0 Ų016.4 Ų16.40%09%0.089CC..Hα-helixtrans-60.8-45.8175.5-1730000111.5L68 S71 D72 C109 C110 N116 L117L68-S113 WeakPolarHBondContact CD1-OG 3.5Å; S71-S113 WeakPolarHBondContact OG-CA 3.36Å; D72-S113 PolarHBondContact OD1-OG 3.45Å; C109-S113 PolarHBondContact O-N 3.33Å; C110-S113 PolarHBondContact O-N 2.87Å; S113-N116 PolarHBondContact O-N 2.99Å; S113-L117 WeakPolarHBondContact O-CG 3.44Å; S113-L117 PolarHBondContact O-N 3.48Å
114I92.5Very high91.8Very high0 Ų017.7 Ų17.70%09%0.093CC..Hα-helixtrans-62.7-46.4177.2-59.3164.1000111.8C110 S111 N116 L117 C118 T196 F197 P200 F277 W281 F285C110-I114 WeakPolarHBondContact O-CG1 3.39Å; C110-I114 PolarHBondContact O-N 3.39Å; S111-I114 PolarHBondContact O-N 3.25Å; I114-N116 VanDerWaalsContact C-N 3.32Å; I114-N116 PolarHBondContact O-N 3Å; I114-L117 WeakPolarHBondContact O-CB 3.44Å; I114-L117 PolarHBondContact O-N 3.29Å; I114-C118 PolarHBondContact O-N 3.48Å; I114-T196 VanDerWaalsContact CG2-O 3.24Å; I114-T196 WeakPolarHBondContact CG2-O 3.37Å; I114-F197 HydrophobicContact CD1-CD2 4.24Å; I114-P200 HydrophobicContact CG2-CB 3.88Å; I114-P200 HydrophobicContact CG2-CG 4.43Å; I114-F277 HydrophobicContact CB-CE2 4.39Å; I114-F277 HydrophobicContact CG1-CE2 4.01Å; I114-F277 HydrophobicContact CG2-CE2 3.98Å; I114-F277 HydrophobicContact CG2-CZ 3.85Å; I114-W281 HydrophobicContact CD1-CD2 4.36Å; I114-W281 HydrophobicContact CD1-CE3 4.5Å; I114-F285 HydrophobicContact CD1-CE2 3.91Å; I114-F285 HydrophobicContact CD1-CZ 3.91Å
115L93.6Very high91.6Very high19 Ų1920.2 Ų20.210%0.09910%0.102CC..Hα-helixtrans-64.6-36.9178.3-70.7172000111.7S111 A112 C118 L119 A150 L153 A154 P200S111-L115 WeakPolarHBondContact O-CB 3.19Å; S111-L115 VanDerWaalsContact O-CG 3.32Å; S111-L115 WeakPolarHBondContact O-CG 3.48Å; S111-L115 PolarHBondContact O-N 3.4Å; A112-L115 PolarHBondContact O-N 3.11Å; L115-C118 WeakPolarHBondContact O-CB 3.45Å; L115-C118 PolarHBondContact O-N 2.87Å; L115-L119 WeakPolarHBondContact O-CG 3.49Å; L115-L119 PolarHBondContact O-N 3.32Å; L115-A150 HydrophobicContact CB-CB 3.95Å; L115-A150 HydrophobicContact CD1-CB 4.48Å; L115-A150 WeakPolarHBondContact CD1-O 3.23Å; L115-L153 HydrophobicContact CD1-CB 4.2Å; L115-L153 HydrophobicContact CD1-CD2 4Å; L115-L153 HydrophobicContact CD1-CG 4.13Å; L115-L153 HydrophobicContact CD2-CD2 4.2Å; L115-A154 HydrophobicContact CD1-CB 4.17Å; L115-P200 HydrophobicContact CD2-CG 3.83Å
116N93.8Very high91.3Very high0 Ų020.6 Ų20.60%011%0.106CC..Hα-helixtrans-64.2-39.1172.9-80.6-63.1000111.9S67 L68 A112 S113 I114 C118 L119 I120S67-N116 VanDerWaalsContact CB-OD1 3.26Å; S67-N116 WeakPolarHBondContact CB-OD1 3.43Å; S67-N116 VanDerWaalsContact OG-CG 3.25Å; S67-N116 PolarHBondContact OG-ND2 3.3Å; S67-N116 PolarHBondContact OG-OD1 3.26Å; L68-N116 HydrophobicContact CB-CB 4.14Å; L68-N116 HydrophobicContact CD1-CB 4.01Å; A112-N116 WeakPolarHBondContact O-CB 3.39Å; A112-N116 PolarHBondContact O-N 3.38Å; A112-N116 PolarHBondContact O-ND2 3Å; S113-N116 PolarHBondContact O-N 2.99Å; I114-N116 VanDerWaalsContact C-N 3.32Å; I114-N116 PolarHBondContact O-N 3Å; N116-C118 VanDerWaalsContact C-N 3.29Å; N116-C118 PolarHBondContact O-N 3.41Å; N116-L119 PolarHBondContact O-N 2.99Å; N116-I120 WeakPolarHBondContact O-CD1 3.22Å; N116-I120 VanDerWaalsContact O-CG1 3.25Å; N116-I120 WeakPolarHBondContact O-CG1 3.25Å; N116-I120 PolarHBondContact O-N 3.4Å
117L90.1Very high90.9Very high19 Ų1922.3 Ų22.310%0.09912%0.115CC..Hα-helixtrans-62.1-37.2172.2-70.6173.2000112.3L68 S113 I114 I120 S121 I204 F277L68-L117 HydrophobicContact CD1-CD2 4.05Å; L68-L117 HydrophobicContact CD1-CG 3.94Å; L68-L117 HydrophobicContact CD2-CD2 3.88Å; S113-L117 WeakPolarHBondContact O-CG 3.44Å; S113-L117 PolarHBondContact O-N 3.48Å; I114-L117 WeakPolarHBondContact O-CB 3.44Å; I114-L117 PolarHBondContact O-N 3.29Å; L117-I120 HydrophobicContact CD2-CD1 4.5Å; L117-I120 PolarHBondContact O-N 3.33Å; L117-S121 WeakPolarHBondContact O-CB 3.39Å; L117-S121 PolarHBondContact O-N 3.22Å; L117-S121 PolarHBondContact O-OG 3.33Å; L117-I204 HydrophobicContact CB-CD1 4.39Å; L117-F277 HydrophobicContact CD1-CD2 3.38Å; L117-F277 HydrophobicContact CD1-CE2 3.83Å; L117-F277 HydrophobicContact CD1-CG 4.25Å
118C91.8Very high90.4Very high26 Ų2624 Ų2418%0.17612%0.122CC..Hα-helixtrans-64.3-44.4173.4-173.50000111.6I114 L115 N116 I120 S121 L122 P200 I204I114-C118 PolarHBondContact O-N 3.48Å; L115-C118 WeakPolarHBondContact O-CB 3.45Å; L115-C118 PolarHBondContact O-N 2.87Å; N116-C118 VanDerWaalsContact C-N 3.29Å; N116-C118 PolarHBondContact O-N 3.41Å; C118-I120 PolarHBondContact O-N 3.5Å; C118-S121 PolarHBondContact O-N 3.22Å; C118-L122 WeakPolarHBondContact O-CB 3.48Å; C118-L122 PolarHBondContact O-N 2.92Å; C118-P200 HydrophobicContact CB-CB 4.26Å; C118-I204 HydrophobicContact CB-CD1 4.06Å; C118-I204 HydrophobicContact CB-CG1 4.02Å
119L92.4Very high89.6Confident23 Ų2325.7 Ų25.712%0.1213%0.131CC..Hα-helixtrans-61.8-41.7174.9-70.3178.1000112.1F64 L115 N116 S121 L122 D123 L146 A150F64-L119 HydrophobicContact CD1-CB 3.87Å; F64-L119 HydrophobicContact CD1-CD1 4.12Å; F64-L119 HydrophobicContact CE1-CB 3.99Å; F64-L119 HydrophobicContact CE1-CD1 4.04Å; F64-L119 HydrophobicContact CE1-CG 4.45Å; L115-L119 WeakPolarHBondContact O-CG 3.49Å; L115-L119 PolarHBondContact O-N 3.32Å; N116-L119 PolarHBondContact O-N 2.99Å; L119-S121 VanDerWaalsContact C-N 3.33Å; L119-S121 PolarHBondContact O-N 3.1Å; L119-L122 PolarHBondContact O-N 3.41Å; L119-D123 WeakPolarHBondContact O-CB 3.37Å; L119-D123 PolarHBondContact O-N 3.36Å; L119-L146 HydrophobicContact CD1-CB 4.37Å; L119-L146 HydrophobicContact CD2-CB 4.16Å; L119-A150 HydrophobicContact CD1-CB 3.81Å
120I90Very high89Confident13 Ų1327.4 Ų27.47%0.06714%0.144CC..Hα-helixtrans-62.4-42.2175.2-67.9161.8000110.7F64 L65 L68 N116 L117 C118 D123 R124F64-I120 HydrophobicContact CB-CD1 4.5Å; F64-I120 HydrophobicContact CB-CG1 3.65Å; L65-I120 HydrophobicContact CD2-CD1 3.9Å; L65-I120 HydrophobicContact CD2-CG1 4.46Å; L68-I120 HydrophobicContact CB-CD1 4.11Å; L68-I120 HydrophobicContact CD2-CD1 3.71Å; L68-I120 HydrophobicContact CG-CD1 4.42Å; N116-I120 WeakPolarHBondContact O-CD1 3.22Å; N116-I120 VanDerWaalsContact O-CG1 3.25Å; N116-I120 WeakPolarHBondContact O-CG1 3.25Å; N116-I120 PolarHBondContact O-N 3.4Å; L117-I120 HydrophobicContact CD2-CD1 4.5Å; L117-I120 PolarHBondContact O-N 3.33Å; C118-I120 PolarHBondContact O-N 3.5Å; I120-D123 PolarHBondContact O-N 3.14Å; I120-R124 HydrophobicContact CG2-CG 4.45Å; I120-R124 WeakPolarHBondContact O-CB 3.45Å; I120-R124 VanDerWaalsContact O-CG 3.22Å; I120-R124 WeakPolarHBondContact O-CG 3.43Å; I120-R124 PolarHBondContact O-N 2.89Å
121S87.8Confident88.5Confident11 Ų1130.8 Ų30.88%0.07717%0.166CC..Hα-helixtrans-64.1-42.2178-60.10000111.5L117 C118 L119 R124 Y125L117-S121 WeakPolarHBondContact O-CB 3.39Å; L117-S121 PolarHBondContact O-N 3.22Å; L117-S121 PolarHBondContact O-OG 3.33Å; C118-S121 PolarHBondContact O-N 3.22Å; L119-S121 VanDerWaalsContact C-N 3.33Å; L119-S121 PolarHBondContact O-N 3.1Å; S121-R124 PolarHBondContact O-N 3.48Å; S121-Y125 WeakPolarHBondContact O-CB 3.47Å; S121-Y125 PolarHBondContact O-N 3.4Å
122L88.6Confident87.9Confident69 Ų6937.3 Ų37.336%0.36120%0.2SC..Hα-helixtrans-65.3-43.6174.7-179.561.7000112.3C118 L119 R124 Y125 L126C118-L122 WeakPolarHBondContact O-CB 3.48Å; C118-L122 PolarHBondContact O-N 2.92Å; L119-L122 PolarHBondContact O-N 3.41Å; L122-R124 VanDerWaalsContact C-N 3.34Å; L122-R124 PolarHBondContact O-N 3.29Å; L122-Y125 HydrophobicContact CD1-CD1 4.29Å; L122-Y125 WeakPolarHBondContact O-CB 3.2Å; L122-Y125 PolarHBondContact O-N 2.92Å; L122-L126 HydrophobicContact CD1-CD1 4.42Å; L122-L126 HydrophobicContact CD1-CG 4.32Å; L122-L126 HydrophobicContact CG-CD1 4.28Å; L122-L126 WeakPolarHBondContact O-CG 3.26Å; L122-L126 PolarHBondContact O-N 3.26Å
123D89.4Confident87.3Confident5 Ų545.2 Ų45.23%0.02723%0.229CC..Hα-helixtrans-56.8-49175.6179.472.8000110.9S61 F64 L119 I120 Y125 L126 L127 Y134S61-D123 WeakPolarHBondContact CB-OD2 3.3Å; S61-D123 PolarHBondContact OG-OD2 3.49Å; F64-D123 HydrophobicContact CD2-CB 3.95Å; F64-D123 HydrophobicContact CE2-CB 3.8Å; F64-D123 WeakPolarHBondContact CE2-OD1 3.41Å; L119-D123 WeakPolarHBondContact O-CB 3.37Å; L119-D123 PolarHBondContact O-N 3.36Å; I120-D123 PolarHBondContact O-N 3.14Å; D123-Y125 PolarHBondContact O-N 2.7Å; D123-L126 PolarHBondContact O-N 2.9Å; D123-L127 WeakPolarHBondContact O-CB 3.49Å; D123-L127 PolarHBondContact O-N 2.94Å; D123-Y134 VanDerWaalsContact OD1-CE2 3.25Å; D123-Y134 WeakPolarHBondContact OD1-CE2 3.43Å; D123-Y134 PolarHBondContact OD1-OH 2.89Å
124R85.3Confident87Confident38 Ų3846.7 Ų46.714%0.14324%0.235CC..Hα-helixtrans-64-40.2177.6-67.2-70.2172.8-128-8.8112.1S61 I120 S121 L122 L127 I128 L270S61-R124 VanDerWaalsContact OG-CZ 3.23Å; S61-R124 PolarHBondContact OG-NH1 2.98Å; S61-R124 PolarHBondContact OG-NH2 2.92Å; I120-R124 HydrophobicContact CG2-CG 4.45Å; I120-R124 WeakPolarHBondContact O-CB 3.45Å; I120-R124 VanDerWaalsContact O-CG 3.22Å; I120-R124 WeakPolarHBondContact O-CG 3.43Å; I120-R124 PolarHBondContact O-N 2.89Å; S121-R124 PolarHBondContact O-N 3.48Å; L122-R124 VanDerWaalsContact C-N 3.34Å; L122-R124 PolarHBondContact O-N 3.29Å; R124-L127 PolarHBondContact O-N 3.38Å; R124-I128 WeakPolarHBondContact O-CB 3.25Å; R124-I128 WeakPolarHBondContact O-CD1 3.37Å; R124-I128 VanDerWaalsContact O-CG1 3.23Å; R124-I128 WeakPolarHBondContact O-CG1 3.33Å; R124-I128 PolarHBondContact O-N 3.43Å; R124-L270 HydrophobicContact CB-CD2 4.07Å; R124-L270 HydrophobicContact CG-CD1 4.12Å; R124-L270 HydrophobicContact CG-CD2 4.41Å
125Y85.1Confident86.6Confident56 Ų5655.3 Ų55.322%0.2227%0.272CS..Hα-helixtrans-57-51173.9170.5-89.7000111.5S121 L122 D123 L127 I128 L129 T207 R210 I211S121-Y125 WeakPolarHBondContact O-CB 3.47Å; S121-Y125 PolarHBondContact O-N 3.4Å; L122-Y125 HydrophobicContact CD1-CD1 4.29Å; L122-Y125 WeakPolarHBondContact O-CB 3.2Å; L122-Y125 PolarHBondContact O-N 2.92Å; D123-Y125 PolarHBondContact O-N 2.7Å; Y125-L127 PolarHBondContact O-N 3.02Å; Y125-I128 PolarHBondContact O-N 2.73Å; Y125-L129 HydrophobicContact CD1-CD1 4.38Å; Y125-L129 HydrophobicContact CD2-CD1 3.26Å; Y125-L129 HydrophobicContact CE1-CD1 4.17Å; Y125-L129 HydrophobicContact CE2-CD1 2.98Å; Y125-L129 HydrophobicContact CE2-CG 4.46Å; Y125-L129 HydrophobicContact CG-CD1 3.95Å; Y125-L129 VanDerWaalsContact CZ-CD1 3.47Å; Y125-L129 WeakPolarHBondContact O-CB 3.43Å; Y125-L129 PolarHBondContact O-N 2.71Å; Y125-T207 HydrophobicContact CD2-CG2 4.11Å; Y125-T207 HydrophobicContact CG-CG2 4.08Å; Y125-R210 HydrophobicContact CD2-CB 4.25Å; Y125-R210 HydrophobicContact CE2-CB 3.71Å; Y125-R210 HydrophobicContact CE2-CG 4.28Å; Y125-I211 HydrophobicContact CD2-CG1 4.19Å
126L87.3Confident86.1Confident67 Ų6761.2 Ų61.235%0.35130%0.303SS..Hα-helixtrans-65.1-40.5-179.3-67.2174.3000112L122 D123 S130 Y134L122-L126 HydrophobicContact CD1-CD1 4.42Å; L122-L126 HydrophobicContact CD1-CG 4.32Å; L122-L126 HydrophobicContact CG-CD1 4.28Å; L122-L126 WeakPolarHBondContact O-CG 3.26Å; L122-L126 PolarHBondContact O-N 3.26Å; D123-L126 PolarHBondContact O-N 2.9Å; L126-S130 CarbonylContact O-C 3.27Å; L126-S130 VanDerWaalsContact O-C 3.27Å; L126-S130 WeakPolarHBondContact O-CA 3.28Å; L126-S130 PolarHBondContact O-N 3.08Å; L126-Y134 HydrophobicContact CB-CD2 3.87Å
127L84.5Confident85.6Confident64 Ų6469.4 Ų69.434%0.33533%0.334SS..Hα-helixtrans-66.4-42.4-180-170.7152.8000112.3D123 R124 Y125 Y134D123-L127 WeakPolarHBondContact O-CB 3.49Å; D123-L127 PolarHBondContact O-N 2.94Å; R124-L127 PolarHBondContact O-N 3.38Å; Y125-L127 PolarHBondContact O-N 3.02Å; L127-Y134 HydrophobicContact CB-CD2 4.23Å; L127-Y134 HydrophobicContact CB-CE2 4.35Å; L127-Y134 HydrophobicContact CB-CG 4.37Å; L127-Y134 HydrophobicContact CD1-CE1 4.11Å
128I79.8Confident85.5Confident67 Ų6769.6 Ų69.634%0.34434%0.335SS..Hα-helixtrans-76.7-43.4-176.5-66.1167.8000111.5R124 Y125 I211R124-I128 WeakPolarHBondContact O-CB 3.25Å; R124-I128 WeakPolarHBondContact O-CD1 3.37Å; R124-I128 VanDerWaalsContact O-CG1 3.23Å; R124-I128 WeakPolarHBondContact O-CG1 3.33Å; R124-I128 PolarHBondContact O-N 3.43Å; Y125-I128 PolarHBondContact O-N 2.73Å; I128-I211 HydrophobicContact CD1-CD1 4.49Å; I128-I211 HydrophobicContact CD1-CG2 3.92Å; I128-I211 HydrophobicContact CG2-CG2 4.49Å
129L79.2Confident85.5Confident51 Ų5170.7 Ų70.727%0.26734%0.341SS..Hα-helixtrans-89.4-22.2-173.4-70.2164.4000113.7Y125 A214Y125-L129 HydrophobicContact CD1-CD1 4.38Å; Y125-L129 HydrophobicContact CD2-CD1 3.26Å; Y125-L129 HydrophobicContact CE1-CD1 4.17Å; Y125-L129 HydrophobicContact CE2-CD1 2.98Å; Y125-L129 HydrophobicContact CE2-CG 4.46Å; Y125-L129 HydrophobicContact CG-CD1 3.95Å; Y125-L129 VanDerWaalsContact CZ-CD1 3.47Å; Y125-L129 WeakPolarHBondContact O-CB 3.43Å; Y125-L129 PolarHBondContact O-N 2.71Å; L129-A214 HydrophobicContact CD2-CB 3.25Å
130S81.6Confident85.3Confident37 Ų3772.8 Ų72.826%0.25936%0.356SS..  trans-146.162.8-172.8-67.20000111.9L126 L132 R133 Y134L126-S130 CarbonylContact O-C 3.27Å; L126-S130 VanDerWaalsContact O-C 3.27Å; L126-S130 WeakPolarHBondContact O-CA 3.28Å; L126-S130 PolarHBondContact O-N 3.08Å; S130-L132 VanDerWaalsContact C-N 3.33Å; S130-L132 PolarHBondContact O-N 3.46Å; S130-R133 PolarHBondContact O-N 2.89Å; S130-Y134 WeakPolarHBondContact O-CB 3.41Å; S130-Y134 PolarHBondContact O-N 3.5Å
131P82.1Confident85.4Confident79 Ų7976.5 Ų76.551%0.51338%0.381SS..Hα-helixtrans-60-37.1-172.523.4-34.5000113.8K135P131-K135 PolarHBondContact O-N 3.48Å; P131-K135 VanDerWaalsContact O-N 3.15Å
132L81.6Confident85.7Confident140 Ų14082.6 Ų82.673%0.73340%0.402SS*.Hα-helixtrans-70.6-44.7178.8-64.3175000111.9S130 Y134 K135 L136S130-L132 VanDerWaalsContact C-N 3.33Å; S130-L132 PolarHBondContact O-N 3.46Å; L132-Y134 VanDerWaalsContact C-N 3.3Å; L132-Y134 PolarHBondContact O-N 3.38Å; L132-K135 PolarHBondContact O-N 3.44Å; L132-L136 WeakPolarHBondContact O-CG 3.39Å; L132-L136 PolarHBondContact O-N 2.91Å
133R83.7Confident85.9Confident166 Ų16679.3 Ų79.363%0.62639%0.385SS*.Hα-helixtrans-66.9-35.4176.6-62.1-179.6178.5175.1-1.2111.1S130 L136 R137S130-R133 PolarHBondContact O-N 2.89Å; R133-L136 PolarHBondContact O-N 2.72Å; R133-R137 VanDerWaalsContact O-CB 3.29Å; R133-R137 WeakPolarHBondContact O-CB 3.32Å; R133-R137 WeakPolarHBondContact O-CG 3.5Å; R133-R137 PolarHBondContact O-N 3.14Å
134Y87.1Confident86.1Confident30 Ų3083.3 Ų83.312%0.11841%0.406CS..Hα-helixtrans-60-49.4175.1179.7-90.7000111.3D123 L126 L127 S130 L132 L136 R137 M138D123-Y134 VanDerWaalsContact OD1-CE2 3.25Å; D123-Y134 WeakPolarHBondContact OD1-CE2 3.43Å; D123-Y134 PolarHBondContact OD1-OH 2.89Å; L126-Y134 HydrophobicContact CB-CD2 3.87Å; L127-Y134 HydrophobicContact CB-CD2 4.23Å; L127-Y134 HydrophobicContact CB-CE2 4.35Å; L127-Y134 HydrophobicContact CB-CG 4.37Å; L127-Y134 HydrophobicContact CD1-CE1 4.11Å; S130-Y134 WeakPolarHBondContact O-CB 3.41Å; S130-Y134 PolarHBondContact O-N 3.5Å; L132-Y134 VanDerWaalsContact C-N 3.3Å; L132-Y134 PolarHBondContact O-N 3.38Å; Y134-L136 VanDerWaalsContact C-N 3.26Å; Y134-L136 PolarHBondContact O-N 2.88Å; Y134-R137 PolarHBondContact O-N 3.31Å; Y134-M138 HydrophobicContact CD1-CB 4.42Å; Y134-M138 HydrophobicContact CD2-CB 3.88Å; Y134-M138 HydrophobicContact CD2-CG 4.27Å; Y134-M138 HydrophobicContact CE1-CB 4.21Å; Y134-M138 HydrophobicContact CE2-CB 3.65Å; Y134-M138 HydrophobicContact CE2-CG 3.58Å; Y134-M138 HydrophobicContact CG-CB 4.26Å; Y134-M138 VanDerWaalsContact O-CB 3.24Å; Y134-M138 WeakPolarHBondContact O-CB 3.29Å; Y134-M138 PolarHBondContact O-N 2.95Å
135K84.2Confident86.6Confident181 Ų18184.3 Ų84.379%0.78742%0.423SS*.Hα-helixtrans-59.9-34.8176.9-77.9-159176-168.10113.5P131 L132P131-K135 PolarHBondContact O-N 3.48Å; P131-K135 VanDerWaalsContact O-N 3.15Å; L132-K135 PolarHBondContact O-N 3.44Å
136L83.1Confident87Confident143 Ų14385.3 Ų85.375%0.74943%0.431SS*.Hα-helixtrans-81.1-31.2-180-68.7167.4000113.1L132 R133 Y134L132-L136 WeakPolarHBondContact O-CG 3.39Å; L132-L136 PolarHBondContact O-N 2.91Å; R133-L136 PolarHBondContact O-N 2.72Å; Y134-L136 VanDerWaalsContact C-N 3.26Å; Y134-L136 PolarHBondContact O-N 2.88Å
137R83.4Confident87.5Confident172 Ų17282.8 Ų82.865%0.64942%0.419SS*.Hα-helixtrans-96.9-32.7-175.6-69.1-162.2-168.8-166.45.1113.9R133 Y134 T139 R142R133-R137 VanDerWaalsContact O-CB 3.29Å; R133-R137 WeakPolarHBondContact O-CB 3.32Å; R133-R137 WeakPolarHBondContact O-CG 3.5Å; R133-R137 PolarHBondContact O-N 3.14Å; Y134-R137 PolarHBondContact O-N 3.31Å; R137-T139 PolarHBondContact O-N 3.25Å; R137-R142 WeakPolarHBondContact O-CD 3.37Å; R137-R142 PolarHBondContact O-NH1 3.49Å
138M87.7Confident88Confident24 Ų2484.5 Ų84.512%0.11843%0.428CS..  trans-9696.1-166.7-159.755.718000111.9T60 F64 Y134 A143 L146T60-M138 HydrophobicContact CG2-CE 4.36Å; T60-M138 HydrophobicContact CG2-CG 3.94Å; F64-M138 HydrophobicContact CE1-CE 4.46Å; F64-M138 HydrophobicContact CE2-CE 3.4Å; F64-M138 VanDerWaalsContact CE2-CE 3.4Å; F64-M138 HydrophobicContact CZ-CE 3.21Å; Y134-M138 HydrophobicContact CD1-CB 4.42Å; Y134-M138 HydrophobicContact CD2-CB 3.88Å; Y134-M138 HydrophobicContact CD2-CG 4.27Å; Y134-M138 HydrophobicContact CE1-CB 4.21Å; Y134-M138 HydrophobicContact CE2-CB 3.65Å; Y134-M138 HydrophobicContact CE2-CG 3.58Å; Y134-M138 HydrophobicContact CG-CB 4.26Å; Y134-M138 VanDerWaalsContact O-CB 3.24Å; Y134-M138 WeakPolarHBondContact O-CB 3.29Å; Y134-M138 PolarHBondContact O-N 2.95Å; M138-A143 HydrophobicContact CE-CB 3.66Å; M138-L146 HydrophobicContact CE-CD1 4.06Å
