A0A2K5M0S3_CERAT 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 , UniProt , Accession A0A2K5M0S3, Species CERAT (Cercocebus atys, Sooty mangabey), 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 1361.5 ms (Link to these results)