139T90.8Very high88.8Confident48 Ų4883.3 Ų83.329%0.29443%0.432SS..  trans-108.8153.9179.662.60000111R137 R142 A143R137-T139 PolarHBondContact O-N 3.25Å; T139-R142 PolarHBondContact O-N 2.97Å; T139-R142 VanDerWaalsContact O-N 3.08Å; T139-R142 WeakPolarHBondContact OG1-CG 3.38Å; T139-A143 PolarHBondContact O-N 2.98Å
140P89.8Confident89.5Confident67 Ų6781.3 Ų81.344%0.43542%0.423SS..Hα-helixtrans-50.3-45.1176.9-26.334.2000115.6R142 A143 L144P140-R142 VanDerWaalsContact C-N 3.31Å; P140-R142 PolarHBondContact O-N 3.47Å; P140-A143 PolarHBondContact O-N 3.49Å; P140-L144 PolarHBondContact O-N 3.46Å
141P92.5Very high90.3Very high92 Ų9282 Ų8260%0.59742%0.42SS*.Hα-helixtrans-65.3-33.2178.124.5-34.9000112.8A145P141-A145 WeakPolarHBondContact O-CB 3.17Å; P141-A145 PolarHBondContact O-N 3.46Å
142R92.8Very high90.9Very high138 Ų13881.9 Ų81.952%0.52142%0.421SS..Hα-helixtrans-69.9-40.3174.8-71.4177.6177.8167.61.9111.7R137 T139 P140 L144 A145 L146R137-R142 WeakPolarHBondContact O-CD 3.37Å; R137-R142 PolarHBondContact O-NH1 3.49Å; T139-R142 PolarHBondContact O-N 2.97Å; T139-R142 VanDerWaalsContact O-N 3.08Å; T139-R142 WeakPolarHBondContact OG1-CG 3.38Å; P140-R142 VanDerWaalsContact C-N 3.31Å; P140-R142 PolarHBondContact O-N 3.47Å; R142-L144 VanDerWaalsContact C-N 3.34Å; R142-A145 PolarHBondContact O-N 3.25Å; R142-L146 WeakPolarHBondContact O-CG 3.5Å; R142-L146 PolarHBondContact O-N 3.39Å
143A93.2Very high91.5Very high0 Ų079.3 Ų79.30%041%0.407CS..Hα-helixtrans-60.3-45.7174.200000111.2T60 F64 M138 T139 P140 A145 L146 V147T60-A143 HydrophobicContact CG2-CB 3.72Å; F64-A143 HydrophobicContact CZ-CB 4.22Å; M138-A143 HydrophobicContact CE-CB 3.66Å; T139-A143 PolarHBondContact O-N 2.98Å; P140-A143 PolarHBondContact O-N 3.49Å; A143-A145 PolarHBondContact O-N 3.43Å; A143-L146 PolarHBondContact O-N 2.94Å; A143-V147 WeakPolarHBondContact O-CG2 3.31Å; A143-V147 PolarHBondContact O-N 3.3Å
144L93.6Very high92Very high89 Ų8971.4 Ų71.447%0.46638%0.377SS..Hα-helixtrans-61.8-43.1175.3-177.162.3000111.9P140 R142 L146 V147 L148P140-L144 PolarHBondContact O-N 3.46Å; R142-L144 VanDerWaalsContact C-N 3.34Å; L144-L146 VanDerWaalsContact C-N 3.35Å; L144-L146 PolarHBondContact O-N 2.93Å; L144-V147 PolarHBondContact O-N 3.46Å; L144-L148 HydrophobicContact CD1-CD1 4.41Å; L144-L148 HydrophobicContact CD1-CG 4.3Å; L144-L148 HydrophobicContact CG-CD1 4.06Å; L144-L148 HydrophobicContact CG-CG 4.39Å; L144-L148 WeakPolarHBondContact O-CB 3.45Å; L144-L148 WeakPolarHBondContact O-CG 3.49Å; L144-L148 PolarHBondContact O-N 3.04Å
145A95.3Very high92.3Very high60 Ų6071.4 Ų71.450%0.49638%0.384SS..Hα-helixtrans-61.5-40.6176.700000112.6P141 R142 A143 L148 G149P141-A145 WeakPolarHBondContact O-CB 3.17Å; P141-A145 PolarHBondContact O-N 3.46Å; R142-A145 PolarHBondContact O-N 3.25Å; A143-A145 PolarHBondContact O-N 3.43Å; A145-L148 PolarHBondContact O-N 3.17Å; A145-G149 PolarHBondContact O-N 3.34Å
146L94.9Very high92.7Very high76 Ų7667.7 Ų67.740%0.39837%0.372SS..Hα-helixtrans-64-43.1174.8-72.4172000111.8F64 L119 M138 R142 A143 L144 G149 A150F64-L146 HydrophobicContact CE1-CB 4.18Å; F64-L146 HydrophobicContact CE1-CD1 4.47Å; F64-L146 HydrophobicContact CZ-CD1 4.13Å; L119-L146 HydrophobicContact CD1-CB 4.37Å; L119-L146 HydrophobicContact CD2-CB 4.16Å; M138-L146 HydrophobicContact CE-CD1 4.06Å; R142-L146 WeakPolarHBondContact O-CG 3.5Å; R142-L146 PolarHBondContact O-N 3.39Å; A143-L146 PolarHBondContact O-N 2.94Å; L144-L146 VanDerWaalsContact C-N 3.35Å; L144-L146 PolarHBondContact O-N 2.93Å; L146-G149 PolarHBondContact O-N 2.92Å; L146-A150 PolarHBondContact O-N 3Å
147V96.2Very high92.9Very high15 Ų1561.8 Ų61.89%0.09134%0.344CS..Hα-helixtrans-59.5-54.5174.9166.10000110.1F64 S67 A143 L144 G149 A150 W151F64-V147 HydrophobicContact CD1-CG2 3.75Å; F64-V147 HydrophobicContact CE1-CG2 4.04Å; S67-V147 VanDerWaalsContact OG-CG1 3.28Å; S67-V147 WeakPolarHBondContact OG-CG1 3.4Å; A143-V147 WeakPolarHBondContact O-CG2 3.31Å; A143-V147 PolarHBondContact O-N 3.3Å; L144-V147 PolarHBondContact O-N 3.46Å; V147-G149 PolarHBondContact O-N 3.48Å; V147-A150 WeakPolarHBondContact O-CB 3.31Å; V147-A150 PolarHBondContact O-N 3.02Å; V147-W151 PolarHBondContact O-N 2.66Å
148L96.3Very high93.3Very high100 Ų10053.7 Ų53.752%0.52431%0.314SS..Hα-helixtrans-57.9-38.8178.7-68.9173.3000112L144 A145 W151 S152L144-L148 HydrophobicContact CD1-CD1 4.41Å; L144-L148 HydrophobicContact CD1-CG 4.3Å; L144-L148 HydrophobicContact CG-CD1 4.06Å; L144-L148 HydrophobicContact CG-CG 4.39Å; L144-L148 WeakPolarHBondContact O-CB 3.45Å; L144-L148 WeakPolarHBondContact O-CG 3.49Å; L144-L148 PolarHBondContact O-N 3.04Å; A145-L148 PolarHBondContact O-N 3.17Å; L148-W151 PolarHBondContact O-N 3.21Å; L148-S152 WeakPolarHBondContact O-CB 3.41Å; L148-S152 PolarHBondContact O-N 2.95Å; L148-S152 PolarHBondContact O-OG 3.2Å
149G95.6Very high93.4Very high41 Ų4154.8 Ų54.842%0.42332%0.318SS..Hα-helixtrans-60.6-43173.600000112.9A145 L146 V147 S152 L153A145-G149 PolarHBondContact O-N 3.34Å; L146-G149 PolarHBondContact O-N 2.92Å; V147-G149 PolarHBondContact O-N 3.48Å; G149-S152 PolarHBondContact O-N 2.93Å; G149-L153 WeakPolarHBondContact O-CB 3.49Å; G149-L153 PolarHBondContact O-N 3.47Å
150A95.3Very high93.3Very high10 Ų1056.4 Ų56.48%0.08332%0.324CS..Hα-helixtrans-65.1-43.217600000112.5L115 L119 L146 V147 L153 A154L115-A150 HydrophobicContact CB-CB 3.95Å; L115-A150 HydrophobicContact CD1-CB 4.48Å; L115-A150 WeakPolarHBondContact CD1-O 3.23Å; L119-A150 HydrophobicContact CD1-CB 3.81Å; L146-A150 PolarHBondContact O-N 3Å; V147-A150 WeakPolarHBondContact O-CB 3.31Å; V147-A150 PolarHBondContact O-N 3.02Å; A150-L153 PolarHBondContact O-N 3.22Å; A150-A154 WeakPolarHBondContact O-CB 3.27Å; A150-A154 PolarHBondContact O-N 3.31Å
151W96.9Very high93Very high50 Ų5054.1 Ų54.119%0.18931%0.309CS..Hα-helixtrans-63.4-44.6175.6-78.593.3000111.9S67 T70 M74 A112 V147 L148 L153 A154 A155S67-W151 PolarHBondContact OG-NE1 3.23Å; T70-W151 HydrophobicContact CG2-CH2 4.46Å; T70-W151 HydrophobicContact CG2-CZ2 4.3Å; M74-W151 HydrophobicContact SD-CH2 3.57Å; M74-W151 VanDerWaalsContact SD-CH2 3.57Å; M74-W151 HydrophobicContact SD-CZ3 3.65Å; A112-W151 HydrophobicContact CB-CD2 4.31Å; A112-W151 HydrophobicContact CB-CE3 4.13Å; A112-W151 HydrophobicContact CB-CH2 4.48Å; A112-W151 HydrophobicContact CB-CZ3 4.22Å; V147-W151 PolarHBondContact O-N 2.66Å; L148-W151 PolarHBondContact O-N 3.21Å; W151-L153 PolarHBondContact O-N 3.01Å; W151-A154 PolarHBondContact O-N 3.47Å; W151-A155 WeakPolarHBondContact O-CB 3.41Å; W151-A155 PolarHBondContact O-N 3.5Å
152S95.8Very high92.4Very high77 Ų7750 Ų5054%0.53828%0.282SS..Hα-helixtrans-62.4-42.2176.1-66.20000111.9L148 G149 A155 L156L148-S152 WeakPolarHBondContact O-CB 3.41Å; L148-S152 PolarHBondContact O-N 2.95Å; L148-S152 PolarHBondContact O-OG 3.2Å; G149-S152 PolarHBondContact O-N 2.93Å; S152-A155 PolarHBondContact O-N 2.98Å; S152-L156 WeakPolarHBondContact O-CB 3.44Å; S152-L156 PolarHBondContact O-N 2.85Å
153L93.1Very high92Very high86 Ų8649.8 Ų49.845%0.4529%0.291SS..Hα-helixtrans-63.6-44176.2-179.661.2000111.4L115 G149 A150 W151 L156 A157L115-L153 HydrophobicContact CD1-CB 4.2Å; L115-L153 HydrophobicContact CD1-CD2 4Å; L115-L153 HydrophobicContact CD1-CG 4.13Å; L115-L153 HydrophobicContact CD2-CD2 4.2Å; G149-L153 WeakPolarHBondContact O-CB 3.49Å; G149-L153 PolarHBondContact O-N 3.47Å; A150-L153 PolarHBondContact O-N 3.22Å; W151-L153 PolarHBondContact O-N 3.01Å; L153-L156 PolarHBondContact O-N 3.01Å; L153-A157 WeakPolarHBondContact O-CB 3.44Å; L153-A157 PolarHBondContact O-N 2.83Å
154A94.8Very high91.5Very high0 Ų054.4 Ų54.40%032%0.315CS..Hα-helixtrans-61.9-46.2175.700000111.9M108 A112 L115 A150 W151 A157 S158M108-A154 HydrophobicContact CG-CB 4.23Å; A112-A154 HydrophobicContact CB-CB 3.97Å; L115-A154 HydrophobicContact CD1-CB 4.17Å; A150-A154 WeakPolarHBondContact O-CB 3.27Å; A150-A154 PolarHBondContact O-N 3.31Å; W151-A154 PolarHBondContact O-N 3.47Å; A154-A157 PolarHBondContact O-N 2.91Å; A154-S158 VanDerWaalsContact O-CB 3.31Å; A154-S158 WeakPolarHBondContact O-CB 3.49Å; A154-S158 PolarHBondContact O-N 3.3Å; A154-S158 VanDerWaalsContact O-N 3.1Å; A154-S158 PolarHBondContact O-OG 2.96Å
155A94.3Very high90.6Very high31 Ų3151.4 Ų51.426%0.25631%0.306SS..Hα-helixtrans-63.4-45.3178.600000111.3M108 W151 S152 S158 F159M108-A155 HydrophobicContact CG-CB 4.3Å; M108-A155 HydrophobicContact SD-CB 3.84Å; W151-A155 WeakPolarHBondContact O-CB 3.41Å; W151-A155 PolarHBondContact O-N 3.5Å; S152-A155 PolarHBondContact O-N 2.98Å; A155-S158 PolarHBondContact O-N 3.45Å; A155-F159 WeakPolarHBondContact O-CB 2.96Å; A155-F159 WeakPolarHBondContact O-CD2 3.44Å; A155-F159 PolarHBondContact O-N 2.74Å
156L91.5Very high89.6Confident102 Ų10255.8 Ų55.853%0.53431%0.31SS..Hα-helixtrans-64.1-45.9178.6-171.567.9000111.5S152 L153 S158 L160S152-L156 WeakPolarHBondContact O-CB 3.44Å; S152-L156 PolarHBondContact O-N 2.85Å; L153-L156 PolarHBondContact O-N 3.01Å; L156-S158 PolarHBondContact O-N 2.86Å; L156-L160 HydrophobicContact CD1-CB 4.08Å; L156-L160 HydrophobicContact CD1-CD2 3.86Å; L156-L160 HydrophobicContact CD1-CG 4.42Å; L156-L160 HydrophobicContact CG-CD2 4.36Å; L156-L160 WeakPolarHBondContact O-CB 3.47Å; L156-L160 PolarHBondContact O-N 3.25Å
157A88.5Confident88.5Confident20 Ų2053.1 Ų53.117%0.16530%0.295CS..Hα-helixtrans-65-21.1178.600000113.3L153 A154 P161 T196L153-A157 WeakPolarHBondContact O-CB 3.44Å; L153-A157 PolarHBondContact O-N 2.83Å; A154-A157 PolarHBondContact O-N 2.91Å; A157-P161 WeakPolarHBondContact O-CD 3.11Å; A157-P161 WeakPolarHBondContact O-CG 3.34Å; A157-T196 HydrophobicContact CB-CG2 4.04Å
158S90.3Very high87Confident1 Ų156.3 Ų56.31%0.00731%0.309CS..Hα-helixtrans-100.6-55.7-176.9-49.70000112.5V107 M108 A154 A155 L156 L162V107-S158 WeakPolarHBondContact CG1-OG 3.45Å; M108-S158 WeakPolarHBondContact CA-OG 3.4Å; M108-S158 PolarHBondContact N-OG 3.39Å; M108-S158 VanDerWaalsContact N-OG 3.1Å; A154-S158 VanDerWaalsContact O-CB 3.31Å; A154-S158 WeakPolarHBondContact O-CB 3.49Å; A154-S158 PolarHBondContact O-N 3.3Å; A154-S158 VanDerWaalsContact O-N 3.1Å; A154-S158 PolarHBondContact O-OG 2.96Å; A155-S158 PolarHBondContact O-N 3.45Å; L156-S158 PolarHBondContact O-N 2.86Å; S158-L162 WeakPolarHBondContact O-CD1 3.38Å
159F90.6Very high85.3Confident48 Ų4857 Ų5721%0.21131%0.313CS..Hα-helixtrans-74.4-40-174.7-77.1-96.8000112.4L101 A104 F105 M108 A155 L162 L163L101-F159 HydrophobicContact CD1-CE1 4.14Å; A104-F159 HydrophobicContact CB-CD1 3.9Å; A104-F159 HydrophobicContact CB-CD2 4.36Å; A104-F159 HydrophobicContact CB-CE1 3.73Å; A104-F159 HydrophobicContact CB-CE2 4.18Å; A104-F159 HydrophobicContact CB-CG 4.22Å; A104-F159 HydrophobicContact CB-CZ 3.88Å; F105-F159 HydrophobicContact CD1-CZ 4.33Å; F105-F159 HydrophobicContact CD2-CZ 4.31Å; F105-F159 HydrophobicContact CE1-CZ 4.22Å; F105-F159 HydrophobicContact CE2-CZ 4.22Å; F105-F159 HydrophobicContact CG-CZ 4.35Å; F105-F159 HydrophobicContact CZ-CZ 4.16Å; M108-F159 HydrophobicContact CB-CE2 4.09Å; M108-F159 HydrophobicContact CE-CE2 4.33Å; M108-F159 HydrophobicContact CG-CE2 4.35Å; M108-F159 HydrophobicContact SD-CD2 4.27Å; M108-F159 HydrophobicContact SD-CE2 3.6Å; M108-F159 VanDerWaalsContact SD-CE2 3.6Å; A155-F159 WeakPolarHBondContact O-CB 2.96Å; A155-F159 WeakPolarHBondContact O-CD2 3.44Å; A155-F159 PolarHBondContact O-N 2.74Å; F159-L162 PolarHBondContact O-N 3.45Å; F159-L163 HydrophobicContact CB-CD1 4.32Å; F159-L163 WeakPolarHBondContact O-CB 3.33Å; F159-L163 VanDerWaalsContact O-CG 3.24Å; F159-L163 WeakPolarHBondContact O-CG 3.25Å; F159-L163 PolarHBondContact O-N 3.06Å
160L88.6Confident83.4Confident81 Ų8158.8 Ų58.842%0.42433%0.331SS..Hα-helixtrans-61-49.1-174.3-173.471.5000112.4L156 L162 L163 L164L156-L160 HydrophobicContact CD1-CB 4.08Å; L156-L160 HydrophobicContact CD1-CD2 3.86Å; L156-L160 HydrophobicContact CD1-CG 4.42Å; L156-L160 HydrophobicContact CG-CD2 4.36Å; L156-L160 WeakPolarHBondContact O-CB 3.47Å; L156-L160 PolarHBondContact O-N 3.25Å; L160-L162 VanDerWaalsContact C-N 3.3Å; L160-L162 PolarHBondContact O-N 3.46Å; L160-L163 PolarHBondContact O-N 3.45Å; L160-L164 HydrophobicContact CD1-CD1 3.82Å; L160-L164 HydrophobicContact CD1-CG 4.27Å; L160-L164 HydrophobicContact CG-CD1 3.88Å; L160-L164 WeakPolarHBondContact O-CB 3.45Å; L160-L164 VanDerWaalsContact O-CG 3.28Å; L160-L164 WeakPolarHBondContact O-CG 3.48Å; L160-L164 PolarHBondContact O-N 3.29Å; L160-L164 VanDerWaalsContact O-N 3.08Å
161P83.4Confident81.7Confident19 Ų1961.7 Ų61.712%0.12334%0.343CS..Hα-helixtrans-67.9-30.1179.6-21.936.2000113.4A157 G165 W166 F188A157-P161 WeakPolarHBondContact O-CD 3.11Å; A157-P161 WeakPolarHBondContact O-CG 3.34Å; P161-G165 PolarHBondContact O-N 2.93Å; P161-W166 HydrophobicContact CB-CB 4.14Å; P161-W166 PolarHBondContact O-N 3.39Å; P161-F188 HydrophobicContact CB-CD2 3.75Å; P161-F188 HydrophobicContact CB-CE2 3.36Å; P161-F188 HydrophobicContact CB-CZ 4.47Å; P161-F188 HydrophobicContact CG-CD2 4.45Å; P161-F188 HydrophobicContact CG-CE2 3.91Å
162L80.6Confident79.4Confident6 Ų664.3 Ų64.33%0.03138%0.375CS..Hα-helixtrans-74.3-43.7179-92.767.7000111.5L100 T103 A104 S158 F159 L160 G165 L182 F188L100-L162 HydrophobicContact CD1-CB 4.2Å; L100-L162 HydrophobicContact CD1-CD2 3.88Å; L100-L162 HydrophobicContact CD1-CG 4Å; T103-L162 HydrophobicContact CG2-CD2 4.05Å; A104-L162 HydrophobicContact CB-CD2 3.77Å; S158-L162 WeakPolarHBondContact O-CD1 3.38Å; F159-L162 PolarHBondContact O-N 3.45Å; L160-L162 VanDerWaalsContact C-N 3.3Å; L160-L162 PolarHBondContact O-N 3.46Å; L162-G165 PolarHBondContact O-N 2.94Å; L162-L182 HydrophobicContact CD1-CD1 4.3Å; L162-L182 HydrophobicContact CG-CD1 4.45Å; L162-F188 HydrophobicContact CD1-CE2 4.4Å; L162-F188 HydrophobicContact CD1-CZ 4Å
163L82.6Confident77.3Confident134 Ų13469.8 Ų69.870%0.70238%0.384SS*.Hα-helixtrans-66.9-35.2177.7-69.5174.4000112.6F159 L160 G165F159-L163 HydrophobicContact CB-CD1 4.32Å; F159-L163 WeakPolarHBondContact O-CB 3.33Å; F159-L163 VanDerWaalsContact O-CG 3.24Å; F159-L163 WeakPolarHBondContact O-CG 3.25Å; F159-L163 PolarHBondContact O-N 3.06Å; L160-L163 PolarHBondContact O-N 3.45Å; L163-G165 VanDerWaalsContact C-N 3.28Å; L163-G165 PolarHBondContact O-N 2.97Å
164L83.4Confident75.4Confident96 Ų9671.1 Ų71.150%0.50340%0.397SS..THydrogen-bonded Turntrans-82.6-1.4177.3-63.8177.9000113.6L160 W166L160-L164 HydrophobicContact CD1-CD1 3.82Å; L160-L164 HydrophobicContact CD1-CG 4.27Å; L160-L164 HydrophobicContact CG-CD1 3.88Å; L160-L164 WeakPolarHBondContact O-CB 3.45Å; L160-L164 VanDerWaalsContact O-CG 3.28Å; L160-L164 WeakPolarHBondContact O-CG 3.48Å; L160-L164 PolarHBondContact O-N 3.29Å; L160-L164 VanDerWaalsContact O-N 3.08Å; L164-W166 HydrophobicContact CB-CG 4.23Å; L164-W166 HydrophobicContact CD1-CZ2 4.41Å; L164-W166 PolarHBondContact O-N 2.97Å
165G75.2Confident73.6Confident27 Ų2775 Ų7528%0.27842%0.423SS..THydrogen-bonded Turntrans69.416.6-178.300000114.5P161 L162 L163 H167 E168P161-G165 PolarHBondContact O-N 2.93Å; L162-G165 PolarHBondContact O-N 2.94Å; L163-G165 VanDerWaalsContact C-N 3.28Å; L163-G165 PolarHBondContact O-N 2.97Å; G165-H167 PolarHBondContact O-N 3.36Å; G165-E168 PolarHBondContact O-N 3.3Å; G165-E168 VanDerWaalsContact O-N 3.07Å
166W74Confident71.9Confident151 Ų15179 Ų7957%0.57244%0.443SS*.G310 helixtrans-64-23.5-178.5-7619.7000113.8P161 L164 E168 L169P161-W166 HydrophobicContact CB-CB 4.14Å; P161-W166 PolarHBondContact O-N 3.39Å; L164-W166 HydrophobicContact CB-CG 4.23Å; L164-W166 HydrophobicContact CD1-CZ2 4.41Å; L164-W166 PolarHBondContact O-N 2.97Å; W166-E168 PolarHBondContact O-N 3.24Å; W166-L169 HydrophobicContact CB-CD1 4.42Å; W166-L169 HydrophobicContact CG-CD1 4.29Å; W166-L169 PolarHBondContact O-N 3.31Å
167H70.9Confident70.1Confident21 Ų2178.7 Ų78.710%0.09745%0.448CS..G310 helixtrans-63.5-26.4174.262.2-77.1000113G165 L182 A184 S185 F188G165-H167 PolarHBondContact O-N 3.36Å; H167-L182 HydrophobicContact CB-CD1 4.04Å; H167-A184 WeakPolarHBondContact O-CA 3.5Å; H167-S185 PolarHBondContact O-N 3.03Å; H167-F188 HydrophobicContact CB-CD1 4.4Å; H167-F188 HydrophobicContact CB-CE1 4.44Å
168E66.1Low68.9Low82 Ų8279 Ų7938%0.38345%0.453SS..G310 helixtrans-94.6-9.6-179.5-64.8-64.117000114G165 W166 G170 H171G165-E168 PolarHBondContact O-N 3.3Å; G165-E168 VanDerWaalsContact O-N 3.07Å; W166-E168 PolarHBondContact O-N 3.24Å; E168-G170 PolarHBondContact O-N 3.37Å; E168-H171 PolarHBondContact O-N 3.44Å; E168-H171 IonicContact OE2-ND1 3.32Å; E168-H171 PolarHBondContact OE2-ND1 3.02Å
169L59.2Low67.6Low115 Ų11582.5 Ų82.560%0.60247%0.469SS*.THydrogen-bonded Turntrans-65.7100.5-179.7-96.9111.8000110.3W166 S185W166-L169 HydrophobicContact CB-CD1 4.42Å; W166-L169 HydrophobicContact CG-CD1 4.29Å; W166-L169 PolarHBondContact O-N 3.31Å; L169-S185 WeakPolarHBondContact O-CB 3.48Å; L169-S185 PolarHBondContact O-OG 3.08Å
170G56.6Low66.7Low77 Ų7780.4 Ų80.479%0.79446%0.461SS*.THydrogen-bonded Turntrans119.9-1174.900000116.1E168E168-G170 PolarHBondContact O-N 3.37Å
171H59.4Low65.8Low72 Ų7280.3 Ų80.333%0.33346%0.455SS..  trans-82.3130.6175.4-71.2124.3000113E168 L183 A184 S185E168-H171 PolarHBondContact O-N 3.44Å; E168-H171 IonicContact OE2-ND1 3.32Å; E168-H171 PolarHBondContact OE2-ND1 3.02Å; H171-L183 VanDerWaalsContact CE1-C 3.45Å; H171-A184 VanDerWaalsContact CE1-C 3.48Å; H171-A184 PolarHBondContact CE1-N 3.47Å; H171-S185 PolarHBondContact CE1-N 2.86Å
172A47.8Very low65Low105 Ų10582 Ų8287%0.86846%0.463SS*.  trans-99.12.317100000113.3
173R53Low64.4Low191 Ų19184.6 Ų84.672%0.72148%0.476SS*.SBendtrans-125.2133.3-178.7-73.9-178.1-176.1160.31.2111.6
174P52.9Low63.9Low114 Ų11478.8 Ų78.874%0.7445%0.447SS*.PPolyproline II helixtrans-69.2148.717628.7-32.9000110.9
175P57.6Low63.7Low83 Ų8374.6 Ų74.654%0.53943%0.426SS..PPolyproline II helixtrans-59.5140.8176.523.5-32.5000111
176V57Low64.1Low113 Ų11376.5 Ų76.569%0.68543%0.429SS*.PPolyproline II helixtrans-59.1126174.3-179.60000108.6G178V176-G178 PolarHBondContact O-N 3.37Å; V176-G178 VanDerWaalsContact O-N 3.07Å
177P55.1Low64.6Low96 Ų9673.5 Ų73.562%0.62343%0.429SS*.THydrogen-bonded Turntrans-65.7114.7-174.822.4-30.5000111W15W15-P177 HydrophobicContact CE3-CB 4.32Å; W15-P177 HydrophobicContact CH2-CB 3.53Å; W15-P177 HydrophobicContact CZ2-CB 4.34Å; W15-P177 HydrophobicContact CZ3-CB 3.52Å
178G62.5Low65.2Low27 Ų2773.5 Ų73.528%0.27843%0.429SS..THydrogen-bonded Turntrans126.6-13.1161.200000115.6R91 W92 V176R91-G178 CarbonylContact C-O 3.45Å; R91-G178 WeakPolarHBondContact CA-O 3.45Å; R91-G178 WeakPolarHBondContact CB-O 3.45Å; W92-G178 PolarHBondContact N-O 2.96Å; V176-G178 PolarHBondContact O-N 3.37Å; V176-G178 VanDerWaalsContact O-N 3.07Å
179Q63.9Low66.2Low74 Ų7469.7 Ų69.735%0.34641%0.412SS..  trans-106.4136.4177.1-75.1179.9-7.700111.5G90 R181G90-Q179 WeakPolarHBondContact O-CG 3.39Å; G90-Q179 PolarHBondContact O-NE2 3.37Å; Q179-R181 PolarHBondContact O-N 2.86Å; Q179-R181 VanDerWaalsContact OE1-CZ 3.29Å
180C70.6Confident67.6Low5 Ų568.3 Ų68.33%0.03440%0.404CS..  trans-84.697.5168.7-174.60000108.1N86 W92 C99 W102N86-C180 PolarHBondContact ND2-O 3.48Å; W92-C180 HydrophobicContact CB-CB 3.81Å; W92-C180 HydrophobicContact CD2-CB 3.45Å; W92-C180 VanDerWaalsContact CD2-CB 3.45Å; W92-C180 HydrophobicContact CE3-CB 3.22Å; W92-C180 HydrophobicContact CG-CB 3.73Å; W92-C180 HydrophobicContact CZ3-CB 3.93Å; C99-C180 WeakPolarHBondContact CA-SG 3.42Å; C99-C180 HydrophobicContact CB-CB 3.89Å; C99-C180 WeakPolarHBondContact CB-SG 3.49Å; C99-C180 WeakPolarHBondContact SG-CB 3.29Å; C99-C180 CovalentContact SG-SG 2.02Å; C99-C180 PolarHBondContact SG-SG 3.4Å; W102-C180 VanDerWaalsContact CE3-SG 3.57Å; W102-C180 HydrophobicContact CZ3-CB 4.18Å
181R69.2Low69.1Low78 Ų7869 Ų6929%0.29439%0.393SS..  trans-128.6138.2170.5-73.5-166.5169.4123.712.7108.7Q179 L183 D303Q179-R181 PolarHBondContact O-N 2.86Å; Q179-R181 VanDerWaalsContact OE1-CZ 3.29Å; R181-L183 VanDerWaalsContact C-N 3.31Å; R181-L183 HydrophobicContact CB-CD1 4.41Å; R181-L183 PolarHBondContact O-N 3.16Å; R181-D303 IonicContact NH2-OD1 3.42Å; R181-D303 PolarHBondContact NH2-OD1 3.49Å; R181-D303 IonicContact NH2-OD2 3.46Å; R181-D303 PolarHBondContact NH2-OD2 2.9Å
182L68.1Low70.3Confident56 Ų5666.2 Ų66.229%0.29338%0.382SS..  trans-72.690.8170.5-171.864.2000107.9T103 L162 H167 A184 F188T103-L182 HydrophobicContact CG2-CB 3.73Å; T103-L182 HydrophobicContact CG2-CD1 3.82Å; T103-L182 HydrophobicContact CG2-CD2 3.84Å; T103-L182 HydrophobicContact CG2-CG 3.98Å; L162-L182 HydrophobicContact CD1-CD1 4.3Å; L162-L182 HydrophobicContact CG-CD1 4.45Å; H167-L182 HydrophobicContact CB-CD1 4.04Å; L182-A184 HydrophobicContact CD2-CB 4.3Å; L182-A184 HydrophobicContact CG-CB 3.92Å; L182-A184 PolarHBondContact O-N 3.22Å; L182-F188 HydrophobicContact CD2-CE1 3.86Å; L182-F188 HydrophobicContact CD2-CZ 4.28Å
183L66.4Low72.3Confident60 Ų6061.3 Ų61.331%0.31434%0.342SS..  trans-71.9113.6162.5-104.772000106.4H171 R181H171-L183 VanDerWaalsContact CE1-C 3.45Å; R181-L183 VanDerWaalsContact C-N 3.31Å; R181-L183 HydrophobicContact CB-CD1 4.41Å; R181-L183 PolarHBondContact O-N 3.16Å
184A72Confident74.1Confident11 Ų1153.4 Ų53.49%0.09132%0.319CS..  trans-128.9127.4-167.700000109H167 H171 L182 F188 V189H167-A184 WeakPolarHBondContact O-CA 3.5Å; H171-A184 VanDerWaalsContact CE1-C 3.48Å; H171-A184 PolarHBondContact CE1-N 3.47Å; L182-A184 HydrophobicContact CD2-CB 4.3Å; L182-A184 HydrophobicContact CG-CB 3.92Å; L182-A184 PolarHBondContact O-N 3.22Å; A184-F188 HydrophobicContact CB-CD1 3.33Å; A184-F188 HydrophobicContact CB-CE1 3.59Å; A184-V189 HydrophobicContact CB-CG2 3.67Å
185S80Confident75.8Confident8 Ų852.1 Ų52.16%0.05631%0.306CS..  trans-59.6148.7-179.768.10000111.4H167 L169 H171 P187 F188 V189H167-S185 PolarHBondContact O-N 3.03Å; L169-S185 WeakPolarHBondContact O-CB 3.48Å; L169-S185 PolarHBondContact O-OG 3.08Å; H171-S185 PolarHBondContact CE1-N 2.86Å; S185-P187 VanDerWaalsContact C-CD 3.47Å; S185-P187 VanDerWaalsContact C-N 3.33Å; S185-F188 WeakPolarHBondContact O-CA 3.47Å; S185-F188 WeakPolarHBondContact O-CB 3.49Å; S185-F188 PolarHBondContact O-N 3.39Å; S185-F188 WeakPolarHBondContact OG-CB 3.45Å; S185-V189 PolarHBondContact O-N 3.29Å
186L83.6Confident77.2Confident67 Ų6748.5 Ų48.535%0.35128%0.283SS..Hα-helixtrans-51-46179.317969.2000113F188 V189 L190 A292 V293L186-F188 VanDerWaalsContact C-N 3.31Å; L186-F188 PolarHBondContact O-N 3.42Å; L186-V189 PolarHBondContact O-N 2.84Å; L186-L190 HydrophobicContact CD1-CD1 4.12Å; L186-L190 HydrophobicContact CD1-CG 4.11Å; L186-L190 HydrophobicContact CG-CD1 3.95Å; L186-L190 HydrophobicContact CG-CG 4.35Å; L186-L190 WeakPolarHBondContact O-CB 3.46Å; L186-L190 VanDerWaalsContact O-CG 3.28Å; L186-L190 WeakPolarHBondContact O-CG 3.43Å; L186-L190 PolarHBondContact O-N 2.99Å; L186-A292 HydrophobicContact CD1-CB 4.14Å; L186-V293 HydrophobicContact CD1-CG2 3.62Å; L186-V293 HydrophobicContact CD2-CG2 4.45Å
187P84.5Confident78.8Confident88 Ų8843.2 Ų43.257%0.57125%0.25SS*.Hα-helixtrans-59.4-41.1176.3-23.634.7000112.8S185 V191S185-P187 VanDerWaalsContact C-CD 3.47Å; S185-P187 VanDerWaalsContact C-N 3.33Å; P187-V191 WeakPolarHBondContact O-CB 3.33Å; P187-V191 VanDerWaalsContact O-CG2 3.31Å; P187-V191 WeakPolarHBondContact O-CG2 3.47Å; P187-V191 PolarHBondContact O-N 3.48Å
188F84.4Confident80.6Confident22 Ų2242.6 Ų42.610%0.09624%0.238CC..Hα-helixtrans-64.5-47.1177.4167.9-94.7000111.3P161 L162 H167 L182 A184 S185 L186 L190 V191 A192P161-F188 HydrophobicContact CB-CD2 3.75Å; P161-F188 HydrophobicContact CB-CE2 3.36Å; P161-F188 HydrophobicContact CB-CZ 4.47Å; P161-F188 HydrophobicContact CG-CD2 4.45Å; P161-F188 HydrophobicContact CG-CE2 3.91Å; L162-F188 HydrophobicContact CD1-CE2 4.4Å; L162-F188 HydrophobicContact CD1-CZ 4Å; H167-F188 HydrophobicContact CB-CD1 4.4Å; H167-F188 HydrophobicContact CB-CE1 4.44Å; L182-F188 HydrophobicContact CD2-CE1 3.86Å; L182-F188 HydrophobicContact CD2-CZ 4.28Å; A184-F188 HydrophobicContact CB-CD1 3.33Å; A184-F188 HydrophobicContact CB-CE1 3.59Å; S185-F188 WeakPolarHBondContact O-CA 3.47Å; S185-F188 WeakPolarHBondContact O-CB 3.49Å; S185-F188 PolarHBondContact O-N 3.39Å; S185-F188 WeakPolarHBondContact OG-CB 3.45Å; L186-F188 VanDerWaalsContact C-N 3.31Å; L186-F188 PolarHBondContact O-N 3.42Å; F188-L190 VanDerWaalsContact C-N 3.33Å; F188-L190 PolarHBondContact O-N 2.91Å; F188-V191 PolarHBondContact O-N 3.38Å; F188-A192 HydrophobicContact CE2-CB 4.29Å; F188-A192 HydrophobicContact CZ-CB 4.23Å; F188-A192 WeakPolarHBondContact O-CB 3.49Å; F188-A192 PolarHBondContact O-N 3.47Å
189V86.1Confident82.1Confident2 Ų246.9 Ų46.91%0.01225%0.254CS..Hα-helixtrans-60.4-42.3178.7173.30000111.7A184 S185 L186 S193 I289 A292A184-V189 HydrophobicContact CB-CG2 3.67Å; S185-V189 PolarHBondContact O-N 3.29Å; L186-V189 PolarHBondContact O-N 2.84Å; V189-S193 WeakPolarHBondContact O-CB 3.44Å; V189-S193 PolarHBondContact O-N 2.92Å; V189-S193 PolarHBondContact O-OG 3.31Å; V189-I289 HydrophobicContact CG1-CG1 3.92Å; V189-A292 HydrophobicContact CB-CB 4.15Å; V189-A292 HydrophobicContact CG1-CB 4.34Å; V189-A292 HydrophobicContact CG2-CB 3.87Å
190L88.5Confident83.4Confident85 Ų8543.5 Ų43.545%0.44524%0.238SC..Hα-helixtrans-66-47.1179.4-70.7174.5000112L186 F188 G194 I289L186-L190 HydrophobicContact CD1-CD1 4.12Å; L186-L190 HydrophobicContact CD1-CG 4.11Å; L186-L190 HydrophobicContact CG-CD1 3.95Å; L186-L190 HydrophobicContact CG-CG 4.35Å; L186-L190 WeakPolarHBondContact O-CB 3.46Å; L186-L190 VanDerWaalsContact O-CG 3.28Å; L186-L190 WeakPolarHBondContact O-CG 3.43Å; L186-L190 PolarHBondContact O-N 2.99Å; F188-L190 VanDerWaalsContact C-N 3.33Å; F188-L190 PolarHBondContact O-N 2.91Å; L190-G194 WeakPolarHBondContact O-CA 3.33Å; L190-G194 PolarHBondContact O-N 3.05Å; L190-I289 HydrophobicContact CD2-CD1 4.3Å; L190-I289 HydrophobicContact CD2-CG1 4.34Å; L190-I289 HydrophobicContact CD2-CG2 4.3Å
191V88.1Confident84.4Confident91 Ų9143.5 Ų43.555%0.55224%0.239SC*.Hα-helixtrans-66.2-47.5179.1172.10000110.7P187 F188 G194 L195P187-V191 WeakPolarHBondContact O-CB 3.33Å; P187-V191 VanDerWaalsContact O-CG2 3.31Å; P187-V191 WeakPolarHBondContact O-CG2 3.47Å; P187-V191 PolarHBondContact O-N 3.48Å; F188-V191 PolarHBondContact O-N 3.38Å; V191-G194 PolarHBondContact O-N 3.09Å; V191-L195 HydrophobicContact CG1-CD1 3.85Å; V191-L195 HydrophobicContact CG1-CG 4.48Å; V191-L195 WeakPolarHBondContact O-CB 3.44Å; V191-L195 WeakPolarHBondContact O-CG 3.25Å; V191-L195 PolarHBondContact O-N 3.07Å
192A85.1Confident85.5Confident14 Ų1441.8 Ų41.812%0.11625%0.245CC..Hα-helixtrans-60.7-54.4179.600000110.9F188 G194 L195 T196F188-A192 HydrophobicContact CE2-CB 4.29Å; F188-A192 HydrophobicContact CZ-CB 4.23Å; F188-A192 WeakPolarHBondContact O-CB 3.49Å; F188-A192 PolarHBondContact O-N 3.47Å; A192-G194 VanDerWaalsContact C-N 3.28Å; A192-G194 PolarHBondContact O-N 3.25Å; A192-L195 PolarHBondContact O-N 2.97Å; A192-T196 WeakPolarHBondContact O-CB 3.44Å; A192-T196 WeakPolarHBondContact O-CG2 3.44Å; A192-T196 PolarHBondContact O-N 3.39Å; A192-T196 PolarHBondContact O-OG1 3.45Å
193S89.9Confident86.6Confident2 Ų240.9 Ų40.91%0.01425%0.245CC..Hα-helixtrans-63.6-34.9179.4-51.50000112.1V189 F197 F198V189-S193 WeakPolarHBondContact O-CB 3.44Å; V189-S193 PolarHBondContact O-N 2.92Å; V189-S193 PolarHBondContact O-OG 3.31Å; S193-F197 WeakPolarHBondContact O-CA 3.27Å; S193-F197 WeakPolarHBondContact O-CB 3.36Å; S193-F197 PolarHBondContact O-N 3.35Å; S193-F198 VanDerWaalsContact O-CD2 3.31Å; S193-F198 WeakPolarHBondContact O-CD2 3.44Å; S193-F198 PolarHBondContact O-N 3.26Å
194G90.9Very high87.7Confident25 Ų2538 Ų3826%0.25823%0.231SC..Iπ-helixtrans-60.5-51.1175.800000112.3L190 V191 A192 L199L190-G194 WeakPolarHBondContact O-CA 3.33Å; L190-G194 PolarHBondContact O-N 3.05Å; V191-G194 PolarHBondContact O-N 3.09Å; A192-G194 VanDerWaalsContact C-N 3.28Å; A192-G194 PolarHBondContact O-N 3.25Å; G194-L199 VanDerWaalsContact O-CB 3.27Å; G194-L199 WeakPolarHBondContact O-CB 3.38Å; G194-L199 PolarHBondContact O-N 3.17Å
195L88.5Confident88.5Confident87 Ų8740 Ų4046%0.45524%0.243SC..Iπ-helixtrans-73.2-39.6-177.6-70.7174.2000113V191 A192 P200V191-L195 HydrophobicContact CG1-CD1 3.85Å; V191-L195 HydrophobicContact CG1-CG 4.48Å; V191-L195 WeakPolarHBondContact O-CB 3.44Å; V191-L195 WeakPolarHBondContact O-CG 3.25Å; V191-L195 PolarHBondContact O-N 3.07Å; A192-L195 PolarHBondContact O-N 2.97Å; L195-P200 VanDerWaalsContact O-CD 3.29Å; L195-P200 WeakPolarHBondContact O-CD 3.35Å; L195-P200 WeakPolarHBondContact O-CG 3.39Å
196T86.3Confident89Confident8 Ų845.9 Ų45.95%0.04927%0.268CS..Iπ-helixtrans-95.3-19.2-170.766.10000113.7S111 I114 A157 A192S111-T196 WeakPolarHBondContact OG-CB 3.26Å; S111-T196 VanDerWaalsContact OG-CG2 3.28Å; S111-T196 WeakPolarHBondContact OG-CG2 3.32Å; I114-T196 VanDerWaalsContact CG2-O 3.24Å; I114-T196 WeakPolarHBondContact CG2-O 3.37Å; A157-T196 HydrophobicContact CB-CG2 4.04Å; A192-T196 WeakPolarHBondContact O-CB 3.44Å; A192-T196 WeakPolarHBondContact O-CG2 3.44Å; A192-T196 PolarHBondContact O-N 3.39Å; A192-T196 PolarHBondContact O-OG1 3.45Å
197F91.1Very high89.2Confident1 Ų143.3 Ų43.30%0.00426%0.255CS..Iπ-helixtrans-128.6-58.7-179.4178.7-104.5000114.7I114 S193 L199 P200 S201 F277 F278 W281 L282 F285I114-F197 HydrophobicContact CD1-CD2 4.24Å; S193-F197 WeakPolarHBondContact O-CA 3.27Å; S193-F197 WeakPolarHBondContact O-CB 3.36Å; S193-F197 PolarHBondContact O-N 3.35Å; F197-L199 PolarHBondContact O-N 2.91Å; F197-P200 WeakPolarHBondContact O-CD 3.45Å; F197-S201 WeakPolarHBondContact CE2-OG 3.34Å; F197-S201 WeakPolarHBondContact O-CB 3.28Å; F197-S201 PolarHBondContact O-N 3.48Å; F197-S201 PolarHBondContact O-OG 3.48Å; F197-F277 AromaticContact CD2-CZ 3.93Å; F197-F277 HydrophobicContact CD2-CZ 3.93Å; F197-F277 AromaticContact CE2-CE1 3.89Å; F197-F277 HydrophobicContact CE2-CE1 3.89Å; F197-F277 HydrophobicContact CE2-CE2 4.47Å; F197-F277 AromaticContact CE2-CZ 3.64Å; F197-F277 HydrophobicContact CE2-CZ 3.64Å; F197-F278 HydrophobicContact CZ-CD1 4.45Å; F197-W281 HydrophobicContact CD2-CB 4.21Å; F197-W281 HydrophobicContact CE2-CB 3.54Å; F197-W281 HydrophobicContact CE2-CG 4.49Å; F197-W281 HydrophobicContact CZ-CB 4.26Å; F197-L282 HydrophobicContact CE1-CD1 3.77Å; F197-L282 HydrophobicContact CZ-CB 4.14Å; F197-L282 HydrophobicContact CZ-CD1 3.99Å; F197-F285 HydrophobicContact CB-CD1 3.82Å; F197-F285 HydrophobicContact CB-CD2 3.71Å; F197-F285 HydrophobicContact CB-CE1 3.59Å; F197-F285 HydrophobicContact CB-CE2 3.46Å; F197-F285 VanDerWaalsContact CB-CE2 3.46Å; F197-F285 HydrophobicContact CB-CG 3.89Å; F197-F285 HydrophobicContact CB-CZ 3.42Å; F197-F285 VanDerWaalsContact CB-CZ 3.42Å; F197-F285 HydrophobicContact CD1-CB 3.79Å; F197-F285 HydrophobicContact CD1-CD1 4.22Å; F197-F285 AromaticContact CD1-CD2 3.5Å; F197-F285 HydrophobicContact CD1-CD2 3.5Å; F197-F285 HydrophobicContact CD1-CE2 4.13Å; F197-F285 AromaticContact CD1-CG 3.56Å; F197-F285 HydrophobicContact CD1-CG 3.56Å; F197-F285 AromaticContact CD2-CD2 3.33Å; F197-F285 HydrophobicContact CD2-CD2 3.33Å; F197-F285 AromaticContact CD2-CE2 3.27Å; F197-F285 HydrophobicContact CD2-CE2 3.27Å; F197-F285 HydrophobicContact CD2-CG 4.21Å; F197-F285 HydrophobicContact CD2-CZ 4.12Å; F197-F285 HydrophobicContact CE1-CB 3.98Å; F197-F285 AromaticContact CE1-CD2 3.89Å; F197-F285 HydrophobicContact CE1-CD2 3.89Å; F197-F285 HydrophobicContact CE1-CG 4.11Å; F197-F285 AromaticContact CE2-CD2 3.74Å; F197-F285 HydrophobicContact CE2-CD2 3.74Å; F197-F285 HydrophobicContact CE2-CE2 4Å; F197-F285 HydrophobicContact CG-CB 4.35Å; F197-F285 HydrophobicContact CG-CD1 4.09Å; F197-F285 AromaticContact CG-CD2 3.2Å; F197-F285 HydrophobicContact CG-CD2 3.2Å; F197-F285 HydrophobicContact CG-CE1 4.21Å; F197-F285 AromaticContact CG-CE2 3.34Å; F197-F285 HydrophobicContact CG-CE2 3.34Å; F197-F285 AromaticContact CG-CG 3.62Å; F197-F285 HydrophobicContact CG-CG 3.62Å; F197-F285 AromaticContact CG-CZ 3.88Å; F197-F285 HydrophobicContact CG-CZ 3.88Å; F197-F285 AromaticContact CZ-CD2 3.99Å; F197-F285 HydrophobicContact CZ-CD2 3.99Å
198F93.1Very high89.2Confident84 Ų8441 Ų4137%0.36824%0.235SC..Iπ-helixtrans-67.2-43-170-69.1-74.2000113S193 S201 G202 F285 I289S193-F198 VanDerWaalsContact O-CD2 3.31Å; S193-F198 WeakPolarHBondContact O-CD2 3.44Å; S193-F198 PolarHBondContact O-N 3.26Å; F198-S201 PolarHBondContact O-N 3.18Å; F198-G202 PolarHBondContact O-N 3.42Å; F198-F285 HydrophobicContact CZ-CB 4.36Å; F198-I289 HydrophobicContact CE2-CD1 3.63Å; F198-I289 HydrophobicContact CZ-CD1 3.81Å
199L93.3Very high89.2Confident116 Ų11643.3 Ų43.361%0.60725%0.253SS*.Hα-helixtrans-66.4-50.8176.6-175.4167.8000111.4G194 F197 S201 G202 A203G194-L199 VanDerWaalsContact O-CB 3.27Å; G194-L199 WeakPolarHBondContact O-CB 3.38Å; G194-L199 PolarHBondContact O-N 3.17Å; F197-L199 PolarHBondContact O-N 2.91Å; L199-S201 VanDerWaalsContact C-N 3.32Å; L199-S201 PolarHBondContact O-N 3.31Å; L199-G202 PolarHBondContact O-N 2.88Å; L199-A203 PolarHBondContact O-N 2.68Å
200P91.4Very high89.3Confident3 Ų349 Ų492%0.01927%0.274CS..Hα-helixtrans-55.5-44.4172.8-29.136.7000113.2I114 L115 C118 L195 F197 G202 A203 I204I114-P200 HydrophobicContact CG2-CB 3.88Å; I114-P200 HydrophobicContact CG2-CG 4.43Å; L115-P200 HydrophobicContact CD2-CG 3.83Å; C118-P200 HydrophobicContact CB-CB 4.26Å; L195-P200 VanDerWaalsContact O-CD 3.29Å; L195-P200 WeakPolarHBondContact O-CD 3.35Å; L195-P200 WeakPolarHBondContact O-CG 3.39Å; F197-P200 WeakPolarHBondContact O-CD 3.45Å; P200-G202 PolarHBondContact O-N 2.91Å; P200-A203 PolarHBondContact O-N 2.75Å; P200-I204 WeakPolarHBondContact O-CB 3.38Å; P200-I204 WeakPolarHBondContact O-CG1 3.37Å; P200-I204 PolarHBondContact O-N 2.99Å
201S91.1Very high89Confident6 Ų645 Ų454%0.04225%0.254CS..Hα-helixtrans-62.2-41.1177.8-64.50000112.5F197 F198 L199 I204 C205 F277F197-S201 WeakPolarHBondContact CE2-OG 3.34Å; F197-S201 WeakPolarHBondContact O-CB 3.28Å; F197-S201 PolarHBondContact O-N 3.48Å; F197-S201 PolarHBondContact O-OG 3.48Å; F198-S201 PolarHBondContact O-N 3.18Å; L199-S201 VanDerWaalsContact C-N 3.32Å; L199-S201 PolarHBondContact O-N 3.31Å; S201-I204 PolarHBondContact O-N 2.86Å; S201-C205 WeakPolarHBondContact O-CB 3.32Å; S201-C205 PolarHBondContact O-N 3.01Å; S201-F277 WeakPolarHBondContact OG-CE1 3.34Å
202G92.4Very high88.7Confident41 Ų4143.4 Ų43.442%0.42324%0.242SC..Hα-helixtrans-61.5-44.717400000112.1F198 L199 P200 C205 F206F198-G202 PolarHBondContact O-N 3.42Å; L199-G202 PolarHBondContact O-N 2.88Å; P200-G202 PolarHBondContact O-N 2.91Å; G202-C205 PolarHBondContact O-N 2.93Å; G202-F206 VanDerWaalsContact O-CB 3.31Å; G202-F206 WeakPolarHBondContact O-CB 3.4Å; G202-F206 PolarHBondContact O-N 3.48Å
203A91.1Very high88.6Confident37 Ų3747.8 Ų47.831%0.30626%0.263SS..Hα-helixtrans-63.3-41.417600000112.2L199 P200 F206 T207L199-A203 PolarHBondContact O-N 2.68Å; P200-A203 PolarHBondContact O-N 2.75Å; A203-F206 PolarHBondContact O-N 3.18Å; A203-T207 WeakPolarHBondContact O-CB 3.48Å; A203-T207 VanDerWaalsContact O-CG2 3.32Å; A203-T207 WeakPolarHBondContact O-CG2 3.46Å; A203-T207 PolarHBondContact O-N 3.28Å; A203-T207 PolarHBondContact O-OG1 3.46Å
204I89.7Confident88.2Confident1 Ų148.7 Ų48.71%0.00527%0.27CS..Hα-helixtrans-61.3-51.3174.7-71.9167.7000110.8L117 C118 P200 S201 F206 T207 Y208 L274 F277L117-I204 HydrophobicContact CB-CD1 4.39Å; C118-I204 HydrophobicContact CB-CD1 4.06Å; C118-I204 HydrophobicContact CB-CG1 4.02Å; P200-I204 WeakPolarHBondContact O-CB 3.38Å; P200-I204 WeakPolarHBondContact O-CG1 3.37Å; P200-I204 PolarHBondContact O-N 2.99Å; S201-I204 PolarHBondContact O-N 2.86Å; I204-F206 VanDerWaalsContact C-N 3.34Å; I204-F206 PolarHBondContact O-N 2.95Å; I204-T207 PolarHBondContact O-N 3.23Å; I204-T207 PolarHBondContact O-OG1 3.43Å; I204-Y208 WeakPolarHBondContact O-CB 3.21Å; I204-Y208 PolarHBondContact O-N 3.21Å; I204-L274 HydrophobicContact CG2-CD1 4.31Å; I204-L274 HydrophobicContact CG2-CD2 3.17Å; I204-L274 HydrophobicContact CG2-CG 4.29Å; I204-F277 HydrophobicContact CD1-CE1 4.42Å
205C90.2Very high87.5Confident53 Ų5348 Ų4836%0.35826%0.263SS..Hα-helixtrans-57.9-46.3176.6-81.40000111.7S201 G202 Y208 C209 F278S201-C205 WeakPolarHBondContact O-CB 3.32Å; S201-C205 PolarHBondContact O-N 3.01Å; G202-C205 PolarHBondContact O-N 2.93Å; C205-Y208 PolarHBondContact O-N 3.23Å; C205-C209 WeakPolarHBondContact O-CB 3.23Å; C205-C209 PolarHBondContact O-N 3.33Å; C205-C209 PolarHBondContact O-SG 3.41Å; C205-F278 VanDerWaalsContact SG-CE2 3.55Å; C205-F278 WeakPolarHBondContact SG-CZ 3.41Å
206F90.1Very high87.1Confident131 Ų13152.2 Ų52.258%0.57527%0.272SS*.Hα-helixtrans-60.3-52179.2173.1-99.4000112.1G202 A203 I204 Y208 C209 R210G202-F206 VanDerWaalsContact O-CB 3.31Å; G202-F206 WeakPolarHBondContact O-CB 3.4Å; G202-F206 PolarHBondContact O-N 3.48Å; A203-F206 PolarHBondContact O-N 3.18Å; I204-F206 VanDerWaalsContact C-N 3.34Å; I204-F206 PolarHBondContact O-N 2.95Å; F206-Y208 VanDerWaalsContact C-N 3.28Å; F206-Y208 PolarHBondContact O-N 2.83Å; F206-C209 PolarHBondContact O-N 2.98Å; F206-R210 HydrophobicContact CE1-CG 4.25Å; F206-R210 HydrophobicContact CE2-CG 4.22Å; F206-R210 HydrophobicContact CZ-CG 4.03Å; F206-R210 WeakPolarHBondContact O-CG 3.39Å; F206-R210 PolarHBondContact O-N 2.79Å
207T87.3Confident86.7Confident13 Ų1358.3 Ų58.38%0.0830%0.298CS..Hα-helixtrans-60.6-40.3179.552.10000111.2Y125 A203 I204 R210 I211Y125-T207 HydrophobicContact CD2-CG2 4.11Å; Y125-T207 HydrophobicContact CG-CG2 4.08Å; A203-T207 WeakPolarHBondContact O-CB 3.48Å; A203-T207 VanDerWaalsContact O-CG2 3.32Å; A203-T207 WeakPolarHBondContact O-CG2 3.46Å; A203-T207 PolarHBondContact O-N 3.28Å; A203-T207 PolarHBondContact O-OG1 3.46Å; I204-T207 PolarHBondContact O-N 3.23Å; I204-T207 PolarHBondContact O-OG1 3.43Å; T207-R210 WeakPolarHBondContact O-CB 3.39Å; T207-R210 PolarHBondContact O-N 3.43Å; T207-I211 VanDerWaalsContact O-CG1 3.25Å; T207-I211 WeakPolarHBondContact O-CG1 3.42Å; T207-I211 PolarHBondContact O-N 2.91Å
208Y83.9Confident85.8Confident39 Ų3962.9 Ų62.915%0.15332%0.32CS..Hα-helixtrans-69.4-44.5178.6-173.4-116.6000113.7I204 C205 F206 R210 I211 L212 S267 L270 G271 L274I204-Y208 WeakPolarHBondContact O-CB 3.21Å; I204-Y208 PolarHBondContact O-N 3.21Å; C205-Y208 PolarHBondContact O-N 3.23Å; F206-Y208 VanDerWaalsContact C-N 3.28Å; F206-Y208 PolarHBondContact O-N 2.83Å; Y208-R210 PolarHBondContact O-N 3.08Å; Y208-I211 WeakPolarHBondContact O-CB 3.45Å; Y208-I211 PolarHBondContact O-N 2.95Å; Y208-I211 VanDerWaalsContact O-N 3.08Å; Y208-L212 HydrophobicContact CD1-CD1 3.87Å; Y208-L212 HydrophobicContact CD1-CG 4.23Å; Y208-L212 HydrophobicContact CD2-CG 4.47Å; Y208-L212 HydrophobicContact CE1-CD1 3.29Å; Y208-L212 HydrophobicContact CE1-CD2 4.38Å; Y208-L212 HydrophobicContact CE1-CG 3.79Å; Y208-L212 HydrophobicContact CE2-CD1 4.43Å; Y208-L212 HydrophobicContact CE2-CD2 4.15Å; Y208-L212 HydrophobicContact CE2-CG 4.03Å; Y208-L212 PolarHBondContact O-N 3.44Å; Y208-S267 PolarHBondContact OH-O 2.91Å; Y208-L270 HydrophobicContact CD2-CD2 4.29Å; Y208-L270 HydrophobicContact CE2-CB 4.08Å; Y208-L270 HydrophobicContact CE2-CD2 4.47Å; Y208-G271 WeakPolarHBondContact OH-CA 3.46Å; Y208-G271 PolarHBondContact OH-N 3.49Å; Y208-L274 VanDerWaalsContact CB-CD1 3.43Å; Y208-L274 HydrophobicContact CD1-CD1 3.59Å; Y208-L274 HydrophobicContact CD2-CD1 3.32Å; Y208-L274 HydrophobicContact CE1-CD1 4.13Å; Y208-L274 HydrophobicContact CE2-CD1 3.93Å; Y208-L274 HydrophobicContact CG-CD1 3.13Å
209C86.3Confident84.8Confident71 Ų7160.3 Ų60.348%0.4831%0.314SS..Hα-helixtrans-54.5-43.8173.2-76.70000110.9C205 F206 L212 L213C205-C209 WeakPolarHBondContact O-CB 3.23Å; C205-C209 PolarHBondContact O-N 3.33Å; C205-C209 PolarHBondContact O-SG 3.41Å; F206-C209 PolarHBondContact O-N 2.98Å; C209-L212 PolarHBondContact O-N 2.92Å; C209-L213 WeakPolarHBondContact O-CB 3.41Å; C209-L213 VanDerWaalsContact O-CG 3.23Å; C209-L213 WeakPolarHBondContact O-CG 3.35Å; C209-L213 PolarHBondContact O-N 2.82Å
210R86.8Confident83.9Confident120 Ų12059.3 Ų59.345%0.45331%0.312SS..Hα-helixtrans-63.5-42.8175.5-70.4-68.8-57.4-177.90.6112.8Y125 F206 T207 Y208 L213 A214Y125-R210 HydrophobicContact CD2-CB 4.25Å; Y125-R210 HydrophobicContact CE2-CB 3.71Å; Y125-R210 HydrophobicContact CE2-CG 4.28Å; F206-R210 HydrophobicContact CE1-CG 4.25Å; F206-R210 HydrophobicContact CE2-CG 4.22Å; F206-R210 HydrophobicContact CZ-CG 4.03Å; F206-R210 WeakPolarHBondContact O-CG 3.39Å; F206-R210 PolarHBondContact O-N 2.79Å; T207-R210 WeakPolarHBondContact O-CB 3.39Å; T207-R210 PolarHBondContact O-N 3.43Å; Y208-R210 PolarHBondContact O-N 3.08Å; R210-L213 PolarHBondContact O-N 2.98Å; R210-A214 WeakPolarHBondContact O-CB 3.43Å; R210-A214 PolarHBondContact O-N 3.02Å
211I83.4Confident83.1Confident2 Ų264.1 Ų64.11%0.0134%0.335CS..Hα-helixtrans-59.7-48.2175.5-69.9162.6000110.3Y125 I128 T207 Y208 A214 A215 L270Y125-I211 HydrophobicContact CD2-CG1 4.19Å; I128-I211 HydrophobicContact CD1-CD1 4.49Å; I128-I211 HydrophobicContact CD1-CG2 3.92Å; I128-I211 HydrophobicContact CG2-CG2 4.49Å; T207-I211 VanDerWaalsContact O-CG1 3.25Å; T207-I211 WeakPolarHBondContact O-CG1 3.42Å; T207-I211 PolarHBondContact O-N 2.91Å; Y208-I211 WeakPolarHBondContact O-CB 3.45Å; Y208-I211 PolarHBondContact O-N 2.95Å; Y208-I211 VanDerWaalsContact O-N 3.08Å; I211-A214 PolarHBondContact O-N 3.27Å; I211-A215 WeakPolarHBondContact O-CB 3.45Å; I211-A215 PolarHBondContact O-N 3.01Å; I211-L270 HydrophobicContact CD1-CD2 4.18Å
212L80.6Confident82.1Confident57 Ų5765.8 Ų65.830%0.29834%0.344SS..Hα-helixtrans-63.5-44.5179.7-74.7-175.8000112.2Y208 C209 A214 A215 R216Y208-L212 HydrophobicContact CD1-CD1 3.87Å; Y208-L212 HydrophobicContact CD1-CG 4.23Å; Y208-L212 HydrophobicContact CD2-CG 4.47Å; Y208-L212 HydrophobicContact CE1-CD1 3.29Å; Y208-L212 HydrophobicContact CE1-CD2 4.38Å; Y208-L212 HydrophobicContact CE1-CG 3.79Å; Y208-L212 HydrophobicContact CE2-CD1 4.43Å; Y208-L212 HydrophobicContact CE2-CD2 4.15Å; Y208-L212 HydrophobicContact CE2-CG 4.03Å; Y208-L212 PolarHBondContact O-N 3.44Å; C209-L212 PolarHBondContact O-N 2.92Å; L212-A214 VanDerWaalsContact C-N 3.34Å; L212-A214 PolarHBondContact O-N 3.25Å; L212-A215 PolarHBondContact O-N 2.89Å; L212-R216 WeakPolarHBondContact O-CB 3.43Å; L212-R216 VanDerWaalsContact O-CG 3.31Å; L212-R216 WeakPolarHBondContact O-CG 3.38Å; L212-R216 PolarHBondContact O-N 3.2Å
213L84.1Confident81Confident106 Ų10666.3 Ų66.356%0.55534%0.344SS*.Hα-helixtrans-61.9-43.1177.7-72.6173.2000111.6C209 R210 R216 K217C209-L213 WeakPolarHBondContact O-CB 3.41Å; C209-L213 VanDerWaalsContact O-CG 3.23Å; C209-L213 WeakPolarHBondContact O-CG 3.35Å; C209-L213 PolarHBondContact O-N 2.82Å; R210-L213 PolarHBondContact O-N 2.98Å; L213-R216 PolarHBondContact O-N 3.18Å; L213-K217 WeakPolarHBondContact O-CB 3.38Å; L213-K217 PolarHBondContact O-N 3.4Å
214A81.2Confident79.9Confident21 Ų2167.9 Ų67.917%0.17435%0.353CS..Hα-helixtrans-66.2-43176.800000112.4L129 R210 I211 L212 R216 K217 Q218L129-A214 HydrophobicContact CD2-CB 3.25Å; R210-A214 WeakPolarHBondContact O-CB 3.43Å; R210-A214 PolarHBondContact O-N 3.02Å; I211-A214 PolarHBondContact O-N 3.27Å; L212-A214 VanDerWaalsContact C-N 3.34Å; L212-A214 PolarHBondContact O-N 3.25Å; A214-R216 VanDerWaalsContact C-N 3.35Å; A214-R216 PolarHBondContact O-N 2.97Å; A214-K217 PolarHBondContact O-N 3.37Å; A214-Q218 WeakPolarHBondContact O-CG 3.29Å; A214-Q218 PolarHBondContact O-N 2.87Å
215A75.6Confident78.8Confident12 Ų1273.5 Ų73.510%0.09938%0.383CS..Hα-helixtrans-61.9-41.8175.300000111.7I211 L212 Q218 A219I211-A215 WeakPolarHBondContact O-CB 3.45Å; I211-A215 PolarHBondContact O-N 3.01Å; L212-A215 PolarHBondContact O-N 2.89Å; A215-Q218 PolarHBondContact O-N 3.49Å; A215-A219 WeakPolarHBondContact O-CB 3.43Å; A215-A219 PolarHBondContact O-N 3.45Å
216R79.3Confident77.4Confident174 Ų17475 Ų7566%0.65739%0.39SS*.Hα-helixtrans-63.9-43.7174.6-73.6-172.280.2-167.34.5111.8L212 L213 A214 Q218 A219 V220L212-R216 WeakPolarHBondContact O-CB 3.43Å; L212-R216 VanDerWaalsContact O-CG 3.31Å; L212-R216 WeakPolarHBondContact O-CG 3.38Å; L212-R216 PolarHBondContact O-N 3.2Å; L213-R216 PolarHBondContact O-N 3.18Å; A214-R216 VanDerWaalsContact C-N 3.35Å; A214-R216 PolarHBondContact O-N 2.97Å; R216-Q218 VanDerWaalsContact C-N 3.33Å; R216-Q218 PolarHBondContact O-N 3.1Å; R216-A219 PolarHBondContact O-N 2.93Å; R216-A219 VanDerWaalsContact O-N 3.17Å; R216-V220 WeakPolarHBondContact O-CG2 3.45Å; R216-V220 PolarHBondContact O-N 3.45Å
217K79.5Confident76Confident137 Ų13773.5 Ų73.560%0.59639%0.392SS*.Hα-helixtrans-58.7-45.2176.4-173.2178179.4-178.90111.3L213 A214 V220 Q221L213-K217 WeakPolarHBondContact O-CB 3.38Å; L213-K217 PolarHBondContact O-N 3.4Å; A214-K217 PolarHBondContact O-N 3.37Å; K217-V220 PolarHBondContact O-N 3.06Å; K217-Q221 WeakPolarHBondContact O-CG 3.34Å; K217-Q221 PolarHBondContact O-N 3.09Å
218Q72.3Confident74.6Confident97 Ų9774.6 Ų74.645%0.45341%0.406SS..Hα-helixtrans-63.2-39.8175.4-71.4176.2-12.100112.1A214 A215 R216 V222A214-Q218 WeakPolarHBondContact O-CG 3.29Å; A214-Q218 PolarHBondContact O-N 2.87Å; A215-Q218 PolarHBondContact O-N 3.49Å; R216-Q218 VanDerWaalsContact C-N 3.33Å; R216-Q218 PolarHBondContact O-N 3.1Å; Q218-V222 VanDerWaalsContact O-CG2 3.24Å; Q218-V222 WeakPolarHBondContact O-CG2 3.35Å; Q218-V222 PolarHBondContact O-N 3.4Å; Q218-V222 VanDerWaalsContact O-N 3.12Å
219A70.5Confident73.2Confident30 Ų3077.4 Ų77.425%0.24842%0.422CS..Hα-helixtrans-65.6-42.6176.900000112.5A215 R216 V222 A223A215-A219 WeakPolarHBondContact O-CB 3.43Å; A215-A219 PolarHBondContact O-N 3.45Å; R216-A219 PolarHBondContact O-N 2.93Å; R216-A219 VanDerWaalsContact O-N 3.17Å; A219-V222 PolarHBondContact O-N 3.41Å; A219-A223 WeakPolarHBondContact O-CB 3.48Å; A219-A223 PolarHBondContact O-N 3.42Å
220V75.5Confident71.7Confident95 Ų9577.1 Ų77.158%0.57643%0.425SS*.Hα-helixtrans-67.1-43.2178.4173.30000111.2R216 K217 V222 A223 S224R216-V220 WeakPolarHBondContact O-CG2 3.45Å; R216-V220 PolarHBondContact O-N 3.45Å; K217-V220 PolarHBondContact O-N 3.06Å; V220-V222 VanDerWaalsContact C-N 3.31Å; V220-V222 PolarHBondContact O-N 3.37Å; V220-A223 PolarHBondContact O-N 2.94Å; V220-S224 PolarHBondContact O-N 2.99Å; V220-S224 PolarHBondContact O-OG 3.02Å
221Q75.1Confident70Confident104 Ų10474.6 Ų74.649%0.48643%0.425SS..Hα-helixtrans-61.2-39.1175.9-77.1179.1-3300112.4K217 S224 L225K217-Q221 WeakPolarHBondContact O-CG 3.34Å; K217-Q221 PolarHBondContact O-N 3.09Å; Q221-S224 PolarHBondContact O-OG 3.42Å; Q221-S224 VanDerWaalsContact O-OG 3.11Å; Q221-L225 WeakPolarHBondContact O-CB 3.4Å; Q221-L225 WeakPolarHBondContact O-CD1 3.33Å; Q221-L225 VanDerWaalsContact O-CG 3.29Å; Q221-L225 WeakPolarHBondContact O-CG 3.23Å; Q221-L225 PolarHBondContact O-N 3.12Å
222V69.4Low68.5Low41 Ų4180.2 Ų80.225%0.24845%0.451CS..Hα-helixtrans-69.8-36.2176.1172.70000111.4Q218 A219 V220 T226 T257Q218-V222 VanDerWaalsContact O-CG2 3.24Å; Q218-V222 WeakPolarHBondContact O-CG2 3.35Å; Q218-V222 PolarHBondContact O-N 3.4Å; Q218-V222 VanDerWaalsContact O-N 3.12Å; A219-V222 PolarHBondContact O-N 3.41Å; V220-V222 VanDerWaalsContact C-N 3.31Å; V220-V222 PolarHBondContact O-N 3.37Å; V222-T226 PolarHBondContact O-N 3.07Å; V222-T226 PolarHBondContact O-OG1 2.96Å; V222-T257 HydrophobicContact CG1-CG2 3.82Å
223A68.8Low67.1Low51 Ų5181 Ų8142%0.42147%0.467SS..Hα-helixtrans-67.8-45.217600000112A219 V220 L225 T226 T227A219-A223 WeakPolarHBondContact O-CB 3.48Å; A219-A223 PolarHBondContact O-N 3.42Å; V220-A223 PolarHBondContact O-N 2.94Å; A223-L225 PolarHBondContact O-N 3.22Å; A223-T226 WeakPolarHBondContact O-CB 3.31Å; A223-T226 PolarHBondContact O-N 3.37Å; A223-T226 VanDerWaalsContact O-N 3.09Å; A223-T227 PolarHBondContact O-N 3.13Å; A223-T227 PolarHBondContact O-OG1 3.27Å; A223-T227 VanDerWaalsContact O-OG1 3.11Å
224S67.9Low65.2Low70 Ų7080.6 Ų80.649%0.4947%0.472SS..Hα-helixtrans-66.1-37.8-179.564.40000112.9V220 Q221 T226 T227 G228V220-S224 PolarHBondContact O-N 2.99Å; V220-S224 PolarHBondContact O-OG 3.02Å; Q221-S224 PolarHBondContact O-OG 3.42Å; Q221-S224 VanDerWaalsContact O-OG 3.11Å; S224-T226 VanDerWaalsContact C-N 3.25Å; S224-T226 PolarHBondContact O-N 3.5Å; S224-T227 PolarHBondContact O-N 3.06Å; S224-G228 PolarHBondContact O-N 3.27Å
225L66.4Low63.5Low120 Ų12087.6 Ų87.663%0.62850%0.501SS*.Hα-helixtrans-63.7-30.7171.9-74.2167.7000112.6Q221 A223 M229Q221-L225 WeakPolarHBondContact O-CB 3.4Å; Q221-L225 WeakPolarHBondContact O-CD1 3.33Å; Q221-L225 VanDerWaalsContact O-CG 3.29Å; Q221-L225 WeakPolarHBondContact O-CG 3.23Å; Q221-L225 PolarHBondContact O-N 3.12Å; A223-L225 PolarHBondContact O-N 3.22Å; L225-M229 WeakPolarHBondContact O-CG 3.25Å
226T61.1Low62.1Low83 Ų8392.2 Ų92.251%0.50953%0.528SS..Hα-helixtrans-76.9-41.3177.4-51.80000111.1V222 A223 S224 A230V222-T226 PolarHBondContact O-N 3.07Å; V222-T226 PolarHBondContact O-OG1 2.96Å; A223-T226 WeakPolarHBondContact O-CB 3.31Å; A223-T226 PolarHBondContact O-N 3.37Å; A223-T226 VanDerWaalsContact O-N 3.09Å; S224-T226 VanDerWaalsContact C-N 3.25Å; S224-T226 PolarHBondContact O-N 3.5Å; T226-A230 PolarHBondContact O-N 3.34Å
227T61.4Low60.6Low100 Ų10091.5 Ų91.561%0.61354%0.537SS*.Hα-helixtrans-74.7-42.3-178.3-52.10000112.8A223 S224 M229 A230 S231A223-T227 PolarHBondContact O-N 3.13Å; A223-T227 PolarHBondContact O-OG1 3.27Å; A223-T227 VanDerWaalsContact O-OG1 3.11Å; S224-T227 PolarHBondContact O-N 3.06Å; T227-M229 PolarHBondContact O-N 3.33Å; T227-A230 PolarHBondContact O-N 3.34Å; T227-S231 PolarHBondContact O-N 3.38Å
228G58.6Low58.9Low37 Ų3793.7 Ų93.738%0.38155%0.549SS..Hα-helixtrans-67.4-19.9-179.200000114.6S224 S231S224-G228 PolarHBondContact O-N 3.27Å; G228-S231 PolarHBondContact O-OG 2.9Å
229M53.5Low57.7Low98 Ų9894.9 Ų94.948%0.48356%0.563SS.*Hα-helixtrans-93-23.9174.5-65-170.783.200113.1L225 T227 S231 Q232 A233L225-M229 WeakPolarHBondContact O-CG 3.25Å; T227-M229 PolarHBondContact O-N 3.33Å; M229-S231 VanDerWaalsContact C-N 3.32Å; M229-Q232 PolarHBondContact O-N 3.4Å; M229-A233 WeakPolarHBondContact O-CB 3.32Å; M229-A233 PolarHBondContact O-N 3.49Å
230A53.9Low56.7Low65 Ų6599.3 Ų99.354%0.53759%0.589SS.*Hα-helixtrans-68.8-33.2172.200000111.5T226 T227 S234T226-A230 PolarHBondContact O-N 3.34Å; T227-A230 PolarHBondContact O-N 3.34Å; A230-S234 PolarHBondContact O-N 3.09Å
231S51.9Low55Low66 Ų66105.2 Ų105.246%0.46260%0.601SS.*Hα-helixtrans-69.1-41.5170.660.60000112.2T227 G228 M229 A233 S234 E235T227-S231 PolarHBondContact O-N 3.38Å; G228-S231 PolarHBondContact O-OG 2.9Å; M229-S231 VanDerWaalsContact C-N 3.32Å; S231-A233 PolarHBondContact O-N 3.3Å; S231-S234 PolarHBondContact O-N 2.84Å; S231-S234 VanDerWaalsContact O-N 3.12Å; S231-E235 PolarHBondContact O-N 3.35Å
232Q51.6Low53.3Low120 Ų120106.4 Ų106.456%0.56162%0.615SS**Hα-helixtrans-65.8-34.5176.3-78.1-175.2-1100113.7M229 S234 E235 T236M229-Q232 PolarHBondContact O-N 3.4Å; Q232-S234 PolarHBondContact O-N 2.96Å; Q232-E235 PolarHBondContact O-N 3.31Å; Q232-T236 PolarHBondContact O-N 3.07Å; Q232-T236 PolarHBondContact O-OG1 3.3Å
233A51Low52.5Low75 Ų75110.3 Ų110.362%0.6264%0.642SS**Hα-helixtrans-68.8-20.5174.300000112.9M229 S231M229-A233 WeakPolarHBondContact O-CB 3.32Å; M229-A233 PolarHBondContact O-N 3.49Å; S231-A233 PolarHBondContact O-N 3.3Å
234S45.7Very low51.3Low97 Ų97119.2 Ų119.268%0.67866%0.664SS**Hα-helixtrans-88.6-22.7175.7-161.30000113.1A230 S231 Q232A230-S234 PolarHBondContact O-N 3.09Å; S231-S234 PolarHBondContact O-N 2.84Å; S231-S234 VanDerWaalsContact O-N 3.12Å; Q232-S234 PolarHBondContact O-N 2.96Å
235E45.5Very low50.3Low167 Ų167121.2 Ų121.278%0.7868%0.676SS**Hα-helixtrans-87-12.6177.6-86.4-176.3139.100114.3S231 Q232S231-E235 PolarHBondContact O-N 3.35Å; Q232-E235 PolarHBondContact O-N 3.31Å
236T46.3Very low49.3Very low109 Ų109118.2 Ų118.267%0.66967%0.674SS**  trans-96.222.5179.129.10000114.5Q232 Q238Q232-T236 PolarHBondContact O-N 3.07Å; Q232-T236 PolarHBondContact O-OG1 3.3Å; T236-Q238 PolarHBondContact O-N 3Å
237L46.8Very low48.8Very low159 Ų159118.8 Ų118.883%0.83268%0.677SS**  trans-74.555.2169.9-160.884.6000112
238Q43.8Very low48.1Very low184 Ų184122 Ų12286%0.8669%0.685SS**SBendtrans-166.782.3165.2-105.2174.947.600108.2T236T236-Q238 PolarHBondContact O-N 3Å
239V48.1Very low47.8Very low122 Ų122123 Ų12374%0.73969%0.687SS**  trans173.7127.7141.5165.40000108.3
240P47.8Very low47.8Very low122 Ų122120.7 Ų120.779%0.79268%0.682SS**  trans-81.3120.7172.90.416.6000110.8
241R41.2Very low47.8Very low220 Ų220122 Ų12283%0.8368%0.681SS**  trans-156.1116.8154.9-117.1175.618098.9-2.2113.4
242T39.4Very low47.9Very low128 Ų128122.8 Ų122.879%0.78569%0.686SS**  trans46.9126.8149.453.80000120.6
243P52.7Low47.9Very low124 Ų124123.2 Ų123.281%0.80568%0.683SS**  trans-89137.4-176.833.8-31.8000114.6
244R42.7Very low48.1Very low237 Ų237128 Ų12889%0.89468%0.684SS**  trans106.3150155.3-67.5-179.8169.1162.1-2117.9
245P46Very low48.5Very low113 Ų113128.7 Ų128.773%0.73468%0.68SS**  cis-120.6114.4-0.330.4-10.9000113.2V247P245-V247 VanDerWaalsContact C-N 3.32Å; P245-V247 PolarHBondContact O-N 2.88Å
246G47.3Very low49Very low56 Ų56123.2 Ų123.258%0.57766%0.663SS**  trans-87.713.2173.400000115.1A250G246-A250 PolarHBondContact O-N 3.41Å
247V49.9Very low49.4Very low96 Ų96120 Ų12058%0.58264%0.643SS**Hα-helixtrans-74.6-42-167.1-174.50000111.9P245 S249 A250 D251P245-V247 VanDerWaalsContact C-N 3.32Å; P245-V247 PolarHBondContact O-N 2.88Å; V247-S249 VanDerWaalsContact C-N 3.3Å; V247-S249 PolarHBondContact O-N 3.44Å; V247-A250 PolarHBondContact O-N 2.87Å; V247-D251 PolarHBondContact O-N 2.93Å; V247-D251 VanDerWaalsContact O-N 3.14Å
248E46.3Very low49.8Very low166 Ų166118.5 Ų118.578%0.77663%0.63SS**Hα-helixtrans-65.6-33-178.5-67.5-169.9140.400113.5S252E248-S252 WeakPolarHBondContact O-CB 3.24Å; E248-S252 PolarHBondContact O-N 3.38Å; E248-S252 PolarHBondContact O-OG 3.41Å
249S52.8Low50.4Low60 Ų60115.7 Ų115.742%0.4262%0.617SS.*Hα-helixtrans-76.9-30.6-179.8-170.90000112V247 R253V247-S249 VanDerWaalsContact C-N 3.3Å; V247-S249 PolarHBondContact O-N 3.44Å; S249-R253 VanDerWaalsContact O-CB 3.28Å; S249-R253 WeakPolarHBondContact O-CB 3.46Å; S249-R253 VanDerWaalsContact O-CG 3.25Å; S249-R253 WeakPolarHBondContact O-CG 3.19Å; S249-R253 PolarHBondContact O-N 3.07Å; S249-R253 PolarHBondContact O-NE 2.86Å; S249-R253 PolarHBondContact OG-NE 2.92Å; S249-R253 PolarHBondContact OG-NH2 2.95Å
250A52.9Low50.8Low48 Ų48111 Ų11140%0.39759%0.59SS.*Hα-helixtrans-72.8-39.7174.500000111.8G246 V247 R253 R254G246-A250 PolarHBondContact O-N 3.41Å; V247-A250 PolarHBondContact O-N 2.87Å; A250-R253 PolarHBondContact O-N 3.4Å; A250-R254 PolarHBondContact O-N 3.06Å
251D54.3Low51.2Low94 Ų94114.1 Ų114.150%0.50359%0.586SS.*Hα-helixtrans-70.2-43.1177.6-79.1-31000112.4V247 R253 R254 L255V247-D251 PolarHBondContact O-N 2.93Å; V247-D251 VanDerWaalsContact O-N 3.14Å; D251-R253 VanDerWaalsContact C-N 3.28Å; D251-R253 PolarHBondContact O-N 2.95Å; D251-R254 PolarHBondContact O-N 3.21Å; D251-L255 WeakPolarHBondContact O-CB 3.37Å; D251-L255 PolarHBondContact O-N 3.26Å
252S53Low52Low82 Ų82109.2 Ų109.257%0.57357%0.57SS**Hα-helixtrans-60.3-37.2172.8-64.90000112.2E248 L255 A256E248-S252 WeakPolarHBondContact O-CB 3.24Å; E248-S252 PolarHBondContact O-N 3.38Å; E248-S252 PolarHBondContact O-OG 3.41Å; S252-L255 PolarHBondContact O-N 3.22Å; S252-A256 WeakPolarHBondContact O-CB 3.32Å; S252-A256 PolarHBondContact O-N 3.41Å
253R52Low52.7Low129 Ų129105.2 Ų105.249%0.48755%0.55SS.*Hα-helixtrans-70.2-41.5175.2-83.8-179.9-86.7-165.8-1.9113.4S249 A250 D251 L255 A256 T257S249-R253 VanDerWaalsContact O-CB 3.28Å; S249-R253 WeakPolarHBondContact O-CB 3.46Å; S249-R253 VanDerWaalsContact O-CG 3.25Å; S249-R253 WeakPolarHBondContact O-CG 3.19Å; S249-R253 PolarHBondContact O-N 3.07Å; S249-R253 PolarHBondContact O-NE 2.86Å; S249-R253 PolarHBondContact OG-NE 2.92Å; S249-R253 PolarHBondContact OG-NH2 2.95Å; A250-R253 PolarHBondContact O-N 3.4Å; D251-R253 VanDerWaalsContact C-N 3.28Å; D251-R253 PolarHBondContact O-N 2.95Å; R253-L255 VanDerWaalsContact C-N 3.28Å; R253-L255 PolarHBondContact O-N 3.44Å; R253-A256 PolarHBondContact O-N 3.37Å; R253-T257 WeakPolarHBondContact O-CG2 3.48Å; R253-T257 PolarHBondContact O-N 3.23Å; R253-T257 PolarHBondContact O-OG1 3.44Å
254R56Low52.9Low175 Ų175103.4 Ų103.466%0.6653%0.533SS*.Hα-helixtrans-63.7-34.6171.9-94.5-175.5-178.2-104.50.6111.6A250 D251 T257 K258A250-R254 PolarHBondContact O-N 3.06Å; D251-R254 PolarHBondContact O-N 3.21Å; R254-T257 PolarHBondContact O-OG1 2.77Å; R254-K258 WeakPolarHBondContact O-CB 3.19Å; R254-K258 WeakPolarHBondContact O-CG 3.32Å; R254-K258 PolarHBondContact O-N 3.18Å
255L54.9Low53.8Low111 Ų11199.1 Ų99.158%0.58152%0.521SS*.Hα-helixtrans-67.7-47175.3-122.481.9000111.9D251 S252 R253 K258 H259D251-L255 WeakPolarHBondContact O-CB 3.37Å; D251-L255 PolarHBondContact O-N 3.26Å; S252-L255 PolarHBondContact O-N 3.22Å; R253-L255 VanDerWaalsContact C-N 3.28Å; R253-L255 PolarHBondContact O-N 3.44Å; L255-K258 PolarHBondContact O-N 3.34Å; L255-H259 WeakPolarHBondContact O-CB 3.45Å; L255-H259 PolarHBondContact O-N 3.23Å
256A54.7Low54.4Low52 Ų5296.6 Ų96.643%0.4351%0.51SS..Hα-helixtrans-65-43.9-179.400000112.9S252 R253 H259 S260S252-A256 WeakPolarHBondContact O-CB 3.32Å; S252-A256 PolarHBondContact O-N 3.41Å; R253-A256 PolarHBondContact O-N 3.37Å; A256-H259 PolarHBondContact O-N 2.88Å; A256-S260 PolarHBondContact O-N 3.23Å
257T55.2Low55Low41 Ų4194.2 Ų94.225%0.25248%0.484SS..Hα-helixtrans-68-37.6175.351.10000112.4V222 R253 R254 R261V222-T257 HydrophobicContact CG1-CG2 3.82Å; R253-T257 WeakPolarHBondContact O-CG2 3.48Å; R253-T257 PolarHBondContact O-N 3.23Å; R253-T257 PolarHBondContact O-OG1 3.44Å; R254-T257 PolarHBondContact O-OG1 2.77Å; T257-R261 WeakPolarHBondContact O-CG 3.09Å; T257-R261 PolarHBondContact O-N 3.06Å
258K55.7Low55.8Low129 Ų12995.2 Ų95.256%0.56149%0.486SS*.Hα-helixtrans-63-40.3168.7-88.3179173.2175.50111.9R254 L255 K262R254-K258 WeakPolarHBondContact O-CB 3.19Å; R254-K258 WeakPolarHBondContact O-CG 3.32Å; R254-K258 PolarHBondContact O-N 3.18Å; L255-K258 PolarHBondContact O-N 3.34Å; K258-K262 WeakPolarHBondContact O-CB 3.13Å; K258-K262 VanDerWaalsContact O-CG 3.25Å; K258-K262 WeakPolarHBondContact O-CG 3.4Å; K258-K262 PolarHBondContact O-N 3.35Å
259H56.3Low56.6Low124 Ų12488.1 Ų88.157%0.57445%0.454SS*.Hα-helixtrans-64.6-44.4178.3-108.1-88.1000111.7L255 A256 K262 A263L255-H259 WeakPolarHBondContact O-CB 3.45Å; L255-H259 PolarHBondContact O-N 3.23Å; A256-H259 PolarHBondContact O-N 2.88Å; H259-K262 PolarHBondContact O-N 3.11Å; H259-A263 WeakPolarHBondContact O-CB 3.36Å; H259-A263 PolarHBondContact O-N 2.91Å
260S55Low57.3Low25 Ų2586 Ų8618%0.17544%0.438CS..Hα-helixtrans-64.5-44.7176.8-179.70000112.5A256 K262 A263 L264A256-S260 PolarHBondContact O-N 3.23Å; S260-K262 VanDerWaalsContact C-N 3.33Å; S260-K262 PolarHBondContact O-N 3.03Å; S260-A263 WeakPolarHBondContact O-CB 3.24Å; S260-A263 PolarHBondContact O-N 2.78Å; S260-L264 PolarHBondContact O-N 3.38Å
261R57.3Low58.2Low187 Ų18784.6 Ų84.671%0.70643%0.428SS*.Hα-helixtrans-64.9-33.6174.4-69.1-179-167.6-165.54.2112.9T257 K265T257-R261 WeakPolarHBondContact O-CG 3.09Å; T257-R261 PolarHBondContact O-N 3.06Å; R261-K265 WeakPolarHBondContact O-CG 3.43Å; R261-K265 PolarHBondContact O-N 3.4Å; R261-K265 VanDerWaalsContact O-N 3.1Å
262K58Low59.3Low117 Ų11783.3 Ų83.351%0.50942%0.42SS..Hα-helixtrans-68.6-39.8172.8-79.2176.2-177.4179.50111.5K258 H259 S260 K265 A266K258-K262 WeakPolarHBondContact O-CB 3.13Å; K258-K262 VanDerWaalsContact O-CG 3.25Å; K258-K262 WeakPolarHBondContact O-CG 3.4Å; K258-K262 PolarHBondContact O-N 3.35Å; H259-K262 PolarHBondContact O-N 3.11Å; S260-K262 VanDerWaalsContact C-N 3.33Å; S260-K262 PolarHBondContact O-N 3.03Å; K262-K265 PolarHBondContact O-N 2.98Å; K262-A266 WeakPolarHBondContact O-CB 3.35Å; K262-A266 PolarHBondContact O-N 3.35Å
263A53Low60.4Low44 Ų4480.5 Ų80.536%0.36440%0.399SS..Hα-helixtrans-64.1-42.3176.100000111.8H259 S260 A266 S267H259-A263 WeakPolarHBondContact O-CB 3.36Å; H259-A263 PolarHBondContact O-N 2.91Å; S260-A263 WeakPolarHBondContact O-CB 3.24Å; S260-A263 PolarHBondContact O-N 2.78Å; A263-A266 PolarHBondContact O-N 2.91Å; A263-S267 PolarHBondContact O-N 3.49Å
264L56.9Low61.7Low85 Ų8575.2 Ų75.245%0.44538%0.38SS..Hα-helixtrans-67.3-37.2176.1-170.167.9000113S260 S267 L268S260-L264 PolarHBondContact O-N 3.38Å; L264-S267 WeakPolarHBondContact CA-OG 3.22Å; L264-S267 PolarHBondContact O-N 3.32Å; L264-S267 PolarHBondContact O-OG 2.83Å; L264-L268 PolarHBondContact O-N 3.28Å; L264-L268 VanDerWaalsContact O-N 3.08Å
265K62Low63Low147 Ų14768.7 Ų68.764%0.63937%0.367SS*.Hα-helixtrans-66.4-37.8172.3-78.3-174.3177.4-170.70112R261 K262 S267 L268 T269R261-K265 WeakPolarHBondContact O-CG 3.43Å; R261-K265 PolarHBondContact O-N 3.4Å; R261-K265 VanDerWaalsContact O-N 3.1Å; K262-K265 PolarHBondContact O-N 2.98Å; K265-S267 VanDerWaalsContact C-N 3.34Å; K265-L268 PolarHBondContact O-N 3.1Å; K265-T269 PolarHBondContact O-N 2.81Å; K265-T269 PolarHBondContact O-OG1 3.4Å
266A58.5Low64.5Low60 Ų6065.6 Ų65.650%0.49635%0.35SS..Hα-helixtrans-68.3-31.7175.700000112.6K262 A263 T269K262-A266 WeakPolarHBondContact O-CB 3.35Å; K262-A266 PolarHBondContact O-N 3.35Å; A263-A266 PolarHBondContact O-N 2.91Å; A266-T269 WeakPolarHBondContact O-CB 3.32Å
267S60.8Low66Low6 Ų663.2 Ų63.24%0.04233%0.33CS..Hα-helixtrans-75-33.6174.564.50000113.2Y208 A263 L264 K265 L270 G271Y208-S267 PolarHBondContact OH-O 2.91Å; A263-S267 PolarHBondContact O-N 3.49Å; L264-S267 WeakPolarHBondContact CA-OG 3.22Å; L264-S267 PolarHBondContact O-N 3.32Å; L264-S267 PolarHBondContact O-OG 2.83Å; K265-S267 VanDerWaalsContact C-N 3.34Å; S267-L270 WeakPolarHBondContact O-CB 3.22Å; S267-L270 PolarHBondContact O-N 2.9Å; S267-L270 VanDerWaalsContact O-N 3.14Å; S267-G271 PolarHBondContact O-N 2.98Å; S267-G271 VanDerWaalsContact O-N 3.1Å
268L65.5Low67.7Low118 Ų11863.8 Ų63.862%0.61833%0.329SS*.Hα-helixtrans-60.7-44.6175.5-173.784.9000111.9L264 K265 L270 G271 I272L264-L268 PolarHBondContact O-N 3.28Å; L264-L268 VanDerWaalsContact O-N 3.08Å; K265-L268 PolarHBondContact O-N 3.1Å; L268-L270 VanDerWaalsContact C-N 3.26Å; L268-L270 PolarHBondContact O-N 2.86Å; L268-G271 PolarHBondContact O-N 3.43Å; L268-G271 VanDerWaalsContact O-N 3.14Å; L268-I272 PolarHBondContact O-N 3.33Å
269T64.1Low69.4Low17 Ų1762.3 Ų62.310%0.10433%0.331CS..Hα-helixtrans-51.5-44.9171.1-71.50000112.5K265 A266 G271 I272 L273 F323K265-T269 PolarHBondContact O-N 2.81Å; K265-T269 PolarHBondContact O-OG1 3.4Å; A266-T269 WeakPolarHBondContact O-CB 3.32Å; T269-G271 VanDerWaalsContact C-N 3.31Å; T269-G271 PolarHBondContact O-N 3.49Å; T269-I272 PolarHBondContact O-N 2.93Å; T269-L273 HydrophobicContact CG2-CD1 4.46Å; T269-L273 PolarHBondContact O-N 2.85Å; T269-F323 HydrophobicContact CG2-CB 3.13Å; T269-F323 HydrophobicContact CG2-CD1 4.24Å; T269-F323 HydrophobicContact CG2-CG 3.87Å; T269-F323 WeakPolarHBondContact OG1-CD1 3.48Å
270L68.1Low71.1Confident15 Ų1556.7 Ų56.78%0.07931%0.306CS..Hα-helixtrans-67.9-35-178.4-142.679.4000110.9R124 Y208 I211 S267 L268 I272 L273 L274R124-L270 HydrophobicContact CB-CD2 4.07Å; R124-L270 HydrophobicContact CG-CD1 4.12Å; R124-L270 HydrophobicContact CG-CD2 4.41Å; Y208-L270 HydrophobicContact CD2-CD2 4.29Å; Y208-L270 HydrophobicContact CE2-CB 4.08Å; Y208-L270 HydrophobicContact CE2-CD2 4.47Å; I211-L270 HydrophobicContact CD1-CD2 4.18Å; S267-L270 WeakPolarHBondContact O-CB 3.22Å; S267-L270 PolarHBondContact O-N 2.9Å; S267-L270 VanDerWaalsContact O-N 3.14Å; L268-L270 VanDerWaalsContact C-N 3.26Å; L268-L270 PolarHBondContact O-N 2.86Å; L270-I272 PolarHBondContact O-N 3.34Å; L270-L273 HydrophobicContact CD1-CD1 4.32Å; L270-L273 WeakPolarHBondContact O-CB 3.28Å; L270-L273 PolarHBondContact O-N 3.21Å; L270-L274 VanDerWaalsContact O-CG 3.27Å; L270-L274 WeakPolarHBondContact O-CG 3.31Å; L270-L274 PolarHBondContact O-N 3.08Å; L270-L274 VanDerWaalsContact O-N 3.16Å
271G71.9Confident72.9Confident19 Ų1955.9 Ų55.920%0.19630%0.298CS..Hα-helixtrans-63.7-35.2173.900000114.8Y208 S267 L268 T269 L274 G275Y208-G271 WeakPolarHBondContact OH-CA 3.46Å; Y208-G271 PolarHBondContact OH-N 3.49Å; S267-G271 PolarHBondContact O-N 2.98Å; S267-G271 VanDerWaalsContact O-N 3.1Å; L268-G271 PolarHBondContact O-N 3.43Å; L268-G271 VanDerWaalsContact O-N 3.14Å; T269-G271 VanDerWaalsContact C-N 3.31Å; T269-G271 PolarHBondContact O-N 3.49Å; G271-L274 PolarHBondContact O-N 3.32Å; G271-G275 PolarHBondContact O-N 3.18Å
272I76.8Confident74.6Confident66 Ų6650.3 Ų50.334%0.33828%0.282SS..Hα-helixtrans-68.4-43.4177.1-65.7168.2000110.6L268 T269 L270 L274 G275 M276 F323L268-I272 PolarHBondContact O-N 3.33Å; T269-I272 PolarHBondContact O-N 2.93Å; L270-I272 PolarHBondContact O-N 3.34Å; I272-L274 VanDerWaalsContact C-N 3.26Å; I272-L274 PolarHBondContact O-N 3.43Å; I272-G275 PolarHBondContact O-N 2.96Å; I272-M276 WeakPolarHBondContact O-CB 3.41Å; I272-M276 PolarHBondContact O-N 3.38Å; I272-F323 HydrophobicContact CB-CZ 4.47Å; I272-F323 HydrophobicContact CD1-CD1 4.46Å; I272-F323 HydrophobicContact CD1-CE1 3.51Å; I272-F323 HydrophobicContact CD1-CZ 3.61Å; I272-F323 HydrophobicContact CG2-CE2 4.14Å; I272-F323 HydrophobicContact CG2-CZ 4.03Å
273L76.1Confident76.4Confident23 Ų2346.9 Ų46.912%0.1227%0.272CS..Hα-helixtrans-54.8-44.7173.8-78.3161000111.2T269 L270 F277 I319 Y320T269-L273 HydrophobicContact CG2-CD1 4.46Å; T269-L273 PolarHBondContact O-N 2.85Å; L270-L273 HydrophobicContact CD1-CD1 4.32Å; L270-L273 WeakPolarHBondContact O-CB 3.28Å; L270-L273 PolarHBondContact O-N 3.21Å; L273-F277 PolarHBondContact O-N 2.98Å; L273-I319 HydrophobicContact CD1-CG2 4.47Å; L273-I319 HydrophobicContact CD2-CB 3.7Å; L273-I319 HydrophobicContact CD2-CD1 3.9Å; L273-I319 HydrophobicContact CD2-CG1 4.42Å; L273-I319 HydrophobicContact CD2-CG2 3.19Å; L273-I319 HydrophobicContact CG-CG2 3.54Å; L273-Y320 HydrophobicContact CD1-CE1 4.4Å; L273-Y320 HydrophobicContact CD2-CE1 4.41Å
274L77.9Confident78.3Confident19 Ų1946.3 Ų46.310%0.09926%0.261CS..Hα-helixtrans-72.4-41.7-179.7-65.3178.4000113.5I204 Y208 L270 G271 I272 M276 F277 F278I204-L274 HydrophobicContact CG2-CD1 4.31Å; I204-L274 HydrophobicContact CG2-CD2 3.17Å; I204-L274 HydrophobicContact CG2-CG 4.29Å; Y208-L274 VanDerWaalsContact CB-CD1 3.43Å; Y208-L274 HydrophobicContact CD1-CD1 3.59Å; Y208-L274 HydrophobicContact CD2-CD1 3.32Å; Y208-L274 HydrophobicContact CE1-CD1 4.13Å; Y208-L274 HydrophobicContact CE2-CD1 3.93Å; Y208-L274 HydrophobicContact CG-CD1 3.13Å; L270-L274 VanDerWaalsContact O-CG 3.27Å; L270-L274 WeakPolarHBondContact O-CG 3.31Å; L270-L274 PolarHBondContact O-N 3.08Å; L270-L274 VanDerWaalsContact O-N 3.16Å; G271-L274 PolarHBondContact O-N 3.32Å; I272-L274 VanDerWaalsContact C-N 3.26Å; I272-L274 PolarHBondContact O-N 3.43Å; L274-M276 VanDerWaalsContact C-N 3.3Å; L274-M276 PolarHBondContact O-N 3.3Å; L274-F277 WeakPolarHBondContact O-CB 3.04Å; L274-F277 PolarHBondContact O-N 3.24Å; L274-F278 WeakPolarHBondContact O-CD2 3.41Å; L274-F278 PolarHBondContact O-N 2.97Å
275G83.9Confident80Confident37 Ų3742.8 Ų42.838%0.38124%0.243SC..Hα-helixtrans-60.5-42.6176.600000111.6G271 I272 F278 V279G271-G275 PolarHBondContact O-N 3.18Å; I272-G275 PolarHBondContact O-N 2.96Å; G275-F278 PolarHBondContact O-N 3.09Å; G275-V279 VanDerWaalsContact O-CG2 3.32Å; G275-V279 WeakPolarHBondContact O-CG2 3.18Å; G275-V279 PolarHBondContact O-N 3.37Å
276M86Confident81.4Confident46 Ų4639.2 Ų39.223%0.22723%0.233CC..Hα-helixtrans-64.7-42.6178.6-168.9171.6-59.900112.4I272 L274 F278 V279 T280 M315 I319I272-M276 WeakPolarHBondContact O-CB 3.41Å; I272-M276 PolarHBondContact O-N 3.38Å; L274-M276 VanDerWaalsContact C-N 3.3Å; L274-M276 PolarHBondContact O-N 3.3Å; M276-F278 VanDerWaalsContact C-N 3.3Å; M276-F278 PolarHBondContact O-N 2.93Å; M276-V279 PolarHBondContact O-N 3.18Å; M276-V279 VanDerWaalsContact O-N 3.13Å; M276-T280 HydrophobicContact CG-CG2 4.36Å; M276-T280 PolarHBondContact O-N 2.97Å; M276-T280 PolarHBondContact O-OG1 2.73Å; M276-T280 VanDerWaalsContact O-OG1 3.07Å; M276-M315 HydrophobicContact CE-CE 3.65Å; M276-M315 HydrophobicContact SD-CB 3.45Å; M276-M315 WeakPolarHBondContact SD-CB 3.37Å; M276-M315 HydrophobicContact SD-CE 3.53Å; M276-M315 VanDerWaalsContact SD-CE 3.53Å; M276-M315 HydrophobicContact SD-CG 3.72Å; M276-M315 HydrophobicContact SD-SD 4.4Å; M276-I319 HydrophobicContact CE-CD1 3.99Å; M276-I319 HydrophobicContact CE-CG1 4.16Å; M276-I319 HydrophobicContact SD-CD1 3.4Å; M276-I319 WeakPolarHBondContact SD-CD1 3.31Å; M276-I319 HydrophobicContact SD-CG1 4.09Å
277F87.2Confident83Confident3 Ų336.6 Ų36.61%0.01321%0.212CC..Hα-helixtrans-52.4-46.7174.7166-98.7000112.4I114 L117 F197 S201 I204 L273 L274 T280 W281I114-F277 HydrophobicContact CB-CE2 4.39Å; I114-F277 HydrophobicContact CG1-CE2 4.01Å; I114-F277 HydrophobicContact CG2-CE2 3.98Å; I114-F277 HydrophobicContact CG2-CZ 3.85Å; L117-F277 HydrophobicContact CD1-CD2 3.38Å; L117-F277 HydrophobicContact CD1-CE2 3.83Å; L117-F277 HydrophobicContact CD1-CG 4.25Å; F197-F277 AromaticContact CD2-CZ 3.93Å; F197-F277 HydrophobicContact CD2-CZ 3.93Å; F197-F277 AromaticContact CE2-CE1 3.89Å; F197-F277 HydrophobicContact CE2-CE1 3.89Å; F197-F277 HydrophobicContact CE2-CE2 4.47Å; F197-F277 AromaticContact CE2-CZ 3.64Å; F197-F277 HydrophobicContact CE2-CZ 3.64Å; S201-F277 WeakPolarHBondContact OG-CE1 3.34Å; I204-F277 HydrophobicContact CD1-CE1 4.42Å; L273-F277 PolarHBondContact O-N 2.98Å; L274-F277 WeakPolarHBondContact O-CB 3.04Å; L274-F277 PolarHBondContact O-N 3.24Å; F277-T280 PolarHBondContact O-N 2.89Å; F277-T280 PolarHBondContact O-OG1 3.12Å; F277-T280 VanDerWaalsContact O-OG1 3.12Å; F277-W281 AromaticContact CD2-CD1 3.69Å; F277-W281 AromaticContact CE2-CD1 3.76Å; F277-W281 HydrophobicContact CE2-CG 4.3Å; F277-W281 WeakPolarHBondContact O-CB 3.3Å; F277-W281 PolarHBondContact O-N 3.46Å
278F90.4Very high84.3Confident52 Ų5238 Ų3823%0.22822%0.218CC..Hα-helixtrans-68.1-41.1177.5-76.3-67.8000112.4F197 C205 L274 G275 M276 T280 L282F197-F278 HydrophobicContact CZ-CD1 4.45Å; C205-F278 VanDerWaalsContact SG-CE2 3.55Å; C205-F278 WeakPolarHBondContact SG-CZ 3.41Å; L274-F278 WeakPolarHBondContact O-CD2 3.41Å; L274-F278 PolarHBondContact O-N 2.97Å; G275-F278 PolarHBondContact O-N 3.09Å; M276-F278 VanDerWaalsContact C-N 3.3Å; M276-F278 PolarHBondContact O-N 2.93Å; F278-T280 VanDerWaalsContact C-N 3.27Å; F278-T280 PolarHBondContact O-N 3.22Å; F278-L282 WeakPolarHBondContact O-CB 3.46Å; F278-L282 PolarHBondContact O-N 3.22Å
279V91.6Very high85.5Confident98 Ų9834.3 Ų34.359%0.59420%0.199SC*.Hα-helixtrans-61.4-37.2178.9169.50000111.6G275 M276 P283G275-V279 VanDerWaalsContact O-CG2 3.32Å; G275-V279 WeakPolarHBondContact O-CG2 3.18Å; G275-V279 PolarHBondContact O-N 3.37Å; M276-V279 PolarHBondContact O-N 3.18Å; M276-V279 VanDerWaalsContact O-N 3.13Å; V279-P283 WeakPolarHBondContact O-CD 3.31Å; V279-P283 WeakPolarHBondContact O-CG 3.08Å
280T91.8Very high86.8Confident7 Ų736.2 Ų36.24%0.04321%0.21CC..Hα-helixtrans-82.7-39.5-178.653.20000113.2M276 F277 F278 L308 G309 N312M276-T280 HydrophobicContact CG-CG2 4.36Å; M276-T280 PolarHBondContact O-N 2.97Å; M276-T280 PolarHBondContact O-OG1 2.73Å; M276-T280 VanDerWaalsContact O-OG1 3.07Å; F277-T280 PolarHBondContact O-N 2.89Å; F277-T280 PolarHBondContact O-OG1 3.12Å; F277-T280 VanDerWaalsContact O-OG1 3.12Å; F278-T280 VanDerWaalsContact C-N 3.27Å; F278-T280 PolarHBondContact O-N 3.22Å; T280-L308 WeakPolarHBondContact CB-O 3.25Å; T280-L308 HydrophobicContact CG2-CD1 4.44Å; T280-G309 WeakPolarHBondContact O-CA 3.02Å; T280-G309 PolarHBondContact O-N 3.03Å; T280-N312 HydrophobicContact CG2-CB 4.49Å; T280-N312 PolarHBondContact OG1-OD1 3.1Å
281W92.8Very high87.6Confident7 Ų737.6 Ų37.63%0.02722%0.217CC..Hα-helixtrans-98-38.1-171-80.4106.7000115C110 I114 F197 F277 P283 F284 F285 N312C110-W281 HydrophobicContact CB-CH2 3.46Å; C110-W281 VanDerWaalsContact CB-CH2 3.46Å; C110-W281 HydrophobicContact CB-CZ2 4.05Å; C110-W281 HydrophobicContact CB-CZ3 4.32Å; C110-W281 VanDerWaalsContact SG-CH2 3.59Å; I114-W281 HydrophobicContact CD1-CD2 4.36Å; I114-W281 HydrophobicContact CD1-CE3 4.5Å; F197-W281 HydrophobicContact CD2-CB 4.21Å; F197-W281 HydrophobicContact CE2-CB 3.54Å; F197-W281 HydrophobicContact CE2-CG 4.49Å; F197-W281 HydrophobicContact CZ-CB 4.26Å; F277-W281 AromaticContact CD2-CD1 3.69Å; F277-W281 AromaticContact CE2-CD1 3.76Å; F277-W281 HydrophobicContact CE2-CG 4.3Å; F277-W281 WeakPolarHBondContact O-CB 3.3Å; F277-W281 PolarHBondContact O-N 3.46Å; W281-P283 VanDerWaalsContact C-CD 3.46Å; W281-F284 HydrophobicContact CE3-CD1 4.13Å; W281-F284 AromaticContact CZ3-CD1 4Å; W281-F284 HydrophobicContact CZ3-CD1 4Å; W281-F284 HydrophobicContact CZ3-CE1 4.37Å; W281-F284 PolarHBondContact O-N 2.68Å; W281-F285 HydrophobicContact CB-CD2 4.26Å; W281-F285 HydrophobicContact CB-CE2 4.29Å; W281-F285 HydrophobicContact CD2-CE2 4.05Å; W281-F285 AromaticContact CE3-CD2 3.98Å; W281-F285 HydrophobicContact CE3-CD2 3.98Å; W281-F285 AromaticContact CE3-CE2 3.3Å; W281-F285 HydrophobicContact CE3-CE2 3.3Å; W281-F285 HydrophobicContact CE3-CZ 4.08Å; W281-F285 HydrophobicContact CG-CE2 4.5Å; W281-F285 AromaticContact CZ3-CE2 3.93Å; W281-F285 HydrophobicContact CZ3-CE2 3.93Å; W281-F285 HydrophobicContact CZ3-CZ 4.28Å; W281-F285 WeakPolarHBondContact O-CD2 3.44Å; W281-F285 PolarHBondContact O-N 3.15Å; W281-F285 VanDerWaalsContact O-N 3.15Å; W281-N312 VanDerWaalsContact NE1-CG 3.32Å; W281-N312 PolarHBondContact NE1-ND2 3.37Å
282L93.4Very high88.2Confident70 Ų7038.1 Ų38.137%0.36622%0.219SC..Hα-helixtrans-57.3-42.6-175.3-175.363.7000112.7F197 F278 F284 F285 V286F197-L282 HydrophobicContact CE1-CD1 3.77Å; F197-L282 HydrophobicContact CZ-CB 4.14Å; F197-L282 HydrophobicContact CZ-CD1 3.99Å; F278-L282 WeakPolarHBondContact O-CB 3.46Å; F278-L282 PolarHBondContact O-N 3.22Å; L282-F284 VanDerWaalsContact C-N 3.33Å; L282-F284 PolarHBondContact O-N 3.37Å; L282-F285 PolarHBondContact O-N 2.87Å; L282-V286 HydrophobicContact CD1-CG2 4.08Å; L282-V286 HydrophobicContact CG-CG2 4.29Å; L282-V286 VanDerWaalsContact O-CG2 3.31Å; L282-V286 WeakPolarHBondContact O-CG2 3.41Å; L282-V286 PolarHBondContact O-N 3.45Å
283P95.1Very high88.7Confident46 Ų4639.9 Ų39.930%0.29923%0.232SC..Hα-helixtrans-58.7-42.4178.4-26.837.7000113.2V279 W281 A287 L305 L308V279-P283 WeakPolarHBondContact O-CD 3.31Å; V279-P283 WeakPolarHBondContact O-CG 3.08Å; W281-P283 VanDerWaalsContact C-CD 3.46Å; P283-A287 VanDerWaalsContact O-CB 3.3Å; P283-A287 WeakPolarHBondContact O-CB 3.29Å; P283-A287 PolarHBondContact O-N 2.81Å; P283-L305 HydrophobicContact CB-CD2 3.74Å; P283-L308 HydrophobicContact CB-CD2 4.47Å; P283-L308 HydrophobicContact CG-CD2 4.24Å
284F92.8Very high89Confident31 Ų3141.5 Ų41.514%0.13625%0.245CC..Hα-helixtrans-64.7-48178.2170-102.4000111.8W281 L282 V286 A287 N288 F302 L305 T306W281-F284 HydrophobicContact CE3-CD1 4.13Å; W281-F284 AromaticContact CZ3-CD1 4Å; W281-F284 HydrophobicContact CZ3-CD1 4Å; W281-F284 HydrophobicContact CZ3-CE1 4.37Å; W281-F284 PolarHBondContact O-N 2.68Å; L282-F284 VanDerWaalsContact C-N 3.33Å; L282-F284 PolarHBondContact O-N 3.37Å; F284-V286 VanDerWaalsContact C-N 3.33Å; F284-V286 PolarHBondContact O-N 3.28Å; F284-A287 CarbonylContact O-C 3.59Å; F284-A287 PolarHBondContact O-N 3.5Å; F284-N288 WeakPolarHBondContact O-CB 3.45Å; F284-N288 PolarHBondContact O-N 3.5Å; F284-F302 HydrophobicContact CE2-CE1 4.19Å; F284-F302 AromaticContact CE2-CZ 3.9Å; F284-F302 HydrophobicContact CE2-CZ 3.9Å; F284-L305 HydrophobicContact CB-CB 4.5Å; F284-T306 HydrophobicContact CE2-CG2 4.48Å; F284-T306 VanDerWaalsContact CE2-OG1 3.3Å; F284-T306 WeakPolarHBondContact CE2-OG1 3.21Å
285F92.5Very high89.1Confident12 Ų1245.6 Ų45.65%0.05327%0.267CS..Hα-helixtrans-65.7-36.1-178.8-79.5-73.9000112.9I114 F197 F198 W281 L282 N288 I289I114-F285 HydrophobicContact CD1-CE2 3.91Å; I114-F285 HydrophobicContact CD1-CZ 3.91Å; F197-F285 HydrophobicContact CB-CD1 3.82Å; F197-F285 HydrophobicContact CB-CD2 3.71Å; F197-F285 HydrophobicContact CB-CE1 3.59Å; F197-F285 HydrophobicContact CB-CE2 3.46Å; F197-F285 VanDerWaalsContact CB-CE2 3.46Å; F197-F285 HydrophobicContact CB-CG 3.89Å; F197-F285 HydrophobicContact CB-CZ 3.42Å; F197-F285 VanDerWaalsContact CB-CZ 3.42Å; F197-F285 HydrophobicContact CD1-CB 3.79Å; F197-F285 HydrophobicContact CD1-CD1 4.22Å; F197-F285 AromaticContact CD1-CD2 3.5Å; F197-F285 HydrophobicContact CD1-CD2 3.5Å; F197-F285 HydrophobicContact CD1-CE2 4.13Å; F197-F285 AromaticContact CD1-CG 3.56Å; F197-F285 HydrophobicContact CD1-CG 3.56Å; F197-F285 AromaticContact CD2-CD2 3.33Å; F197-F285 HydrophobicContact CD2-CD2 3.33Å; F197-F285 AromaticContact CD2-CE2 3.27Å; F197-F285 HydrophobicContact CD2-CE2 3.27Å; F197-F285 HydrophobicContact CD2-CG 4.21Å; F197-F285 HydrophobicContact CD2-CZ 4.12Å; F197-F285 HydrophobicContact CE1-CB 3.98Å; F197-F285 AromaticContact CE1-CD2 3.89Å; F197-F285 HydrophobicContact CE1-CD2 3.89Å; F197-F285 HydrophobicContact CE1-CG 4.11Å; F197-F285 AromaticContact CE2-CD2 3.74Å; F197-F285 HydrophobicContact CE2-CD2 3.74Å; F197-F285 HydrophobicContact CE2-CE2 4Å; F197-F285 HydrophobicContact CG-CB 4.35Å; F197-F285 HydrophobicContact CG-CD1 4.09Å; F197-F285 AromaticContact CG-CD2 3.2Å; F197-F285 HydrophobicContact CG-CD2 3.2Å; F197-F285 HydrophobicContact CG-CE1 4.21Å; F197-F285 AromaticContact CG-CE2 3.34Å; F197-F285 HydrophobicContact CG-CE2 3.34Å; F197-F285 AromaticContact CG-CG 3.62Å; F197-F285 HydrophobicContact CG-CG 3.62Å; F197-F285 AromaticContact CG-CZ 3.88Å; F197-F285 HydrophobicContact CG-CZ 3.88Å; F197-F285 AromaticContact CZ-CD2 3.99Å; F197-F285 HydrophobicContact CZ-CD2 3.99Å; F198-F285 HydrophobicContact CZ-CB 4.36Å; W281-F285 HydrophobicContact CB-CD2 4.26Å; W281-F285 HydrophobicContact CB-CE2 4.29Å; W281-F285 HydrophobicContact CD2-CE2 4.05Å; W281-F285 AromaticContact CE3-CD2 3.98Å; W281-F285 HydrophobicContact CE3-CD2 3.98Å; W281-F285 AromaticContact CE3-CE2 3.3Å; W281-F285 HydrophobicContact CE3-CE2 3.3Å; W281-F285 HydrophobicContact CE3-CZ 4.08Å; W281-F285 HydrophobicContact CG-CE2 4.5Å; W281-F285 AromaticContact CZ3-CE2 3.93Å; W281-F285 HydrophobicContact CZ3-CE2 3.93Å; W281-F285 HydrophobicContact CZ3-CZ 4.28Å; W281-F285 WeakPolarHBondContact O-CD2 3.44Å; W281-F285 PolarHBondContact O-N 3.15Å; W281-F285 VanDerWaalsContact O-N 3.15Å; L282-F285 PolarHBondContact O-N 2.87Å; F285-N288 PolarHBondContact O-N 2.99Å; F285-I289 PolarHBondContact O-N 3.39Å
286V92.8Very high89.2Confident71 Ų7148.1 Ų48.143%0.4328%0.278SS..Hα-helixtrans-64-47.7172.1172.80000110.3L282 F284 N288 I289 V290L282-V286 HydrophobicContact CD1-CG2 4.08Å; L282-V286 HydrophobicContact CG-CG2 4.29Å; L282-V286 VanDerWaalsContact O-CG2 3.31Å; L282-V286 WeakPolarHBondContact O-CG2 3.41Å; L282-V286 PolarHBondContact O-N 3.45Å; F284-V286 VanDerWaalsContact C-N 3.33Å; F284-V286 PolarHBondContact O-N 3.28Å; V286-N288 VanDerWaalsContact C-N 3.31Å; V286-N288 PolarHBondContact O-N 2.77Å; V286-I289 PolarHBondContact O-N 3.37Å; V286-V290 HydrophobicContact CG1-CG2 4.35Å; V286-V290 VanDerWaalsContact O-CG2 3.31Å; V286-V290 WeakPolarHBondContact O-CG2 3.42Å; V286-V290 PolarHBondContact O-N 2.95Å
287A91Very high89.2Confident6 Ų647.2 Ų47.25%0.0527%0.274CS..Hα-helixtrans-60.8-38.6177.200000112.7P283 F284 I289 V290 Q291 I297 L305P283-A287 VanDerWaalsContact O-CB 3.3Å; P283-A287 WeakPolarHBondContact O-CB 3.29Å; P283-A287 PolarHBondContact O-N 2.81Å; F284-A287 CarbonylContact O-C 3.59Å; F284-A287 PolarHBondContact O-N 3.5Å; A287-I289 PolarHBondContact O-N 2.98Å; A287-V290 PolarHBondContact O-N 3.38Å; A287-Q291 VanDerWaalsContact O-CB 3.29Å; A287-Q291 WeakPolarHBondContact O-CB 3.38Å; A287-Q291 PolarHBondContact O-N 3.08Å; A287-I297 HydrophobicContact CB-CD1 3.54Å; A287-I297 WeakPolarHBondContact O-CD1 3.34Å; A287-L305 HydrophobicContact CB-CD1 3.43Å; A287-L305 VanDerWaalsContact CB-CD1 3.43Å
288N88.9Confident89.3Confident35 Ų3550.3 Ų50.319%0.18730%0.296CS..Hα-helixtrans-62.3-43.2178.3-164.841.2000111.9F284 F285 V286 A292F284-N288 WeakPolarHBondContact O-CB 3.45Å; F284-N288 PolarHBondContact O-N 3.5Å; F285-N288 PolarHBondContact O-N 2.99Å; V286-N288 VanDerWaalsContact C-N 3.31Å; V286-N288 PolarHBondContact O-N 2.77Å; N288-A292 PolarHBondContact O-N 3.31Å
289I90.7Very high88.9Confident40 Ų4051.1 Ų51.121%0.20531%0.306CS..Hα-helixtrans-66.2-46.5174.5-67.7169000110.9V189 L190 F198 F285 V286 A287 Q291 A292 V293V189-I289 HydrophobicContact CG1-CG1 3.92Å; L190-I289 HydrophobicContact CD2-CD1 4.3Å; L190-I289 HydrophobicContact CD2-CG1 4.34Å; L190-I289 HydrophobicContact CD2-CG2 4.3Å; F198-I289 HydrophobicContact CE2-CD1 3.63Å; F198-I289 HydrophobicContact CZ-CD1 3.81Å; F285-I289 PolarHBondContact O-N 3.39Å; V286-I289 PolarHBondContact O-N 3.37Å; A287-I289 PolarHBondContact O-N 2.98Å; I289-Q291 PolarHBondContact O-N 3Å; I289-A292 PolarHBondContact O-N 3.39Å; I289-V293 WeakPolarHBondContact O-CG2 3.04Å; I289-V293 PolarHBondContact O-N 2.93Å
290V90.4Very high88.6Confident57 Ų5748.8 Ų48.835%0.34530%0.302SS..Hα-helixtrans-61.1-45.7-179.2169.50000110.8V286 A287 A292 V293 C294 I297V286-V290 HydrophobicContact CG1-CG2 4.35Å; V286-V290 VanDerWaalsContact O-CG2 3.31Å; V286-V290 WeakPolarHBondContact O-CG2 3.42Å; V286-V290 PolarHBondContact O-N 2.95Å; A287-V290 PolarHBondContact O-N 3.38Å; V290-A292 VanDerWaalsContact C-N 3.29Å; V290-A292 PolarHBondContact O-N 3.01Å; V290-V293 PolarHBondContact O-N 2.98Å; V290-C294 VanDerWaalsContact CG1-SG 3.55Å; V290-C294 PolarHBondContact O-N 3.02Å; V290-C294 PolarHBondContact O-SG 3.07Å; V290-I297 HydrophobicContact CB-CD1 4.08Å; V290-I297 HydrophobicContact CG1-CD1 3.97Å; V290-I297 HydrophobicContact CG1-CG1 4.12Å
291Q86.2Confident88.5Confident45 Ų4552.8 Ų52.821%0.2132%0.323CS..Hα-helixtrans-56.3-44.5175.9-176.963.733.400111.1A287 I289 V293 D295 I297 F302A287-Q291 VanDerWaalsContact O-CB 3.29Å; A287-Q291 WeakPolarHBondContact O-CB 3.38Å; A287-Q291 PolarHBondContact O-N 3.08Å; I289-Q291 PolarHBondContact O-N 3Å; Q291-V293 PolarHBondContact O-N 3.27Å; Q291-D295 VanDerWaalsContact NE2-CA 3.26Å; Q291-D295 PolarHBondContact NE2-OD1 2.02Å; Q291-D295 WeakPolarHBondContact O-CA 3.4Å; Q291-D295 PolarHBondContact O-N 3.48Å; Q291-I297 HydrophobicContact CB-CD1 4.35Å; Q291-I297 VanDerWaalsContact OE1-CB 3.25Å; Q291-I297 PolarHBondContact OE1-O 3.31Å; Q291-F302 HydrophobicContact CB-CE2 4.3Å
292A84.3Confident88.3Confident30 Ų3054.2 Ų54.225%0.24833%0.329CS..Hα-helixtrans-66.2-16.7178.200000114.5L186 V189 N288 I289 V290L186-A292 HydrophobicContact CD1-CB 4.14Å; V189-A292 HydrophobicContact CB-CB 4.15Å; V189-A292 HydrophobicContact CG1-CB 4.34Å; V189-A292 HydrophobicContact CG2-CB 3.87Å; N288-A292 PolarHBondContact O-N 3.31Å; I289-A292 PolarHBondContact O-N 3.39Å; V290-A292 VanDerWaalsContact C-N 3.29Å; V290-A292 PolarHBondContact O-N 3.01Å
293V86.3Confident88Confident102 Ų10252.9 Ų52.962%0.61832%0.323SS*.Hα-helixtrans-94.6-47.3178.4174.20000112.2L186 I289 V290 Q291L186-V293 HydrophobicContact CD1-CG2 3.62Å; L186-V293 HydrophobicContact CD2-CG2 4.45Å; I289-V293 WeakPolarHBondContact O-CG2 3.04Å; I289-V293 PolarHBondContact O-N 2.93Å; V290-V293 PolarHBondContact O-N 2.98Å; Q291-V293 PolarHBondContact O-N 3.27Å
294C83.7Confident87.8Confident58 Ų5853.4 Ų53.439%0.39233%0.33SS..Hα-helixtrans-119.9-9.1-166.564.10000114.9V290 C296V290-C294 VanDerWaalsContact CG1-SG 3.55Å; V290-C294 PolarHBondContact O-N 3.02Å; V290-C294 PolarHBondContact O-SG 3.07Å; C294-C296 HydrophobicContact CB-CB 3.79Å; C294-C296 WeakPolarHBondContact CB-SG 3.44Å; C294-C296 PolarHBondContact O-N 2.84Å; C294-C296 WeakPolarHBondContact SG-CB 3.28Å; C294-C296 PolarHBondContact SG-N 2.64Å; C294-C296 CovalentContact SG-SG 2.04Å; C294-C296 PolarHBondContact SG-SG 2.94Å
295D80.3Confident87.8Confident104 Ų10453.4 Ų53.456%0.55633%0.332SS*.  trans48.328.3-168.4-76.9-43.3000114.9Q291Q291-D295 VanDerWaalsContact NE2-CA 3.26Å; Q291-D295 PolarHBondContact NE2-OD1 2.02Å; Q291-D295 WeakPolarHBondContact O-CA 3.4Å; Q291-D295 PolarHBondContact O-N 3.48Å
296C84.7Confident87.8Confident90 Ų9053.8 Ų53.861%0.60834%0.335SS*.  trans-100.14-163.964.10000115.1C294C294-C296 HydrophobicContact CB-CB 3.79Å; C294-C296 WeakPolarHBondContact CB-SG 3.44Å; C294-C296 PolarHBondContact O-N 2.84Å; C294-C296 WeakPolarHBondContact SG-CB 3.28Å; C294-C296 PolarHBondContact SG-N 2.64Å; C294-C296 CovalentContact SG-SG 2.04Å; C294-C296 PolarHBondContact SG-SG 2.94Å
297I87.1Confident87.8Confident28 Ų2852 Ų5214%0.14432%0.32CS..SBendtrans-92.7130.7179.4-55.9-177.4000109.6A287 V290 Q291 L301 F302A287-I297 HydrophobicContact CB-CD1 3.54Å; A287-I297 WeakPolarHBondContact O-CD1 3.34Å; V290-I297 HydrophobicContact CB-CD1 4.08Å; V290-I297 HydrophobicContact CG1-CD1 3.97Å; V290-I297 HydrophobicContact CG1-CG1 4.12Å; Q291-I297 HydrophobicContact CB-CD1 4.35Å; Q291-I297 VanDerWaalsContact OE1-CB 3.25Å; Q291-I297 PolarHBondContact OE1-O 3.31Å; I297-L301 HydrophobicContact CG2-CB 4.09Å; I297-L301 HydrophobicContact CG2-CD2 4.06Å; I297-L301 HydrophobicContact CG2-CG 4.07Å; I297-F302 HydrophobicContact CG2-CB 4.12Å
298S87.8Confident87.9Confident67 Ų6754.6 Ų54.647%0.46933%0.333SS..  trans-62.3139.9176.173.10000111G300 L301 F302S298-G300 VanDerWaalsContact C-N 3.26Å; S298-G300 PolarHBondContact O-N 3.32Å; S298-L301 PolarHBondContact O-N 3.3Å; S298-L301 VanDerWaalsContact OG-CB 3.25Å; S298-L301 WeakPolarHBondContact OG-CB 3.48Å; S298-L301 PolarHBondContact OG-N 2.81Å; S298-F302 PolarHBondContact O-N 2.81Å
299P82.6Confident88.1Confident70 Ų7053 Ų5346%0.45533%0.325SS..Hα-helixtrans-46.3-45.7176.3-3640000114.3F302 D303P299-F302 PolarHBondContact O-N 3Å; P299-D303 PolarHBondContact O-N 3.25Å
300G85.3Confident88.2Confident49 Ų4951.3 Ų51.351%0.50532%0.316SS..Hα-helixtrans-68.7-35.4-179.200000113.7S298 A304S298-G300 VanDerWaalsContact C-N 3.26Å; S298-G300 PolarHBondContact O-N 3.32Å; G300-A304 VanDerWaalsContact O-CB 3.31Å; G300-A304 WeakPolarHBondContact O-CB 3.31Å; G300-A304 PolarHBondContact O-N 3.27Å
301L89.5Confident88.2Confident90 Ų9050.7 Ų50.747%0.47131%0.314SS..Hα-helixtrans-68.6-42.6174178.358.7000110.8I297 S298 A304 L305I297-L301 HydrophobicContact CG2-CB 4.09Å; I297-L301 HydrophobicContact CG2-CD2 4.06Å; I297-L301 HydrophobicContact CG2-CG 4.07Å; S298-L301 PolarHBondContact O-N 3.3Å; S298-L301 VanDerWaalsContact OG-CB 3.25Å; S298-L301 WeakPolarHBondContact OG-CB 3.48Å; S298-L301 PolarHBondContact OG-N 2.81Å; L301-A304 PolarHBondContact O-N 3.48Å; L301-L305 HydrophobicContact CD1-CD1 4.3Å; L301-L305 HydrophobicContact CD1-CG 4.16Å; L301-L305 HydrophobicContact CG-CD1 4.25Å; L301-L305 HydrophobicContact CG-CG 4.49Å; L301-L305 VanDerWaalsContact O-CG 3.28Å; L301-L305 WeakPolarHBondContact O-CG 3.5Å; L301-L305 PolarHBondContact O-N 3.17Å
302F88.4Confident88.4Confident37 Ų3748.7 Ų48.716%0.16230%0.304CS..Hα-helixtrans-59.5-49.6176.7-168.8-89.2000111F284 Q291 I297 S298 P299 A304 L305 T306F284-F302 HydrophobicContact CE2-CE1 4.19Å; F284-F302 AromaticContact CE2-CZ 3.9Å; F284-F302 HydrophobicContact CE2-CZ 3.9Å; Q291-F302 HydrophobicContact CB-CE2 4.3Å; I297-F302 HydrophobicContact CG2-CB 4.12Å; S298-F302 PolarHBondContact O-N 2.81Å; P299-F302 PolarHBondContact O-N 3Å; F302-A304 VanDerWaalsContact C-N 3.33Å; F302-A304 PolarHBondContact O-N 3.34Å; F302-L305 PolarHBondContact O-N 2.97Å; F302-T306 PolarHBondContact O-N 2.67Å; F302-T306 PolarHBondContact O-OG1 3.22Å; F302-T306 VanDerWaalsContact O-OG1 3.09Å
303D87.8Confident88.7Confident43 Ų4347.3 Ų47.323%0.2329%0.293CS..Hα-helixtrans-59.8-43177.6-63.7-21.1000110.9R181 P299 L305 T306 W307R181-D303 IonicContact NH2-OD1 3.42Å; R181-D303 PolarHBondContact NH2-OD1 3.49Å; R181-D303 IonicContact NH2-OD2 3.46Å; R181-D303 PolarHBondContact NH2-OD2 2.9Å; P299-D303 PolarHBondContact O-N 3.25Å; D303-L305 PolarHBondContact O-N 3.32Å; D303-T306 WeakPolarHBondContact O-CB 3.39Å; D303-T306 PolarHBondContact O-N 3.1Å; D303-W307 PolarHBondContact O-N 3.02Å
304A90.7Very high88.8Confident56 Ų5643.1 Ų43.146%0.46327%0.268SS..Hα-helixtrans-61.6-40.4176.800000113G300 L301 F302 W307 L308G300-A304 VanDerWaalsContact O-CB 3.31Å; G300-A304 WeakPolarHBondContact O-CB 3.31Å; G300-A304 PolarHBondContact O-N 3.27Å; L301-A304 PolarHBondContact O-N 3.48Å; F302-A304 VanDerWaalsContact C-N 3.33Å; F302-A304 PolarHBondContact O-N 3.34Å; A304-W307 PolarHBondContact O-N 3.32Å; A304-L308 WeakPolarHBondContact O-CB 3.11Å; A304-L308 PolarHBondContact O-N 3.36Å
305L93.4Very high89Confident32 Ų3243.7 Ų43.717%0.16827%0.265CS..Hα-helixtrans-68.9-36.5175.9-65.9178.1000111.8P283 F284 A287 L301 F302 D303 L308 G309P283-L305 HydrophobicContact CB-CD2 3.74Å; F284-L305 HydrophobicContact CB-CB 4.5Å; A287-L305 HydrophobicContact CB-CD1 3.43Å; A287-L305 VanDerWaalsContact CB-CD1 3.43Å; L301-L305 HydrophobicContact CD1-CD1 4.3Å; L301-L305 HydrophobicContact CD1-CG 4.16Å; L301-L305 HydrophobicContact CG-CD1 4.25Å; L301-L305 HydrophobicContact CG-CG 4.49Å; L301-L305 VanDerWaalsContact O-CG 3.28Å; L301-L305 WeakPolarHBondContact O-CG 3.5Å; L301-L305 PolarHBondContact O-N 3.17Å; F302-L305 PolarHBondContact O-N 2.97Å; D303-L305 PolarHBondContact O-N 3.32Å; L305-L308 WeakPolarHBondContact O-CB 3.42Å; L305-L308 PolarHBondContact O-N 3Å; L305-G309 PolarHBondContact O-N 3.35Å
306T91.4Very high89.3Confident19 Ų1938.9 Ų38.912%0.11724%0.24CC..Hα-helixtrans-61.7-47.4172.3-58.70000111.3F284 F302 D303 L308 G309 Y310F284-T306 HydrophobicContact CE2-CG2 4.48Å; F284-T306 VanDerWaalsContact CE2-OG1 3.3Å; F284-T306 WeakPolarHBondContact CE2-OG1 3.21Å; F302-T306 PolarHBondContact O-N 2.67Å; F302-T306 PolarHBondContact O-OG1 3.22Å; F302-T306 VanDerWaalsContact O-OG1 3.09Å; D303-T306 WeakPolarHBondContact O-CB 3.39Å; D303-T306 PolarHBondContact O-N 3.1Å; T306-L308 VanDerWaalsContact C-N 3.32Å; T306-L308 PolarHBondContact O-N 2.96Å; T306-G309 WeakPolarHBondContact O-CA 3.3Å; T306-G309 PolarHBondContact O-N 2.79Å; T306-G309 VanDerWaalsContact O-N 3.09Å; T306-Y310 HydrophobicContact CG2-CD2 4.39Å; T306-Y310 HydrophobicContact CG2-CE1 4.07Å; T306-Y310 HydrophobicContact CG2-CE2 3.71Å; T306-Y310 PolarHBondContact O-N 2.79Å
307W93.1Very high89.3Confident33 Ų3335 Ų3513%0.12521%0.213CC..Hα-helixtrans-64-35.6176.3-81.999.8000112.8L33 I37 M80 A83 M84 D303 A304 G309 Y310 C311L33-W307 HydrophobicContact CB-CH2 4.3Å; L33-W307 HydrophobicContact CD1-CH2 4.31Å; L33-W307 HydrophobicContact CD1-CZ2 3.95Å; L33-W307 HydrophobicContact CD2-CD2 3.87Å; L33-W307 HydrophobicContact CD2-CE3 3.72Å; L33-W307 HydrophobicContact CD2-CH2 3.76Å; L33-W307 HydrophobicContact CD2-CZ2 3.89Å; L33-W307 HydrophobicContact CD2-CZ3 3.66Å; L33-W307 HydrophobicContact CG-CH2 4.34Å; L33-W307 HydrophobicContact CG-CZ2 4.4Å; I37-W307 HydrophobicContact CD1-CH2 4.49Å; M80-W307 HydrophobicContact CB-CH2 4.18Å; M80-W307 HydrophobicContact CB-CZ3 4.3Å; M80-W307 HydrophobicContact CG-CZ3 4.17Å; M80-W307 HydrophobicContact SD-CZ3 4.46Å; A83-W307 HydrophobicContact CB-CZ2 4.2Å; M84-W307 HydrophobicContact CB-CH2 4.09Å; M84-W307 HydrophobicContact CB-CZ2 4Å; D303-W307 PolarHBondContact O-N 3.02Å; A304-W307 PolarHBondContact O-N 3.32Å; W307-G309 VanDerWaalsContact C-N 3.29Å; W307-G309 PolarHBondContact O-N 3.47Å; W307-Y310 HydrophobicContact CD2-CD2 4.15Å; W307-Y310 HydrophobicContact CE3-CD2 4.05Å; W307-Y310 HydrophobicContact CZ3-CD2 4.43Å; W307-Y310 PolarHBondContact O-N 3.04Å; W307-C311 PolarHBondContact O-N 3.17Å; W307-C311 PolarHBondContact O-SG 2.85Å
308L93.8Very high89.1Confident62 Ų6237.4 Ų37.433%0.32523%0.226SC..Hα-helixtrans-60.6-39.6171.8179.263.5000111.6T280 P283 A304 L305 T306 C311T280-L308 WeakPolarHBondContact CB-O 3.25Å; T280-L308 HydrophobicContact CG2-CD1 4.44Å; P283-L308 HydrophobicContact CB-CD2 4.47Å; P283-L308 HydrophobicContact CG-CD2 4.24Å; A304-L308 WeakPolarHBondContact O-CB 3.11Å; A304-L308 PolarHBondContact O-N 3.36Å; L305-L308 WeakPolarHBondContact O-CB 3.42Å; L305-L308 PolarHBondContact O-N 3Å; T306-L308 VanDerWaalsContact C-N 3.32Å; T306-L308 PolarHBondContact O-N 2.96Å; L308-C311 WeakPolarHBondContact O-CB 3.37Å; L308-C311 PolarHBondContact O-N 3.19Å
309G92.4Very high88.8Confident0 Ų034.6 Ų34.60%021%0.205CC..Hα-helixtrans-61.2-46.9171.800000112.2T280 L305 T306 W307 C311 N312T280-G309 WeakPolarHBondContact O-CA 3.02Å; T280-G309 PolarHBondContact O-N 3.03Å; L305-G309 PolarHBondContact O-N 3.35Å; T306-G309 WeakPolarHBondContact O-CA 3.3Å; T306-G309 PolarHBondContact O-N 2.79Å; T306-G309 VanDerWaalsContact O-N 3.09Å; W307-G309 VanDerWaalsContact C-N 3.29Å; W307-G309 PolarHBondContact O-N 3.47Å; G309-C311 VanDerWaalsContact C-N 3.28Å; G309-C311 PolarHBondContact O-N 2.97Å; G309-N312 WeakPolarHBondContact O-CB 3.14Å; G309-N312 PolarHBondContact O-N 3.33Å; G309-N312 VanDerWaalsContact O-N 3.07Å
310Y93.8Very high88.6Confident6 Ų631.5 Ų31.52%0.02418%0.184CC..Hα-helixtrans-61.5-32.6177.7-63.7-23.3000113.6V75 V79 M80 A83 D106 T306 W307 N312 S313V75-Y310 HydrophobicContact CG1-CD1 4.08Å; V75-Y310 HydrophobicContact CG1-CG 4.45Å; V79-Y310 HydrophobicContact CG1-CE1 3.77Å; V79-Y310 HydrophobicContact CG1-CE2 4.29Å; V79-Y310 WeakPolarHBondContact CG1-OH 3.19Å; M80-Y310 WeakPolarHBondContact CE-O 2.9Å; M80-Y310 HydrophobicContact CG-CD2 4.21Å; M80-Y310 HydrophobicContact CG-CG 4.45Å; A83-Y310 HydrophobicContact CB-CE2 3.96Å; D106-Y310 VanDerWaalsContact OD1-CE1 3.31Å; D106-Y310 WeakPolarHBondContact OD1-CE1 3.31Å; D106-Y310 PolarHBondContact OD1-OH 2.91Å; D106-Y310 PolarHBondContact OD2-OH 3.3Å; T306-Y310 HydrophobicContact CG2-CD2 4.39Å; T306-Y310 HydrophobicContact CG2-CE1 4.07Å; T306-Y310 HydrophobicContact CG2-CE2 3.71Å; T306-Y310 PolarHBondContact O-N 2.79Å; W307-Y310 HydrophobicContact CD2-CD2 4.15Å; W307-Y310 HydrophobicContact CE3-CD2 4.05Å; W307-Y310 HydrophobicContact CZ3-CD2 4.43Å; W307-Y310 PolarHBondContact O-N 3.04Å; Y310-N312 PolarHBondContact O-N 3.41Å; Y310-N312 VanDerWaalsContact O-N 3.09Å; Y310-S313 WeakPolarHBondContact O-CB 3.27Å; Y310-S313 PolarHBondContact O-N 3.2Å
311C90.3Very high88.3Confident44 Ų4430 Ų3030%0.29717%0.165SC..Hα-helixtrans-58.3-22.3175.1-73.30000113.1W307 L308 G309 S313 T314 M315W307-C311 PolarHBondContact O-N 3.17Å; W307-C311 PolarHBondContact O-SG 2.85Å; L308-C311 WeakPolarHBondContact O-CB 3.37Å; L308-C311 PolarHBondContact O-N 3.19Å; G309-C311 VanDerWaalsContact C-N 3.28Å; G309-C311 PolarHBondContact O-N 2.97Å; C311-S313 PolarHBondContact O-N 2.71Å; C311-T314 WeakPolarHBondContact O-CB 3.18Å; C311-T314 PolarHBondContact O-N 2.9Å; C311-M315 VanDerWaalsContact O-CG 3.25Å; C311-M315 WeakPolarHBondContact O-CG 3.48Å; C311-M315 PolarHBondContact O-N 2.97Å
312N90.1Very high87.6Confident3 Ų331.4 Ų31.42%0.01617%0.173CC..Hα-helixtrans-52.9-44.1172.5-175.972.7000111.8T280 W281 G309 Y310 T314 M315 N316T280-N312 HydrophobicContact CG2-CB 4.49Å; T280-N312 PolarHBondContact OG1-OD1 3.1Å; W281-N312 VanDerWaalsContact NE1-CG 3.32Å; W281-N312 PolarHBondContact NE1-ND2 3.37Å; G309-N312 WeakPolarHBondContact O-CB 3.14Å; G309-N312 PolarHBondContact O-N 3.33Å; G309-N312 VanDerWaalsContact O-N 3.07Å; Y310-N312 PolarHBondContact O-N 3.41Å; Y310-N312 VanDerWaalsContact O-N 3.09Å; N312-T314 VanDerWaalsContact C-N 3.28Å; N312-T314 PolarHBondContact O-N 3.3Å; N312-M315 PolarHBondContact O-N 3.25Å; N312-N316 VanDerWaalsContact O-CG 3.28Å; N312-N316 PolarHBondContact O-N 3.38Å; N312-N316 VanDerWaalsContact O-N 3.08Å; N312-N316 PolarHBondContact O-ND2 3.5Å
313S90.2Very high86.6Confident1 Ų133 Ų331%0.00718%0.18CC..Hα-helixtrans-68.2-25.4178.6-64.50000113.2N44 D72 Y310 C311 P317N44-S313 PolarHBondContact ND2-O 2.91Å; D72-S313 WeakPolarHBondContact OD1-CB 3.31Å; D72-S313 PolarHBondContact OD1-OG 2.84Å; Y310-S313 WeakPolarHBondContact O-CB 3.27Å; Y310-S313 PolarHBondContact O-N 3.2Å; C311-S313 PolarHBondContact O-N 2.71Å; S313-P317 WeakPolarHBondContact O-CD 3.41Å
314T89.8Confident85.8Confident14 Ų1433 Ų339%0.08618%0.179CC..Hα-helixtrans-79-36.1173.2-42.70000111.7L39 T40 C311 N312 P317L39-T314 HydrophobicContact CD2-CG2 3.98Å; L39-T314 HydrophobicContact CG-CG2 4.23Å; T40-T314 WeakPolarHBondContact OG1-CB 3.32Å; T40-T314 PolarHBondContact OG1-OG1 2.96Å; C311-T314 WeakPolarHBondContact O-CB 3.18Å; C311-T314 PolarHBondContact O-N 2.9Å; N312-T314 VanDerWaalsContact C-N 3.28Å; N312-T314 PolarHBondContact O-N 3.3Å; T314-P317 WeakPolarHBondContact O-CD 3.16Å
315M87.1Confident84.9Confident69 Ų6937.9 Ų37.934%0.3419%0.186SC..Hα-helixtrans-76.2-33-176.4-65.4-64.7-95.900112.4M276 C311 N312 I318 I319M276-M315 HydrophobicContact CE-CE 3.65Å; M276-M315 HydrophobicContact SD-CB 3.45Å; M276-M315 WeakPolarHBondContact SD-CB 3.37Å; M276-M315 HydrophobicContact SD-CE 3.53Å; M276-M315 VanDerWaalsContact SD-CE 3.53Å; M276-M315 HydrophobicContact SD-CG 3.72Å; M276-M315 HydrophobicContact SD-SD 4.4Å; C311-M315 VanDerWaalsContact O-CG 3.25Å; C311-M315 WeakPolarHBondContact O-CG 3.48Å; C311-M315 PolarHBondContact O-N 2.97Å; N312-M315 PolarHBondContact O-N 3.25Å; M315-I318 WeakPolarHBondContact O-CA 3.28Å; M315-I318 WeakPolarHBondContact O-CB 3.4Å; M315-I318 PolarHBondContact O-N 2.88Å; M315-I318 HydrophobicContact SD-CD1 4.2Å; M315-I319 HydrophobicContact CB-CD1 4.13Å; M315-I319 VanDerWaalsContact O-CG1 3.27Å; M315-I319 WeakPolarHBondContact O-CG1 3.46Å; M315-I319 PolarHBondContact O-N 3.43Å
316N85.3Confident83.9Confident4 Ų441 Ų412%0.02120%0.202CC..Hα-helixtrans-47.9-53.4180-77.3-22.5000112.3D72 N312 I318 I319 Y320D72-N316 PolarHBondContact OD2-ND2 3.49Å; N312-N316 VanDerWaalsContact O-CG 3.28Å; N312-N316 PolarHBondContact O-N 3.38Å; N312-N316 VanDerWaalsContact O-N 3.08Å; N312-N316 PolarHBondContact O-ND2 3.5Å; N316-I318 PolarHBondContact O-N 3.08Å; N316-I318 VanDerWaalsContact O-N 3.16Å; N316-I319 PolarHBondContact O-N 2.97Å; N316-Y320 HydrophobicContact CB-CE2 4.23Å; N316-Y320 WeakPolarHBondContact O-CD2 3.44Å; N316-Y320 PolarHBondContact O-N 3.28Å
317P85.1Confident83.1Confident9 Ų940.3 Ų40.36%0.05820%0.198CC..Hα-helixtrans-61.3-20.9176-28.935.7000117.6A43 N44 L47 S313 T314 P321A43-P317 HydrophobicContact CB-CB 3.55Å; A43-P317 HydrophobicContact CB-CG 3.9Å; N44-P317 HydrophobicContact CB-CG 4.35Å; N44-P317 VanDerWaalsContact CG-CG 3.46Å; N44-P317 VanDerWaalsContact OD1-CG 3.23Å; N44-P317 WeakPolarHBondContact OD1-CG 3.36Å; L47-P317 HydrophobicContact CD1-CB 3.57Å; L47-P317 HydrophobicContact CD1-CG 4.18Å; L47-P317 HydrophobicContact CG-CB 4.34Å; S313-P317 WeakPolarHBondContact O-CD 3.41Å; T314-P317 WeakPolarHBondContact O-CD 3.16Å; P317-P321 WeakPolarHBondContact O-CD 3.24Å; P317-P321 VanDerWaalsContact O-CG 3.26Å; P317-P321 WeakPolarHBondContact O-CG 3.41Å
318I83.9Confident82.5Confident78 Ų7845.4 Ų45.440%0.422%0.221SC..Hα-helixtrans-81.9-42.2177.5-62.1170.6000109.4M315 N316 L322M315-I318 WeakPolarHBondContact O-CA 3.28Å; M315-I318 WeakPolarHBondContact O-CB 3.4Å; M315-I318 PolarHBondContact O-N 2.88Å; M315-I318 HydrophobicContact SD-CD1 4.2Å; N316-I318 PolarHBondContact O-N 3.08Å; N316-I318 VanDerWaalsContact O-N 3.16Å; I318-L322 HydrophobicContact CG2-CD1 3.7Å; I318-L322 WeakPolarHBondContact O-CD1 3.48Å; I318-L322 WeakPolarHBondContact O-CG 3.28Å; I318-L322 PolarHBondContact O-N 2.89Å
319I81.5Confident81.7Confident7 Ų749.3 Ų49.34%0.03623%0.231CC..Hα-helixtrans-70.5-43.1-173.8-52.3158.6000110.6L273 M276 M315 N316 L322 F323L273-I319 HydrophobicContact CD1-CG2 4.47Å; L273-I319 HydrophobicContact CD2-CB 3.7Å; L273-I319 HydrophobicContact CD2-CD1 3.9Å; L273-I319 HydrophobicContact CD2-CG1 4.42Å; L273-I319 HydrophobicContact CD2-CG2 3.19Å; L273-I319 HydrophobicContact CG-CG2 3.54Å; M276-I319 HydrophobicContact CE-CD1 3.99Å; M276-I319 HydrophobicContact CE-CG1 4.16Å; M276-I319 HydrophobicContact SD-CD1 3.4Å; M276-I319 WeakPolarHBondContact SD-CD1 3.31Å; M276-I319 HydrophobicContact SD-CG1 4.09Å; M315-I319 HydrophobicContact CB-CD1 4.13Å; M315-I319 VanDerWaalsContact O-CG1 3.27Å; M315-I319 WeakPolarHBondContact O-CG1 3.46Å; M315-I319 PolarHBondContact O-N 3.43Å; N316-I319 PolarHBondContact O-N 2.97Å; I319-L322 PolarHBondContact O-N 3.19Å; I319-F323 HydrophobicContact CB-CD2 4.48Å; I319-F323 HydrophobicContact CG2-CD2 3.47Å; I319-F323 VanDerWaalsContact CG2-CD2 3.47Å; I319-F323 HydrophobicContact CG2-CE2 3.76Å; I319-F323 VanDerWaalsContact O-CD2 3.26Å; I319-F323 WeakPolarHBondContact O-CD2 3.2Å; I319-F323 PolarHBondContact O-N 3.31Å; I319-F323 VanDerWaalsContact O-N 3.13Å
320Y79Confident81Confident5 Ų549.6 Ų49.62%0.0223%0.234CC..Hα-helixtrans-60.1-49.3-176-70.9-72.8000113.8L65 L68 F69 L273 N316 L322 F323 M324L65-Y320 HydrophobicContact CD2-CD1 3.93Å; L65-Y320 HydrophobicContact CD2-CE1 3.3Å; L65-Y320 HydrophobicContact CD2-CE2 4.13Å; L65-Y320 VanDerWaalsContact CD2-CZ 3.42Å; L68-Y320 HydrophobicContact CD2-CE2 3.76Å; L68-Y320 WeakPolarHBondContact CD2-OH 3.29Å; F69-Y320 AromaticContact CE1-CD2 3.51Å; F69-Y320 HydrophobicContact CE1-CD2 3.51Å; F69-Y320 AromaticContact CE1-CE2 3.7Å; F69-Y320 HydrophobicContact CE1-CE2 3.7Å; F69-Y320 AromaticContact CZ-CD2 3.46Å; F69-Y320 HydrophobicContact CZ-CD2 3.46Å; F69-Y320 VanDerWaalsContact CZ-CD2 3.46Å; F69-Y320 AromaticContact CZ-CE2 3.89Å; F69-Y320 HydrophobicContact CZ-CE2 3.89Å; F69-Y320 HydrophobicContact CZ-CG 4.08Å; L273-Y320 HydrophobicContact CD1-CE1 4.4Å; L273-Y320 HydrophobicContact CD2-CE1 4.41Å; N316-Y320 HydrophobicContact CB-CE2 4.23Å; N316-Y320 WeakPolarHBondContact O-CD2 3.44Å; N316-Y320 PolarHBondContact O-N 3.28Å; Y320-L322 PolarHBondContact O-N 3.36Å; Y320-F323 PolarHBondContact O-N 3.21Å; Y320-M324 HydrophobicContact CD1-CG 4.28Å; Y320-M324 WeakPolarHBondContact O-CA 3.43Å; Y320-M324 WeakPolarHBondContact O-CB 3.44Å; Y320-M324 PolarHBondContact O-N 2.8Å
321P77Confident80.4Confident17 Ų1751 Ų5111%0.1124%0.241CC..Hα-helixtrans-67.8-30176.5-21.935.3000114.2L47 P317 F323 K328 L331L47-P321 HydrophobicContact CD2-CG 4.09Å; P317-P321 WeakPolarHBondContact O-CD 3.24Å; P317-P321 VanDerWaalsContact O-CG 3.26Å; P317-P321 WeakPolarHBondContact O-CG 3.41Å; P321-F323 VanDerWaalsContact C-N 3.31Å; P321-F323 PolarHBondContact O-N 3.39Å; P321-K328 WeakPolarHBondContact O-CB 3.31Å; P321-L331 HydrophobicContact CB-CD2 4.04Å; P321-L331 HydrophobicContact CG-CD2 4.31Å
322L74.9Confident79.7Confident121 Ų12151.2 Ų51.263%0.63425%0.251SS*.Hα-helixtrans-66.7-35.9177.8-75.3176.1000111.9I318 I319 Y320I318-L322 HydrophobicContact CG2-CD1 3.7Å; I318-L322 WeakPolarHBondContact O-CD1 3.48Å; I318-L322 WeakPolarHBondContact O-CG 3.28Å; I318-L322 PolarHBondContact O-N 2.89Å; I319-L322 PolarHBondContact O-N 3.19Å; Y320-L322 PolarHBondContact O-N 3.36Å
323F68.1Low79Confident71 Ų7159.9 Ų59.931%0.31128%0.284SS..Hα-helixtrans-117.5-17.2-169.9-60.5-83.2000115.7T269 I272 I319 Y320 P321T269-F323 HydrophobicContact CG2-CB 3.13Å; T269-F323 HydrophobicContact CG2-CD1 4.24Å; T269-F323 HydrophobicContact CG2-CG 3.87Å; T269-F323 WeakPolarHBondContact OG1-CD1 3.48Å; I272-F323 HydrophobicContact CB-CZ 4.47Å; I272-F323 HydrophobicContact CD1-CD1 4.46Å; I272-F323 HydrophobicContact CD1-CE1 3.51Å; I272-F323 HydrophobicContact CD1-CZ 3.61Å; I272-F323 HydrophobicContact CG2-CE2 4.14Å; I272-F323 HydrophobicContact CG2-CZ 4.03Å; I319-F323 HydrophobicContact CB-CD2 4.48Å; I319-F323 HydrophobicContact CG2-CD2 3.47Å; I319-F323 VanDerWaalsContact CG2-CD2 3.47Å; I319-F323 HydrophobicContact CG2-CE2 3.76Å; I319-F323 VanDerWaalsContact O-CD2 3.26Å; I319-F323 WeakPolarHBondContact O-CD2 3.2Å; I319-F323 PolarHBondContact O-N 3.31Å; I319-F323 VanDerWaalsContact O-N 3.13Å; Y320-F323 PolarHBondContact O-N 3.21Å; P321-F323 VanDerWaalsContact C-N 3.31Å; P321-F323 PolarHBondContact O-N 3.39Å
324M72.2Confident78.1Confident42 Ų4264 Ų6421%0.20730%0.302CS..  trans-97.7110.8170.8-60.9-70.2-177.100110Y320 D326 F327 K328Y320-M324 HydrophobicContact CD1-CG 4.28Å; Y320-M324 WeakPolarHBondContact O-CA 3.43Å; Y320-M324 WeakPolarHBondContact O-CB 3.44Å; Y320-M324 PolarHBondContact O-N 2.8Å; M324-D326 PolarHBondContact O-N 3.31Å; M324-F327 HydrophobicContact CB-CB 4.22Å; M324-F327 HydrophobicContact CB-CD2 3.77Å; M324-F327 HydrophobicContact CB-CG 4.42Å; M324-F327 HydrophobicContact CG-CD2 4.36Å; M324-F327 PolarHBondContact O-N 3.48Å; M324-K328 PolarHBondContact O-N 3.22Å
325R70.3Confident77.4Confident158 Ų15868.2 Ų68.260%0.59632%0.323SS*.Hα-helixtrans-58.8-33.7-177.7-76.7179.8167.8152.1-3.8113.6K328 R329R325-K328 PolarHBondContact O-N 3.47Å; R325-R329 VanDerWaalsContact O-CG 3.32Å; R325-R329 WeakPolarHBondContact O-CG 3.47Å; R325-R329 PolarHBondContact O-N 3.29Å
326D73Confident76.1Confident97 Ų9770.7 Ų70.752%0.51934%0.344SS..Hα-helixtrans-71.5-37.4-177.6-58.8-37.5000111.3L57 M324 R329 A330L57-D326 HydrophobicContact CD2-CB 4.02Å; M324-D326 PolarHBondContact O-N 3.31Å; D326-R329 PolarHBondContact O-N 3.48Å; D326-R329 IonicContact OD1-NH1 3.02Å; D326-R329 PolarHBondContact OD1-NH1 3.05Å; D326-A330 WeakPolarHBondContact O-CB 3.48Å; D326-A330 PolarHBondContact O-N 2.85Å
327F74.6Confident74.6Confident5 Ų574.2 Ų74.22%0.02237%0.368CS..Hα-helixtrans-66-44.6170.4-81.3-89.2000111.9L47 L50 I51 L65 M324 R329 A330 L331L47-F327 HydrophobicContact CD2-CD1 4.19Å; L50-F327 HydrophobicContact CD2-CD1 4.35Å; I51-F327 HydrophobicContact CD1-CE1 3.72Å; I51-F327 HydrophobicContact CD1-CZ 3.63Å; I51-F327 HydrophobicContact CG1-CE1 3.59Å; I51-F327 HydrophobicContact CG1-CZ 3.74Å; L65-F327 HydrophobicContact CD1-CE2 3.58Å; L65-F327 HydrophobicContact CD1-CZ 3.56Å; M324-F327 HydrophobicContact CB-CB 4.22Å; M324-F327 HydrophobicContact CB-CD2 3.77Å; M324-F327 HydrophobicContact CB-CG 4.42Å; M324-F327 HydrophobicContact CG-CD2 4.36Å; M324-F327 PolarHBondContact O-N 3.48Å; F327-R329 VanDerWaalsContact C-N 3.31Å; F327-R329 PolarHBondContact O-N 2.97Å; F327-A330 PolarHBondContact O-N 3.03Å; F327-L331 VanDerWaalsContact O-CB 3.29Å; F327-L331 WeakPolarHBondContact O-CB 3.11Å; F327-L331 PolarHBondContact O-N 2.92Å
328K80.1Confident73.3Confident140 Ų14080 Ų8061%0.60941%0.406SS*.Hα-helixtrans-56.1-44.9176.1-170.5173.1178.3171.50112.3P321 M324 R325 G332P321-K328 WeakPolarHBondContact O-CB 3.31Å; M324-K328 PolarHBondContact O-N 3.22Å; R325-K328 PolarHBondContact O-N 3.47Å; K328-G332 PolarHBondContact O-N 3.07Å
329R78.1Confident71.8Confident145 Ų14587.1 Ų87.155%0.54743%0.428SS..Hα-helixtrans-67.3-43.3178.8-73.1174.6-170.5146.9-9.4112R325 D326 F327 G332 R333R325-R329 VanDerWaalsContact O-CG 3.32Å; R325-R329 WeakPolarHBondContact O-CG 3.47Å; R325-R329 PolarHBondContact O-N 3.29Å; D326-R329 PolarHBondContact O-N 3.48Å; D326-R329 IonicContact OD1-NH1 3.02Å; D326-R329 PolarHBondContact OD1-NH1 3.05Å; F327-R329 VanDerWaalsContact C-N 3.31Å; F327-R329 PolarHBondContact O-N 2.97Å; R329-G332 PolarHBondContact O-N 3.39Å; R329-R333 WeakPolarHBondContact O-CG 3.18Å; R329-R333 PolarHBondContact O-N 3.43Å
330A77.2Confident70.1Confident6 Ų691.1 Ų91.15%0.0546%0.455CS..Hα-helixtrans-64.9-44.3178.700000111.2L50 Q54 L57 D326 F327 G332 R333 F334L50-A330 HydrophobicContact CD1-CB 3.92Å; L50-A330 HydrophobicContact CD2-CB 3.98Å; L50-A330 HydrophobicContact CG-CB 4.06Å; Q54-A330 HydrophobicContact CG-CB 4.48Å; L57-A330 HydrophobicContact CD1-CB 3.65Å; L57-A330 HydrophobicContact CG-CB 4.36Å; D326-A330 WeakPolarHBondContact O-CB 3.48Å; D326-A330 PolarHBondContact O-N 2.85Å; F327-A330 PolarHBondContact O-N 3.03Å; A330-G332 PolarHBondContact O-N 2.98Å; A330-R333 PolarHBondContact O-N 3.39Å; A330-F334 PolarHBondContact O-N 3.07Å; A330-F334 VanDerWaalsContact O-N 3.16Å
331L80.6Confident68.2Low35 Ų3596.8 Ų96.818%0.18349%0.492CS..Hα-helixtrans-63.8-39.9176.1-172.964.5000111.9L46 L50 P321 F327 R333 F334 L335L46-L331 HydrophobicContact CD2-CD1 4Å; L50-L331 HydrophobicContact CD2-CB 4.26Å; P321-L331 HydrophobicContact CB-CD2 4.04Å; P321-L331 HydrophobicContact CG-CD2 4.31Å; F327-L331 VanDerWaalsContact O-CB 3.29Å; F327-L331 WeakPolarHBondContact O-CB 3.11Å; F327-L331 PolarHBondContact O-N 2.92Å; L331-R333 PolarHBondContact O-N 3.02Å; L331-F334 PolarHBondContact O-N 3.35Å; L331-F334 VanDerWaalsContact O-N 3.09Å; L331-L335 HydrophobicContact CD1-CD1 4.03Å; L331-L335 HydrophobicContact CD1-CG 4.13Å; L331-L335 HydrophobicContact CD2-CD1 4.31Å; L331-L335 HydrophobicContact CG-CD1 3.83Å; L331-L335 HydrophobicContact CG-CG 4.3Å; L331-L335 PolarHBondContact O-N 3.22Å
332G76.2Confident66.2Low49 Ų49105.3 Ų105.351%0.50552%0.523SS..Hα-helixtrans-66.3-19.4175.700000114.8K328 R329 A330K328-G332 PolarHBondContact O-N 3.07Å; R329-G332 PolarHBondContact O-N 3.39Å; A330-G332 PolarHBondContact O-N 2.98Å
333R75.5Confident64.5Low185 Ų185108.8 Ų108.870%0.69854%0.535SS*.Hα-helixtrans-85.9-27.5170.2-68.6175.7-174.1167.7-0.8112.6R329 A330 L331R329-R333 WeakPolarHBondContact O-CG 3.18Å; R329-R333 PolarHBondContact O-N 3.43Å; A330-R333 PolarHBondContact O-N 3.39Å; L331-R333 PolarHBondContact O-N 3.02Å
334F69.9Low63Low88 Ų88114.5 Ų114.539%0.38656%0.555SS.*Hα-helixtrans-85.7-34-177.2-130.9-89.9000112.5L50 A330 L331 P336L50-F334 HydrophobicContact CD1-CB 4.16Å; L50-F334 HydrophobicContact CD1-CD2 3.62Å; L50-F334 HydrophobicContact CD1-CE2 4.24Å; L50-F334 HydrophobicContact CD1-CG 4.02Å; A330-F334 PolarHBondContact O-N 3.07Å; A330-F334 VanDerWaalsContact O-N 3.16Å; L331-F334 PolarHBondContact O-N 3.35Å; L331-F334 VanDerWaalsContact O-N 3.09Å; F334-P336 WeakPolarHBondContact O-CD 3.39Å
335L74.9Confident61.7Low101 Ų101121 Ų12153%0.52959%0.585SS.*SBendtrans-82.1116.1170.9-67.9172.6000108.4L331 C337L331-L335 HydrophobicContact CD1-CD1 4.03Å; L331-L335 HydrophobicContact CD1-CG 4.13Å; L331-L335 HydrophobicContact CD2-CD1 4.31Å; L331-L335 HydrophobicContact CG-CD1 3.83Å; L331-L335 HydrophobicContact CG-CG 4.3Å; L331-L335 PolarHBondContact O-N 3.22Å; L335-C337 PolarHBondContact O-N 3.37Å
336P60.1Low60.2Low122 Ų122118 Ų11879%0.79259%0.594SS**  trans-62.9103.8175.324-30.2000107.9F334 P338F334-P336 WeakPolarHBondContact O-CD 3.39Å; P336-P338 VanDerWaalsContact O-CD 3.25Å; P336-P338 WeakPolarHBondContact O-CD 3.04Å
337C54.9Low58.6Low77 Ų77119 Ų11952%0.5261%0.609SS.*  trans-81.4113.3174.2-147.10000107.2L335 R339 C340L335-C337 PolarHBondContact O-N 3.37Å; C337-R339 PolarHBondContact O-N 2.87Å; C337-C340 HydrophobicContact CB-CB 4.26Å
338P57.3Low57.2Low130 Ų130126.7 Ų126.784%0.84465%0.649SS**THydrogen-bonded Turntrans-69.5-1-17716.7-15.6000113.6P336P336-P338 VanDerWaalsContact O-CD 3.25Å; P336-P338 WeakPolarHBondContact O-CD 3.04Å
339R51.9Low55.2Low229 Ų229124.2 Ų124.286%0.86466%0.655SS**THydrogen-bonded Turntrans-126.111-174.3-67.5-169.8178-176.10.2115.3C337C337-R339 PolarHBondContact O-N 2.87Å
340C45.6Very low52.8Low90 Ų90123.2 Ų123.261%0.60867%0.67SS**SBendtrans-104.6116.4174.9-68.70000110.1C337 W342C337-C340 HydrophobicContact CB-CB 4.26Å; C340-W342 PolarHBondContact O-N 3.32Å
341P40.9Very low50.9Low124 Ų124128.5 Ų128.581%0.80570%0.703SS**  trans-56.3124.3168.6-19.931.3000109E343P341-E343 PolarHBondContact O-N 3.04Å
342W34.6Very low48.6Very low197 Ų197131.3 Ų131.375%0.74673%0.726SS**  trans-51.598.8169.7172-93.4000109.9C340 R344C340-W342 PolarHBondContact O-N 3.32Å; W342-R344 VanDerWaalsContact CD1-CB 3.44Å; W342-R344 VanDerWaalsContact NE1-CB 3.3Å; W342-R344 VanDerWaalsContact NE1-NE 3.13Å; W342-R344 PolarHBondContact O-N 3.32Å
343E38.2Very low46.7Very low193 Ų193137.1 Ų137.190%0.90275%0.745SS**  trans-72.680.7166.1-123.9163.3-171.400107.1P341 Q345P341-E343 PolarHBondContact O-N 3.04Å; E343-Q345 PolarHBondContact O-N 2.04Å
344R38.1Very low44.6Very low192 Ų192138.6 Ų138.673%0.72575%0.75SS**  trans-56.5104.6168.2-151.4171.4-55.1-150.57.1106.2W342 A346W342-R344 VanDerWaalsContact CD1-CB 3.44Å; W342-R344 VanDerWaalsContact NE1-CB 3.3Å; W342-R344 VanDerWaalsContact NE1-NE 3.13Å; W342-R344 PolarHBondContact O-N 3.32Å; R344-A346 PolarHBondContact O-N 3.26Å
345Q42.8Very low42.8Very low179 Ų179140.8 Ų140.884%0.83677%0.771SS**  trans15.376.3150.6-160132.2-10.600115.1E343E343-Q345 PolarHBondContact O-N 2.04Å
346A40.3Very low40.8Very low95 Ų95140.5 Ų140.579%0.78578%0.777SS**  trans-111.176169.100000108.6R344R344-A346 PolarHBondContact O-N 3.26Å
347S39.9Very low39.5Very low118 Ų118143.8 Ų143.883%0.82578%0.782SS**  trans-155.151.2157.4-21.40000110.4
348L44.6Very low38.6Very low166 Ų166146 Ų14687%0.86980%0.798SS**SBendtrans-126.964.4161.2-112.7163.1000106.9
349A37.3Very low37.4Very low88 Ų88143.3 Ų143.373%0.72779%0.794SS**  trans177.191.9162.400000108.7
350S27.6Very low36.5Very low124 Ų124138.2 Ų138.287%0.86779%0.791SS**  trans-87.6116147.2-81.50000106.4S352S350-S352 PolarHBondContact O-N 2.96Å
351P37.8Very low35.8Very low116 Ų116145.7 Ų145.775%0.75381%0.806SS**  trans-70.5118.2172.424.2-23.7000109.1L353P351-L353 PolarHBondContact O-N 3.05Å
352S32.9Very low35.5Very low94 Ų94145.6 Ų145.666%0.65781%0.805SS**  trans-10.7110.61481600000114.6S350S350-S352 PolarHBondContact O-N 2.96Å
353L35.9Very low35.4Very low171 Ų171139.5 Ų139.590%0.89580%0.804SS**  trans-9395.5146.9-97.4150.2000107.5P351 T355P351-L353 PolarHBondContact O-N 3.05Å; L353-T355 PolarHBondContact O-N 3Å
354R31.7Very low35Very low217 Ų217139.1 Ų139.182%0.81981%0.807SS**  trans-66.8115.7161.2-88.4177.7177.2-176.3-1.3107.7
355T32.4Very low34.5Very low134 Ų134134.3 Ų134.382%0.82280%0.803SS**  trans-102.2118.5144.548.70000106.9L353L353-T355 PolarHBondContact O-N 3Å
356S33Very low33.9Very low94 Ų94133 Ų13366%0.65780%0.801SS**  trans-63.4175.7177.9-63.30000112.6
357H32.2Very low33.4Very low191 Ų191136.5 Ų136.588%0.88480%0.801SS**  trans88.6102.9-172.9-48.4-71000110.8
358S35.9Very low32.9Very low125 Ų125140.1 Ų140.187%0.87481%0.805SS**  cis-15816137.439.30000111.2
359G31.3Very low32.2Very low73 Ų73138.7 Ų138.775%0.75380%0.802SS**  trans-70.4-173.2-170.500000117.6
360P32.8Very low31.7Very low122 Ų122142 Ų14279%0.79281%0.807SS**  trans-101.7157.4-143.437.8-33.9000114.4
361R31.1Very low32Very low247 Ų247141.3 Ų141.393%0.93280%0.8SS**  trans-178.1159.3135.1-98.2171.3-173.1-161.63.1111.6
362P36.1Very low31.5Very low121 Ų121143.5 Ų143.579%0.78680%0.804SS**  trans-106.9157.9-141.226.8-9.8000115.1
363G30.9Very low31.5Very low70 Ų70144.8 Ų144.872%0.72281%0.811SS**  trans27.1127.415200000120.7
364L30.2Very low31.3Very low185 Ų185144.7 Ų144.797%0.96981%0.81SS**  -168.1151.1126.5-102.3151.3000111
365S27.2Very low31.5Very low91 Ų91139.7 Ų139.764%0.63681%0.806SS**  trans-103.6153.7-169.5117.90000110.6
366L30.9Very low31.8Very low150 Ų150139.2 Ų139.279%0.78581%0.805SS**  trans71.5137.3153.2-94.7149.9000120
367Q29.5Very low31.6Very low169 Ų169142.8 Ų142.879%0.7982%0.816SS**  trans73.7106.9162-68.6176.3-8.600116.8
368Q29.2Very low31.5Very low194 Ų194138.5 Ų138.591%0.90781%0.808SS**  trans-158103.6131.5-109.4154.8-6.300110.9
369V29.9Very low31.2Very low136 Ų136139.7 Ų139.782%0.82481%0.805SS**PPolyproline II helixtrans-61.5128.4153.8169.50000106.9
370L27.9Very low31.2Very low158 Ų158142 Ų14283%0.82781%0.81SS**PPolyproline II helixtrans-96.8117.8174.4-156.692.6000108.2
371P33.6Very low31Very low109 Ų109143.8 Ų143.871%0.70881%0.812SS**PPolyproline II helixtrans-95.2136.1159.411.37.2000110.2
372L26.8Very low31Very low162 Ų162137.2 Ų137.285%0.84880%0.804SS**PPolyproline II helixtrans-59.8142.6168.3-108.885.9000111
373P33.1Very low30.7Very low122 Ų122138.7 Ų138.779%0.79281%0.806SS**PPolyproline II helixtrans-91.4137.8167.611.17000112.4
374L31.1Very low30.6Very low168 Ų168140.2 Ų140.288%0.8881%0.811SS**PPolyproline II helixtrans-89.3160.7161.2-84.7156.9000110.1
375P36.5Very low30.5Very low113 Ų113135 Ų13573%0.73480%0.802SS**PPolyproline II helixtrans-80.2170.6-164.4-3.922.7000114.2
376P38.8Very low30.6Very low123 Ų123136.7 Ų136.780%0.79981%0.814SS**PPolyproline II helixtrans-89.8144.9-162.835.4-32.3000113.4
377D28.2Very low30.4Very low169 Ų169133.3 Ų133.390%0.90482%0.816SS**  trans-104.7138.7159.4-78.8-35.4000109.6
378S30.1Very low30.2Very low102 Ų102129.2 Ų129.271%0.71382%0.819SS**  trans-85.1142.3-17339.20000114
379D29.4Very low30.1Very low150 Ų150125.4 Ų125.480%0.80281%0.814SS**  trans54.4119.6147.1-55.6-23.3000120.3
380S31.6Very low30Very low122 Ų122124.2 Ų124.285%0.85381%0.811SS**  164.9141.792.239.30000112.5
381D28.6Very low29.9Very low158 Ų158120.1 Ų120.185%0.84581%0.807SS**  trans-59.4156.4-177.2-67-58.4000115.1
382S31Very low29.5Very low109 Ų109122.9 Ų122.976%0.76282%0.815SS**  176.1130123.9-68.40000113.2
383D29.5Very low29.5Very low153 Ų153124.1 Ų124.182%0.81882%0.816SS**  trans73.6103.1143.4-65-18.4000124.1
384A30.2Very low29Very low102 Ų102126.1 Ų126.184%0.84382%0.82SS**  46.8128.3113.400000121.8
385G27.8Very low28.9Very low75 Ų75124.5 Ų124.577%0.77382%0.817SS**  trans147.885.6146.100000118.5
386S28.2Very low28.4Very low126 Ų126123.5 Ų123.588%0.88182%0.818SS**  trans27.9117.1139.41780000121.9
387G27.1Very low27.8Very low80 Ų80126.1 Ų126.183%0.82582%0.819SS**  96.1132.6117.300000119.4
388G26.6Very low27.5Very low83 Ų83124.6 Ų124.686%0.85681%0.811SS**  trans129.995.9152.200000116.7
389S26.3Very low27.2Very low114 Ų114127.1 Ų127.180%0.79782%0.815SS**  trans-70.1135.2166.1138.90000111.4
390S28.6Very low27Very low111 Ų111127.5 Ų127.578%0.77682%0.816SS**  173.2120.3123.4-73.50000113.1
391G24.2Very low27Very low71 Ų71127.7 Ų127.773%0.73282%0.815SS**  trans48.5125.4140.800000122.4
392L24.8Very low26.8Very low167 Ų167123.5 Ų123.587%0.87481%0.809SS**  -163.9119.2125.5-128.984.3000111.8
393Q27.1Very low26.5Very low188 Ų188127.7 Ų127.788%0.87982%0.816SS**  trans-75.5137.6153.2-96.9175.7-24.700108.3
394L23.8Very low26.4Very low165 Ų165124.4 Ų124.486%0.86481%0.81SS**  trans-159124.6150.6-142.374.2000113.2
395T28.3Very low26.2Very low134 Ų134125.7 Ų125.782%0.82281%0.808SS**  trans-78.3150.7160.928.70000112.3
396A26.2Very low26.1Very low92 Ų92133.9 Ų133.976%0.7682%0.816SS**  trans148.9115.814300000109.8
397Q25.4Very low25.9Very low177 Ų177135.3 Ų135.383%0.82781%0.813SS**  68.4134.990.1-96-163.7300116.6
398L23.1Very low26.2Very low138 Ų138137 Ų13772%0.72381%0.81SS**  trans102.6128.4144.3-77153.9000121.8
399L24.1Very low26.5Very low154 Ų154138.6 Ų138.681%0.80681%0.805SS**  trans100.1130.7130.8-75.9158.6000122.9
400L25.6Very low26.7Very low158 Ų158140.8 Ų140.883%0.82781%0.807SS**  trans-66.5162.4162.7-78153.1000112.8
401P30.3Very low26.7Very low126 Ų126141 Ų14182%0.81881%0.806SS**  -141.1148.3106.622-0.4000113.3
402G24.5Very low26.8Very low70 Ų70143.6 Ų143.672%0.72281%0.808SS**  82.887.380.500000112.5
403E24.9Very low26.9Very low197 Ų197147.6 Ų147.692%0.92181%0.811SS**  87.7112.793.1-158.8170179.700116.1
404A26.8Very low26.9Very low84 Ų84143 Ų14369%0.69481%0.805SS**  trans163.8115.2134.100000115.5
405T25.9Very low27.1Very low130 Ų130139.8 Ų139.880%0.79880%0.803SS**  trans74.5104.2139.861.90000122.7
406R26.9Very low27.1Very low246 Ų246137.8 Ų137.893%0.92880%0.8SS**  160.6111.6108.9-90.2-178173.7153.7-0.9111.9
407D23.6Very low27.2Very low156 Ų156137.5 Ų137.583%0.83480%0.797SS**  trans-70159.3158.3-85.4-37.6000110.7
408P34.3Very low27.5Very low115 Ų115135.5 Ų135.575%0.74780%0.797SS**  cis-150.6-160.647.639.7-16000115.5
409P32.7Very low27.7Very low118 Ų118135.6 Ų135.677%0.76680%0.798SS**  -116.4166.9-63.235-19.9000113.7
410L29.8Very low28.3Very low160 Ų160137.5 Ų137.584%0.83880%0.8SS**  trans-56.5155.5173.8-94.193.7000115.3
411P29.5Very low28.6Very low115 Ų115138.6 Ų138.675%0.74780%0.799SS**  trans-107112.5140.219.9-2.1000111.7
412T26.1Very low28.4Very low126 Ų126139.3 Ų139.377%0.77380%0.795SS**  trans22109.8140.337.40000119.1A414T412-A414 PolarHBondContact O-N 3.21Å
413R27Very low29Very low251 Ų251143 Ų14395%0.94780%0.797SS**  trans-6991.6163.4-161177.4-169.41652.5109.6A415R413-A415 PolarHBondContact O-N 3.02Å
414A26Very low29.3Very low91 Ų91140 Ų14075%0.75279%0.787SS**  trans-71.1114.7167.900000109.4T412 A416T412-A414 PolarHBondContact O-N 3.21Å; A414-A416 PolarHBondContact O-N 3.29Å; A414-A416 VanDerWaalsContact O-N 3.08Å
415A29Very low29.6Very low98 Ų98141.3 Ų141.381%0.8179%0.789SS**  trans-63.3104.5166.200000108.6R413 A417R413-A415 PolarHBondContact O-N 3.02Å; A415-A417 VanDerWaalsContact C-N 3.34Å; A415-A417 PolarHBondContact O-N 3.38Å
416A26.7Very low30Very low92 Ų92139.6 Ų139.676%0.7679%0.788SS**  trans-72.992.6171.300000109A414 V418A414-A416 PolarHBondContact O-N 3.29Å; A414-A416 VanDerWaalsContact O-N 3.08Å; A416-V418 PolarHBondContact O-N 3.08Å
417A28.5Very low30.4Very low85 Ų85136.7 Ų136.770%0.70279%0.785SS**  trans-59.6112.8161.200000108.4A415 N419A415-A417 VanDerWaalsContact C-N 3.34Å; A415-A417 PolarHBondContact O-N 3.38Å; A417-N419 PolarHBondContact O-N 3.42Å; A417-N419 VanDerWaalsContact O-N 3.17Å
418V32Very low30.8Very low135 Ų135135.3 Ų135.382%0.81878%0.784SS**  trans-80.299.8175.1179.90000107.9A416A416-V418 PolarHBondContact O-N 3.08Å
419N28Very low30.6Very low141 Ų141139.3 Ų139.375%0.75479%0.79SS**  trans-63133.9178.3-89.2-23.8000112.3A417 F421A417-N419 PolarHBondContact O-N 3.42Å; A417-N419 VanDerWaalsContact O-N 3.17Å; N419-F421 VanDerWaalsContact C-N 3.31Å; N419-F421 PolarHBondContact O-N 3.2Å
420F36.3Very low30.4Very low193 Ų193141.4 Ų141.485%0.84679%0.794SS**SBendtrans-79.91.1-171.5-124.5-99.2000115
421F31.3Very low30.3Very low181 Ų181145 Ų14579%0.79480%0.797SS**  trans-143.154.2-171.1-78.9-82000113.9N419N419-F421 VanDerWaalsContact C-N 3.31Å; N419-F421 PolarHBondContact O-N 3.2Å
422N26.7Very low30.4Very low141 Ų141147 Ų14775%0.75480%0.8SS**  trans-91.8102.4159.6-117.8-11.5000109.2D424N422-D424 PolarHBondContact O-N 3.01Å
423I36.5Very low30.6Very low148 Ų148149.3 Ų149.376%0.75980%0.802SS**  trans-79.994.9161-64.1172.9000105.1
424D32.6Very low31.1Very low133 Ų133143 Ų14371%0.71179%0.793SS**  trans-67.5130.8166.1-82.4-39000109N422N422-D424 PolarHBondContact O-N 3.01Å
425P32Very low31.6Very low112 Ų112146.9 Ų146.973%0.72780%0.801SS**  trans-73.7137.2177.629.4-30.9000110.4
426A34.1Very low31.9Very low95 Ų95145.7 Ų145.779%0.78580%0.797SS**  trans41.4118.915600000118.8
427E35.6Very low32.3Very low185 Ų185147.4 Ų147.486%0.86480%0.799SS**  trans-42.1136.6164.1-66.4175156.600112.5K429E427-K429 PolarHBondContact O-N 3.32Å
428P31.4Very low32.9Very low126 Ų126149.4 Ų149.482%0.81880%0.804SS**  trans-66.9122.2173.226-30000109.4L430P428-L430 PolarHBondContact O-N 2.92Å
429K30Very low33.4Very low199 Ų199149.4 Ų149.487%0.86581%0.805SS**  trans-49.1120.6168.3-77.9175.8174.7174.40109.4E427 R431E427-K429 PolarHBondContact O-N 3.32Å; K429-R431 PolarHBondContact O-N 2.89Å
430L28.7Very low33.8Very low162 Ų162154 Ų15485%0.84883%0.83SS**  trans-57101.4165.2-147.789.6000107.9P428 L432P428-L430 PolarHBondContact O-N 2.92Å; L430-L432 PolarHBondContact O-N 2.92Å
431R27.5Very low33.6Very low236 Ų236152.1 Ų152.189%0.89183%0.829SS**  trans-73.5109.6169.8-81.1-162.8-174.1-161.74.6107.6K429 H433K429-R431 PolarHBondContact O-N 2.89Å; R431-H433 PolarHBondContact O-N 2.84Å
432L31.4Very low33.7Very low156 Ų156150.6 Ų150.682%0.81783%0.831SS**PPolyproline II helixtrans-64.8124.6160-86.6104.3000108.5L430L430-L432 PolarHBondContact O-N 2.92Å
433H32Very low34.1Very low176 Ų176151.1 Ų151.182%0.81584%0.835SS**PPolyproline II helixtrans-66.3132.2164.3-97.8-85.9000109.4R431 L435R431-H433 PolarHBondContact O-N 2.84Å; H433-L435 PolarHBondContact O-N 3.29Å
434P36.1Very low34Very low118 Ų118151.3 Ų151.377%0.76684%0.84SS**PPolyproline II helixtrans-68.8127.4166.9-10.825.9000109.3G436P434-G436 PolarHBondContact O-N 3.45Å
435L37.1Very low34.1Very low173 Ų173152.4 Ų152.491%0.90685%0.848SS**PPolyproline II helixtrans-60.1132.8164.4-96.791.4000108.8H433H433-L435 PolarHBondContact O-N 3.29Å
436G34.5Very low34.2Very low72 Ų72155.1 Ų155.174%0.74286%0.856SS**PPolyproline II helixtrans-58.6142174.600000112.3P434P434-G436 PolarHBondContact O-N 3.45Å
437T35.6Very low34.2Very low129 Ų129159.4 Ų159.479%0.79186%0.861SS**PPolyproline II helixtrans-65.1139.8167.443.30000110.7
438P41.3Very low34.1Very low126 Ų126157.5 Ų157.582%0.81886%0.86SS**PPolyproline II helixtrans-75.7127.4170.830.3-29.6000109.9
439T42.1Very low34.4Very low136 Ų136160.1 Ų160.183%0.83486%0.864SS**PPolyproline II helixtrans-72.4126.1163.444.20000109.2
440N36.2Very low34.8Very low238 Ų238156.5 Ų156.5100%1.27386%0.864SS**  trans-84.60153.1-89.3-14.9000109.4

Retrieved 440 of 440 residues in 214.6 ms (Link to these results)